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6xey-validation-alt.cif
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6xey-validation-alt.cif
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data_6XEY-validation-alt
#
_entry.id 6XEY
#
_pdbx_percentile_list.entry_id 6XEY
_pdbx_percentile_list.name all,em
#
loop_
_pdbx_percentile_view.entry_id
_pdbx_percentile_view.conditions_id
_pdbx_percentile_view.type
_pdbx_percentile_view.conditions_label
_pdbx_percentile_view.rank
6XEY 1 all_atom_clashscore absolute 71.4
6XEY 2 all_atom_clashscore relative 79.5
6XEY 3 Ramachandran_outlier_percent absolute 54.4
6XEY 4 Ramachandran_outlier_percent relative 70.0
6XEY 5 rotamer_outliers_percent absolute 92.3
6XEY 6 rotamer_outliers_percent relative 77.5
#
loop_
_pdbx_percentile_conditions.id
_pdbx_percentile_conditions.number_entries_total
1 158937
2 4297
3 154571
4 4023
5 154315
6 3826
#
loop_
_pdbx_percentile_entity_view.conditions_id
_pdbx_percentile_entity_view.type
_pdbx_percentile_entity_view.label_asym_id
_pdbx_percentile_entity_view.PDB_model_num
_pdbx_percentile_entity_view.entity_id
_pdbx_percentile_entity_view.auth_asym_id
_pdbx_percentile_entity_view.conditions_label
_pdbx_percentile_entity_view.rank
3 Ramachandran_outlier_percent A 1 1 A absolute 51.42
4 Ramachandran_outlier_percent A 1 1 A relative 81.94
5 rotamer_outliers_percent A 1 1 A absolute 90.76
6 rotamer_outliers_percent A 1 1 A relative 94.38
3 Ramachandran_outlier_percent B 1 1 B absolute 100.00
4 Ramachandran_outlier_percent B 1 1 B relative 100.00
5 rotamer_outliers_percent B 1 1 B absolute 93.23
6 rotamer_outliers_percent B 1 1 B relative 96.99
3 Ramachandran_outlier_percent C 1 1 C absolute 100.00
4 Ramachandran_outlier_percent C 1 1 C relative 100.00
5 rotamer_outliers_percent C 1 1 C absolute 92.21
6 rotamer_outliers_percent C 1 1 C relative 95.60
3 Ramachandran_outlier_percent D 1 2 F absolute 100.00
4 Ramachandran_outlier_percent D 1 2 F relative 100.00
5 rotamer_outliers_percent D 1 2 F absolute 100.00
6 rotamer_outliers_percent D 1 2 F relative 100.00
3 Ramachandran_outlier_percent F 1 2 H absolute 100.00
4 Ramachandran_outlier_percent F 1 2 H relative 100.00
5 rotamer_outliers_percent F 1 2 H absolute 100.00
6 rotamer_outliers_percent F 1 2 H relative 100.00
3 Ramachandran_outlier_percent G 1 2 J absolute 100.00
4 Ramachandran_outlier_percent G 1 2 J relative 100.00
5 rotamer_outliers_percent G 1 2 J absolute 100.00
6 rotamer_outliers_percent G 1 2 J relative 100.00
3 Ramachandran_outlier_percent E 1 3 G absolute 17.19
4 Ramachandran_outlier_percent E 1 3 G relative 49.63
5 rotamer_outliers_percent E 1 3 G absolute 58.54
6 rotamer_outliers_percent E 1 3 G relative 77.44
3 Ramachandran_outlier_percent H 1 3 K absolute 17.19
4 Ramachandran_outlier_percent H 1 3 K relative 49.63
5 rotamer_outliers_percent H 1 3 K absolute 100.00
6 rotamer_outliers_percent H 1 3 K relative 100.00
3 Ramachandran_outlier_percent I 1 3 L absolute 100.00
4 Ramachandran_outlier_percent I 1 3 L relative 100.00
5 rotamer_outliers_percent I 1 3 L absolute 100.00
6 rotamer_outliers_percent I 1 3 L relative 100.00
#
_pdbx_dcc_geometry.entry_id 6XEY
_pdbx_dcc_geometry.Ramachandran_outlier_percent 0.08
_pdbx_dcc_geometry.all_atom_clashscore 3.45
_pdbx_dcc_geometry.angle_overall_rmsz 0.51
_pdbx_dcc_geometry.bond_overall_rmsz 0.32
_pdbx_dcc_geometry.number_angles 38721
_pdbx_dcc_geometry.number_bonds 28277
_pdbx_dcc_geometry.rotamer_outliers_percent 0.26
#
loop_
_pdbx_dcc_entity_geometry.label_asym_id
_pdbx_dcc_entity_geometry.PDB_model_num
_pdbx_dcc_entity_geometry.entity_id
_pdbx_dcc_entity_geometry.auth_asym_id
_pdbx_dcc_entity_geometry.angle_overall_rmsz
_pdbx_dcc_entity_geometry.bond_overall_rmsz
_pdbx_dcc_entity_geometry.number_angles
_pdbx_dcc_entity_geometry.number_bonds
A 1 1 A 0.50 0.32 10731 7840
B 1 1 B 0.51 0.32 10691 7806
C 1 1 C 0.50 0.32 10753 7863
D 1 2 F 0.53 0.33 1202 875
F 1 2 H 0.55 0.31 1211 882
G 1 2 J 0.56 0.31 1198 873
E 1 3 G 0.59 0.30 982 716
H 1 3 K 0.53 0.29 975 710
I 1 3 L 0.59 0.31 978 712
#
_em_admin.entry_id EMD-22156
_em_admin.deposition_date 2020-06-14
#
loop_
_pdbx_em_validate_map_model_entity.label_asym_id
_pdbx_em_validate_map_model_entity.PDB_model_num
_pdbx_em_validate_map_model_entity.entity_id
_pdbx_em_validate_map_model_entity.auth_asym_id
_pdbx_em_validate_map_model_entity.average_atom_inclusion_all
A 1 1 A 0.801267988395
B 1 1 B 0.805060348162
C 1 1 C 0.795142330097
D 1 2 F 0.714768141593
F 1 2 H 0.660795575221
G 1 2 J 0.671553097345
E 1 3 G 0.707320192308
H 1 3 K 0.675789423077
I 1 3 L 0.650429807692
J 1 4 D 0.10715
L 1 4 I 0.64285
N 1 4 N 0.67855
R 1 4 R 0.67855
S 1 4 S 0.60715
T 1 4 T 0.60715
U 1 4 U 0.60715
K 1 5 E 0.448033333333
O 1 5 O 0.549766666667
P 1 5 P 0.400433333333
M 1 6 M 0.22725
Q 1 6 Q 0.17205
V 1 7 A 0.6429
W 1 7 A 0.5714
X 1 7 A 0.3571
Y 1 7 A 0.7857
Z 1 7 A 0.7857
AA 1 7 A 0.7143
BA 1 7 A 0.7143
CA 1 7 A 0.2143
DA 1 7 A 0.4286
EA 1 7 A 0.0
FA 1 7 A 0.2857
GA 1 7 A 0.2143
HA 1 7 B 0.0
IA 1 7 B 0.3571
JA 1 7 B 0.2143
KA 1 7 B 0.0
LA 1 7 B 0.6429
