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6rjh-validation-alt.cif
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6rjh-validation-alt.cif
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data_6RJH-validation-alt
#
_entry.id 6RJH
#
_pdbx_percentile_list.entry_id 6RJH
_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
6RJH 1 all_atom_clashscore absolute 18.9
6RJH 2 all_atom_clashscore relative 42.0
6RJH 3 Ramachandran_outlier_percent absolute 31.4
6RJH 4 Ramachandran_outlier_percent relative 65.6
6RJH 5 rotamer_outliers_percent absolute 21.3
6RJH 6 rotamer_outliers_percent relative 29.7
#
loop_
_pdbx_percentile_conditions.id
_pdbx_percentile_conditions.number_entries_total
1 136327
2 1886
3 132723
4 1663
5 132532
6 1531
#
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 26.95
4 Ramachandran_outlier_percent A 1 1 A relative 20.55
5 rotamer_outliers_percent A 1 1 A absolute 16.91
6 rotamer_outliers_percent A 1 1 A relative 11.72
3 Ramachandran_outlier_percent B 1 1 B absolute 26.95
4 Ramachandran_outlier_percent B 1 1 B relative 20.55
5 rotamer_outliers_percent B 1 1 B absolute 16.91
6 rotamer_outliers_percent B 1 1 B relative 11.72
3 Ramachandran_outlier_percent C 1 1 C absolute 26.95
4 Ramachandran_outlier_percent C 1 1 C relative 20.55
5 rotamer_outliers_percent C 1 1 C absolute 16.91
6 rotamer_outliers_percent C 1 1 C relative 11.72
3 Ramachandran_outlier_percent D 1 1 D absolute 26.95
4 Ramachandran_outlier_percent D 1 1 D relative 20.55
5 rotamer_outliers_percent D 1 1 D absolute 16.91
6 rotamer_outliers_percent D 1 1 D relative 11.72
3 Ramachandran_outlier_percent E 1 1 E absolute 26.95
4 Ramachandran_outlier_percent E 1 1 E relative 20.55
5 rotamer_outliers_percent E 1 1 E absolute 16.91
6 rotamer_outliers_percent E 1 1 E relative 11.72
3 Ramachandran_outlier_percent F 1 1 F absolute 26.95
4 Ramachandran_outlier_percent F 1 1 F relative 20.55
5 rotamer_outliers_percent F 1 1 F absolute 16.91
6 rotamer_outliers_percent F 1 1 F relative 11.72
3 Ramachandran_outlier_percent G 1 1 G absolute 26.95
4 Ramachandran_outlier_percent G 1 1 G relative 20.55
5 rotamer_outliers_percent G 1 1 G absolute 16.91
6 rotamer_outliers_percent G 1 1 G relative 11.72
3 Ramachandran_outlier_percent H 1 1 H absolute 26.95
4 Ramachandran_outlier_percent H 1 1 H relative 20.55
5 rotamer_outliers_percent H 1 1 H absolute 16.91
6 rotamer_outliers_percent H 1 1 H relative 11.72
3 Ramachandran_outlier_percent I 1 1 I absolute 26.95
4 Ramachandran_outlier_percent I 1 1 I relative 20.55
5 rotamer_outliers_percent I 1 1 I absolute 16.91
6 rotamer_outliers_percent I 1 1 I relative 11.72
3 Ramachandran_outlier_percent J 1 1 J absolute 26.95
4 Ramachandran_outlier_percent J 1 1 J relative 20.55
5 rotamer_outliers_percent J 1 1 J absolute 16.91
6 rotamer_outliers_percent J 1 1 J relative 11.72
3 Ramachandran_outlier_percent K 1 1 K absolute 26.95
4 Ramachandran_outlier_percent K 1 1 K relative 20.55
5 rotamer_outliers_percent K 1 1 K absolute 16.91
6 rotamer_outliers_percent K 1 1 K relative 11.72
3 Ramachandran_outlier_percent L 1 1 L absolute 26.95
4 Ramachandran_outlier_percent L 1 1 L relative 20.55
5 rotamer_outliers_percent L 1 1 L absolute 16.91
6 rotamer_outliers_percent L 1 1 L relative 11.72
3 Ramachandran_outlier_percent M 1 1 M absolute 26.95
4 Ramachandran_outlier_percent M 1 1 M relative 20.55
5 rotamer_outliers_percent M 1 1 M absolute 16.91
6 rotamer_outliers_percent M 1 1 M relative 11.72
3 Ramachandran_outlier_percent N 1 1 N absolute 26.95
4 Ramachandran_outlier_percent N 1 1 N relative 20.55
5 rotamer_outliers_percent N 1 1 N absolute 16.91
6 rotamer_outliers_percent N 1 1 N relative 11.72
3 Ramachandran_outlier_percent O 1 1 O absolute 26.95
4 Ramachandran_outlier_percent O 1 1 O relative 20.55
5 rotamer_outliers_percent O 1 1 O absolute 16.91
6 rotamer_outliers_percent O 1 1 O relative 11.72
3 Ramachandran_outlier_percent P 1 1 P absolute 26.95
4 Ramachandran_outlier_percent P 1 1 P relative 20.55
5 rotamer_outliers_percent P 1 1 P absolute 16.91
6 rotamer_outliers_percent P 1 1 P relative 11.72
3 Ramachandran_outlier_percent Q 1 1 Q absolute 26.95
4 Ramachandran_outlier_percent Q 1 1 Q relative 20.55
5 rotamer_outliers_percent Q 1 1 Q absolute 16.91
6 rotamer_outliers_percent Q 1 1 Q relative 11.72
3 Ramachandran_outlier_percent R 1 1 R absolute 26.95
4 Ramachandran_outlier_percent R 1 1 R relative 20.55
5 rotamer_outliers_percent R 1 1 R absolute 16.91
6 rotamer_outliers_percent R 1 1 R relative 11.72
3 Ramachandran_outlier_percent S 1 1 S absolute 26.95
4 Ramachandran_outlier_percent S 1 1 S relative 20.55
5 rotamer_outliers_percent S 1 1 S absolute 16.91
6 rotamer_outliers_percent S 1 1 S relative 11.72
