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2hiu_1H.pdb
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2hiu_1H.pdb
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USER MOD reduce.3.23.130521 H: found=381, std=494, add=2, rem=0, adj=13
USER MOD -----------------------------------------------------------------
USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER MOD "!" flags a clash with an overlap of 0.40A or greater
USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER MOD Single : A 1 GLY N :NH3+ 171:sc= 0 (180deg=-0.0759)
USER MOD Single : A 5 GLN : amide:sc= -0.595 K(o=-0.6,f=-1.2)
USER MOD Single : A 8 THR OG1 : rot 180:sc= 0
USER MOD Single : A 9 SER OG : rot 180:sc= 0.0656!
USER MOD Single : A 12 SER OG : rot 180:sc= 0.0456
USER MOD Single : A 14 TYR OH : rot 180:sc= 0
USER MOD Single : A 15 GLN : amide:sc= -2.46 K(o=-2.5,f=-9.9!)
USER MOD Single : A 18 ASN :FLIP amide:sc=-0.000172 F(o=-0.76,f=-0.00017)
USER MOD Single : A 19 TYR OH : rot 180:sc= 0.363
USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.085)
USER MOD Single : B 1 PHE N :NH3+ 180:sc= 0 (180deg=0)
USER MOD Single : B 3 ASN : amide:sc= -0.041 K(o=-0.041,f=-0.6)
USER MOD Single : B 4 GLN : amide:sc= 0 X(o=0,f=0)
USER MOD Single : B 5 HIS : no HD1:sc= -6.68! C(o=-6.7!,f=-9.2!)
USER MOD Single : B 9 SER OG : rot 180:sc= -0.0418
USER MOD Single : B 10 HIS : no HD1:sc= -0.0973 X(o=-0.097,f=-0.0043)
USER MOD Single : B 16 TYR OH : rot 165:sc= 0
USER MOD Single : B 26 TYR OH : rot 165:sc= -0.0124
USER MOD Single : B 27 THR OG1 : rot 180:sc= 0
USER MOD Single : B 29 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.344)
USER MOD Single : B 30 THR OG1 : rot 180:sc= 0.0337
USER MOD -----------------------------------------------------------------
MODEL 1
ATOM 1 N GLY A 1 -6.132 6.735 1.016 1.00 0.00 N
ATOM 2 CA GLY A 1 -4.686 6.753 1.376 1.00 0.00 C
ATOM 3 C GLY A 1 -3.864 6.149 0.235 1.00 0.00 C
ATOM 4 O GLY A 1 -3.324 6.855 -0.593 1.00 0.00 O
ATOM 5 H1 GLY A 1 -6.619 6.963 1.725 1.00 0.00 H std
ATOM 6 H2 GLY A 1 -6.281 7.315 0.358 1.00 0.00 H std
ATOM 7 H3 GLY A 1 -6.360 5.917 0.748 1.00 0.00 H std
ATOM 8 HA2 GLY A 1 -4.402 7.668 1.530 1.00 0.00 H std
ATOM 9 HA3 GLY A 1 -4.547 6.229 2.181 1.00 0.00 H std
ATOM 10 N ILE A 2 -3.761 4.849 0.186 1.00 0.00 N
ATOM 11 CA ILE A 2 -2.967 4.202 -0.903 1.00 0.00 C
ATOM 12 C ILE A 2 -3.225 4.889 -2.249 1.00 0.00 C
ATOM 13 O ILE A 2 -2.395 4.864 -3.136 1.00 0.00 O
ATOM 14 CB ILE A 2 -3.444 2.747 -0.936 1.00 0.00 C
ATOM 15 CG1 ILE A 2 -3.026 2.098 -2.256 1.00 0.00 C
ATOM 16 CG2 ILE A 2 -4.968 2.697 -0.808 1.00 0.00 C
ATOM 17 CD1 ILE A 2 -3.110 0.577 -2.126 1.00 0.00 C
ATOM 18 H ILE A 2 -4.146 4.365 0.784 1.00 0.00 H std
ATOM 19 HA ILE A 2 -2.022 4.234 -0.688 1.00 0.00 H std
ATOM 20 HB ILE A 2 -3.042 2.261 -0.199 1.00 0.00 H std
ATOM 21 HG12 ILE A 2 -3.619 2.397 -2.963 1.00 0.00 H std
ATOM 22 HG13 ILE A 2 -2.114 2.353 -2.468 1.00 0.00 H std
ATOM 23 HG21 ILE A 2 -5.360 3.417 -1.327 1.00 0.00 H std
ATOM 24 HG22 ILE A 2 -5.293 1.845 -1.139 1.00 0.00 H std
ATOM 25 HG23 ILE A 2 -5.217 2.799 0.124 1.00 0.00 H std
ATOM 26 HD11 ILE A 2 -2.887 0.318 -1.218 1.00 0.00 H std
ATOM 27 HD12 ILE A 2 -4.012 0.285 -2.332 1.00 0.00 H std
ATOM 28 HD13 ILE A 2 -2.486 0.164 -2.743 1.00 0.00 H std
ATOM 29 N VAL A 3 -4.363 5.502 -2.410 1.00 0.00 N
ATOM 30 CA VAL A 3 -4.662 6.186 -3.700 1.00 0.00 C
ATOM 31 C VAL A 3 -3.971 7.551 -3.748 1.00 0.00 C
ATOM 32 O VAL A 3 -3.683 8.073 -4.806 1.00 0.00 O
ATOM 33 CB VAL A 3 -6.181 6.357 -3.719 1.00 0.00 C
ATOM 34 CG1 VAL A 3 -6.849 4.982 -3.793 1.00 0.00 C
ATOM 35 CG2 VAL A 3 -6.632 7.075 -2.445 1.00 0.00 C
ATOM 36 H VAL A 3 -4.940 5.512 -1.772 1.00 0.00 H std
ATOM 37 HA VAL A 3 -4.382 5.638 -4.450 1.00 0.00 H std
ATOM 38 HB VAL A 3 -6.438 6.880 -4.495 1.00 0.00 H std
ATOM 39 HG11 VAL A 3 -6.545 4.517 -4.588 1.00 0.00 H std
ATOM 40 HG12 VAL A 3 -6.614 4.465 -3.007 1.00 0.00 H std
ATOM 41 HG13 VAL A 3 -7.812 5.092 -3.832 1.00 0.00 H std
ATOM 42 HG21 VAL A 3 -5.868 7.213 -1.864 1.00 0.00 H std
ATOM 43 HG22 VAL A 3 -7.021 7.932 -2.679 1.00 0.00 H std
ATOM 44 HG23 VAL A 3 -7.294 6.535 -1.985 1.00 0.00 H std
ATOM 45 N GLU A 4 -3.715 8.138 -2.612 1.00 0.00 N
ATOM 46 CA GLU A 4 -3.056 9.477 -2.599 1.00 0.00 C
ATOM 47 C GLU A 4 -1.593 9.369 -2.161 1.00 0.00 C
ATOM 48 O GLU A 4 -0.851 10.330 -2.223 1.00 0.00 O
ATOM 49 CB GLU A 4 -3.844 10.317 -1.587 1.00 0.00 C
ATOM 50 CG GLU A 4 -5.326 9.938 -1.628 1.00 0.00 C
ATOM 51 CD GLU A 4 -6.181 11.206 -1.571 1.00 0.00 C
ATOM 52 OE1 GLU A 4 -6.080 11.921 -0.587 1.00 0.00 O
ATOM 53 OE2 GLU A 4 -6.920 11.439 -2.512 1.00 0.00 O
ATOM 54 H GLU A 4 -3.933 7.758 -1.872 1.00 0.00 H std
ATOM 55 HA GLU A 4 -3.111 9.884 -3.478 1.00 0.00 H std
ATOM 56 HB2 GLU A 4 -3.496 10.155 -0.696 1.00 0.00 H std
ATOM 57 HB3 GLU A 4 -3.747 11.257 -1.804 1.00 0.00 H std
ATOM 58 HG2 GLU A 4 -5.512 9.456 -2.449 1.00 0.00 H std
ATOM 59 HG3 GLU A 4 -5.535 9.374 -0.867 1.00 0.00 H std
ATOM 60 N GLN A 5 -1.162 8.226 -1.705 1.00 0.00 N
ATOM 61 CA GLN A 5 0.259 8.118 -1.262 1.00 0.00 C
ATOM 62 C GLN A 5 1.166 7.758 -2.446 1.00 0.00 C
ATOM 63 O GLN A 5 2.264 8.267 -2.558 1.00 0.00 O
ATOM 64 CB GLN A 5 0.286 7.037 -0.171 1.00 0.00 C
ATOM 65 CG GLN A 5 1.224 7.479 0.957 1.00 0.00 C
ATOM 66 CD GLN A 5 0.814 8.866 1.458 1.00 0.00 C
ATOM 67 OE1 GLN A 5 -0.356 9.192 1.492 1.00 0.00 O
ATOM 68 NE2 GLN A 5 1.735 9.704 1.850 1.00 0.00 N
ATOM 69 H GLN A 5 -1.691 7.550 -1.653 1.00 0.00 H std
ATOM 70 HA GLN A 5 0.543 8.966 -0.886 1.00 0.00 H std
ATOM 71 HB2 GLN A 5 -0.609 6.913 0.183 1.00 0.00 H std
ATOM 72 HB3 GLN A 5 0.608 6.199 -0.538 1.00 0.00 H std
ATOM 73 HG2 GLN A 5 1.171 6.842 1.687 1.00 0.00 H std