MA 1 7 B 0.5
NA 1 7 B 0.4286
OA 1 7 B 0.0714
PA 1 7 B 0.6429
QA 1 7 B 0.7143
RA 1 7 B 0.7857
SA 1 7 B 0.2857
TA 1 7 C 0.2143
UA 1 7 C 0.1429
VA 1 7 C 0.5714
WA 1 7 C 0.0
XA 1 7 C 0.7857
YA 1 7 C 0.7857
ZA 1 7 C 0.7143
AB 1 7 C 0.0714
BB 1 7 C 0.2857
CB 1 7 C 0.5
DB 1 7 C 0.6429
EB 1 7 C 0.2857
#
_pdbx_em_validate_map_model_overall.entry_id 6XEY
_pdbx_em_validate_map_model_overall.recommended_contour_level 0.22
_pdbx_em_validate_map_model_overall.atom_inclusion_main 0.889586
#
loop_
_pdbx_dcc_mon_geometry.id
_pdbx_dcc_mon_geometry.PDB_model_num
_pdbx_dcc_mon_geometry.auth_asym_id
_pdbx_dcc_mon_geometry.auth_comp_id
_pdbx_dcc_mon_geometry.auth_seq_id
_pdbx_dcc_mon_geometry.angle_overall_rmsz
_pdbx_dcc_mon_geometry.bond_overall_rmsz
_pdbx_dcc_mon_geometry.number_angles
_pdbx_dcc_mon_geometry.number_bonds
1035 1 A NAG 1303 0.55 0.26 17 14
1036 1 A NAG 1304 0.51 0.24 17 14
1037 1 A NAG 1305 0.43 0.21 17 14
1038 1 A NAG 1309 0.40 0.27 17 14
1039 1 A NAG 1310 0.43 0.23 17 14
1040 1 A NAG 1311 0.53 0.20 17 14
1041 1 A NAG 1314 0.48 0.24 17 14
1042 1 A NAG 1315 0.45 0.26 17 14
1043 1 A NAG 1316 0.46 0.23 17 14
1044 1 A NAG 1317 0.49 0.29 17 14
1045 1 A NAG 1318 0.46 0.17 17 14
1046 1 A NAG 1319 0.66 0.35 17 14
2081 1 B NAG 1301 0.48 0.26 17 14
2082 1 B NAG 1302 0.43 0.20 17 14
2083 1 B NAG 1303 0.41 0.23 17 14
2084 1 B NAG 1306 0.38 0.28 17 14
2085 1 B NAG 1312 0.54 0.17 17 14
2086 1 B NAG 1313 0.47 0.22 17 14
2087 1 B NAG 1314 0.46 0.28 17 14
2088 1 B NAG 1315 0.44 0.28 17 14
2089 1 B NAG 1316 1.96 0.78 17 14
2090 1 B NAG 1317 0.57 0.23 17 14
2091 1 B NAG 1318 0.45 0.25 17 14
2092 1 B NAG 1319 0.50 0.22 17 14
3123 1 C NAG 1301 0.44 0.24 17 14
3124 1 C NAG 1305 0.53 0.41 17 14
3125 1 C NAG 1308 0.49 0.22 17 14
3126 1 C NAG 1309 0.53 0.26 17 14
3127 1 C NAG 1310 0.57 0.28 17 14
3128 1 C NAG 1311 0.50 0.17 17 14
3129 1 C NAG 1312 0.42 0.19 17 14
3130 1 C NAG 1315 0.52 0.26 17 14
3131 1 C NAG 1316 0.78 0.24 17 14
3132 1 C NAG 1317 0.53 0.35 17 14
3133 1 C NAG 1318 0.54 0.22 17 14
3134 1 C NAG 1319 0.45 0.21 17 14
3825 1 D NAG 1 0.54 0.33 17 14
3826 1 D NAG 2 0.41 0.30 17 14
3827 1 E NAG 1 0.90 0.49 17 14
3828 1 E NAG 2 1.96 0.67 17 14
3829 1 E BMA 3 0.76 0.70 15 11
3830 1 I NAG 1 0.46 0.36 17 14
3831 1 I NAG 2 0.39 0.22 17 14
3832 1 M NAG 1 0.83 0.58 17 14
3833 1 M BMA 2 0.83 0.75 15 11
3834 1 N NAG 1 0.50 0.53 17 14
3835 1 N NAG 2 0.40 0.21 17 14
3836 1 O NAG 1 0.88 0.41 17 14
3837 1 O NAG 2 0.49 0.25 17 14
3838 1 O BMA 3 0.72 0.70 15 11
3839 1 P NAG 1 0.55 0.28 17 14
3840 1 P NAG 2 0.48 0.26 17 14
3841 1 P BMA 3 1.08 0.66 15 11
3842 1 Q NAG 1 0.54 0.40 17 14
3843 1 Q BMA 2 1.07 0.61 15 11
3844 1 R NAG 1 0.48 0.40 17 14
3845 1 R NAG 2 0.38 0.22 17 14
3846 1 S NAG 1 0.40 0.24 17 14
3847 1 S NAG 2 0.53 0.17 17 14
3848 1 T NAG 1 0.39 0.25 17 14
3849 1 T NAG 2 0.51 0.19 17 14
3850 1 U NAG 1 0.42 0.22 17 14
3851 1 U NAG 2 0.53 0.17 17 14
#
loop_
_struct_mon_prot.pdbx_id
_struct_mon_prot.PDB_model_num
_struct_mon_prot.auth_asym_id
_struct_mon_prot.auth_comp_id
_struct_mon_prot.auth_seq_id
_struct_mon_prot.phi
_struct_mon_prot.psi
_struct_mon_prot.pdbx_Ramachandran_region
_struct_mon_prot.pdbx_rotamer
_struct_mon_prot.pdbx_flippable_side_chain
2 1 A TYR 28 -149.8 136.4 Favored m-85 ?
3 1 A THR 29 -131.6 173.4 Favored p ?
4 1 A ASN 30 -101.8 160.8 Favored p-10 ?
5 1 A SER 31 -91.1 0.3 Favored m ?
6 1 A PHE 32 47.7 -94.6 OUTLIER m-85 ?
7 1 A THR 33 -134.5 3.9 Favored p ?
8 1 A ARG 34 -72.7 165.0 Favored mmm180 ?
9 1 A GLY 35 99.8 6.7 Favored ? ?
10 1 A VAL 36 -84.0 151.4 Favored p ?
11 1 A TYR 37 -143.7 165.8 Favored p90 ?
12 1 A TYR 38 -77.5 116.8 Favored m-85 ?
13 1 A PRO 39 -78.6 -38.3 Allowed Cg_endo ?
14 1 A ASP 40 -134.9 14.7 Favored p-10 ?
15 1 A LYS 41 58.2 34.9 Favored mtpt ?
16 1 A VAL 42 -122.0 124.8 Favored t ?
17 1 A PHE 43 -71.6 134.0 Favored t80 ?
18 1 A ARG 44 -139.0 145.8 Favored mtt85 ?
19 1 A SER 45 -130.9 130.8 Favored t ?
20 1 A SER 46 56.0 39.5 Favored m ?
21 1 A VAL 47 -126.4 127.3 Favored t ?
22 1 A LEU 48 -90.5 95.8 Favored mt ?
23 1 A HIS 49 -97.3 128.3 Favored t60 ?
24 1 A SER 50 -86.2 106.1 Favored t ?
25 1 A THR 51 -107.2 139.1 Favored m ?
26 1 A GLN 52 -119.2 111.1 Favored tp60 ?
27 1 A ASP 53 -160.1 173.5 Favored t0 ?
28 1 A LEU 54 -77.2 77.8 Favored mt ?
29 1 A PHE 55 -89.5 168.0 Favored m-85 ?
30 1 A LEU 56 -77.9 121.7 Favored tp ?
31 1 A PRO 57 -63.4 140.8 Favored Cg_endo ?
32 1 A PHE 58 -68.6 147.2 Favored m-30 ?
33 1 A PHE 59 59.9 26.2 Favored m-85 ?
34 1 A SER 60 -78.6 170.8 Favored m ?
35 1 A ASN 61 -89.5 140.1 Favored m-20 ?
36 1 A VAL 62 -119.8 136.5 Favored m ?
37 1 A THR 63 -87.7 78.7 Favored m ?
38 1 A TRP 64 -64.2 142.3 Favored t90 ?
39 1 A PHE 65 -124.5 130.5 Favored m-85 ?
40 1 A HIS 66 -79.8 83.6 Favored t-160 ?
41 1 A ALA 67 -91.7 7.0 Favored ? ?
42 1 A ILE 68 -64.7 -38.5 Favored ? ?
43 1 A HIS 69 50.4 41.3 Favored p-80 ?
44 1 A VAL 70 -63.2 -36.9 Favored t ?
45 1 A SER 71 -128.6 149.2 Favored t ?
46 1 A GLY 72 95.9 52.6 Allowed ? ?
47 1 A THR 73 ? ? ? m ?
48 1 A ASP 80 ? ? ? t0 ?
49 1 A ASN 81 -73.8 122.0 Favored t30 ?