3 Ramachandran_outlier_percent T 1 1 T absolute 26.95
4 Ramachandran_outlier_percent T 1 1 T relative 20.55
5 rotamer_outliers_percent T 1 1 T absolute 16.91
6 rotamer_outliers_percent T 1 1 T relative 11.72
3 Ramachandran_outlier_percent U 1 1 U absolute 26.95
4 Ramachandran_outlier_percent U 1 1 U relative 20.55
5 rotamer_outliers_percent U 1 1 U absolute 16.91
6 rotamer_outliers_percent U 1 1 U relative 11.72
3 Ramachandran_outlier_percent V 1 1 V absolute 26.95
4 Ramachandran_outlier_percent V 1 1 V relative 20.55
5 rotamer_outliers_percent V 1 1 V absolute 16.91
6 rotamer_outliers_percent V 1 1 V relative 11.72
3 Ramachandran_outlier_percent W 1 1 W absolute 26.95
4 Ramachandran_outlier_percent W 1 1 W relative 20.55
5 rotamer_outliers_percent W 1 1 W absolute 16.91
6 rotamer_outliers_percent W 1 1 W relative 11.72
3 Ramachandran_outlier_percent X 1 1 X absolute 26.95
4 Ramachandran_outlier_percent X 1 1 X relative 20.55
5 rotamer_outliers_percent X 1 1 X absolute 16.91
6 rotamer_outliers_percent X 1 1 X relative 11.72
#
_pdbx_dcc_geometry.entry_id 6RJH
_pdbx_dcc_geometry.Ramachandran_outlier_percent 0.60
_pdbx_dcc_geometry.all_atom_clashscore 15.43
_pdbx_dcc_geometry.angle_overall_rmsz 1.03
_pdbx_dcc_geometry.bond_overall_rmsz 0.80
_pdbx_dcc_geometry.number_angles 44784
_pdbx_dcc_geometry.number_bonds 33264
_pdbx_dcc_geometry.rotamer_outliers_percent 6.94
#
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 1.03 0.80 1866 1386
B 1 1 B 1.03 0.80 1866 1386
C 1 1 C 1.03 0.80 1866 1386
D 1 1 D 1.03 0.80 1866 1386
E 1 1 E 1.03 0.80 1866 1386
F 1 1 F 1.03 0.80 1866 1386
G 1 1 G 1.03 0.80 1866 1386
H 1 1 H 1.03 0.80 1866 1386
I 1 1 I 1.03 0.80 1866 1386
J 1 1 J 1.03 0.80 1866 1386
K 1 1 K 1.03 0.80 1866 1386
L 1 1 L 1.03 0.80 1866 1386
M 1 1 M 1.03 0.80 1866 1386
N 1 1 N 1.03 0.80 1866 1386
O 1 1 O 1.03 0.80 1866 1386
P 1 1 P 1.03 0.80 1866 1386
Q 1 1 Q 1.03 0.80 1866 1386
R 1 1 R 1.03 0.80 1866 1386
S 1 1 S 1.03 0.80 1866 1386
T 1 1 T 1.03 0.80 1866 1386
U 1 1 U 1.03 0.80 1866 1386
V 1 1 V 1.03 0.80 1866 1386
W 1 1 W 1.03 0.80 1866 1386
X 1 1 X 1.03 0.80 1866 1386
#
_em_admin.entry_id EMD-4905
#
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 0.852325294118
B 1 1 B 0.852325294118
C 1 1 C 0.852325294118
D 1 1 D 0.852325294118
E 1 1 E 0.852325294118
F 1 1 F 0.852325294118
G 1 1 G 0.852325294118
H 1 1 H 0.852325294118
I 1 1 I 0.852325294118
J 1 1 J 0.852325294118
K 1 1 K 0.852325294118
L 1 1 L 0.852325294118
M 1 1 M 0.852325294118
N 1 1 N 0.852325294118
O 1 1 O 0.852325294118
P 1 1 P 0.852325294118
Q 1 1 Q 0.852325294118
R 1 1 R 0.852325294118
S 1 1 S 0.852325294118
T 1 1 T 0.852325294118
U 1 1 U 0.852325294118
V 1 1 V 0.852325294118
W 1 1 W 0.852325294118
X 1 1 X 0.852325294118
#
_pdbx_em_validate_map_model_overall.entry_id 6RJH
_pdbx_em_validate_map_model_overall.recommended_contour_level 0.04
_pdbx_em_validate_map_model_overall.atom_inclusion_main 0.957353
#
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.pdbx_rotamer
_struct_mon_prot.phi
_struct_mon_prot.psi
_struct_mon_prot.pdbx_Ramachandran_region
_struct_mon_prot.pdbx_flippable_side_chain
1 1 A SER 2 t ? ? ? ?
2 1 A GLN 3 pt20 -63.1 -12.6 Favored ?
3 1 A ILE 4 pt -115.6 -6.9 Favored ?
4 1 A ARG 5 ttt180 -67.1 120.5 Favored ?
5 1 A GLN 6 tt0 -139.1 121.0 Favored ?
6 1 A ASN 7 t30 55.5 41.6 Favored ?
7 1 A TYR 8 t80 -119.2 88.1 Favored ?
8 1 A SER 9 p -57.7 142.1 Favored ?
9 1 A THR 10 p -62.4 -11.2 Favored ?
10 1 A GLU 11 mp0 -76.0 -44.6 Favored ?
11 1 A VAL 12 t -75.3 -33.4 Favored ?
12 1 A GLU 13 tt0 -56.8 -50.8 Favored ?
13 1 A ALA 14 ? -66.2 -37.5 Favored ?
14 1 A ALA 15 ? -71.5 -25.3 Favored ?
15 1 A VAL 16 t -87.7 -30.3 Favored ?
16 1 A ASN 17 m-20 -63.5 -38.6 Favored ?
17 1 A ARG 18 mtp180 -73.1 -28.9 Favored ?
18 1 A LEU 19 tp -88.1 -23.9 Favored ?
19 1 A VAL 20 t -60.4 -41.4 Favored ?
20 1 A ASN 21 t-20 -67.7 -41.9 Favored ?
21 1 A LEU 22 tp -59.8 -40.9 Favored ?
22 1 A TYR 23 m-85 -72.1 -32.9 Favored ?
23 1 A LEU 24 mt -78.7 -32.3 Favored ?
24 1 A ARG 25 OUTLIER -62.3 -44.5 Favored ?
25 1 A ALA 26 ? -62.3 -44.7 Favored ?
26 1 A SER 27 t -58.7 -35.0 Favored ?
27 1 A TYR 28 t80 -69.1 -44.4 Favored ?
28 1 A THR 29 m -63.1 -43.2 Favored ?
29 1 A TYR 30 m-85 -65.3 -27.0 Favored ?
30 1 A LEU 31 tp -71.2 -41.7 Favored ?
31 1 A SER 32 t -61.5 -44.5 Favored ?
32 1 A LEU 33 mt -63.0 -47.2 Favored ?
33 1 A GLY 34 ? -53.3 -56.1 Favored ?
34 1 A PHE 35 m-85 -69.7 -14.5 Favored ?
35 1 A TYR 36 t80 -82.9 -33.9 Favored ?
36 1 A PHE 37 m-85 -78.9 -2.6 Favored ?
37 1 A ASP 38 t70 -98.8 -4.7 Favored ?
38 1 A ARG 39 mtp180 -62.6 143.6 Favored ?
39 1 A ASP 40 OUTLIER -57.7 -32.9 Favored ?
40 1 A ASP 41 p-10 -90.6 1.4 Favored ?
41 1 A VAL 42 t -110.8 -53.7 Favored ?
42 1 A ALA 43 ? 44.4 65.0 Allowed ?