ATOM 74 HG3 GLN A 5 2.134 7.514 0.623 1.00 0.00 H std
ATOM 75 HE21 GLN A 5 2.563 9.474 1.825 1.00 0.00 H std
ATOM 76 HE22 GLN A 5 1.514 10.486 2.132 1.00 0.00 H std
ATOM 77 N CYS A 6 0.737 6.900 -3.337 1.00 0.00 N
ATOM 78 CA CYS A 6 1.622 6.560 -4.489 1.00 0.00 C
ATOM 79 C CYS A 6 1.322 7.450 -5.702 1.00 0.00 C
ATOM 80 O CYS A 6 2.206 8.070 -6.214 1.00 0.00 O
ATOM 81 CB CYS A 6 1.430 5.054 -4.806 1.00 0.00 C
ATOM 82 SG CYS A 6 0.947 4.148 -3.324 1.00 0.00 S
ATOM 83 H CYS A 6 -0.038 6.536 -3.261 1.00 0.00 H std
ATOM 84 HA CYS A 6 2.546 6.707 -4.232 1.00 0.00 H std
ATOM 85 HB2 CYS A 6 0.766 4.924 -5.501 1.00 0.00 H std
ATOM 86 HB3 CYS A 6 2.275 4.693 -5.118 1.00 0.00 H std
ATOM 87 N CYS A 7 0.119 7.560 -6.183 1.00 0.00 N
ATOM 88 CA CYS A 7 -0.065 8.451 -7.375 1.00 0.00 C
ATOM 89 C CYS A 7 0.271 9.883 -7.000 1.00 0.00 C
ATOM 90 O CYS A 7 1.000 10.575 -7.682 1.00 0.00 O
ATOM 91 CB CYS A 7 -1.535 8.365 -7.759 1.00 0.00 C
ATOM 92 SG CYS A 7 -1.759 9.107 -9.403 1.00 0.00 S
ATOM 93 H CYS A 7 -0.546 7.148 -5.827 1.00 0.00 H std
ATOM 94 HA CYS A 7 0.493 8.153 -8.111 1.00 0.00 H std
ATOM 95 HB2 CYS A 7 -1.819 7.438 -7.762 1.00 0.00 H std
ATOM 96 HB3 CYS A 7 -2.062 8.857 -7.110 1.00 0.00 H std
ATOM 97 N THR A 8 -0.285 10.326 -5.923 1.00 0.00 N
ATOM 98 CA THR A 8 -0.053 11.715 -5.462 1.00 0.00 C
ATOM 99 C THR A 8 1.244 11.805 -4.639 1.00 0.00 C
ATOM 100 O THR A 8 1.420 12.707 -3.847 1.00 0.00 O
ATOM 101 CB THR A 8 -1.289 11.992 -4.605 1.00 0.00 C
ATOM 102 OG1 THR A 8 -2.383 12.307 -5.456 1.00 0.00 O
ATOM 103 CG2 THR A 8 -1.037 13.160 -3.651 1.00 0.00 C
ATOM 104 H THR A 8 -0.807 9.809 -5.476 1.00 0.00 H std
ATOM 105 HA THR A 8 -0.026 12.327 -6.214 1.00 0.00 H std
ATOM 106 HB THR A 8 -1.500 11.195 -4.094 1.00 0.00 H std
ATOM 107 HG1 THR A 8 -3.054 12.455 -4.972 1.00 0.00 H std
ATOM 108 HG21 THR A 8 -0.564 13.865 -4.120 1.00 0.00 H std
ATOM 109 HG22 THR A 8 -1.885 13.500 -3.325 1.00 0.00 H std
ATOM 110 HG23 THR A 8 -0.503 12.855 -2.901 1.00 0.00 H std
ATOM 111 N SER A 9 2.164 10.886 -4.828 1.00 0.00 N
ATOM 112 CA SER A 9 3.445 10.943 -4.049 1.00 0.00 C
ATOM 113 C SER A 9 4.212 9.623 -4.201 1.00 0.00 C
ATOM 114 O SER A 9 4.033 8.899 -5.156 1.00 0.00 O
ATOM 115 CB SER A 9 3.020 11.163 -2.589 1.00 0.00 C
ATOM 116 OG SER A 9 4.054 10.743 -1.710 1.00 0.00 O
ATOM 117 H SER A 9 2.040 10.260 -5.404 1.00 0.00 H std
ATOM 118 HA SER A 9 3.989 11.687 -4.352 1.00 0.00 H std
ATOM 119 HB2 SER A 9 2.848 12.106 -2.440 1.00 0.00 H std
ATOM 120 HB3 SER A 9 2.210 10.660 -2.412 1.00 0.00 H std
ATOM 121 HG SER A 9 3.796 10.876 -0.922 1.00 0.00 H std
ATOM 122 N ILE A 10 5.065 9.305 -3.272 1.00 0.00 N
ATOM 123 CA ILE A 10 5.833 8.032 -3.368 1.00 0.00 C
ATOM 124 C ILE A 10 5.524 7.138 -2.167 1.00 0.00 C
ATOM 125 O ILE A 10 5.875 7.447 -1.046 1.00 0.00 O
ATOM 126 CB ILE A 10 7.299 8.452 -3.345 1.00 0.00 C
ATOM 127 CG1 ILE A 10 7.567 9.439 -4.482 1.00 0.00 C
ATOM 128 CG2 ILE A 10 8.186 7.220 -3.518 1.00 0.00 C
ATOM 129 CD1 ILE A 10 7.259 10.859 -4.006 1.00 0.00 C
ATOM 130 H ILE A 10 5.184 9.831 -2.602 1.00 0.00 H std
ATOM 131 HA ILE A 10 5.631 7.574 -4.199 1.00 0.00 H std
ATOM 132 HB ILE A 10 7.496 8.875 -2.494 1.00 0.00 H std
ATOM 133 HG12 ILE A 10 8.498 9.380 -4.749 1.00 0.00 H std
ATOM 134 HG13 ILE A 10 6.999 9.223 -5.238 1.00 0.00 H std
ATOM 135 HG21 ILE A 10 7.724 6.563 -4.062 1.00 0.00 H std
ATOM 136 HG22 ILE A 10 9.015 7.476 -3.952 1.00 0.00 H std
ATOM 137 HG23 ILE A 10 8.381 6.838 -2.648 1.00 0.00 H std
ATOM 138 HD11 ILE A 10 7.306 10.893 -3.038 1.00 0.00 H std
ATOM 139 HD12 ILE A 10 7.909 11.473 -4.382 1.00 0.00 H std
ATOM 140 HD13 ILE A 10 6.369 11.111 -4.297 1.00 0.00 H std
ATOM 141 N CYS A 11 4.890 6.020 -2.390 1.00 0.00 N
ATOM 142 CA CYS A 11 4.588 5.103 -1.246 1.00 0.00 C
ATOM 143 C CYS A 11 5.443 3.840 -1.394 1.00 0.00 C
ATOM 144 O CYS A 11 5.807 3.460 -2.489 1.00 0.00 O
ATOM 145 CB CYS A 11 3.078 4.811 -1.326 1.00 0.00 C
ATOM 146 SG CYS A 11 2.734 3.576 -2.598 1.00 0.00 S
ATOM 147 H CYS A 11 4.663 5.808 -3.192 1.00 0.00 H std
ATOM 148 HA CYS A 11 4.794 5.544 -0.407 1.00 0.00 H std
ATOM 149 HB2 CYS A 11 2.759 4.483 -0.471 1.00 0.00 H std
ATOM 150 HB3 CYS A 11 2.605 5.632 -1.535 1.00 0.00 H std
ATOM 151 N SER A 12 5.810 3.208 -0.310 1.00 0.00 N
ATOM 152 CA SER A 12 6.690 2.003 -0.431 1.00 0.00 C
ATOM 153 C SER A 12 5.936 0.694 -0.275 1.00 0.00 C
ATOM 154 O SER A 12 4.725 0.644 -0.197 1.00 0.00 O
ATOM 155 CB SER A 12 7.721 2.129 0.682 1.00 0.00 C
ATOM 156 OG SER A 12 7.273 3.073 1.644 1.00 0.00 O
ATOM 157 H SER A 12 5.573 3.496 0.465 1.00 0.00 H std
ATOM 158 HA SER A 12 7.146 2.017 -1.287 1.00 0.00 H std
ATOM 159 HB2 SER A 12 7.831 1.268 1.114 1.00 0.00 H std
ATOM 160 HB3 SER A 12 8.571 2.400 0.302 1.00 0.00 H std
ATOM 161 HG SER A 12 7.855 3.125 2.248 1.00 0.00 H std
ATOM 162 N LEU A 13 6.684 -0.373 -0.229 1.00 0.00 N
ATOM 163 CA LEU A 13 6.071 -1.723 -0.084 1.00 0.00 C
ATOM 164 C LEU A 13 5.572 -1.924 1.343 1.00 0.00 C
ATOM 165 O LEU A 13 4.673 -2.703 1.590 1.00 0.00 O
ATOM 166 CB LEU A 13 7.186 -2.719 -0.422 1.00 0.00 C
ATOM 167 CG LEU A 13 7.750 -2.406 -1.809 1.00 0.00 C
ATOM 168 CD1 LEU A 13 9.218 -2.830 -1.870 1.00 0.00 C
ATOM 169 CD2 LEU A 13 6.954 -3.173 -2.867 1.00 0.00 C
ATOM 170 H LEU A 13 7.538 -0.288 -0.283 1.00 0.00 H std
ATOM 171 HA LEU A 13 5.337 -1.825 -0.710 1.00 0.00 H std
ATOM 172 HB2 LEU A 13 7.895 -2.651 0.237 1.00 0.00 H std
ATOM 173 HB3 LEU A 13 6.827 -3.620 -0.418 1.00 0.00 H std
ATOM 174 HG LEU A 13 7.681 -1.453 -1.978 1.00 0.00 H std
ATOM 175 HD11 LEU A 13 9.319 -3.707 -1.468 1.00 0.00 H std
ATOM 176 HD12 LEU A 13 9.507 -2.864 -2.795 1.00 0.00 H std
ATOM 177 HD13 LEU A 13 9.760 -2.188 -1.385 1.00 0.00 H std