50 1 A PRO 82 -87.9 160.5 Favored Cg_endo ?
51 1 A VAL 83 -96.5 125.7 Favored t ?
52 1 A LEU 84 -111.7 151.8 Favored mt ?
53 1 A PRO 85 -78.2 166.8 Favored Cg_endo ?
54 1 A PHE 86 -127.2 54.3 Allowed t80 ?
55 1 A ASN 87 -53.5 -51.9 Favored m120 ?
56 1 A ASP 88 -143.3 33.8 Allowed t0 ?
57 1 A GLY 89 88.2 138.5 Favored ? ?
58 1 A VAL 90 -120.4 175.8 Favored m ?
59 1 A TYR 91 -121.3 140.3 Favored t80 ?
60 1 A PHE 92 -135.3 140.3 Favored t80 ?
61 1 A ALA 93 -149.5 158.5 Favored ? ?
62 1 A SER 94 -150.7 159.8 Favored m ?
63 1 A THR 95 -146.4 96.2 Favored t ?
64 1 A GLU 96 -164.4 143.5 Favored pt-20 ?
65 1 A LYS 97 -89.1 -9.6 Favored ? ?
66 1 A SER 98 -73.4 -18.4 Favored p ?
67 1 A ASN 99 58.2 36.7 Favored m-20 ?
68 1 A ILE 100 -80.0 -26.6 Favored tt ?
69 1 A ILE 101 -71.3 105.2 Allowed mm ?
70 1 A ARG 102 -115.7 5.4 Favored ttt85 ?
71 1 A GLY 103 155.7 -171.4 Favored ? ?
72 1 A TRP 104 -143.8 156.8 Favored m-90 ?
73 1 A ILE 105 -123.8 155.1 Favored pt ?
74 1 A PHE 106 -140.5 174.2 Favored m-85 ?
75 1 A GLY 107 149.2 164.3 Favored ? ?
76 1 A THR 108 -73.8 -40.0 Favored ? ?
77 1 A THR 109 -135.1 -2.4 Favored ? ?
78 1 A LEU 110 55.9 39.8 Favored ? ?
79 1 A ASP 111 -130.5 171.6 Favored ? ?
80 1 A SER 112 -68.4 -17.7 Favored ? ?
81 1 A LYS 113 -74.4 -42.0 Favored ? ?
82 1 A THR 114 -112.7 169.7 Favored t ?
83 1 A GLN 115 -68.4 160.4 Favored mm-40 ?
84 1 A SER 116 -155.7 175.7 Favored p ?
85 1 A LEU 117 -141.4 141.2 Favored tp ?
86 1 A LEU 118 -125.5 135.2 Favored tt ?
87 1 A ILE 119 -124.2 128.7 Favored mt ?
88 1 A VAL 120 -127.3 135.2 Favored p ?
89 1 A ASN 121 -119.2 48.4 Allowed ? ?
90 1 A ASN 122 -62.6 170.0 Favored ? ?
91 1 A ALA 123 -64.7 -19.4 Favored ? ?
92 1 A THR 124 -89.5 -61.9 Allowed p ?
93 1 A ASN 125 -147.1 158.3 Favored m-80 ?
94 1 A VAL 126 -86.8 138.0 Favored m ?
95 1 A VAL 127 -122.6 96.3 Favored t ?
96 1 A ILE 128 -94.3 114.5 Favored mt ?
97 1 A LYS 129 -130.8 132.5 Favored mtmt ?
98 1 A VAL 130 -101.7 116.0 Favored t ?
99 1 A CYS 131 -127.5 -27.4 Favored m ?
100 1 A GLU 132 52.1 43.9 Favored ? ?
101 1 A PHE 133 -81.5 174.5 Favored ? ?
102 1 A GLN 134 -100.7 119.0 Favored tp60 ?
103 1 A PHE 135 -92.5 168.2 Favored m-85 ?
104 1 A CYS 136 -76.9 168.2 Favored m ?
105 1 A ASN 137 -63.5 -43.2 Favored ? ?
106 1 A ASP 138 -139.8 106.7 Favored m-20 ?
107 1 A PRO 139 -71.8 158.9 Favored Cg_endo ?
108 1 A PHE 140 -164.8 163.4 Favored t80 ?
109 1 A LEU 141 -116.8 -58.0 Favored mt ?
110 1 A GLY 142 61.4 41.2 Favored ? ?
113 1 A ARG 158 54.0 41.5 Favored ? ?
114 1 A VAL 159 -69.0 -27.7 Favored t ?
115 1 A TYR 160 -61.7 -39.6 Favored ? ?
116 1 A SER 161 -95.8 122.9 Favored m ?
117 1 A SER 162 -84.3 -48.2 Favored t ?
118 1 A ALA 163 -135.1 139.2 Favored ? ?
119 1 A ASN 164 -137.9 129.7 Favored m-80 ?
120 1 A ASN 165 -136.5 53.1 Allowed p-10 ?
121 1 A CYS 166 -58.7 166.8 Allowed m ?
122 1 A THR 167 -116.8 -42.5 Favored p ?
123 1 A PHE 168 -120.7 136.2 Favored t80 ?
124 1 A GLU 169 -135.8 161.5 Favored mp0 ?
125 1 A TYR 170 -161.4 135.4 Favored t80 ?
126 1 A VAL 171 -134.9 132.0 Favored t ?
127 1 A SER 172 -149.7 -163.8 Allowed p ?
128 1 A GLN 173 -67.8 149.2 Favored ? ?
129 1 A PRO 174 -74.2 -176.6 Favored Cg_endo ?
130 1 A PHE 175 -103.8 9.5 Favored m-30 ?
133 1 A ASN 188 -83.0 129.9 Favored ? ?
134 1 A LEU 189 -115.3 107.4 Favored tp ?
135 1 A ARG 190 -87.8 153.3 Favored mtt85 ?
136 1 A GLU 191 -142.9 148.6 Favored mt-10 ?
137 1 A PHE 192 -149.1 156.6 Favored m-85 ?
138 1 A VAL 193 -132.4 147.3 Favored m ?
139 1 A PHE 194 -123.6 100.7 Favored m-85 ?
140 1 A LYS 195 -100.0 128.3 Favored mtmt ?
141 1 A ASN 196 -115.6 86.4 Favored t30 ?
142 1 A ILE 197 -119.1 137.4 Favored pt ?
143 1 A ASP 198 34.5 48.3 Allowed p30 ?
144 1 A GLY 199 85.8 -0.6 Favored ? ?
145 1 A TYR 200 -117.6 111.5 Favored ? ?
146 1 A PHE 201 -85.8 114.8 Favored t80 ?
147 1 A LYS 202 -111.8 124.8 Favored mtpp ?
148 1 A ILE 203 -113.8 127.7 Favored mt ?
149 1 A TYR 204 -111.6 159.8 Favored m-85 ?
150 1 A SER 205 -153.1 155.7 Favored t ?
151 1 A LYS 206 -170.0 139.8 Allowed tptt ?
152 1 A HIS 207 -135.7 124.9 Favored p-80 ?
153 1 A THR 208 -123.5 138.4 Favored m ?
154 1 A PRO 209 -74.1 85.2 Allowed Cg_endo ?
155 1 A ILE 210 -70.0 165.1 Favored ? ?
156 1 A ASN 211 -90.9 24.6 Favored ? ?
157 1 A LEU 212 59.5 61.8 Allowed ? ?
158 1 A VAL 213 -97.0 0.6 Favored ? ?
159 1 A ARG 214 61.7 14.0 Favored ? ?
160 1 A ASP 215 -153.0 -170.0 Favored p30 ?
161 1 A LEU 216 -70.6 125.7 Favored mt ?
162 1 A PRO 217 -69.7 156.8 Favored Cg_endo ?
163 1 A GLN 218 -76.4 -1.6 Favored ? ?
164 1 A GLY 219 -72.8 -175.5 Favored ? ?
165 1 A PHE 220 -127.4 133.4 Favored t80 ?
166 1 A SER 221 -147.7 142.6 Favored m ?
167 1 A ALA 222 -105.9 130.9 Favored ? ?
168 1 A LEU 223 -84.7 120.4 Favored mp ?
169 1 A GLU 224 -77.8 139.5 Favored ? ?