43 1 A LEU 44 mt -126.2 81.8 Favored ?
44 1 A GLU 45 tt0 -63.9 -24.2 Favored ?
45 1 A GLY 46 ? -73.7 -38.4 Favored ?
46 1 A VAL 47 t -72.0 -34.3 Favored ?
47 1 A CYS 48 t -71.8 -41.6 Favored ?
48 1 A HIS 49 m-70 -67.9 -27.2 Favored Y
49 1 A PHE 50 t80 -72.3 -43.0 Favored ?
50 1 A PHE 51 m-85 -79.0 -24.7 Favored ?
51 1 A ARG 52 mmm-85 -71.6 -38.1 Favored ?
52 1 A GLU 53 OUTLIER -67.0 -37.0 Favored ?
53 1 A LEU 54 mt -71.8 -22.9 Favored ?
54 1 A ALA 55 ? -78.5 -29.9 Favored ?
55 1 A GLU 56 tt0 -82.0 -37.6 Favored ?
56 1 A GLU 57 OUTLIER -58.7 -35.0 Favored ?
57 1 A LYS 58 mmtt -73.4 -40.1 Favored ?
58 1 A ARG 59 ttm105 -60.8 -44.3 Favored ?
59 1 A GLU 60 mt-10 -65.1 -27.6 Favored ?
60 1 A GLY 61 ? -69.9 -40.5 Favored ?
61 1 A ALA 62 ? -56.3 -49.3 Favored ?
62 1 A GLU 63 mt-10 -63.1 -38.7 Favored ?
63 1 A ARG 64 ttm180 -60.0 -44.9 Favored ?
64 1 A LEU 65 mt -66.3 -34.2 Favored ?
65 1 A LEU 66 mt -77.4 -33.3 Favored ?
66 1 A LYS 67 tptp -63.5 -42.2 Favored ?
67 1 A MET 68 tmm? -67.5 -37.6 Favored ?
68 1 A GLN 69 tp-100 -59.9 -43.7 Favored ?
69 1 A ASN 70 m-20 -67.6 -36.8 Favored ?
70 1 A GLN 71 mt-30 -64.2 -33.3 Favored ?
71 1 A ARG 72 mmm-85 -90.9 0.2 Favored ?
72 1 A GLY 73 ? 83.2 15.7 Favored ?
73 1 A GLY 74 ? -81.8 165.5 Favored ?
74 1 A ARG 75 mmt180 -115.1 114.8 Favored ?
75 1 A ALA 76 ? -51.6 125.7 Favored ?
76 1 A LEU 77 mt -126.7 113.2 Favored ?
77 1 A PHE 78 m-85 -89.1 142.4 Favored ?
78 1 A GLN 79 mm-40 -111.3 165.2 Favored ?
79 1 A ASP 80 m-20 -59.8 140.3 Favored ?
80 1 A LEU 81 mt -87.2 113.8 Favored ?
81 1 A GLN 82 tt0 -64.2 141.0 Favored ?
82 1 A LYS 83 OUTLIER -69.6 151.6 Favored ?
83 1 A PRO 84 Cg_exo -41.0 160.8 OUTLIER ?
84 1 A SER 85 p -95.5 -2.0 Favored ?
85 1 A GLN 86 mt-30 -141.0 158.3 Favored ?
86 1 A ASP 87 m-20 -100.1 -36.0 Favored ?
87 1 A GLU 88 mt-10 -115.9 139.7 Favored ?
88 1 A TRP 89 m95 -101.3 6.9 Favored ?
89 1 A GLY 90 ? 83.3 -145.1 Favored ?
90 1 A THR 91 p -94.5 174.8 Favored ?
91 1 A THR 92 m -59.7 -35.8 Favored ?
92 1 A LEU 93 tp -61.0 -56.2 Favored ?
93 1 A ASP 94 m-20 -55.8 -49.8 Favored ?
94 1 A ALA 95 ? -59.0 -44.7 Favored ?
95 1 A MET 96 tpp -62.0 -41.4 Favored ?
96 1 A LYS 97 mttt -66.3 -39.5 Favored ?
97 1 A ALA 98 ? -64.6 -41.7 Favored ?
98 1 A ALA 99 ? -66.3 -32.5 Favored ?
99 1 A ILE 100 tt -84.9 -26.4 Favored ?
100 1 A VAL 101 t -53.8 -47.1 Favored ?
101 1 A LEU 102 tp -55.5 -48.6 Favored ?
102 1 A GLU 103 mm-40 -70.4 -35.6 Favored ?
103 1 A LYS 104 mttt -72.5 -23.0 Favored ?
104 1 A SER 105 p -89.3 -28.2 Favored ?
105 1 A LEU 106 mt -62.9 -41.5 Favored ?
106 1 A ASN 107 t30 -68.5 -32.9 Favored ?
107 1 A GLN 108 tp60 -77.6 -29.7 Favored ?
108 1 A ALA 109 ? -65.0 -39.1 Favored ?
109 1 A LEU 110 mt -66.0 -43.9 Favored ?
110 1 A LEU 111 mt -62.5 -37.6 Favored ?
111 1 A ASP 112 m-20 -65.2 -46.4 Favored ?
112 1 A LEU 113 tp -61.5 -38.5 Favored ?
113 1 A HIS 114 t-80 -61.1 -47.2 Favored ?
114 1 A ALA 115 ? -60.9 -42.9 Favored ?
115 1 A LEU 116 tp -59.9 -39.7 Favored ?
116 1 A GLY 117 ? -69.1 -24.9 Favored ?
117 1 A SER 118 m -79.7 -46.6 Favored ?
118 1 A ALA 119 ? -52.8 -56.2 Favored ?
119 1 A GLN 120 mm-40 -73.8 -3.4 Favored ?
120 1 A ALA 121 ? 53.8 69.8 Allowed ?
121 1 A ASP 122 t0 -121.3 75.7 Favored ?
122 1 A PRO 123 Cg_endo -53.6 -36.9 Favored ?
123 1 A HIS 124 t-80 -65.9 -39.1 Favored ?
124 1 A LEU 125 tp -66.5 -36.2 Favored ?
125 1 A CYS 126 m -74.8 -46.5 Favored ?
126 1 A ASP 127 OUTLIER -56.5 -30.5 Favored ?
127 1 A PHE 128 t80 -70.2 -55.9 Favored ?
128 1 A LEU 129 mt -64.1 -21.8 Favored ?
129 1 A GLU 130 mt-10 -71.3 -53.3 Favored ?
130 1 A SER 131 OUTLIER -57.1 -47.4 Favored ?
131 1 A HIS 132 m-70 -111.8 -9.1 Favored Y
132 1 A PHE 133 m-85 -125.5 -50.6 Allowed ?
133 1 A LEU 134 mt -53.1 -53.9 Favored ?
134 1 A ASP 135 t70 -64.2 -41.3 Favored ?