ATOM 178 HD21 LEU A 13 6.858 -4.098 -2.592 1.00 0.00 H std
ATOM 179 HD22 LEU A 13 6.076 -2.772 -2.967 1.00 0.00 H std
ATOM 180 HD23 LEU A 13 7.424 -3.136 -3.715 1.00 0.00 H std
ATOM 181 N TYR A 14 6.125 -1.213 2.281 1.00 0.00 N
ATOM 182 CA TYR A 14 5.651 -1.355 3.682 1.00 0.00 C
ATOM 183 C TYR A 14 4.493 -0.389 3.900 1.00 0.00 C
ATOM 184 O TYR A 14 3.644 -0.592 4.745 1.00 0.00 O
ATOM 185 CB TYR A 14 6.839 -1.001 4.572 1.00 0.00 C
ATOM 186 CG TYR A 14 6.590 -1.561 5.950 1.00 0.00 C
ATOM 187 CD1 TYR A 14 5.806 -0.845 6.862 1.00 0.00 C
ATOM 188 CD2 TYR A 14 7.136 -2.799 6.313 1.00 0.00 C
ATOM 189 CE1 TYR A 14 5.568 -1.365 8.141 1.00 0.00 C
ATOM 190 CE2 TYR A 14 6.899 -3.321 7.593 1.00 0.00 C
ATOM 191 CZ TYR A 14 6.115 -2.603 8.507 1.00 0.00 C
ATOM 192 OH TYR A 14 5.880 -3.115 9.766 1.00 0.00 O
ATOM 193 H TYR A 14 6.745 -0.649 2.087 1.00 0.00 H std
ATOM 194 HA TYR A 14 5.366 -2.267 3.851 1.00 0.00 H std
ATOM 195 HB2 TYR A 14 7.648 -1.388 4.202 1.00 0.00 H std
ATOM 196 HB3 TYR A 14 6.932 -0.037 4.625 1.00 0.00 H std
ATOM 197 HD1 TYR A 14 5.442 -0.025 6.618 1.00 0.00 H std
ATOM 198 HD2 TYR A 14 7.654 -3.275 5.705 1.00 0.00 H std
ATOM 199 HE1 TYR A 14 5.047 -0.890 8.748 1.00 0.00 H std
ATOM 200 HE2 TYR A 14 7.262 -4.142 7.835 1.00 0.00 H std
ATOM 201 HH TYR A 14 6.272 -3.856 9.823 1.00 0.00 H std
ATOM 202 N GLN A 15 4.429 0.643 3.106 1.00 0.00 N
ATOM 203 CA GLN A 15 3.297 1.589 3.230 1.00 0.00 C
ATOM 204 C GLN A 15 2.105 0.938 2.537 1.00 0.00 C
ATOM 205 O GLN A 15 0.981 0.983 3.003 1.00 0.00 O
ATOM 206 CB GLN A 15 3.751 2.862 2.508 1.00 0.00 C
ATOM 207 CG GLN A 15 3.813 4.012 3.514 1.00 0.00 C
ATOM 208 CD GLN A 15 3.030 5.212 2.977 1.00 0.00 C
ATOM 209 OE1 GLN A 15 2.979 5.435 1.783 1.00 0.00 O
ATOM 210 NE2 GLN A 15 2.414 6.000 3.816 1.00 0.00 N
ATOM 211 H GLN A 15 5.021 0.754 2.493 1.00 0.00 H std
ATOM 212 HA GLN A 15 3.099 1.774 4.161 1.00 0.00 H std
ATOM 213 HB2 GLN A 15 4.631 2.718 2.127 1.00 0.00 H std
ATOM 214 HB3 GLN A 15 3.125 3.085 1.801 1.00 0.00 H std
ATOM 215 HG2 GLN A 15 3.424 3.724 4.354 1.00 0.00 H std
ATOM 216 HG3 GLN A 15 4.737 4.268 3.658 1.00 0.00 H std
ATOM 217 HE21 GLN A 15 2.451 5.841 4.660 1.00 0.00 H std
ATOM 218 HE22 GLN A 15 1.972 6.678 3.524 1.00 0.00 H std
ATOM 219 N LEU A 16 2.373 0.272 1.447 1.00 0.00 N
ATOM 220 CA LEU A 16 1.302 -0.452 0.720 1.00 0.00 C
ATOM 221 C LEU A 16 0.971 -1.730 1.492 1.00 0.00 C
ATOM 222 O LEU A 16 -0.039 -2.366 1.267 1.00 0.00 O
ATOM 223 CB LEU A 16 1.918 -0.787 -0.639 1.00 0.00 C
ATOM 224 CG LEU A 16 0.894 -0.556 -1.749 1.00 0.00 C
ATOM 225 CD1 LEU A 16 0.739 0.945 -2.002 1.00 0.00 C
ATOM 226 CD2 LEU A 16 1.383 -1.236 -3.028 1.00 0.00 C
ATOM 227 H LEU A 16 3.184 0.224 1.166 1.00 0.00 H std
ATOM 228 HA LEU A 16 0.516 0.106 0.612 1.00 0.00 H std
ATOM 229 HB2 LEU A 16 2.691 -0.221 -0.790 1.00 0.00 H std
ATOM 230 HB3 LEU A 16 2.194 -1.717 -0.645 1.00 0.00 H std
ATOM 231 HG LEU A 16 0.039 -0.931 -1.486 1.00 0.00 H std
ATOM 232 HD11 LEU A 16 1.079 1.438 -1.239 1.00 0.00 H std
ATOM 233 HD12 LEU A 16 1.239 1.191 -2.796 1.00 0.00 H std
ATOM 234 HD13 LEU A 16 -0.199 1.155 -2.131 1.00 0.00 H std
ATOM 235 HD21 LEU A 16 1.682 -2.135 -2.821 1.00 0.00 H std
ATOM 236 HD22 LEU A 16 0.659 -1.275 -3.672 1.00 0.00 H std
ATOM 237 HD23 LEU A 16 2.122 -0.730 -3.401 1.00 0.00 H std
ATOM 238 N GLU A 17 1.830 -2.107 2.407 1.00 0.00 N
ATOM 239 CA GLU A 17 1.586 -3.340 3.207 1.00 0.00 C
ATOM 240 C GLU A 17 0.315 -3.188 4.032 1.00 0.00 C
ATOM 241 O GLU A 17 -0.271 -4.157 4.476 1.00 0.00 O
ATOM 242 CB GLU A 17 2.793 -3.466 4.132 1.00 0.00 C
ATOM 243 CG GLU A 17 3.703 -4.578 3.629 1.00 0.00 C
ATOM 244 CD GLU A 17 4.214 -5.399 4.813 1.00 0.00 C
ATOM 245 OE1 GLU A 17 4.615 -4.798 5.797 1.00 0.00 O
ATOM 246 OE2 GLU A 17 4.197 -6.615 4.717 1.00 0.00 O
ATOM 247 H GLU A 17 2.539 -1.640 2.547 1.00 0.00 H std
ATOM 248 HA GLU A 17 1.529 -4.116 2.628 1.00 0.00 H std
ATOM 249 HB2 GLU A 17 3.282 -2.628 4.140 1.00 0.00 H std
ATOM 250 HB3 GLU A 17 2.493 -3.677 5.030 1.00 0.00 H std
ATOM 251 HG2 GLU A 17 3.210 -5.152 3.023 1.00 0.00 H std
ATOM 252 HG3 GLU A 17 4.454 -4.180 3.162 1.00 0.00 H std
ATOM 253 N ASN A 18 -0.125 -1.977 4.239 1.00 0.00 N
ATOM 254 CA ASN A 18 -1.364 -1.771 5.038 1.00 0.00 C
ATOM 255 C ASN A 18 -2.604 -2.168 4.228 1.00 0.00 C
ATOM 256 O ASN A 18 -3.719 -1.861 4.603 1.00 0.00 O
ATOM 257 CB ASN A 18 -1.385 -0.274 5.354 1.00 0.00 C
ATOM 258 CG ASN A 18 -0.099 0.114 6.088 1.00 0.00 C
ATOM 259 OD1 ASN A 18 0.495 -0.763 6.852 1.00 0.00 O flip
ATOM 260 ND2 ASN A 18 0.371 1.228 5.966 1.00 0.00 N flip
ATOM 261 H ASN A 18 0.298 -1.303 3.914 1.00 0.00 H std
ATOM 262 HA ASN A 18 -1.322 -2.280 5.863 1.00 0.00 H std
ATOM 263 HB2 ASN A 18 -1.451 0.229 4.527 1.00 0.00 H std
ATOM 264 HB3 ASN A 18 -2.149 -0.073 5.917 1.00 0.00 H std
ATOM 265 HD21 ASN A 18 -0.019 1.807 5.463 1.00 0.00 H std
ATOM 266 HD22 ASN A 18 1.094 1.438 6.382 1.00 0.00 H std
ATOM 267 N TYR A 19 -2.431 -2.846 3.122 1.00 0.00 N
ATOM 268 CA TYR A 19 -3.615 -3.245 2.309 1.00 0.00 C
ATOM 269 C TYR A 19 -3.600 -4.753 2.033 1.00 0.00 C
ATOM 270 O TYR A 19 -4.578 -5.315 1.578 1.00 0.00 O
ATOM 271 CB TYR A 19 -3.483 -2.440 1.018 1.00 0.00 C
ATOM 272 CG TYR A 19 -3.528 -0.971 1.364 1.00 0.00 C
ATOM 273 CD1 TYR A 19 -4.762 -0.320 1.496 1.00 0.00 C
ATOM 274 CD2 TYR A 19 -2.337 -0.264 1.576 1.00 0.00 C
ATOM 275 CE1 TYR A 19 -4.805 1.038 1.836 1.00 0.00 C
ATOM 276 CE2 TYR A 19 -2.380 1.094 1.919 1.00 0.00 C
ATOM 277 CZ TYR A 19 -3.614 1.745 2.050 1.00 0.00 C
ATOM 278 OH TYR A 19 -3.655 3.082 2.389 1.00 0.00 O
ATOM 279 H TYR A 19 -1.640 -3.057 2.859 1.00 0.00 H std
ATOM 280 HA TYR A 19 -4.434 -2.998 2.767 1.00 0.00 H std
ATOM 281 HB2 TYR A 19 -2.640 -2.651 0.587 1.00 0.00 H std