170 1 A PRO 225 -69.0 138.3 Favored Cg_endo ?
171 1 A LEU 226 -118.7 -54.5 Favored tp ?
172 1 A VAL 227 -134.6 130.8 Favored t ?
173 1 A ASP 228 -109.0 119.2 Favored t70 ?
174 1 A LEU 229 -97.1 120.7 Favored mt ?
175 1 A PRO 230 -85.0 47.9 Favored Cg_endo ?
176 1 A ILE 231 -118.3 131.1 Favored tp ?
177 1 A GLY 232 -104.0 101.1 Allowed ? ?
178 1 A ILE 233 -128.6 137.1 Favored pt ?
179 1 A ASN 234 -70.6 111.2 Favored t30 ?
180 1 A ILE 235 -118.0 126.0 Favored mt ?
181 1 A THR 236 -125.8 -15.3 Favored p ?
182 1 A ARG 237 -139.8 155.6 Favored mtp-105 ?
183 1 A PHE 238 -146.6 172.6 Favored p90 ?
184 1 A GLN 239 -153.6 137.4 Favored tt0 ?
185 1 A THR 240 -81.3 162.1 Favored t ?
186 1 A LEU 241 -113.8 123.6 Favored mt ?
187 1 A LEU 242 -109.6 151.4 Favored mt ?
188 1 A ALA 243 -155.8 110.0 Favored ? ?
189 1 A LEU 244 -72.2 160.8 Favored ? ?
190 1 A HIS 245 -70.8 -15.2 Favored m-70 ?
191 1 A ARG 246 -159.3 127.6 Favored ? ?
192 1 A SER 247 -161.8 -168.7 Favored t ?
193 1 A TYR 248 -74.6 150.2 Favored ? ?
194 1 A LEU 249 -105.9 10.8 Favored ? ?
195 1 A THR 250 -79.5 125.6 Favored ? ?
196 1 A PRO 251 -76.6 12.3 Allowed Cg_endo ?
197 1 A GLY 252 -107.8 -3.2 Favored ? ?
198 1 A ASP 253 -92.8 160.2 Favored p30 ?
199 1 A SER 254 -126.1 -42.0 Allowed m ?
200 1 A SER 255 -138.6 45.7 Favored m ?
201 1 A SER 256 -149.1 161.5 Favored t ?
202 1 A GLY 257 110.5 -44.0 Allowed ? ?
203 1 A TRP 258 -164.4 163.5 Favored t-105 ?
204 1 A THR 259 -112.1 111.4 Favored ? ?
205 1 A ALA 260 -83.0 -179.1 Favored ? ?
206 1 A GLY 261 -76.9 179.5 Favored ? ?
207 1 A ALA 262 -69.7 137.9 Favored ? ?
208 1 A ALA 263 -127.3 147.2 Favored ? ?
209 1 A ALA 264 -160.2 121.6 Favored ? ?
210 1 A TYR 265 -147.1 175.2 Favored p90 ?
211 1 A TYR 266 -132.3 165.3 Favored m-85 ?
212 1 A VAL 267 -153.7 132.7 Favored p ?
213 1 A GLY 268 -122.3 -170.6 Favored ? ?
214 1 A TYR 269 -139.5 136.9 Favored m-85 ?
215 1 A LEU 270 -85.1 145.3 Favored mt ?
216 1 A GLN 271 -128.6 149.4 Favored mm-40 ?
217 1 A PRO 272 -68.4 107.0 Allowed Cg_endo ?
218 1 A ARG 273 -132.8 147.0 Favored mmt85 ?
219 1 A THR 274 -86.8 137.7 Favored m ?
220 1 A PHE 275 -130.5 150.5 Favored m-85 ?
221 1 A LEU 276 -113.5 94.0 Favored tp ?
222 1 A LEU 277 -84.2 130.5 Favored mt ?
223 1 A LYS 278 -101.0 97.1 Favored tttt ?
224 1 A TYR 279 -76.5 133.9 Favored m-85 ?
225 1 A ASN 280 -85.4 -166.0 Allowed p-10 ?
226 1 A GLU 281 -60.6 -44.4 Favored tm-20 ?
227 1 A ASN 282 -75.6 -12.9 Favored m-20 ?
228 1 A GLY 283 96.8 20.8 Favored ? ?
229 1 A THR 284 -117.5 151.6 Favored t ?
230 1 A ILE 285 -79.3 128.1 Favored mt ?
231 1 A THR 286 -117.4 -16.8 Favored p ?
232 1 A ASP 287 -157.3 161.2 Favored t0 ?
233 1 A ALA 288 -152.8 156.2 Favored ? ?
234 1 A VAL 289 -127.8 122.1 Favored t ?
235 1 A ASP 290 -89.5 112.8 Favored t0 ?
236 1 A CYS 291 -69.1 -16.4 Favored m ?
237 1 A ALA 292 -102.1 -5.1 Favored ? ?
238 1 A LEU 293 -73.6 -42.1 Favored tp ?
239 1 A ASP 294 -153.1 143.0 Favored t0 ?
240 1 A PRO 295 -55.5 -34.0 Favored Cg_exo ?
241 1 A LEU 296 -64.5 -42.1 Favored tp ?
242 1 A SER 297 -67.5 -35.6 Favored m ?
243 1 A GLU 298 -66.5 -36.0 Favored tt0 ?
244 1 A THR 299 -66.8 -38.9 Favored m ?
245 1 A LYS 300 -62.0 -41.0 Favored mttt ?
246 1 A CYS 301 -68.9 -36.2 Favored m ?
247 1 A THR 302 -69.9 -43.6 Favored m ?
248 1 A LEU 303 -78.3 -11.2 Favored mt ?
249 1 A LYS 304 53.8 48.1 Favored ? ?
250 1 A SER 305 -147.8 152.9 Favored p ?
251 1 A PHE 306 -93.5 -8.3 Favored m-85 ?
252 1 A THR 307 -127.1 97.5 Favored p ?
253 1 A VAL 308 -77.7 128.6 Favored t ?
254 1 A GLU 309 -87.9 -179.0 Favored mp0 ?
255 1 A LYS 310 -65.6 112.8 Favored tptm ?
256 1 A GLY 311 162.2 -179.1 Favored ? ?
257 1 A ILE 312 -98.7 138.3 Favored tt ?
258 1 A TYR 313 -138.3 123.2 Favored m-85 ?
259 1 A GLN 314 -69.6 130.4 Favored tt0 ?
260 1 A THR 315 -117.0 -31.6 Favored t ?
261 1 A SER 316 -163.9 -174.7 Favored p ?
262 1 A ASN 317 -117.7 136.9 Favored m-20 ?
263 1 A PHE 318 -106.7 127.2 Favored t80 ?
264 1 A ARG 319 -140.5 134.4 Favored ? ?
265 1 A VAL 320 -75.8 123.6 Favored t ?
266 1 A GLN 321 -70.6 145.2 Favored ? ?
267 1 A PRO 322 -64.3 130.4 Favored Cg_exo ?
268 1 A THR 323 -70.1 -39.9 Favored ? ?
269 1 A GLU 324 -148.0 173.1 Favored pt-20 ?
270 1 A SER 325 -125.1 132.7 Favored t ?
271 1 A ILE 326 -121.1 147.7 Favored pt ?
272 1 A VAL 327 -121.5 131.1 Favored t ?
273 1 A ARG 328 -136.4 106.4 Favored tpp85 ?
274 1 A PHE 329 -121.4 158.6 Favored m-85 ?
275 1 A PRO 330 -67.0 -178.0 Allowed Cg_exo ?
276 1 A ASN 331 -77.9 8.3 Favored m-20 ?
277 1 A ILE 332 -63.0 127.1 Favored mt ?
278 1 A THR 333 -128.8 -24.2 Favored m ?
279 1 A ASN 334 -62.5 136.2 Favored p30 ?
280 1 A LEU 335 -90.0 153.2 Favored mt ?
281 1 A CYS 336 -72.2 145.7 Favored m ?
282 1 A PRO 337 -80.8 47.4 Favored Cg_endo ?
283 1 A PHE 338 -60.8 -34.2 Favored m-85 ?