135 1 A GLU 136 mt-10 -61.2 -46.6 Favored ?
136 1 A GLU 137 mm-40 -65.0 -43.7 Favored ?
137 1 A VAL 138 t -59.9 -47.2 Favored ?
138 1 A LYS 139 mttm -62.4 -41.6 Favored ?
139 1 A LEU 140 tp -65.0 -42.0 Favored ?
140 1 A ILE 141 mt -72.1 -29.1 Favored ?
141 1 A LYS 142 tptp -75.6 -36.1 Favored ?
142 1 A LYS 143 ttpt -59.2 -39.5 Favored ?
143 1 A MET 144 mtt -77.4 -35.2 Favored ?
144 1 A GLY 145 ? -64.1 -38.0 Favored ?
145 1 A ASP 146 m-20 -62.4 -52.1 Favored ?
146 1 A HIS 147 m-70 -55.6 -47.0 Favored ?
147 1 A LEU 148 mt -58.9 -48.3 Favored ?
148 1 A THR 149 m -60.1 -39.9 Favored ?
149 1 A ASN 150 m-80 -70.2 -40.6 Favored ?
150 1 A ILE 151 mt -66.8 -41.8 Favored ?
151 1 A GLN 152 mt-30 -63.3 -37.0 Favored ?
152 1 A ARG 153 OUTLIER -71.3 -36.3 Favored ?
153 1 A LEU 154 mt -82.7 -8.8 Favored ?
154 1 A VAL 155 OUTLIER -98.5 -15.6 Favored ?
155 1 A GLY 156 ? -43.7 -64.5 Allowed ?
156 1 A SER 157 p -93.0 -92.5 Allowed ?
157 1 A GLN 158 OUTLIER -78.2 107.9 Favored ?
158 1 A ALA 159 ? -82.1 -48.7 Favored ?
159 1 A GLY 160 ? -54.8 -53.3 Favored ?
160 1 A LEU 161 tp -57.3 -46.2 Favored ?
161 1 A GLY 162 ? -63.0 -48.6 Favored ?
162 1 A GLU 163 tt0 -58.8 -42.9 Favored ?
163 1 A TYR 164 t80 -63.9 -50.6 Favored ?
164 1 A LEU 165 mt -59.9 -46.5 Favored ?
165 1 A PHE 166 t80 -57.9 -51.0 Favored ?
166 1 A GLU 167 tm-20 -59.7 -41.5 Favored ?
167 1 A ARG 168 mmp_? -75.8 -42.3 Favored ?
168 1 A LEU 169 mt -92.7 -41.2 Favored ?
169 1 A THR 170 m -94.7 -47.2 Favored ?
170 1 A LEU 171 mt ? ? ? ?
171 1 B SER 2 t ? ? ? ?
172 1 B GLN 3 pt20 -63.1 -12.7 Favored ?
173 1 B ILE 4 pt -115.5 -6.9 Favored ?
174 1 B ARG 5 ttt180 -67.1 120.5 Favored ?
175 1 B GLN 6 tt0 -139.0 121.0 Favored ?
176 1 B ASN 7 t30 55.4 41.7 Favored ?
177 1 B TYR 8 t80 -119.2 88.1 Favored ?
178 1 B SER 9 p -57.7 142.1 Favored ?
179 1 B THR 10 p -62.4 -11.2 Favored ?
180 1 B GLU 11 mp0 -76.0 -44.7 Favored ?
181 1 B VAL 12 t -75.3 -33.4 Favored ?
182 1 B GLU 13 tt0 -56.8 -50.8 Favored ?
183 1 B ALA 14 ? -66.2 -37.5 Favored ?
184 1 B ALA 15 ? -71.5 -25.2 Favored ?
185 1 B VAL 16 t -87.7 -30.3 Favored ?
186 1 B ASN 17 m-20 -63.5 -38.6 Favored ?
187 1 B ARG 18 mtp180 -73.1 -28.9 Favored ?
188 1 B LEU 19 tp -88.1 -23.8 Favored ?
189 1 B VAL 20 t -60.4 -41.5 Favored ?
190 1 B ASN 21 t-20 -67.6 -41.9 Favored ?
191 1 B LEU 22 tp -59.8 -40.9 Favored ?
192 1 B TYR 23 m-85 -72.1 -32.8 Favored ?
193 1 B LEU 24 mt -78.7 -32.3 Favored ?
194 1 B ARG 25 OUTLIER -62.3 -44.5 Favored ?
195 1 B ALA 26 ? -62.3 -44.7 Favored ?
196 1 B SER 27 t -58.8 -35.0 Favored ?
197 1 B TYR 28 t80 -69.1 -44.4 Favored ?
198 1 B THR 29 m -63.0 -43.3 Favored ?
199 1 B TYR 30 m-85 -65.4 -26.9 Favored ?
200 1 B LEU 31 tp -71.1 -41.8 Favored ?
201 1 B SER 32 t -61.5 -44.5 Favored ?
202 1 B LEU 33 mt -63.0 -47.2 Favored ?
203 1 B GLY 34 ? -53.3 -56.1 Favored ?
204 1 B PHE 35 m-85 -69.7 -14.6 Favored ?
205 1 B TYR 36 t80 -82.9 -33.9 Favored ?
206 1 B PHE 37 m-85 -78.9 -2.5 Favored ?
207 1 B ASP 38 t70 -98.9 -4.7 Favored ?
208 1 B ARG 39 mtp180 -62.6 143.6 Favored ?
209 1 B ASP 40 OUTLIER -57.7 -32.9 Favored ?
210 1 B ASP 41 p-10 -90.7 1.4 Favored ?
211 1 B VAL 42 t -110.7 -53.8 Favored ?
212 1 B ALA 43 ? 44.4 65.0 Allowed ?
213 1 B LEU 44 mt -126.1 81.8 Favored ?
214 1 B GLU 45 tt0 -63.9 -24.2 Favored ?
215 1 B GLY 46 ? -73.7 -38.4 Favored ?
216 1 B VAL 47 t -72.0 -34.3 Favored ?
217 1 B CYS 48 t -71.8 -41.6 Favored ?
218 1 B HIS 49 m-70 -67.9 -27.3 Favored Y
219 1 B PHE 50 t80 -72.3 -43.0 Favored ?
220 1 B PHE 51 m-85 -79.0 -24.7 Favored ?
221 1 B ARG 52 mmm-85 -71.6 -38.0 Favored ?
222 1 B GLU 53 OUTLIER -67.0 -37.0 Favored ?
223 1 B LEU 54 mt -71.8 -22.9 Favored ?
224 1 B ALA 55 ? -78.4 -29.9 Favored ?
225 1 B GLU 56 tt0 -82.0 -37.7 Favored ?
226 1 B GLU 57 OUTLIER -58.7 -34.9 Favored ?
227 1 B LYS 58 mmtt -73.3 -40.2 Favored ?
228 1 B ARG 59 ttm105 -60.9 -44.3 Favored ?