ATOM 282 HB3 TYR A 19 -4.216 -2.656 0.421 1.00 0.00 H std
ATOM 283 HD1 TYR A 19 -5.553 -0.788 1.354 1.00 0.00 H std
ATOM 284 HD2 TYR A 19 -1.518 -0.695 1.487 1.00 0.00 H std
ATOM 285 HE1 TYR A 19 -5.624 1.470 1.922 1.00 0.00 H std
ATOM 286 HE2 TYR A 19 -1.589 1.563 2.059 1.00 0.00 H std
ATOM 287 HH TYR A 19 -2.865 3.351 2.481 1.00 0.00 H std
ATOM 288 N CYS A 20 -2.500 -5.412 2.309 1.00 0.00 N
ATOM 289 CA CYS A 20 -2.420 -6.886 2.069 1.00 0.00 C
ATOM 290 C CYS A 20 -3.584 -7.611 2.767 1.00 0.00 C
ATOM 291 O CYS A 20 -4.729 -7.459 2.396 1.00 0.00 O
ATOM 292 CB CYS A 20 -1.076 -7.310 2.673 1.00 0.00 C
ATOM 293 SG CYS A 20 0.250 -6.262 2.032 1.00 0.00 S
ATOM 294 H CYS A 20 -1.820 -4.994 2.630 1.00 0.00 H std
ATOM 295 HA CYS A 20 -2.427 -7.073 1.117 1.00 0.00 H std
ATOM 296 HB2 CYS A 20 -1.114 -7.223 3.638 1.00 0.00 H std
ATOM 297 HB3 CYS A 20 -0.896 -8.234 2.441 1.00 0.00 H std
ATOM 298 N ASN A 21 -3.308 -8.402 3.773 1.00 0.00 N
ATOM 299 CA ASN A 21 -4.408 -9.124 4.472 1.00 0.00 C
ATOM 300 C ASN A 21 -5.437 -8.127 5.012 1.00 0.00 C
ATOM 301 O ASN A 21 -5.100 -6.961 5.124 1.00 0.00 O
ATOM 302 CB ASN A 21 -3.721 -9.863 5.618 1.00 0.00 C
ATOM 303 CG ASN A 21 -3.047 -11.124 5.074 1.00 0.00 C
ATOM 304 OD1 ASN A 21 -3.702 -11.988 4.528 1.00 0.00 O
ATOM 305 ND2 ASN A 21 -1.756 -11.265 5.200 1.00 0.00 N
ATOM 306 OXT ASN A 21 -6.543 -8.548 5.303 1.00 0.00 O
ATOM 307 H ASN A 21 -2.495 -8.510 4.032 1.00 0.00 H std
ATOM 308 HA ASN A 21 -4.831 -9.759 3.873 1.00 0.00 H std
ATOM 309 HB2 ASN A 21 -3.053 -9.286 6.021 1.00 0.00 H std
ATOM 310 HB3 ASN A 21 -4.379 -10.113 6.285 1.00 0.00 H std
ATOM 311 HD21 ASN A 21 -1.292 -10.653 5.586 1.00 0.00 H std
ATOM 312 HD22 ASN A 21 -1.369 -11.971 4.897 1.00 0.00 H std
TER 313 ASN A 21
ATOM 314 N PHE B 1 11.144 -2.426 -8.884 1.00 0.00 N
ATOM 315 CA PHE B 1 11.105 -1.883 -7.495 1.00 0.00 C
ATOM 316 C PHE B 1 11.782 -0.512 -7.444 1.00 0.00 C
ATOM 317 O PHE B 1 12.978 -0.391 -7.620 1.00 0.00 O
ATOM 318 CB PHE B 1 11.882 -2.890 -6.650 1.00 0.00 C
ATOM 319 CG PHE B 1 12.210 -2.277 -5.308 1.00 0.00 C
ATOM 320 CD1 PHE B 1 11.366 -1.304 -4.756 1.00 0.00 C
ATOM 321 CD2 PHE B 1 13.362 -2.679 -4.618 1.00 0.00 C
ATOM 322 CE1 PHE B 1 11.674 -0.733 -3.514 1.00 0.00 C
ATOM 323 CE2 PHE B 1 13.668 -2.108 -3.375 1.00 0.00 C
ATOM 324 CZ PHE B 1 12.825 -1.136 -2.823 1.00 0.00 C
ATOM 325 H1 PHE B 1 10.748 -3.223 -8.902 1.00 0.00 H std
ATOM 326 H2 PHE B 1 10.717 -1.870 -9.432 1.00 0.00 H std
ATOM 327 H3 PHE B 1 11.990 -2.509 -9.146 1.00 0.00 H std
ATOM 328 HA PHE B 1 10.190 -1.822 -7.180 1.00 0.00 H std
ATOM 329 HB2 PHE B 1 11.345 -3.687 -6.520 1.00 0.00 H std
ATOM 330 HB3 PHE B 1 12.705 -3.123 -7.107 1.00 0.00 H std
ATOM 331 HD1 PHE B 1 10.602 -1.037 -5.215 1.00 0.00 H std
ATOM 332 HD2 PHE B 1 13.922 -3.325 -4.984 1.00 0.00 H std
ATOM 333 HE1 PHE B 1 11.114 -0.087 -3.148 1.00 0.00 H std
ATOM 334 HE2 PHE B 1 14.432 -2.375 -2.917 1.00 0.00 H std
ATOM 335 HZ PHE B 1 13.029 -0.756 -1.999 1.00 0.00 H std
ATOM 336 N VAL B 2 11.024 0.518 -7.199 1.00 0.00 N
ATOM 337 CA VAL B 2 11.619 1.884 -7.133 1.00 0.00 C
ATOM 338 C VAL B 2 10.699 2.828 -6.350 1.00 0.00 C
ATOM 339 O VAL B 2 9.516 2.915 -6.612 1.00 0.00 O
ATOM 340 CB VAL B 2 11.732 2.341 -8.588 1.00 0.00 C
ATOM 341 CG1 VAL B 2 12.824 1.538 -9.297 1.00 0.00 C
ATOM 342 CG2 VAL B 2 10.395 2.115 -9.296 1.00 0.00 C
ATOM 343 H VAL B 2 10.180 0.407 -7.074 1.00 0.00 H std
ATOM 344 HA VAL B 2 12.499 1.853 -6.726 1.00 0.00 H std
ATOM 345 HB VAL B 2 11.957 3.284 -8.611 1.00 0.00 H std
ATOM 346 HG11 VAL B 2 13.558 1.377 -8.683 1.00 0.00 H std
ATOM 347 HG12 VAL B 2 12.460 0.690 -9.594 1.00 0.00 H std
ATOM 348 HG13 VAL B 2 13.146 2.038 -10.064 1.00 0.00 H std
ATOM 349 HG21 VAL B 2 9.779 1.675 -8.690 1.00 0.00 H std
ATOM 350 HG22 VAL B 2 10.025 2.969 -9.569 1.00 0.00 H std
ATOM 351 HG23 VAL B 2 10.532 1.557 -10.078 1.00 0.00 H std
ATOM 352 N ASN B 3 11.235 3.541 -5.398 1.00 0.00 N
ATOM 353 CA ASN B 3 10.392 4.485 -4.608 1.00 0.00 C
ATOM 354 C ASN B 3 9.812 5.554 -5.538 1.00 0.00 C
ATOM 355 O ASN B 3 10.505 6.451 -5.973 1.00 0.00 O
ATOM 356 CB ASN B 3 11.349 5.114 -3.594 1.00 0.00 C
ATOM 357 CG ASN B 3 10.974 4.655 -2.184 1.00 0.00 C
ATOM 358 OD1 ASN B 3 9.817 4.677 -1.813 1.00 0.00 O
ATOM 359 ND2 ASN B 3 11.911 4.238 -1.376 1.00 0.00 N
ATOM 360 H ASN B 3 12.076 3.473 -5.230 1.00 0.00 H std
ATOM 361 HA ASN B 3 9.683 4.008 -4.148 1.00 0.00 H std
ATOM 362 HB2 ASN B 3 12.256 4.835 -3.794 1.00 0.00 H std
ATOM 363 HB3 ASN B 3 11.289 6.081 -3.645 1.00 0.00 H std
ATOM 364 HD21 ASN B 3 12.730 4.222 -1.638 1.00 0.00 H std
ATOM 365 HD22 ASN B 3 11.709 3.977 -0.582 1.00 0.00 H std
ATOM 366 N GLN B 4 8.551 5.457 -5.865 1.00 0.00 N
ATOM 367 CA GLN B 4 7.950 6.458 -6.786 1.00 0.00 C
ATOM 368 C GLN B 4 6.421 6.487 -6.626 1.00 0.00 C
ATOM 369 O GLN B 4 5.868 5.938 -5.682 1.00 0.00 O
ATOM 370 CB GLN B 4 8.358 5.953 -8.177 1.00 0.00 C
ATOM 371 CG GLN B 4 8.231 7.079 -9.207 1.00 0.00 C
ATOM 372 CD GLN B 4 9.341 6.941 -10.250 1.00 0.00 C
ATOM 373 OE1 GLN B 4 9.520 5.886 -10.826 1.00 0.00 O
ATOM 374 NE2 GLN B 4 10.099 7.968 -10.521 1.00 0.00 N
ATOM 375 H GLN B 4 8.073 4.809 -5.563 1.00 0.00 H std
ATOM 376 HA GLN B 4 8.327 7.338 -6.628 1.00 0.00 H std
ATOM 377 HB2 GLN B 4 9.280 5.653 -8.147 1.00 0.00 H std
ATOM 378 HB3 GLN B 4 7.790 5.210 -8.435 1.00 0.00 H std
ATOM 379 HG2 GLN B 4 7.367 7.021 -9.644 1.00 0.00 H std
ATOM 380 HG3 GLN B 4 8.313 7.937 -8.762 1.00 0.00 H std
ATOM 381 HE21 GLN B 4 9.972 8.715 -10.114 1.00 0.00 H std
ATOM 382 HE22 GLN B 4 10.725 7.899 -11.107 1.00 0.00 H std
ATOM 383 N HIS B 5 5.734 7.131 -7.537 1.00 0.00 N
ATOM 384 CA HIS B 5 4.249 7.198 -7.449 1.00 0.00 C