284 1 A GLY 339 -63.0 -23.3 Favored ? ?
285 1 A GLU 340 -83.8 -45.5 Favored tt0 ?
286 1 A VAL 341 -75.4 -24.8 Favored p ?
287 1 A PHE 342 -95.0 -0.7 Favored m-85 ?
288 1 A ASN 343 -135.0 24.7 Favored m-20 ?
289 1 A ALA 344 -68.5 145.6 Favored ? ?
290 1 A THR 345 -75.4 -18.9 Favored t ?
291 1 A ARG 346 -153.4 142.3 Favored ptt180 ?
292 1 A PHE 347 -103.0 158.6 Favored m-85 ?
293 1 A ALA 348 -80.7 161.8 Favored ? ?
294 1 A SER 349 -73.4 164.1 Favored p ?
295 1 A VAL 350 -69.7 -24.7 Favored p ?
296 1 A TYR 351 -69.5 123.7 Favored t80 ?
297 1 A ALA 352 54.6 62.5 Favored ? ?
298 1 A TRP 353 -66.6 144.4 Favored p-90 ?
299 1 A ASN 354 -72.4 137.3 Favored t30 ?
300 1 A ARG 355 -126.3 122.0 Favored ttm180 ?
301 1 A LYS 356 -117.5 122.9 Favored tttp ?
302 1 A ARG 357 -89.5 126.3 Favored ttt85 ?
303 1 A ILE 358 -110.2 117.3 Favored mm ?
304 1 A SER 359 -153.3 156.8 Favored p ?
305 1 A ASN 360 54.0 61.3 Favored m-20 ?
306 1 A CYS 361 -162.0 150.2 Favored p ?
307 1 A VAL 362 -85.8 120.2 Favored t ?
308 1 A ALA 363 -87.8 164.0 Favored ? ?
309 1 A ASP 364 -141.4 92.1 Favored t0 ?
310 1 A TYR 365 -77.7 -18.6 Favored m-85 ?
311 1 A SER 366 -65.0 -19.3 Favored p ?
312 1 A VAL 367 -64.3 -38.0 Favored t ?
313 1 A LEU 368 -108.3 -28.0 Favored pp ?
314 1 A TYR 369 -66.5 -20.8 Favored ? ?
315 1 A ASN 370 -116.4 14.5 Favored t30 ?
316 1 A SER 371 -77.3 125.9 Favored ? ?
317 1 A ALA 372 -78.2 -8.0 Favored ? ?
318 1 A SER 373 -72.7 -10.4 Favored p ?
319 1 A PHE 374 -93.2 142.4 Favored m-85 ?
320 1 A SER 375 -78.7 -64.1 Allowed m ?
321 1 A THR 376 -121.7 127.5 Favored p ?
322 1 A PHE 377 -117.8 85.0 Favored t80 ?
323 1 A LYS 378 -108.7 115.3 Favored ttmm ?
324 1 A CYS 379 -104.3 145.4 Favored m ?
325 1 A TYR 380 -121.5 128.0 Favored m-85 ?
326 1 A GLY 381 76.5 6.5 Favored ? ?
327 1 A VAL 382 -157.5 150.7 Favored p ?
328 1 A SER 383 -99.9 142.4 Favored p ?
329 1 A PRO 384 -61.7 -27.9 Favored Cg_exo ?
330 1 A THR 385 -81.3 -14.2 Favored p ?
331 1 A LYS 386 -101.3 9.8 Favored mmtt ?
332 1 A LEU 387 -67.8 -33.1 Favored mt ?
333 1 A ASN 388 -75.5 -10.3 Favored m-20 ?
334 1 A ASP 389 -99.1 4.6 Favored m-20 ?
335 1 A LEU 390 -116.4 159.1 Favored mt ?
336 1 A CYS 391 -110.4 150.0 Favored m ?
337 1 A PHE 392 -129.7 133.7 Favored m-85 ?
338 1 A THR 393 -72.5 -37.9 Favored p ?
339 1 A ASN 394 -151.8 143.4 Favored p30 ?
340 1 A VAL 395 -124.8 103.0 Favored t ?
341 1 A TYR 396 -89.7 113.4 Favored m-85 ?
342 1 A ALA 397 -100.8 123.3 Favored ? ?
343 1 A ASP 398 -116.9 161.5 Favored m-20 ?
344 1 A SER 399 -156.7 138.6 Favored p ?
345 1 A PHE 400 -162.2 168.6 Favored p90 ?
346 1 A VAL 401 -122.6 124.8 Favored t ?
347 1 A ILE 402 -129.6 175.1 Favored pt ?
348 1 A ARG 403 -72.4 165.0 Favored ? ?
349 1 A GLY 404 -66.5 -44.2 Favored ? ?
350 1 A ASP 405 -75.6 -9.8 Favored p-10 ?
351 1 A GLU 406 -87.0 -3.1 Favored ? ?
352 1 A VAL 407 -75.4 -16.3 Favored m ?
353 1 A ARG 408 -71.0 -24.5 Favored ? ?
354 1 A GLN 409 -75.2 -26.0 Favored mt-30 ?
355 1 A ILE 410 -83.4 85.1 Allowed mm ?
356 1 A ALA 411 -163.4 153.6 Favored ? ?
357 1 A PRO 412 -64.0 133.6 Favored Cg_exo ?
358 1 A GLY 413 81.3 2.9 Favored ? ?
359 1 A GLN 414 -77.8 168.3 Favored mm-40 ?
360 1 A THR 415 -133.5 148.3 Favored ? ?
361 1 A GLY 416 154.2 175.7 Favored ? ?
362 1 A LYS 417 -64.1 -44.1 Favored ? ?
363 1 A ILE 418 -69.4 -38.1 Favored mm ?
364 1 A ALA 419 -71.3 -37.5 Favored ? ?
365 1 A ASP 420 -83.2 -40.0 Favored m-20 ?
366 1 A TYR 421 -116.4 -2.6 Favored m-85 ?
367 1 A ASN 422 -121.1 -49.3 Favored m-80 ?
368 1 A TYR 423 -156.3 113.6 Favored t80 ?
369 1 A LYS 424 -110.2 111.4 Favored ? ?
370 1 A LEU 425 -78.6 140.1 Favored mt ?
371 1 A PRO 426 -72.1 166.2 Favored Cg_endo ?
372 1 A ASP 427 -67.5 -33.3 Favored ? ?
373 1 A ASP 428 -93.0 30.6 Allowed ? ?
374 1 A PHE 429 -74.0 130.7 Favored t80 ?
375 1 A THR 430 -120.7 136.8 Favored t ?
376 1 A GLY 431 147.6 -158.2 Favored ? ?
377 1 A CYS 432 -137.1 140.1 Favored m ?
378 1 A VAL 433 -106.8 141.9 Favored m ?
379 1 A ILE 434 -131.3 109.4 Favored mp ?
380 1 A ALA 435 -89.0 145.3 Favored ? ?
381 1 A TRP 436 -157.7 109.1 Favored t90 ?
382 1 A ASN 437 -67.9 136.6 Favored t-20 ?
383 1 A SER 438 -137.4 40.8 Favored p ?
384 1 A ASN 439 -66.8 -33.8 Favored ? ?
385 1 A ASN 440 -83.9 -3.8 Favored ? ?
386 1 A LEU 441 -117.5 -41.5 Favored mt ?
387 1 A ASP 442 -101.5 18.5 Favored ? ?
388 1 A SER 443 -127.8 144.9 Favored t ?
389 1 A LYS 444 -122.8 153.3 Favored ? ?
390 1 A VAL 445 -62.3 -29.4 Favored ? ?
391 1 A GLY 446 -140.4 21.1 Favored ? ?
392 1 A GLY 447 -138.0 -130.0 Favored ? ?
393 1 A ASN 448 55.5 59.2 Favored ? ?
394 1 A TYR 449 -101.4 10.2 Favored m-85 ?
395 1 A ASN 450 -70.0 -33.8 Favored m120 ?
396 1 A TYR 451 -77.8 110.0 Favored m-85 ?
397 1 A LEU 452 -102.9 168.3 Favored mt ?
398 1 A TYR 453 -154.7 142.6 Favored p90 ?