229 1 B GLU 60 mt-10 -65.1 -27.6 Favored ?
230 1 B GLY 61 ? -69.9 -40.5 Favored ?
231 1 B ALA 62 ? -56.2 -49.3 Favored ?
232 1 B GLU 63 mt-10 -63.1 -38.7 Favored ?
233 1 B ARG 64 ttm180 -60.0 -44.9 Favored ?
234 1 B LEU 65 mt -66.3 -34.2 Favored ?
235 1 B LEU 66 mt -77.5 -33.3 Favored ?
236 1 B LYS 67 tptp -63.5 -42.2 Favored ?
237 1 B MET 68 tmm? -67.5 -37.6 Favored ?
238 1 B GLN 69 tp-100 -60.0 -43.7 Favored ?
239 1 B ASN 70 m-20 -67.6 -36.8 Favored ?
240 1 B GLN 71 mt-30 -64.2 -33.3 Favored ?
241 1 B ARG 72 mmm-85 -90.9 0.2 Favored ?
242 1 B GLY 73 ? 83.2 15.7 Favored ?
243 1 B GLY 74 ? -81.7 165.5 Favored ?
244 1 B ARG 75 mmt180 -115.1 114.8 Favored ?
245 1 B ALA 76 ? -51.6 125.7 Favored ?
246 1 B LEU 77 mt -126.7 113.2 Favored ?
247 1 B PHE 78 m-85 -89.1 142.4 Favored ?
248 1 B GLN 79 mm-40 -111.3 165.2 Favored ?
249 1 B ASP 80 m-20 -59.9 140.3 Favored ?
250 1 B LEU 81 mt -87.2 113.9 Favored ?
251 1 B GLN 82 tt0 -64.3 141.0 Favored ?
252 1 B LYS 83 OUTLIER -69.6 151.6 Favored ?
253 1 B PRO 84 Cg_exo -41.0 160.8 OUTLIER ?
254 1 B SER 85 p -95.5 -2.0 Favored ?
255 1 B GLN 86 mt-30 -141.0 158.2 Favored ?
256 1 B ASP 87 m-20 -100.1 -36.1 Favored ?
257 1 B GLU 88 mt-10 -115.9 139.6 Favored ?
258 1 B TRP 89 m95 -101.3 6.9 Favored ?
259 1 B GLY 90 ? 83.3 -145.1 Favored ?
260 1 B THR 91 p -94.5 174.8 Favored ?
261 1 B THR 92 m -59.7 -35.8 Favored ?
262 1 B LEU 93 tp -61.0 -56.2 Favored ?
263 1 B ASP 94 m-20 -55.8 -49.9 Favored ?
264 1 B ALA 95 ? -59.0 -44.7 Favored ?
265 1 B MET 96 tpp -62.0 -41.4 Favored ?
266 1 B LYS 97 mttt -66.3 -39.5 Favored ?
267 1 B ALA 98 ? -64.6 -41.7 Favored ?
268 1 B ALA 99 ? -66.2 -32.5 Favored ?
269 1 B ILE 100 tt -84.9 -26.4 Favored ?
270 1 B VAL 101 t -53.8 -47.1 Favored ?
271 1 B LEU 102 tp -55.5 -48.6 Favored ?
272 1 B GLU 103 mm-40 -70.4 -35.5 Favored ?
273 1 B LYS 104 mttt -72.5 -23.0 Favored ?
274 1 B SER 105 p -89.2 -28.3 Favored ?
275 1 B LEU 106 mt -62.9 -41.6 Favored ?
276 1 B ASN 107 t30 -68.4 -32.9 Favored ?
277 1 B GLN 108 tp60 -77.6 -29.7 Favored ?
278 1 B ALA 109 ? -65.0 -39.1 Favored ?
279 1 B LEU 110 mt -66.0 -43.9 Favored ?
280 1 B LEU 111 mt -62.5 -37.6 Favored ?
281 1 B ASP 112 m-20 -65.2 -46.4 Favored ?
282 1 B LEU 113 tp -61.5 -38.5 Favored ?
283 1 B HIS 114 t-80 -61.1 -47.2 Favored ?
284 1 B ALA 115 ? -60.9 -42.9 Favored ?
285 1 B LEU 116 tp -59.8 -39.7 Favored ?
286 1 B GLY 117 ? -69.0 -24.9 Favored ?
287 1 B SER 118 m -79.7 -46.6 Favored ?
288 1 B ALA 119 ? -52.8 -56.1 Favored ?
289 1 B GLN 120 mm-40 -73.8 -3.4 Favored ?
290 1 B ALA 121 ? 53.8 69.8 Allowed ?
291 1 B ASP 122 t0 -121.3 75.8 Favored ?
292 1 B PRO 123 Cg_endo -53.7 -36.9 Favored ?
293 1 B HIS 124 t-80 -65.9 -39.1 Favored ?
294 1 B LEU 125 tp -66.5 -36.3 Favored ?
295 1 B CYS 126 m -74.8 -46.5 Favored ?
296 1 B ASP 127 OUTLIER -56.6 -30.4 Favored ?
297 1 B PHE 128 t80 -70.2 -55.9 Favored ?
298 1 B LEU 129 mt -64.1 -21.8 Favored ?
299 1 B GLU 130 mt-10 -71.4 -53.3 Favored ?
300 1 B SER 131 OUTLIER -57.1 -47.4 Favored ?
301 1 B HIS 132 m-70 -111.8 -9.0 Favored Y
302 1 B PHE 133 m-85 -125.5 -50.6 Allowed ?
303 1 B LEU 134 mt -53.1 -53.8 Favored ?
304 1 B ASP 135 t70 -64.2 -41.2 Favored ?
305 1 B GLU 136 mt-10 -61.2 -46.6 Favored ?
306 1 B GLU 137 mm-40 -65.0 -43.6 Favored ?
307 1 B VAL 138 t -59.9 -47.2 Favored ?
308 1 B LYS 139 mttm -62.4 -41.5 Favored ?
309 1 B LEU 140 tp -65.0 -42.0 Favored ?
310 1 B ILE 141 mt -72.1 -29.2 Favored ?
311 1 B LYS 142 tptp -75.6 -36.1 Favored ?
312 1 B LYS 143 ttpt -59.2 -39.5 Favored ?
313 1 B MET 144 mtt -77.4 -35.2 Favored ?
314 1 B GLY 145 ? -64.1 -38.1 Favored ?
315 1 B ASP 146 m-20 -62.4 -52.1 Favored ?
316 1 B HIS 147 m-70 -55.6 -47.1 Favored ?
317 1 B LEU 148 mt -58.9 -48.2 Favored ?
318 1 B THR 149 m -60.0 -39.9 Favored ?
319 1 B ASN 150 m-80 -70.2 -40.6 Favored ?
320 1 B ILE 151 mt -66.8 -41.8 Favored ?
321 1 B GLN 152 mt-30 -63.3 -37.0 Favored ?