ATOM 385 C HIS B 5 3.650 5.981 -8.173 1.00 0.00 C
ATOM 386 O HIS B 5 4.158 5.548 -9.187 1.00 0.00 O
ATOM 387 CB HIS B 5 3.855 8.517 -8.143 1.00 0.00 C
ATOM 388 CG HIS B 5 4.823 9.610 -7.768 1.00 0.00 C
ATOM 389 ND1 HIS B 5 4.489 10.609 -6.871 1.00 0.00 N
ATOM 390 CD2 HIS B 5 6.110 9.879 -8.165 1.00 0.00 C
ATOM 391 CE1 HIS B 5 5.551 11.427 -6.757 1.00 0.00 C
ATOM 392 NE2 HIS B 5 6.567 11.027 -7.526 1.00 0.00 N
ATOM 393 H HIS B 5 6.140 7.519 -8.189 1.00 0.00 H std
ATOM 394 HA HIS B 5 3.977 7.207 -6.518 1.00 0.00 H std
ATOM 395 HB2 HIS B 5 3.865 8.394 -9.105 1.00 0.00 H std
ATOM 396 HB3 HIS B 5 2.960 8.779 -7.875 1.00 0.00 H std
ATOM 398 HD2 HIS B 5 6.602 9.370 -8.769 1.00 0.00 H std
ATOM 399 HE1 HIS B 5 5.573 12.178 -6.209 1.00 0.00 H std
ATOM 0 HE2 HIS B 5 7.338 11.399 -7.608 1.00 0.00 H new
ATOM 400 N LEU B 6 2.608 5.394 -7.638 1.00 0.00 N
ATOM 401 CA LEU B 6 2.038 4.173 -8.287 1.00 0.00 C
ATOM 402 C LEU B 6 0.558 4.294 -8.676 1.00 0.00 C
ATOM 403 O LEU B 6 -0.163 3.326 -8.589 1.00 0.00 O
ATOM 404 CB LEU B 6 2.157 3.085 -7.218 1.00 0.00 C
ATOM 405 CG LEU B 6 3.612 2.881 -6.809 1.00 0.00 C
ATOM 406 CD1 LEU B 6 3.669 2.365 -5.370 1.00 0.00 C
ATOM 407 CD2 LEU B 6 4.241 1.845 -7.725 1.00 0.00 C
ATOM 408 H LEU B 6 2.281 5.686 -6.898 1.00 0.00 H std
ATOM 409 HA LEU B 6 2.568 3.939 -9.065 1.00 0.00 H std
ATOM 410 HB2 LEU B 6 1.641 3.347 -6.440 1.00 0.00 H std
ATOM 411 HB3 LEU B 6 1.799 2.254 -7.567 1.00 0.00 H std
ATOM 412 HG LEU B 6 4.095 3.719 -6.877 1.00 0.00 H std
ATOM 413 HD11 LEU B 6 2.792 2.446 -4.963 1.00 0.00 H std
ATOM 414 HD12 LEU B 6 3.939 1.433 -5.373 1.00 0.00 H std
ATOM 415 HD13 LEU B 6 4.311 2.886 -4.863 1.00 0.00 H std
ATOM 416 HD21 LEU B 6 3.636 1.662 -8.461 1.00 0.00 H std
ATOM 417 HD22 LEU B 6 5.083 2.185 -8.067 1.00 0.00 H std
ATOM 418 HD23 LEU B 6 4.397 1.030 -7.223 1.00 0.00 H std
ATOM 419 N CYS B 7 0.101 5.431 -9.110 1.00 0.00 N
ATOM 420 CA CYS B 7 -1.348 5.570 -9.493 1.00 0.00 C
ATOM 421 C CYS B 7 -2.023 4.220 -9.767 1.00 0.00 C
ATOM 422 O CYS B 7 -1.537 3.407 -10.522 1.00 0.00 O
ATOM 423 CB CYS B 7 -1.363 6.460 -10.729 1.00 0.00 C
ATOM 424 SG CYS B 7 -2.661 7.689 -10.521 1.00 0.00 S
ATOM 425 H CYS B 7 0.632 6.104 -9.180 1.00 0.00 H std
ATOM 426 HA CYS B 7 -1.829 6.015 -8.778 1.00 0.00 H std
ATOM 427 HB2 CYS B 7 -0.508 6.909 -10.818 1.00 0.00 H std
ATOM 428 HB3 CYS B 7 -1.543 5.928 -11.520 1.00 0.00 H std
ATOM 429 N GLY B 8 -3.135 4.004 -9.105 1.00 0.00 N
ATOM 430 CA GLY B 8 -3.933 2.735 -9.209 1.00 0.00 C
ATOM 431 C GLY B 8 -3.301 1.672 -10.128 1.00 0.00 C
ATOM 432 O GLY B 8 -2.942 0.607 -9.668 1.00 0.00 O
ATOM 433 H GLY B 8 -3.414 4.616 -8.569 1.00 0.00 H std
ATOM 434 HA2 GLY B 8 -4.008 2.355 -8.320 1.00 0.00 H std
ATOM 435 HA3 GLY B 8 -4.826 2.947 -9.523 1.00 0.00 H std
ATOM 436 N SER B 9 -3.178 1.908 -11.414 1.00 0.00 N
ATOM 437 CA SER B 9 -2.593 0.852 -12.282 1.00 0.00 C
ATOM 438 C SER B 9 -1.210 0.453 -11.784 1.00 0.00 C
ATOM 439 O SER B 9 -0.817 -0.700 -11.855 1.00 0.00 O
ATOM 440 CB SER B 9 -2.513 1.470 -13.678 1.00 0.00 C
ATOM 441 OG SER B 9 -1.306 2.212 -13.796 1.00 0.00 O
ATOM 442 H SER B 9 -3.438 2.651 -11.762 1.00 0.00 H std
ATOM 443 HA SER B 9 -3.176 0.077 -12.293 1.00 0.00 H std
ATOM 444 HB2 SER B 9 -2.520 0.767 -14.346 1.00 0.00 H std
ATOM 445 HB3 SER B 9 -3.277 2.052 -13.818 1.00 0.00 H std
ATOM 446 HG SER B 9 -1.279 2.542 -14.568 1.00 0.00 H std
ATOM 447 N HIS B 10 -0.477 1.376 -11.242 1.00 0.00 N
ATOM 448 CA HIS B 10 0.857 1.011 -10.723 1.00 0.00 C
ATOM 449 C HIS B 10 0.653 0.402 -9.353 1.00 0.00 C
ATOM 450 O HIS B 10 1.271 -0.577 -8.985 1.00 0.00 O
ATOM 451 CB HIS B 10 1.634 2.319 -10.649 1.00 0.00 C
ATOM 452 CG HIS B 10 2.547 2.429 -11.837 1.00 0.00 C
ATOM 453 ND1 HIS B 10 3.788 3.042 -11.762 1.00 0.00 N
ATOM 454 CD2 HIS B 10 2.416 2.007 -13.137 1.00 0.00 C
ATOM 455 CE1 HIS B 10 4.350 2.969 -12.983 1.00 0.00 C
ATOM 456 NE2 HIS B 10 3.556 2.349 -13.858 1.00 0.00 N
ATOM 457 H HIS B 10 -0.776 2.177 -11.152 1.00 0.00 H std
ATOM 458 HA HIS B 10 1.296 0.383 -11.318 1.00 0.00 H std
ATOM 459 HB2 HIS B 10 1.013 3.065 -10.648 1.00 0.00 H std
ATOM 460 HB3 HIS B 10 2.160 2.329 -9.834 1.00 0.00 H std
ATOM 462 HD2 HIS B 10 1.676 1.563 -13.483 1.00 0.00 H std
ATOM 463 HE1 HIS B 10 5.191 3.307 -13.190 1.00 0.00 H std
ATOM 0 HE2 HIS B 10 3.715 2.194 -14.689 1.00 0.00 H new
ATOM 464 N LEU B 11 -0.243 0.964 -8.603 1.00 0.00 N
ATOM 465 CA LEU B 11 -0.523 0.405 -7.263 1.00 0.00 C
ATOM 466 C LEU B 11 -1.008 -1.020 -7.406 1.00 0.00 C
ATOM 467 O LEU B 11 -0.491 -1.922 -6.782 1.00 0.00 O
ATOM 468 CB LEU B 11 -1.654 1.238 -6.684 1.00 0.00 C
ATOM 469 CG LEU B 11 -1.063 2.410 -5.917 1.00 0.00 C
ATOM 470 CD1 LEU B 11 -2.186 3.230 -5.284 1.00 0.00 C
ATOM 471 CD2 LEU B 11 -0.155 1.852 -4.826 1.00 0.00 C
ATOM 472 H LEU B 11 -0.677 1.650 -8.888 1.00 0.00 H std
ATOM 473 HA LEU B 11 0.264 0.453 -6.698 1.00 0.00 H std
ATOM 474 HB2 LEU B 11 -2.227 1.551 -7.401 1.00 0.00 H std
ATOM 475 HB3 LEU B 11 -2.174 0.692 -6.074 1.00 0.00 H std
ATOM 476 HG LEU B 11 -0.546 2.971 -6.517 1.00 0.00 H std
ATOM 477 HD11 LEU B 11 -3.037 2.954 -5.659 1.00 0.00 H std
ATOM 478 HD12 LEU B 11 -2.192 3.083 -4.325 1.00 0.00 H std
ATOM 479 HD13 LEU B 11 -2.040 4.171 -5.467 1.00 0.00 H std
ATOM 480 HD21 LEU B 11 -0.161 0.883 -4.869 1.00 0.00 H std
ATOM 481 HD22 LEU B 11 0.749 2.176 -4.962 1.00 0.00 H std
ATOM 482 HD23 LEU B 11 -0.479 2.139 -3.958 1.00 0.00 H std
ATOM 483 N VAL B 12 -2.011 -1.246 -8.215 1.00 0.00 N
ATOM 484 CA VAL B 12 -2.498 -2.621 -8.338 1.00 0.00 C
ATOM 485 C VAL B 12 -1.325 -3.524 -8.713 1.00 0.00 C
ATOM 486 O VAL B 12 -1.314 -4.696 -8.406 1.00 0.00 O
ATOM 487 CB VAL B 12 -3.586 -2.570 -9.415 1.00 0.00 C
ATOM 488 CG1 VAL B 12 -3.581 -3.849 -10.250 1.00 0.00 C