399 1 A ARG 454 -74.1 131.9 Favored ttm105 ?
400 1 A LEU 455 -105.9 -45.6 Favored tp ?
401 1 A PHE 456 -119.9 137.1 Favored m-85 ?
402 1 A ARG 457 -143.7 152.3 Favored ttt-85 ?
403 1 A LYS 458 -66.0 -33.2 Favored ? ?
404 1 A SER 459 -150.6 160.2 Favored p ?
405 1 A ASN 460 -70.0 149.9 Favored m-20 ?
406 1 A LEU 461 -72.8 151.5 Favored mt ?
407 1 A LYS 462 -72.0 158.8 Favored ? ?
408 1 A PRO 463 -60.7 139.7 Favored Cg_exo ?
409 1 A PHE 464 55.7 31.2 Favored m-85 ?
410 1 A GLU 465 -82.5 152.8 Favored ? ?
411 1 A ARG 466 -133.1 92.1 Favored ttp180 ?
412 1 A ASP 467 -89.4 89.5 Favored t0 ?
413 1 A ILE 468 -80.5 -6.8 Favored pt ?
414 1 A SER 469 -79.1 132.1 Favored t ?
415 1 A THR 470 -93.4 32.2 Allowed p ?
416 1 A GLU 471 -62.3 140.0 Favored tp10 ?
417 1 A ILE 472 -72.6 138.4 Favored mt ?
418 1 A TYR 473 -64.3 158.0 Favored t80 ?
419 1 A GLN 474 -84.0 139.6 Favored ? ?
420 1 A ALA 475 -72.1 -44.6 Favored ? ?
421 1 A GLY 476 105.3 -33.6 Favored ? ?
422 1 A SER 477 -91.5 -163.8 Allowed p ?
423 1 A THR 478 -60.9 144.1 Favored p ?
424 1 A PRO 479 -71.5 161.7 Favored Cg_endo ?
425 1 A CYS 480 -115.7 99.3 Favored m ?
426 1 A ASN 481 -84.1 55.0 Favored p-10 ?
427 1 A GLY 482 114.7 22.0 Favored ? ?
428 1 A VAL 483 -129.9 136.5 Favored m ?
429 1 A GLU 484 -92.7 170.8 Favored mp0 ?
430 1 A GLY 485 144.8 -157.9 Favored ? ?
431 1 A PHE 486 -46.6 123.0 Favored t80 ?
432 1 A ASN 487 73.1 149.3 Allowed ? ?
433 1 A CYS 488 49.3 64.0 Allowed m ?
434 1 A TYR 489 -71.6 174.2 Favored OUTLIER ?
435 1 A PHE 490 -82.3 132.9 Favored t80 ?
436 1 A PRO 491 -77.2 -28.1 Favored Cg_endo ?
437 1 A LEU 492 -88.3 172.5 Favored mt ?
438 1 A GLN 493 -162.7 134.2 Favored tp-100 ?
439 1 A SER 494 -86.4 140.6 Favored t ?
440 1 A TYR 495 -70.2 -48.2 Favored m-85 ?
441 1 A GLY 496 71.7 68.9 Allowed ? ?
442 1 A PHE 497 -83.5 102.7 Favored m-85 ?
443 1 A GLN 498 -97.9 147.0 Favored mt-30 ?
444 1 A PRO 499 -69.4 -18.9 Favored Cg_exo ?
445 1 A THR 500 -79.5 -7.3 Favored ? ?
446 1 A ASN 501 -68.4 158.8 Favored m-20 ?
447 1 A GLY 502 -73.3 175.4 Favored ? ?
448 1 A VAL 503 -66.9 -24.6 Favored m ?
449 1 A GLY 504 -73.7 -12.4 Favored ? ?
450 1 A TYR 505 -125.2 6.1 Favored m-85 ?
451 1 A GLN 506 -71.0 149.6 Favored mt-30 ?
452 1 A PRO 507 -70.1 121.1 Favored Cg_endo ?
453 1 A TYR 508 -108.3 119.9 Favored m-85 ?
454 1 A ARG 509 -75.3 130.8 Favored ? ?
455 1 A VAL 510 -125.9 127.8 Favored t ?
456 1 A VAL 511 -118.2 126.3 Favored t ?
457 1 A VAL 512 -117.0 127.1 Favored p ?
458 1 A LEU 513 -104.2 110.9 Favored mt ?
459 1 A SER 514 -102.4 124.6 Favored t ?
460 1 A PHE 515 -145.8 144.8 Favored p90 ?
461 1 A GLU 516 -97.9 134.4 Favored ? ?
462 1 A LEU 517 -104.7 38.5 Allowed mt ?
463 1 A LEU 518 -74.5 -176.9 Favored mt ?
464 1 A HIS 519 -84.7 -167.1 Allowed m170 ?
465 1 A ALA 520 -46.9 145.7 Favored ? ?
466 1 A PRO 521 -74.7 147.2 Favored Cg_exo ?
467 1 A ALA 522 -89.4 94.5 Favored ? ?
468 1 A THR 523 -64.7 -46.7 Favored ? ?
469 1 A VAL 524 -127.4 127.5 Favored t ?
470 1 A CYS 525 -140.5 -175.9 Favored t ?
471 1 A GLY 526 -82.3 179.1 Favored ? ?
472 1 A PRO 527 -89.5 17.9 Allowed Cg_endo ?
473 1 A LYS 528 -67.3 138.8 Favored ? ?
474 1 A LYS 529 -73.2 133.9 Favored ? ?
475 1 A SER 530 -77.7 130.5 Favored p ?
476 1 A THR 531 -103.0 179.2 Favored p ?
477 1 A ASN 532 -74.2 170.1 Favored m120 ?
478 1 A LEU 533 -108.4 132.0 Favored tp ?
479 1 A VAL 534 -116.0 151.2 Favored m ?
480 1 A LYS 535 -132.2 160.4 Favored mttt ?
481 1 A ASN 536 60.1 27.8 Favored m-80 ?
482 1 A LYS 537 -148.5 152.8 Favored ptmm? ?
483 1 A CYS 538 -70.5 112.2 Favored t ?
484 1 A VAL 539 -136.0 133.3 Favored p ?
485 1 A ASN 540 -77.3 131.8 Favored t30 ?
486 1 A PHE 541 -127.1 160.9 Favored p90 ?
487 1 A ASN 542 -138.7 89.4 Favored t-20 ?
488 1 A PHE 543 -92.5 85.2 Favored m-85 ?
489 1 A ASN 544 38.7 58.8 Allowed p-10 ?
490 1 A GLY 545 98.0 -152.4 Favored ? ?
491 1 A LEU 546 55.6 40.8 Favored mt ?
492 1 A THR 547 -68.0 130.3 Favored m ?
493 1 A GLY 548 -176.9 173.4 Favored ? ?
494 1 A THR 549 -120.9 131.4 Favored p ?
495 1 A GLY 550 178.0 168.0 Favored ? ?
496 1 A VAL 551 -87.7 134.7 Favored p ?
497 1 A LEU 552 -99.8 124.3 Favored mt ?
498 1 A THR 553 -126.0 151.6 Favored p ?
499 1 A GLU 554 -67.0 143.6 Favored pp20? ?
500 1 A SER 555 -122.3 151.2 Favored t ?
501 1 A ASN 556 -96.2 9.0 Favored p-10 ?
502 1 A LYS 557 -65.0 121.7 Favored ? ?
503 1 A LYS 558 -83.2 86.5 Favored ? ?
504 1 A PHE 559 -68.4 147.6 Favored m-30 ?
505 1 A LEU 560 -77.2 149.6 Favored mt ?
506 1 A PRO 561 -63.3 -19.9 Favored Cg_exo ?
507 1 A PHE 562 -87.3 -23.2 Favored p90 ?
508 1 A GLN 563 -71.9 133.0 Favored mt-30 ?
509 1 A GLN 564 -96.7 -32.6 Favored mm100 ?
510 1 A PHE 565 -155.7 164.7 Favored p90 ?
511 1 A GLY 566 -122.3 158.1 Favored ? ?
512 1 A ARG 567 -134.6 153.1 Favored mtt180 ?
513 1 A ASP 568 -102.0 -166.4 Allowed ? ?