322 1 B ARG 153 OUTLIER -71.3 -36.3 Favored ?
323 1 B LEU 154 mt -82.7 -8.8 Favored ?
324 1 B VAL 155 OUTLIER -98.5 -15.6 Favored ?
325 1 B GLY 156 ? -43.7 -64.4 Allowed ?
326 1 B SER 157 p -93.0 -92.5 Allowed ?
327 1 B GLN 158 OUTLIER -78.2 107.9 Favored ?
328 1 B ALA 159 ? -82.1 -48.7 Favored ?
329 1 B GLY 160 ? -54.8 -53.3 Favored ?
330 1 B LEU 161 tp -57.3 -46.3 Favored ?
331 1 B GLY 162 ? -63.0 -48.6 Favored ?
332 1 B GLU 163 tt0 -58.8 -42.9 Favored ?
333 1 B TYR 164 t80 -63.9 -50.6 Favored ?
334 1 B LEU 165 mt -59.9 -46.5 Favored ?
335 1 B PHE 166 t80 -57.9 -51.0 Favored ?
336 1 B GLU 167 tm-20 -59.7 -41.5 Favored ?
337 1 B ARG 168 mmp_? -75.8 -42.4 Favored ?
338 1 B LEU 169 mt -92.7 -41.3 Favored ?
339 1 B THR 170 m -94.7 -47.2 Favored ?
340 1 B LEU 171 mt ? ? ? ?
341 1 C SER 2 t ? ? ? ?
342 1 C GLN 3 pt20 -63.1 -12.6 Favored ?
343 1 C ILE 4 pt -115.6 -6.9 Favored ?
344 1 C ARG 5 ttt180 -67.1 120.6 Favored ?
345 1 C GLN 6 tt0 -139.1 121.0 Favored ?
346 1 C ASN 7 t30 55.4 41.6 Favored ?
347 1 C TYR 8 t80 -119.1 88.1 Favored ?
348 1 C SER 9 p -57.7 142.1 Favored ?
349 1 C THR 10 p -62.4 -11.2 Favored ?
350 1 C GLU 11 mp0 -76.0 -44.7 Favored ?
351 1 C VAL 12 t -75.2 -33.4 Favored ?
352 1 C GLU 13 tt0 -56.9 -50.7 Favored ?
353 1 C ALA 14 ? -66.2 -37.5 Favored ?
354 1 C ALA 15 ? -71.5 -25.3 Favored ?
355 1 C VAL 16 t -87.7 -30.3 Favored ?
356 1 C ASN 17 m-20 -63.5 -38.7 Favored ?
357 1 C ARG 18 mtp180 -73.0 -28.9 Favored ?
358 1 C LEU 19 tp -88.1 -23.9 Favored ?
359 1 C VAL 20 t -60.3 -41.4 Favored ?
360 1 C ASN 21 t-20 -67.7 -41.9 Favored ?
361 1 C LEU 22 tp -59.9 -40.9 Favored ?
362 1 C TYR 23 m-85 -72.1 -32.8 Favored ?
363 1 C LEU 24 mt -78.7 -32.3 Favored ?
364 1 C ARG 25 OUTLIER -62.2 -44.5 Favored ?
365 1 C ALA 26 ? -62.3 -44.7 Favored ?
366 1 C SER 27 t -58.7 -35.0 Favored ?
367 1 C TYR 28 t80 -69.0 -44.4 Favored ?
368 1 C THR 29 m -63.1 -43.3 Favored ?
369 1 C TYR 30 m-85 -65.3 -26.9 Favored ?
370 1 C LEU 31 tp -71.2 -41.7 Favored ?
371 1 C SER 32 t -61.6 -44.5 Favored ?
372 1 C LEU 33 mt -63.0 -47.2 Favored ?
373 1 C GLY 34 ? -53.3 -56.1 Favored ?
374 1 C PHE 35 m-85 -69.8 -14.5 Favored ?
375 1 C TYR 36 t80 -83.0 -33.8 Favored ?
376 1 C PHE 37 m-85 -78.9 -2.6 Favored ?
377 1 C ASP 38 t70 -98.8 -4.7 Favored ?
378 1 C ARG 39 mtp180 -62.7 143.6 Favored ?
379 1 C ASP 40 OUTLIER -57.7 -32.9 Favored ?
380 1 C ASP 41 p-10 -90.6 1.3 Favored ?
381 1 C VAL 42 t -110.8 -53.7 Favored ?
382 1 C ALA 43 ? 44.4 65.0 Allowed ?
383 1 C LEU 44 mt -126.1 81.8 Favored ?
384 1 C GLU 45 tt0 -63.9 -24.2 Favored ?
385 1 C GLY 46 ? -73.7 -38.4 Favored ?
386 1 C VAL 47 t -72.0 -34.3 Favored ?
387 1 C CYS 48 t -71.8 -41.6 Favored ?
388 1 C HIS 49 m-70 -67.9 -27.3 Favored Y
389 1 C PHE 50 t80 -72.3 -43.0 Favored ?
390 1 C PHE 51 m-85 -79.0 -24.7 Favored ?
391 1 C ARG 52 mmm-85 -71.6 -38.1 Favored ?
392 1 C GLU 53 OUTLIER -67.0 -37.0 Favored ?
393 1 C LEU 54 mt -71.8 -22.9 Favored ?
394 1 C ALA 55 ? -78.4 -29.9 Favored ?
395 1 C GLU 56 tt0 -82.0 -37.6 Favored ?
396 1 C GLU 57 OUTLIER -58.6 -35.0 Favored ?
397 1 C LYS 58 mmtt -73.4 -40.1 Favored ?
398 1 C ARG 59 ttm105 -60.8 -44.3 Favored ?
399 1 C GLU 60 mt-10 -65.2 -27.6 Favored ?
400 1 C GLY 61 ? -69.9 -40.5 Favored ?
401 1 C ALA 62 ? -56.3 -49.3 Favored ?
402 1 C GLU 63 mt-10 -63.1 -38.7 Favored ?
403 1 C ARG 64 ttm180 -60.0 -44.9 Favored ?
404 1 C LEU 65 mt -66.3 -34.2 Favored ?
405 1 C LEU 66 mt -77.5 -33.3 Favored ?
406 1 C LYS 67 tptp -63.5 -42.2 Favored ?
407 1 C MET 68 tmm? -67.5 -37.6 Favored ?
408 1 C GLN 69 tp-100 -59.8 -43.8 Favored ?
409 1 C ASN 70 m-20 -67.6 -36.8 Favored ?
410 1 C GLN 71 mt-30 -64.3 -33.2 Favored ?
411 1 C ARG 72 mmm-85 -90.9 0.2 Favored ?
412 1 C GLY 73 ? 83.3 15.6 Favored ?
413 1 C GLY 74 ? -81.7 165.5 Favored ?
414 1 C ARG 75 mmt180 -115.1 114.8 Favored ?