ATOM 489 CG2 VAL B 12 -4.952 -2.415 -8.742 1.00 0.00 C
ATOM 490 H VAL B 12 -2.383 -0.614 -8.664 1.00 0.00 H std
ATOM 491 HA VAL B 12 -2.881 -2.891 -7.489 1.00 0.00 H std
ATOM 492 HB VAL B 12 -3.425 -1.807 -9.992 1.00 0.00 H std
ATOM 493 HG11 VAL B 12 -3.556 -4.619 -9.661 1.00 0.00 H std
ATOM 494 HG12 VAL B 12 -4.383 -3.880 -10.794 1.00 0.00 H std
ATOM 495 HG13 VAL B 12 -2.799 -3.854 -10.824 1.00 0.00 H std
ATOM 496 HG21 VAL B 12 -4.869 -1.832 -7.971 1.00 0.00 H std
ATOM 497 HG22 VAL B 12 -5.580 -2.031 -9.373 1.00 0.00 H std
ATOM 498 HG23 VAL B 12 -5.271 -3.286 -8.457 1.00 0.00 H std
ATOM 499 N GLU B 13 -0.322 -2.981 -9.357 1.00 0.00 N
ATOM 500 CA GLU B 13 0.854 -3.821 -9.720 1.00 0.00 C
ATOM 501 C GLU B 13 1.937 -3.731 -8.628 1.00 0.00 C
ATOM 502 O GLU B 13 2.844 -4.543 -8.573 1.00 0.00 O
ATOM 503 CB GLU B 13 1.343 -3.268 -11.075 1.00 0.00 C
ATOM 504 CG GLU B 13 2.576 -2.372 -10.900 1.00 0.00 C
ATOM 505 CD GLU B 13 3.843 -3.219 -11.018 1.00 0.00 C
ATOM 506 OE1 GLU B 13 4.110 -3.701 -12.106 1.00 0.00 O
ATOM 507 OE2 GLU B 13 4.524 -3.373 -10.018 1.00 0.00 O
ATOM 508 H GLU B 13 -0.338 -2.145 -9.559 1.00 0.00 H std
ATOM 509 HA GLU B 13 0.575 -4.744 -9.827 1.00 0.00 H std
ATOM 510 HB2 GLU B 13 1.572 -4.010 -11.657 1.00 0.00 H std
ATOM 511 HB3 GLU B 13 0.630 -2.753 -11.484 1.00 0.00 H std
ATOM 512 HG2 GLU B 13 2.578 -1.689 -11.589 1.00 0.00 H std
ATOM 513 HG3 GLU B 13 2.552 -1.950 -10.027 1.00 0.00 H std
ATOM 514 N ALA B 14 1.833 -2.776 -7.736 1.00 0.00 N
ATOM 515 CA ALA B 14 2.846 -2.665 -6.650 1.00 0.00 C
ATOM 516 C ALA B 14 2.257 -3.263 -5.389 1.00 0.00 C
ATOM 517 O ALA B 14 2.953 -3.606 -4.454 1.00 0.00 O
ATOM 518 CB ALA B 14 3.099 -1.162 -6.474 1.00 0.00 C
ATOM 519 H ALA B 14 1.168 -2.231 -7.753 1.00 0.00 H std
ATOM 520 HA ALA B 14 3.664 -3.124 -6.898 1.00 0.00 H std
ATOM 521 HB1 ALA B 14 2.307 -0.666 -6.734 1.00 0.00 H std
ATOM 522 HB2 ALA B 14 3.305 -0.975 -5.545 1.00 0.00 H std
ATOM 523 HB3 ALA B 14 3.846 -0.892 -7.030 1.00 0.00 H std
ATOM 524 N LEU B 15 0.967 -3.400 -5.371 1.00 0.00 N
ATOM 525 CA LEU B 15 0.293 -3.982 -4.198 1.00 0.00 C
ATOM 526 C LEU B 15 0.144 -5.485 -4.428 1.00 0.00 C
ATOM 527 O LEU B 15 0.087 -6.266 -3.499 1.00 0.00 O
ATOM 528 CB LEU B 15 -1.029 -3.230 -4.181 1.00 0.00 C
ATOM 529 CG LEU B 15 -2.170 -4.113 -3.686 1.00 0.00 C
ATOM 530 CD1 LEU B 15 -1.742 -4.842 -2.413 1.00 0.00 C
ATOM 531 CD2 LEU B 15 -3.391 -3.241 -3.386 1.00 0.00 C
ATOM 532 H LEU B 15 0.496 -3.157 -6.048 1.00 0.00 H std
ATOM 533 HA LEU B 15 0.799 -3.807 -3.389 1.00 0.00 H std
ATOM 534 HB2 LEU B 15 -0.941 -2.444 -3.620 1.00 0.00 H std
ATOM 535 HB3 LEU B 15 -1.222 -2.935 -5.085 1.00 0.00 H std
ATOM 536 HG LEU B 15 -2.396 -4.756 -4.376 1.00 0.00 H std
ATOM 537 HD11 LEU B 15 -0.833 -4.591 -2.187 1.00 0.00 H std
ATOM 538 HD12 LEU B 15 -2.335 -4.596 -1.686 1.00 0.00 H std
ATOM 539 HD13 LEU B 15 -1.787 -5.800 -2.557 1.00 0.00 H std
ATOM 540 HD21 LEU B 15 -3.517 -2.606 -4.108 1.00 0.00 H std
ATOM 541 HD22 LEU B 15 -4.178 -3.803 -3.308 1.00 0.00 H std
ATOM 542 HD23 LEU B 15 -3.250 -2.761 -2.555 1.00 0.00 H std
ATOM 543 N TYR B 16 0.144 -5.903 -5.667 1.00 0.00 N
ATOM 544 CA TYR B 16 0.074 -7.359 -5.946 1.00 0.00 C
ATOM 545 C TYR B 16 1.485 -7.913 -5.831 1.00 0.00 C
ATOM 546 O TYR B 16 1.712 -8.975 -5.285 1.00 0.00 O
ATOM 547 CB TYR B 16 -0.441 -7.497 -7.392 1.00 0.00 C
ATOM 548 CG TYR B 16 0.567 -8.248 -8.257 1.00 0.00 C
ATOM 549 CD1 TYR B 16 0.735 -9.634 -8.097 1.00 0.00 C
ATOM 550 CD2 TYR B 16 1.335 -7.559 -9.208 1.00 0.00 C
ATOM 551 CE1 TYR B 16 1.663 -10.325 -8.888 1.00 0.00 C
ATOM 552 CE2 TYR B 16 2.263 -8.253 -9.997 1.00 0.00 C
ATOM 553 CZ TYR B 16 2.425 -9.635 -9.837 1.00 0.00 C
ATOM 554 OH TYR B 16 3.338 -10.316 -10.615 1.00 0.00 O
ATOM 555 H TYR B 16 0.226 -5.344 -6.315 1.00 0.00 H std
ATOM 556 HA TYR B 16 -0.525 -7.803 -5.325 1.00 0.00 H std
ATOM 557 HB2 TYR B 16 -1.281 -7.982 -7.390 1.00 0.00 H std
ATOM 558 HB3 TYR B 16 -0.586 -6.612 -7.762 1.00 0.00 H std
ATOM 559 HD1 TYR B 16 0.234 -10.096 -7.464 1.00 0.00 H std
ATOM 560 HD2 TYR B 16 1.235 -6.640 -9.313 1.00 0.00 H std
ATOM 561 HE1 TYR B 16 1.773 -11.242 -8.780 1.00 0.00 H std
ATOM 562 HE2 TYR B 16 2.770 -7.795 -10.629 1.00 0.00 H std
ATOM 563 HH TYR B 16 3.555 -9.819 -11.256 1.00 0.00 H std
ATOM 564 N LEU B 17 2.439 -7.201 -6.372 1.00 0.00 N
ATOM 565 CA LEU B 17 3.823 -7.710 -6.314 1.00 0.00 C
ATOM 566 C LEU B 17 4.212 -7.746 -4.864 1.00 0.00 C
ATOM 567 O LEU B 17 5.031 -8.534 -4.433 1.00 0.00 O
ATOM 568 CB LEU B 17 4.703 -6.654 -6.975 1.00 0.00 C
ATOM 569 CG LEU B 17 5.631 -7.264 -8.050 1.00 0.00 C
ATOM 570 CD1 LEU B 17 5.914 -8.743 -7.767 1.00 0.00 C
ATOM 571 CD2 LEU B 17 4.963 -7.136 -9.420 1.00 0.00 C
ATOM 572 H LEU B 17 2.262 -6.458 -6.767 1.00 0.00 H std
ATOM 573 HA LEU B 17 3.895 -8.575 -6.747 1.00 0.00 H std
ATOM 574 HB2 LEU B 17 4.141 -5.954 -7.343 1.00 0.00 H std
ATOM 575 HB3 LEU B 17 5.265 -6.256 -6.292 1.00 0.00 H std
ATOM 576 HG LEU B 17 6.470 -6.777 -8.059 1.00 0.00 H std
ATOM 577 HD11 LEU B 17 5.982 -8.883 -6.810 1.00 0.00 H std
ATOM 578 HD12 LEU B 17 5.190 -9.282 -8.121 1.00 0.00 H std
ATOM 579 HD13 LEU B 17 6.746 -9.001 -8.193 1.00 0.00 H std
ATOM 580 HD21 LEU B 17 4.106 -6.692 -9.322 1.00 0.00 H std
ATOM 581 HD22 LEU B 17 5.530 -6.615 -10.010 1.00 0.00 H std
ATOM 582 HD23 LEU B 17 4.827 -8.019 -9.798 1.00 0.00 H std
ATOM 583 N VAL B 18 3.656 -6.840 -4.110 1.00 0.00 N
ATOM 584 CA VAL B 18 4.031 -6.774 -2.702 1.00 0.00 C
ATOM 585 C VAL B 18 3.103 -7.656 -1.860 1.00 0.00 C
ATOM 586 O VAL B 18 3.462 -8.124 -0.797 1.00 0.00 O
ATOM 587 CB VAL B 18 3.905 -5.293 -2.313 1.00 0.00 C
ATOM 588 CG1 VAL B 18 2.466 -4.967 -1.900 1.00 0.00 C