514 1 A ILE 569 -63.4 151.4 Favored ? ?
515 1 A ALA 570 61.9 17.2 Favored ? ?
516 1 A ASP 571 59.0 45.2 Favored t70 ?
517 1 A THR 572 -101.8 143.7 Favored p ?
518 1 A THR 573 -66.2 130.2 Favored p ?
519 1 A ASP 574 -125.4 -30.1 Favored t70 ?
520 1 A ALA 575 -148.5 145.2 Favored ? ?
521 1 A VAL 576 -124.4 157.9 Favored m ?
522 1 A ARG 577 -95.9 134.8 Favored ttm-85 ?
523 1 A ASP 578 -71.5 119.7 Favored t0 ?
524 1 A PRO 579 -69.9 -12.1 Favored Cg_endo ?
525 1 A GLN 580 -104.2 -25.2 Favored ? ?
526 1 A THR 581 -125.8 2.7 Favored p ?
527 1 A LEU 582 56.1 36.1 Favored mt ?
528 1 A GLU 583 -102.3 135.3 Favored tp10 ?
529 1 A ILE 584 -84.1 104.0 Favored mt ?
530 1 A LEU 585 -103.6 121.6 Favored mt ?
531 1 A ASP 586 -79.2 138.7 Favored t70 ?
532 1 A ILE 587 -107.8 144.5 Favored pt ?
533 1 A THR 588 -139.5 136.7 Favored m ?
534 1 A PRO 589 -60.8 142.5 Favored Cg_endo ?
535 1 A CYS 590 -64.9 146.7 Favored m ?
536 1 A SER 591 -62.7 133.8 Favored p ?
537 1 A PHE 592 -152.3 158.2 Favored p90 ?
538 1 A GLY 593 173.0 158.8 Favored ? ?
539 1 A GLY 594 -71.4 149.5 Favored ? ?
540 1 A VAL 595 -111.6 133.2 Favored p ?
541 1 A SER 596 -128.7 140.8 Favored m ?
542 1 A VAL 597 -90.4 158.2 Favored m ?
543 1 A ILE 598 -117.2 117.3 Favored mm ?
544 1 A THR 599 -125.2 125.9 Favored m ?
545 1 A PRO 600 -83.7 15.1 Favored Cg_endo ?
546 1 A GLY 601 105.3 137.2 Favored ? ?
547 1 A THR 602 -65.4 -44.5 Favored m ?
548 1 A ASN 603 -77.8 -6.0 Favored p-10 ?
549 1 A THR 604 -86.1 -54.8 Favored m ?
550 1 A SER 605 -160.1 163.4 Favored t ?
551 1 A ASN 606 -93.4 3.9 Favored m-80 ?
552 1 A GLN 607 -68.8 130.7 Favored mm-40 ?
553 1 A VAL 608 -135.4 131.9 Favored t ?
554 1 A ALA 609 -112.3 139.4 Favored ? ?
555 1 A VAL 610 -105.2 156.3 Favored m ?
556 1 A LEU 611 -132.6 112.8 Favored tp ?
557 1 A TYR 612 -91.1 109.2 Favored m-85 ?
558 1 A GLN 613 -73.2 133.4 Favored mt-30 ?
559 1 A ASP 614 58.5 33.6 Favored t0 ?
560 1 A VAL 615 -117.0 133.2 Favored t ?
561 1 A ASN 616 -72.5 140.1 Favored t-20 ?
562 1 A CYS 617 -73.5 6.4 Favored m ?
563 1 A THR 618 -63.7 -39.2 Favored ? ?
564 1 A GLU 619 -99.6 149.5 Favored pm0 ?
565 1 A VAL 620 ? ? ? t ?
566 1 A SER 640 ? ? ? t ?
567 1 A ASN 641 -120.1 123.6 Favored t-20 ?
568 1 A VAL 642 -117.2 108.3 Favored t ?
569 1 A PHE 643 -114.6 126.1 Favored t80 ?
570 1 A GLN 644 -91.1 105.7 Favored tp60 ?
571 1 A THR 645 -83.6 -176.6 Favored p ?
572 1 A ARG 646 -85.1 -1.7 Favored ? ?
573 1 A ALA 647 -104.8 -29.2 Favored ? ?
574 1 A GLY 648 161.1 -173.0 Favored ? ?
575 1 A CYS 649 -72.5 112.3 Favored m ?
576 1 A LEU 650 -99.9 101.8 Favored tp ?
577 1 A ILE 651 -99.9 127.0 Favored mt ?
578 1 A GLY 652 104.3 -12.4 Favored ? ?
579 1 A ALA 653 -98.4 153.6 Favored ? ?
580 1 A GLU 654 -103.0 125.6 Favored tt0 ?
581 1 A HIS 655 -77.9 134.4 Favored t60 ?
582 1 A VAL 656 -130.1 129.7 Favored t ?
583 1 A ASN 657 -72.6 -12.2 Favored m-20 ?
584 1 A ASN 658 -74.0 -179.7 Favored m-20 ?
585 1 A SER 659 -142.6 132.0 Favored t ?
586 1 A TYR 660 -135.5 -169.1 Favored m-85 ?
587 1 A GLU 661 -72.9 162.6 Favored ? ?
588 1 A CYS 662 -87.0 105.4 Favored t ?
589 1 A ASP 663 -82.9 -61.6 Allowed ? ?
590 1 A ILE 664 -118.5 115.3 Favored mt ?
591 1 A PRO 665 -72.1 146.7 Favored Cg_endo ?
592 1 A ILE 666 -119.7 -49.1 Favored mt ?
593 1 A GLY 667 138.1 148.9 Favored ? ?
594 1 A ALA 668 55.9 40.5 Favored ? ?
595 1 A GLY 669 84.5 15.9 Favored ? ?
596 1 A ILE 670 -117.9 129.5 Favored mt ?
597 1 A CYS 671 -127.8 153.2 Favored m ?
598 1 A ALA 672 -118.7 150.9 Favored ? ?
599 1 A SER 673 -146.5 -172.7 Favored ? ?
600 1 A TYR 674 -104.5 113.4 Favored t80 ?
601 1 A GLN 675 -62.0 -40.4 Favored ? ?
603 1 A GLN 690 ? ? ? OUTLIER ?
604 1 A SER 691 -159.1 158.4 Favored t ?
605 1 A ILE 692 -102.2 112.9 Favored mm ?
606 1 A ILE 693 -106.5 157.7 Favored pt ?
607 1 A ALA 694 -129.4 131.8 Favored ? ?
608 1 A TYR 695 -144.9 161.0 Favored p90 ?
609 1 A THR 696 -74.5 131.1 Favored m ?
610 1 A MET 697 -69.4 150.0 Favored ptm ?
611 1 A SER 698 -102.2 146.0 Favored t ?
612 1 A LEU 699 -95.5 28.0 Favored mt ?
613 1 A GLY 700 100.8 173.8 Favored ? ?
614 1 A ALA 701 -69.1 150.2 Favored ? ?
615 1 A GLU 702 -105.6 120.7 Favored ? ?
616 1 A ASN 703 -140.5 140.6 Favored p30 ?
617 1 A SER 704 -101.1 124.9 Favored t ?
618 1 A VAL 705 -72.3 131.6 Favored t ?
619 1 A ALA 706 -73.5 73.2 Allowed ? ?
620 1 A TYR 707 -76.4 144.7 Favored t80 ?
621 1 A SER 708 -154.8 165.2 Favored t ?
622 1 A ASN 709 -78.0 -2.9 Favored p30 ?
623 1 A ASN 710 -140.0 24.3 Favored p-10 ?
624 1 A SER 711 -121.2 136.2 Favored p ?
625 1 A ILE 712 -128.0 159.2 Favored tt ?
626 1 A ALA 713 -122.9 119.1 Favored ? ?
627 1 A ILE 714 -112.8 127.8 Favored mt ?
628 1 A PRO 715 -67.2 132.1 Favored Cg_endo ?
629 1 A THR 716 -92.5 5.4 Favored p ?
630 1 A ASN 717 -159.6 178.7 Favored t-20 ?
631 1 A PHE 718 -149.2 161.2 Favored p90 ?
632 1 A THR 719 -131.5 98.9 Favored p ?