415 1 C ALA 76 ? -51.5 125.7 Favored ?
416 1 C LEU 77 mt -126.7 113.2 Favored ?
417 1 C PHE 78 m-85 -89.1 142.4 Favored ?
418 1 C GLN 79 mm-40 -111.4 165.2 Favored ?
419 1 C ASP 80 m-20 -59.8 140.3 Favored ?
420 1 C LEU 81 mt -87.2 113.9 Favored ?
421 1 C GLN 82 tt0 -64.3 141.0 Favored ?
422 1 C LYS 83 OUTLIER -69.6 151.6 Favored ?
423 1 C PRO 84 Cg_exo -40.9 160.7 OUTLIER ?
424 1 C SER 85 p -95.5 -2.0 Favored ?
425 1 C GLN 86 mt-30 -141.1 158.3 Favored ?
426 1 C ASP 87 m-20 -100.2 -36.0 Favored ?
427 1 C GLU 88 mt-10 -115.9 139.6 Favored ?
428 1 C TRP 89 m95 -101.3 6.9 Favored ?
429 1 C GLY 90 ? 83.4 -145.1 Favored ?
430 1 C THR 91 p -94.5 174.8 Favored ?
431 1 C THR 92 m -59.6 -35.8 Favored ?
432 1 C LEU 93 tp -61.0 -56.2 Favored ?
433 1 C ASP 94 m-20 -55.8 -49.9 Favored ?
434 1 C ALA 95 ? -59.0 -44.7 Favored ?
435 1 C MET 96 tpp -62.0 -41.3 Favored ?
436 1 C LYS 97 mttt -66.3 -39.5 Favored ?
437 1 C ALA 98 ? -64.6 -41.7 Favored ?
438 1 C ALA 99 ? -66.3 -32.5 Favored ?
439 1 C ILE 100 tt -84.9 -26.4 Favored ?
440 1 C VAL 101 t -53.8 -47.2 Favored ?
441 1 C LEU 102 tp -55.6 -48.6 Favored ?
442 1 C GLU 103 mm-40 -70.4 -35.6 Favored ?
443 1 C LYS 104 mttt -72.5 -23.0 Favored ?
444 1 C SER 105 p -89.3 -28.3 Favored ?
445 1 C LEU 106 mt -62.9 -41.5 Favored ?
446 1 C ASN 107 t30 -68.5 -32.9 Favored ?
447 1 C GLN 108 tp60 -77.6 -29.7 Favored ?
448 1 C ALA 109 ? -65.0 -39.1 Favored ?
449 1 C LEU 110 mt -66.0 -43.9 Favored ?
450 1 C LEU 111 mt -62.5 -37.6 Favored ?
451 1 C ASP 112 m-20 -65.3 -46.3 Favored ?
452 1 C LEU 113 tp -61.5 -38.5 Favored ?
453 1 C HIS 114 t-80 -61.1 -47.2 Favored ?
454 1 C ALA 115 ? -60.9 -42.9 Favored ?
455 1 C LEU 116 tp -59.9 -39.6 Favored ?
456 1 C GLY 117 ? -69.1 -24.9 Favored ?
457 1 C SER 118 m -79.7 -46.6 Favored ?
458 1 C ALA 119 ? -52.8 -56.1 Favored ?
459 1 C GLN 120 mm-40 -73.8 -3.4 Favored ?
460 1 C ALA 121 ? 53.8 69.8 Allowed ?
461 1 C ASP 122 t0 -121.3 75.7 Favored ?
462 1 C PRO 123 Cg_endo -53.7 -36.9 Favored ?
463 1 C HIS 124 t-80 -65.9 -39.1 Favored ?
464 1 C LEU 125 tp -66.4 -36.2 Favored ?
465 1 C CYS 126 m -74.8 -46.5 Favored ?
466 1 C ASP 127 OUTLIER -56.5 -30.5 Favored ?
467 1 C PHE 128 t80 -70.2 -55.9 Favored ?
468 1 C LEU 129 mt -64.1 -21.8 Favored ?
469 1 C GLU 130 mt-10 -71.3 -53.3 Favored ?
470 1 C SER 131 OUTLIER -57.1 -47.4 Favored ?
471 1 C HIS 132 m-70 -111.8 -9.1 Favored Y
472 1 C PHE 133 m-85 -125.4 -50.6 Allowed ?
473 1 C LEU 134 mt -53.1 -53.9 Favored ?
474 1 C ASP 135 t70 -64.1 -41.3 Favored ?
475 1 C GLU 136 mt-10 -61.2 -46.6 Favored ?
476 1 C GLU 137 mm-40 -64.9 -43.6 Favored ?
477 1 C VAL 138 t -59.9 -47.3 Favored ?
478 1 C LYS 139 mttm -62.4 -41.6 Favored ?
479 1 C LEU 140 tp -65.0 -42.0 Favored ?
480 1 C ILE 141 mt -72.1 -29.1 Favored ?
481 1 C LYS 142 tptp -75.6 -36.2 Favored ?
482 1 C LYS 143 ttpt -59.1 -39.5 Favored ?
483 1 C MET 144 mtt -77.4 -35.2 Favored ?
484 1 C GLY 145 ? -64.1 -38.1 Favored ?
485 1 C ASP 146 m-20 -62.3 -52.1 Favored ?
486 1 C HIS 147 m-70 -55.5 -47.0 Favored ?
487 1 C LEU 148 mt -58.9 -48.3 Favored ?
488 1 C THR 149 m -60.1 -40.0 Favored ?
489 1 C ASN 150 m-80 -70.2 -40.6 Favored ?
490 1 C ILE 151 mt -66.8 -41.8 Favored ?
491 1 C GLN 152 mt-30 -63.3 -37.0 Favored ?
492 1 C ARG 153 OUTLIER -71.2 -36.3 Favored ?
493 1 C LEU 154 mt -82.6 -8.7 Favored ?
494 1 C VAL 155 OUTLIER -98.5 -15.6 Favored ?
495 1 C GLY 156 ? -43.7 -64.4 Allowed ?
496 1 C SER 157 p -93.0 -92.5 Allowed ?
497 1 C GLN 158 OUTLIER -78.2 107.9 Favored ?
498 1 C ALA 159 ? -82.1 -48.7 Favored ?
499 1 C GLY 160 ? -54.8 -53.3 Favored ?
500 1 C LEU 161 tp -57.3 -46.3 Favored ?
501 1 C GLY 162 ? -63.0 -48.6 Favored ?
502 1 C GLU 163 tt0 -58.8 -42.9 Favored ?
503 1 C TYR 164 t80 -63.8 -50.8 Favored ?
504 1 C LEU 165 mt -59.8 -46.5 Favored ?
505 1 C PHE 166 t80 -57.9 -51.0 Favored ?
506 1 C GLU 167 tm-20 -59.7 -41.5 Favored ?
507 1 C ARG 168 mmp_? -75.9 -42.3 Favored ?