ATOM 589 CG2 VAL B 18 4.843 -4.999 -1.140 1.00 0.00 C
ATOM 590 H VAL B 18 3.101 -6.271 -4.440 1.00 0.00 H std
ATOM 591 HA VAL B 18 4.957 -7.055 -2.635 1.00 0.00 H std
ATOM 592 HB VAL B 18 4.152 -4.740 -3.070 1.00 0.00 H std
ATOM 593 HG11 VAL B 18 1.848 -5.479 -2.445 1.00 0.00 H std
ATOM 594 HG12 VAL B 18 2.338 -5.193 -0.966 1.00 0.00 H std
ATOM 595 HG13 VAL B 18 2.299 -4.020 -2.027 1.00 0.00 H std
ATOM 596 HG21 VAL B 18 5.696 -5.437 -1.290 1.00 0.00 H std
ATOM 597 HG22 VAL B 18 4.979 -4.041 -1.068 1.00 0.00 H std
ATOM 598 HG23 VAL B 18 4.449 -5.332 -0.319 1.00 0.00 H std
ATOM 599 N CYS B 19 1.901 -7.865 -2.327 1.00 0.00 N
ATOM 600 CA CYS B 19 0.930 -8.693 -1.559 1.00 0.00 C
ATOM 601 C CYS B 19 -0.118 -9.288 -2.517 1.00 0.00 C
ATOM 602 O CYS B 19 -1.299 -9.034 -2.383 1.00 0.00 O
ATOM 603 CB CYS B 19 0.273 -7.697 -0.608 1.00 0.00 C
ATOM 604 SG CYS B 19 1.317 -7.498 0.853 1.00 0.00 S
ATOM 605 H CYS B 19 1.666 -7.513 -3.075 1.00 0.00 H std
ATOM 606 HA CYS B 19 1.384 -9.382 -1.049 1.00 0.00 H std
ATOM 607 HB2 CYS B 19 0.174 -6.841 -1.053 1.00 0.00 H std
ATOM 608 HB3 CYS B 19 -0.600 -8.025 -0.341 1.00 0.00 H std
ATOM 609 N GLY B 20 0.297 -10.055 -3.497 1.00 0.00 N
ATOM 610 CA GLY B 20 -0.681 -10.627 -4.461 1.00 0.00 C
ATOM 611 C GLY B 20 -1.296 -11.915 -3.913 1.00 0.00 C
ATOM 612 O GLY B 20 -2.425 -11.933 -3.470 1.00 0.00 O
ATOM 613 H GLY B 20 1.135 -10.221 -3.598 1.00 0.00 H std
ATOM 614 HA2 GLY B 20 -1.386 -9.981 -4.623 1.00 0.00 H std
ATOM 615 HA3 GLY B 20 -0.224 -10.818 -5.295 1.00 0.00 H std
ATOM 616 N GLU B 21 -0.571 -12.993 -3.955 1.00 0.00 N
ATOM 617 CA GLU B 21 -1.123 -14.285 -3.447 1.00 0.00 C
ATOM 618 C GLU B 21 -1.820 -14.078 -2.101 1.00 0.00 C
ATOM 619 O GLU B 21 -2.697 -14.827 -1.721 1.00 0.00 O
ATOM 620 CB GLU B 21 0.089 -15.202 -3.286 1.00 0.00 C
ATOM 621 CG GLU B 21 0.287 -16.017 -4.565 1.00 0.00 C
ATOM 622 CD GLU B 21 1.374 -17.069 -4.337 1.00 0.00 C
ATOM 623 OE1 GLU B 21 1.036 -18.161 -3.912 1.00 0.00 O
ATOM 624 OE2 GLU B 21 2.528 -16.764 -4.589 1.00 0.00 O
ATOM 625 H GLU B 21 0.222 -12.961 -4.285 1.00 0.00 H std
ATOM 626 HA GLU B 21 -1.742 -14.662 -4.092 1.00 0.00 H std
ATOM 627 HB2 GLU B 21 0.879 -14.665 -3.117 1.00 0.00 H std
ATOM 628 HB3 GLU B 21 -0.058 -15.804 -2.540 1.00 0.00 H std
ATOM 629 HG2 GLU B 21 -0.545 -16.457 -4.799 1.00 0.00 H std
ATOM 630 HG3 GLU B 21 0.556 -15.427 -5.286 1.00 0.00 H std
ATOM 631 N ARG B 22 -1.438 -13.063 -1.379 1.00 0.00 N
ATOM 632 CA ARG B 22 -2.079 -12.802 -0.057 1.00 0.00 C
ATOM 633 C ARG B 22 -3.418 -12.093 -0.257 1.00 0.00 C
ATOM 634 O ARG B 22 -4.236 -12.017 0.638 1.00 0.00 O
ATOM 635 CB ARG B 22 -1.103 -11.891 0.686 1.00 0.00 C
ATOM 636 CG ARG B 22 0.154 -12.676 1.062 1.00 0.00 C
ATOM 637 CD ARG B 22 0.324 -12.660 2.582 1.00 0.00 C
ATOM 638 NE ARG B 22 1.726 -13.101 2.821 1.00 0.00 N
ATOM 639 CZ ARG B 22 2.648 -12.221 3.100 1.00 0.00 C
ATOM 640 NH1 ARG B 22 2.844 -11.206 2.304 1.00 0.00 N
ATOM 641 NH2 ARG B 22 3.374 -12.355 4.176 1.00 0.00 N
ATOM 642 H ARG B 22 -0.816 -12.544 -1.669 1.00 0.00 H std
ATOM 643 HA ARG B 22 -2.201 -13.631 0.432 1.00 0.00 H std
ATOM 644 HB2 ARG B 22 -0.862 -11.146 0.114 1.00 0.00 H std
ATOM 645 HB3 ARG B 22 -1.525 -11.555 1.492 1.00 0.00 H std
ATOM 646 HG2 ARG B 22 0.069 -13.592 0.754 1.00 0.00 H std
ATOM 647 HG3 ARG B 22 0.929 -12.265 0.648 1.00 0.00 H std
ATOM 648 HD2 ARG B 22 0.186 -11.764 2.926 1.00 0.00 H std
ATOM 649 HD3 ARG B 22 -0.296 -13.281 2.996 1.00 0.00 H std
ATOM 650 HE ARG B 22 1.928 -13.936 2.776 1.00 0.00 H std
ATOM 651 HH11 ARG B 22 2.367 -11.117 1.594 1.00 0.00 H std
ATOM 652 HH12 ARG B 22 3.449 -10.624 2.491 1.00 0.00 H std
ATOM 653 HH21 ARG B 22 3.244 -13.024 4.701 1.00 0.00 H std
ATOM 654 HH22 ARG B 22 3.981 -11.775 4.361 1.00 0.00 H std
ATOM 655 N GLY B 23 -3.639 -11.570 -1.428 1.00 0.00 N
ATOM 656 CA GLY B 23 -4.917 -10.856 -1.701 1.00 0.00 C
ATOM 657 C GLY B 23 -4.953 -9.562 -0.892 1.00 0.00 C
ATOM 658 O GLY B 23 -4.115 -9.327 -0.042 1.00 0.00 O
ATOM 659 H GLY B 23 -3.042 -11.635 -2.044 1.00 0.00 H std
ATOM 660 HA2 GLY B 23 -4.975 -10.650 -2.647 1.00 0.00 H std
ATOM 661 HA3 GLY B 23 -5.665 -11.417 -1.443 1.00 0.00 H std
ATOM 662 N PHE B 24 -5.913 -8.719 -1.142 1.00 0.00 N
ATOM 663 CA PHE B 24 -5.997 -7.445 -0.379 1.00 0.00 C
ATOM 664 C PHE B 24 -7.314 -6.733 -0.665 1.00 0.00 C
ATOM 665 O PHE B 24 -8.227 -7.288 -1.240 1.00 0.00 O
ATOM 666 CB PHE B 24 -4.829 -6.594 -0.875 1.00 0.00 C
ATOM 667 CG PHE B 24 -4.895 -6.475 -2.376 1.00 0.00 C
ATOM 668 CD1 PHE B 24 -5.921 -5.729 -2.973 1.00 0.00 C
ATOM 669 CD2 PHE B 24 -3.932 -7.106 -3.172 1.00 0.00 C
ATOM 670 CE1 PHE B 24 -5.982 -5.614 -4.367 1.00 0.00 C
ATOM 671 CE2 PHE B 24 -3.993 -6.990 -4.565 1.00 0.00 C
ATOM 672 CZ PHE B 24 -5.017 -6.244 -5.164 1.00 0.00 C
ATOM 673 H PHE B 24 -6.500 -8.900 -1.744 1.00 0.00 H std
ATOM 674 HA PHE B 24 -5.903 -7.612 0.572 1.00 0.00 H std
ATOM 675 HB2 PHE B 24 -4.885 -5.708 -0.483 1.00 0.00 H std
ATOM 676 HB3 PHE B 24 -3.991 -7.010 -0.618 1.00 0.00 H std
ATOM 677 HD1 PHE B 24 -6.561 -5.311 -2.443 1.00 0.00 H std
ATOM 678 HD2 PHE B 24 -3.252 -7.600 -2.774 1.00 0.00 H std
ATOM 679 HE1 PHE B 24 -6.662 -5.119 -4.764 1.00 0.00 H std
ATOM 680 HE2 PHE B 24 -3.352 -7.408 -5.094 1.00 0.00 H std
ATOM 681 HZ PHE B 24 -5.056 -6.168 -6.090 1.00 0.00 H std
ATOM 682 N PHE B 25 -7.405 -5.501 -0.265 1.00 0.00 N
ATOM 683 CA PHE B 25 -8.657 -4.729 -0.507 1.00 0.00 C
ATOM 684 C PHE B 25 -8.375 -3.232 -0.390 1.00 0.00 C
ATOM 685 O PHE B 25 -8.449 -2.659 0.680 1.00 0.00 O
ATOM 686 CB PHE B 25 -9.620 -5.187 0.588 1.00 0.00 C
ATOM 687 CG PHE B 25 -11.025 -4.750 0.246 1.00 0.00 C
ATOM 688 CD1 PHE B 25 -11.622 -5.176 -0.947 1.00 0.00 C
ATOM 689 CD2 PHE B 25 -11.732 -3.919 1.126 1.00 0.00 C