633 1 A ILE 720 -71.9 132.7 Favored tt ?
634 1 A SER 721 -133.2 153.4 Favored p ?
635 1 A VAL 722 -117.4 121.2 Favored t ?
636 1 A THR 723 -121.6 127.1 Favored m ?
637 1 A THR 724 -79.2 158.3 Favored p ?
638 1 A GLU 725 -153.8 112.1 Favored tt0 ?
639 1 A ILE 726 -102.9 125.2 Favored mp ?
640 1 A LEU 727 -128.5 146.0 Favored mt ?
641 1 A PRO 728 -89.6 145.5 Favored Cg_endo ?
642 1 A VAL 729 -120.0 -22.3 Favored m ?
643 1 A SER 730 -156.4 146.4 Favored p ?
644 1 A MET 731 -92.9 176.1 Favored mtp ?
645 1 A THR 732 -76.9 131.4 Favored p ?
646 1 A LYS 733 -73.8 86.0 Allowed mtpt ?
647 1 A THR 734 -88.6 160.9 Favored t ?
648 1 A SER 735 -158.1 137.6 Favored t ?
649 1 A VAL 736 -123.0 118.5 Favored t ?
650 1 A ASP 737 -70.0 112.4 Favored t0 ?
651 1 A CYS 738 -67.5 -45.6 Favored t ?
652 1 A THR 739 -75.3 -18.6 Favored t ?
653 1 A MET 740 -89.6 -8.3 Favored ? ?
654 1 A TYR 741 -96.4 -46.8 Favored t80 ?
655 1 A ILE 742 -70.2 -43.0 Favored mt ?
656 1 A CYS 743 -114.0 -27.4 Favored m ?
657 1 A GLY 744 82.3 -80.0 Allowed ? ?
658 1 A ASP 745 -140.2 -14.9 Allowed p-10 ?
659 1 A SER 746 -75.5 124.9 Favored t ?
660 1 A THR 747 -70.6 -28.9 Favored p ?
661 1 A GLU 748 -65.6 -22.3 Favored mp0 ?
662 1 A CYS 749 -86.0 -37.8 Favored t ?
663 1 A SER 750 -72.6 -41.8 Favored t ?
664 1 A ASN 751 -64.5 -27.5 Favored m-20 ?
665 1 A LEU 752 -80.2 -28.0 Favored tp ?
666 1 A LEU 753 -72.4 -30.6 Favored tp ?
667 1 A LEU 754 -63.5 -16.4 Favored mt ?
668 1 A GLN 755 -67.2 -22.2 Favored mt-30 ?
669 1 A TYR 756 -83.2 -0.8 Favored m-85 ?
670 1 A GLY 757 85.9 -148.2 Favored ? ?
671 1 A SER 758 -88.2 26.7 Allowed p ?
672 1 A PHE 759 -62.0 -43.3 Favored m-85 ?
673 1 A CYS 760 -64.1 -39.1 Favored m ?
674 1 A THR 761 -63.9 -43.0 Favored m ?
675 1 A GLN 762 -62.6 -44.9 Favored mt-30 ?
676 1 A LEU 763 -67.3 -42.9 Favored mt ?
677 1 A ASN 764 -65.8 -37.1 Favored t30 ?
678 1 A ARG 765 -65.7 -42.2 Favored ttm180 ?
679 1 A ALA 766 -65.5 -41.6 Favored ? ?
680 1 A LEU 767 -66.7 -38.3 Favored mt ?
681 1 A THR 768 -65.5 -35.9 Favored m ?
682 1 A GLY 769 -63.1 -45.9 Favored ? ?
683 1 A ILE 770 -71.3 -28.6 Favored pt ?
684 1 A ALA 771 -65.7 -40.3 Favored ? ?
685 1 A VAL 772 -66.8 -39.8 Favored t ?
686 1 A GLU 773 -65.5 -28.2 Favored tt0 ?
687 1 A GLN 774 -63.5 -48.2 Favored mm-40 ?
688 1 A ASP 775 -68.3 -30.6 Favored m-20 ?
689 1 A LYS 776 -61.9 -40.8 Favored tptp ?
690 1 A ASN 777 -65.9 -43.7 Favored m-20 ?
691 1 A THR 778 -65.0 -39.1 Favored m ?
692 1 A GLN 779 -69.5 -35.4 Favored tt0 ?
693 1 A GLU 780 -66.0 -37.9 Favored tt0 ?
694 1 A VAL 781 -74.3 -58.8 Favored t ?
695 1 A PHE 782 -87.4 -39.3 Favored m-85 ?
696 1 A ALA 783 -79.3 61.6 Favored ? ?
697 1 A GLN 784 -108.0 14.7 Favored mt-30 ?
698 1 A VAL 785 -115.9 137.0 Favored m ?
699 1 A LYS 786 -77.2 -11.9 Favored ? ?
700 1 A GLN 787 -159.2 157.3 Favored pt20 ?
701 1 A ILE 788 -92.2 120.4 Favored mm ?
702 1 A TYR 789 -96.0 142.1 Favored m-85 ?
703 1 A LYS 790 -113.4 133.9 Favored ? ?
704 1 A THR 791 -68.2 148.8 Favored t ?
705 1 A PRO 792 -65.3 151.2 Favored Cg_endo ?
706 1 A PRO 793 -65.9 -27.7 Favored Cg_endo ?
707 1 A ILE 794 -99.3 111.4 Favored ? ?
708 1 A LYS 795 -90.0 69.7 Favored ? ?
709 1 A ASP 796 -94.9 68.3 Favored m-20 ?
710 1 A PHE 797 -95.0 56.4 Allowed m-85 ?
711 1 A GLY 798 64.5 20.4 Favored ? ?
712 1 A GLY 799 95.1 -13.0 Favored ? ?
713 1 A PHE 800 -73.3 144.2 Favored m-85 ?
714 1 A ASN 801 -117.8 104.6 Favored t-20 ?
715 1 A PHE 802 -100.6 27.9 Favored m-85 ?
716 1 A SER 803 -69.6 -26.9 Favored m ?
717 1 A GLN 804 -77.0 -29.7 Favored mp0 ?
718 1 A ILE 805 -103.6 -24.2 Favored pt ?
719 1 A LEU 806 -75.6 153.0 Favored mt ?
720 1 A PRO 807 -66.8 147.0 Favored Cg_endo ?
721 1 A ASP 808 -108.5 132.4 Favored ? ?
722 1 A PRO 809 -66.0 -21.6 Favored Cg_exo ?
723 1 A SER 810 -68.8 -34.4 Favored p ?
724 1 A LYS 811 -78.8 -178.8 Allowed ? ?
725 1 A PRO 812 -48.5 119.0 Favored Cg_exo ?
726 1 A SER 813 -59.2 -21.2 Favored m ?
727 1 A LYS 814 -93.7 -5.1 Favored ? ?
728 1 A ARG 815 -92.1 131.9 Favored mmm-85 ?
729 1 A SER 816 -95.1 -177.0 Favored p ?
730 1 A PHE 817 -67.7 -49.8 Favored t80 ?
731 1 A ILE 818 -68.4 -35.8 Favored mt ?
732 1 A GLU 819 -65.2 -34.0 Favored ? ?
733 1 A ASP 820 -67.2 -35.5 Favored m-20 ?
734 1 A LEU 821 -65.3 -39.6 Favored mt ?
735 1 A LEU 822 -67.0 -40.6 Favored mt ?
736 1 A PHE 823 -71.2 -17.3 Favored m-85 ?
737 1 A ASN 824 -100.4 -23.2 Favored m-20 ?
738 1 A LYS 825 -76.2 -9.4 Favored ? ?
739 1 A VAL 826 -126.9 139.6 Favored m ?
740 1 A THR 827 -137.9 177.2 Favored p ?
741 1 A LEU 828 ? ? ? mt ?
743 1 A PHE 855 -83.1 -172.3 Favored m-85 ?
744 1 A ASN 856 -71.0 136.5 Favored p-10 ?
745 1 A GLY 857 76.6 -47.2 Favored ? ?
746 1 A LEU 858 -66.8 148.1 Favored mp ?
747 1 A THR 859 -149.1 156.7 Favored t ?