ATOM 690 CE1 PHE B 25 -12.928 -4.772 -1.261 1.00 0.00 C
ATOM 691 CE2 PHE B 25 -13.035 -3.515 0.813 1.00 0.00 C
ATOM 692 CZ PHE B 25 -13.634 -3.940 -0.380 1.00 0.00 C
ATOM 693 H PHE B 25 -6.739 -5.133 0.136 1.00 0.00 H std
ATOM 694 HA PHE B 25 -9.022 -4.939 -1.381 1.00 0.00 H std
ATOM 695 HB2 PHE B 25 -9.591 -6.154 0.657 1.00 0.00 H std
ATOM 696 HB3 PHE B 25 -9.358 -4.794 1.435 1.00 0.00 H std
ATOM 697 HD1 PHE B 25 -11.155 -5.727 -1.532 1.00 0.00 H std
ATOM 698 HD2 PHE B 25 -11.334 -3.636 1.918 1.00 0.00 H std
ATOM 699 HE1 PHE B 25 -13.325 -5.054 -2.053 1.00 0.00 H std
ATOM 700 HE2 PHE B 25 -13.504 -2.963 1.397 1.00 0.00 H std
ATOM 701 HZ PHE B 25 -14.500 -3.673 -0.588 1.00 0.00 H std
ATOM 702 N TYR B 26 -8.047 -2.589 -1.476 1.00 0.00 N
ATOM 703 CA TYR B 26 -7.758 -1.130 -1.411 1.00 0.00 C
ATOM 704 C TYR B 26 -8.728 -0.352 -2.314 1.00 0.00 C
ATOM 705 O TYR B 26 -8.724 -0.490 -3.521 1.00 0.00 O
ATOM 706 CB TYR B 26 -6.291 -0.999 -1.868 1.00 0.00 C
ATOM 707 CG TYR B 26 -6.204 -0.623 -3.332 1.00 0.00 C
ATOM 708 CD1 TYR B 26 -6.297 -1.612 -4.322 1.00 0.00 C
ATOM 709 CD2 TYR B 26 -6.032 0.719 -3.698 1.00 0.00 C
ATOM 710 CE1 TYR B 26 -6.217 -1.256 -5.676 1.00 0.00 C
ATOM 711 CE2 TYR B 26 -5.952 1.073 -5.050 1.00 0.00 C
ATOM 712 CZ TYR B 26 -6.044 0.085 -6.039 1.00 0.00 C
ATOM 713 OH TYR B 26 -5.964 0.434 -7.372 1.00 0.00 O
ATOM 714 H TYR B 26 -7.995 -3.007 -2.226 1.00 0.00 H std
ATOM 715 HA TYR B 26 -7.841 -0.820 -0.496 1.00 0.00 H std
ATOM 716 HB2 TYR B 26 -5.851 -0.317 -1.337 1.00 0.00 H std
ATOM 717 HB3 TYR B 26 -5.839 -1.846 -1.731 1.00 0.00 H std
ATOM 718 HD1 TYR B 26 -6.412 -2.503 -4.081 1.00 0.00 H std
ATOM 719 HD2 TYR B 26 -5.970 1.375 -3.042 1.00 0.00 H std
ATOM 720 HE1 TYR B 26 -6.278 -1.912 -6.332 1.00 0.00 H std
ATOM 721 HE2 TYR B 26 -5.837 1.964 -5.291 1.00 0.00 H std
ATOM 722 HH TYR B 26 -6.071 1.265 -7.430 1.00 0.00 H std
ATOM 723 N THR B 27 -9.569 0.460 -1.732 1.00 0.00 N
ATOM 724 CA THR B 27 -10.538 1.239 -2.554 1.00 0.00 C
ATOM 725 C THR B 27 -10.936 2.537 -1.840 1.00 0.00 C
ATOM 726 O THR B 27 -12.094 2.906 -1.842 1.00 0.00 O
ATOM 727 CB THR B 27 -11.752 0.320 -2.699 1.00 0.00 C
ATOM 728 OG1 THR B 27 -12.141 -0.146 -1.414 1.00 0.00 O
ATOM 729 CG2 THR B 27 -11.392 -0.872 -3.588 1.00 0.00 C
ATOM 730 H THR B 27 -9.569 0.540 -0.876 1.00 0.00 H std
ATOM 731 HA THR B 27 -10.166 1.431 -3.429 1.00 0.00 H std
ATOM 732 HB THR B 27 -12.486 0.811 -3.101 1.00 0.00 H std
ATOM 733 HG1 THR B 27 -12.808 -0.647 -1.511 1.00 0.00 H std
ATOM 734 HG21 THR B 27 -10.926 -0.557 -4.378 1.00 0.00 H std
ATOM 735 HG22 THR B 27 -10.820 -1.482 -3.097 1.00 0.00 H std
ATOM 736 HG23 THR B 27 -12.203 -1.333 -3.854 1.00 0.00 H std
ATOM 737 N PRO B 28 -9.968 3.197 -1.249 1.00 0.00 N
ATOM 738 CA PRO B 28 -10.251 4.465 -0.535 1.00 0.00 C
ATOM 739 C PRO B 28 -10.513 5.590 -1.533 1.00 0.00 C
ATOM 740 O PRO B 28 -10.090 5.537 -2.672 1.00 0.00 O
ATOM 741 CB PRO B 28 -8.973 4.734 0.249 1.00 0.00 C
ATOM 742 CG PRO B 28 -7.904 4.024 -0.509 1.00 0.00 C
ATOM 743 CD PRO B 28 -8.545 2.840 -1.185 1.00 0.00 C
ATOM 744 HA PRO B 28 -11.000 4.360 0.072 1.00 0.00 H std
ATOM 745 HB2 PRO B 28 -8.787 5.685 0.282 1.00 0.00 H std
ATOM 746 HB3 PRO B 28 -9.041 4.369 1.145 1.00 0.00 H std
ATOM 747 HG2 PRO B 28 -7.517 4.618 -1.171 1.00 0.00 H std
ATOM 748 HG3 PRO B 28 -7.219 3.720 0.107 1.00 0.00 H std
ATOM 749 HD2 PRO B 28 -8.179 2.718 -2.075 1.00 0.00 H std
ATOM 750 HD3 PRO B 28 -8.422 2.039 -0.652 1.00 0.00 H std
ATOM 751 N LYS B 29 -11.203 6.606 -1.112 1.00 0.00 N
ATOM 752 CA LYS B 29 -11.497 7.745 -2.029 1.00 0.00 C
ATOM 753 C LYS B 29 -11.783 9.013 -1.225 1.00 0.00 C
ATOM 754 O LYS B 29 -12.882 9.532 -1.233 1.00 0.00 O
ATOM 755 CB LYS B 29 -12.738 7.314 -2.801 1.00 0.00 C
ATOM 756 CG LYS B 29 -12.329 6.810 -4.188 1.00 0.00 C
ATOM 757 CD LYS B 29 -11.859 7.991 -5.037 1.00 0.00 C
ATOM 758 CE LYS B 29 -11.677 7.536 -6.487 1.00 0.00 C
ATOM 759 NZ LYS B 29 -12.885 8.031 -7.203 1.00 0.00 N
ATOM 760 H LYS B 29 -11.488 6.617 -0.301 1.00 0.00 H std
ATOM 761 HA LYS B 29 -10.758 7.888 -2.641 1.00 0.00 H std
ATOM 762 HB2 LYS B 29 -13.183 6.603 -2.313 1.00 0.00 H std
ATOM 763 HB3 LYS B 29 -13.340 8.069 -2.896 1.00 0.00 H std
ATOM 764 HG2 LYS B 29 -11.609 6.166 -4.099 1.00 0.00 H std
ATOM 765 HG3 LYS B 29 -13.090 6.388 -4.616 1.00 0.00 H std
ATOM 766 HD2 LYS B 29 -12.520 8.700 -4.999 1.00 0.00 H std
ATOM 767 HD3 LYS B 29 -11.012 8.318 -4.695 1.00 0.00 H std
ATOM 768 HE2 LYS B 29 -10.874 7.929 -6.864 1.00 0.00 H std
ATOM 769 HE3 LYS B 29 -11.637 6.568 -6.535 1.00 0.00 H std
ATOM 770 HZ1 LYS B 29 -12.942 8.915 -7.115 1.00 0.00 H std
ATOM 771 HZ2 LYS B 29 -12.825 7.822 -8.066 1.00 0.00 H std
ATOM 772 HZ3 LYS B 29 -13.612 7.652 -6.856 1.00 0.00 H std
ATOM 773 N THR B 30 -10.803 9.513 -0.531 1.00 0.00 N
ATOM 774 CA THR B 30 -11.011 10.749 0.277 1.00 0.00 C
ATOM 775 C THR B 30 -10.576 11.982 -0.522 1.00 0.00 C
ATOM 776 O THR B 30 -10.589 13.063 0.042 1.00 0.00 O
ATOM 777 CB THR B 30 -10.128 10.572 1.516 1.00 0.00 C
ATOM 778 OG1 THR B 30 -9.416 9.345 1.425 1.00 0.00 O
ATOM 779 CG2 THR B 30 -11.005 10.564 2.770 1.00 0.00 C
ATOM 780 OXT THR B 30 -10.239 11.821 -1.683 1.00 0.00 O
ATOM 781 H THR B 30 -10.034 9.129 -0.542 1.00 0.00 H std
ATOM 782 HA THR B 30 -11.941 10.828 0.541 1.00 0.00 H std
ATOM 783 HB THR B 30 -9.499 11.309 1.574 1.00 0.00 H std
ATOM 784 HG1 THR B 30 -8.939 9.269 2.112 1.00 0.00 H std
ATOM 785 HG21 THR B 30 -11.729 9.928 2.654 1.00 0.00 H std
ATOM 786 HG22 THR B 30 -10.470 10.309 3.538 1.00 0.00 H std
ATOM 787 HG23 THR B 30 -11.375 11.449 2.912 1.00 0.00 H std
TER 788 THR B 30
ENDMDL
CONECT 82 146
CONECT 92 424
CONECT 146 82
CONECT 293 604
CONECT 424 92
CONECT 604 293
END