508 1 C LEU 169 mt -92.8 -41.2 Favored ?
509 1 C THR 170 m -94.8 -47.1 Favored ?
510 1 C LEU 171 mt ? ? ? ?
511 1 D SER 2 t ? ? ? ?
512 1 D GLN 3 pt20 -63.2 -12.6 Favored ?
513 1 D ILE 4 pt -115.6 -7.0 Favored ?
514 1 D ARG 5 ttt180 -67.1 120.6 Favored ?
515 1 D GLN 6 tt0 -139.1 121.0 Favored ?
516 1 D ASN 7 t30 55.4 41.7 Favored ?
517 1 D TYR 8 t80 -119.2 88.1 Favored ?
518 1 D SER 9 p -57.8 142.2 Favored ?
519 1 D THR 10 p -62.4 -11.2 Favored ?
520 1 D GLU 11 mp0 -76.0 -44.6 Favored ?
521 1 D VAL 12 t -75.3 -33.4 Favored ?
522 1 D GLU 13 tt0 -56.8 -50.8 Favored ?
523 1 D ALA 14 ? -66.2 -37.5 Favored ?
524 1 D ALA 15 ? -71.5 -25.3 Favored ?
525 1 D VAL 16 t -87.7 -30.3 Favored ?
526 1 D ASN 17 m-20 -63.5 -38.6 Favored ?
527 1 D ARG 18 mtp180 -73.1 -28.9 Favored ?
528 1 D LEU 19 tp -88.1 -23.9 Favored ?
529 1 D VAL 20 t -60.4 -41.4 Favored ?
530 1 D ASN 21 t-20 -67.6 -42.0 Favored ?
531 1 D LEU 22 tp -59.8 -40.9 Favored ?
532 1 D TYR 23 m-85 -72.1 -32.9 Favored ?
533 1 D LEU 24 mt -78.7 -32.3 Favored ?
534 1 D ARG 25 OUTLIER -62.3 -44.5 Favored ?
535 1 D ALA 26 ? -62.3 -44.7 Favored ?
536 1 D SER 27 t -58.8 -35.0 Favored ?
537 1 D TYR 28 t80 -69.1 -44.4 Favored ?
538 1 D THR 29 m -63.0 -43.3 Favored ?
539 1 D TYR 30 m-85 -65.3 -27.0 Favored ?
540 1 D LEU 31 tp -71.1 -41.8 Favored ?
541 1 D SER 32 t -61.5 -44.5 Favored ?
542 1 D LEU 33 mt -63.0 -47.2 Favored ?
543 1 D GLY 34 ? -53.3 -56.2 Favored ?
544 1 D PHE 35 m-85 -69.7 -14.5 Favored ?
545 1 D TYR 36 t80 -83.0 -33.9 Favored ?
546 1 D PHE 37 m-85 -78.9 -2.6 Favored ?
547 1 D ASP 38 t70 -98.9 -4.6 Favored ?
548 1 D ARG 39 mtp180 -62.7 143.6 Favored ?
549 1 D ASP 40 OUTLIER -57.7 -32.9 Favored ?
550 1 D ASP 41 p-10 -90.6 1.3 Favored ?
551 1 D VAL 42 t -110.8 -53.8 Favored ?
552 1 D ALA 43 ? 44.4 65.1 Allowed ?
553 1 D LEU 44 mt -126.2 81.8 Favored ?
554 1 D GLU 45 tt0 -63.9 -24.2 Favored ?
555 1 D GLY 46 ? -73.8 -38.4 Favored ?
556 1 D VAL 47 t -72.0 -34.3 Favored ?
557 1 D CYS 48 t -71.8 -41.5 Favored ?
558 1 D HIS 49 m-70 -67.9 -27.3 Favored Y
559 1 D PHE 50 t80 -72.2 -43.0 Favored ?
560 1 D PHE 51 m-85 -79.0 -24.7 Favored ?
561 1 D ARG 52 mmm-85 -71.6 -38.0 Favored ?
562 1 D GLU 53 OUTLIER -67.0 -37.0 Favored ?
563 1 D LEU 54 mt -71.8 -22.9 Favored ?
564 1 D ALA 55 ? -78.4 -29.9 Favored ?
565 1 D GLU 56 tt0 -82.0 -37.6 Favored ?
566 1 D GLU 57 OUTLIER -58.7 -35.0 Favored ?
567 1 D LYS 58 mmtt -73.4 -40.2 Favored ?
568 1 D ARG 59 ttm105 -60.8 -44.3 Favored ?
569 1 D GLU 60 mt-10 -65.2 -27.6 Favored ?
570 1 D GLY 61 ? -69.9 -40.5 Favored ?
571 1 D ALA 62 ? -56.3 -49.3 Favored ?
572 1 D GLU 63 mt-10 -63.1 -38.7 Favored ?
573 1 D ARG 64 ttm180 -60.0 -45.0 Favored ?
574 1 D LEU 65 mt -66.3 -34.2 Favored ?
575 1 D LEU 66 mt -77.5 -33.3 Favored ?
576 1 D LYS 67 tptp -63.5 -42.2 Favored ?
577 1 D MET 68 tmm? -67.5 -37.6 Favored ?
578 1 D GLN 69 tp-100 -59.9 -43.7 Favored ?
579 1 D ASN 70 m-20 -67.6 -36.8 Favored ?
580 1 D GLN 71 mt-30 -64.2 -33.3 Favored ?
581 1 D ARG 72 mmm-85 -90.8 0.2 Favored ?
582 1 D GLY 73 ? 83.2 15.7 Favored ?
583 1 D GLY 74 ? -81.8 165.5 Favored ?
584 1 D ARG 75 mmt180 -115.1 114.8 Favored ?
585 1 D ALA 76 ? -51.6 125.7 Favored ?
586 1 D LEU 77 mt -126.7 113.3 Favored ?
587 1 D PHE 78 m-85 -89.1 142.4 Favored ?
588 1 D GLN 79 mm-40 -111.3 165.2 Favored ?
589 1 D ASP 80 m-20 -59.9 140.3 Favored ?
590 1 D LEU 81 mt -87.2 113.9 Favored ?
591 1 D GLN 82 tt0 -64.3 140.9 Favored ?
592 1 D LYS 83 OUTLIER -69.5 151.6 Favored ?
593 1 D PRO 84 Cg_exo -41.0 160.8 OUTLIER ?
594 1 D SER 85 p -95.4 -2.1 Favored ?
595 1 D GLN 86 mt-30 -141.0 158.2 Favored ?
596 1 D ASP 87 m-20 -100.1 -36.0 Favored ?
597 1 D GLU 88 mt-10 -115.9 139.7 Favored ?
598 1 D TRP 89 m95 -101.4 7.0 Favored ?
599 1 D GLY 90 ? 83.3 -145.1 Favored ?
600 1 D THR 91 p -94.5 174.8 Favored ?
601 1 D THR 92 m -59.6 -35.8 Favored ?
602 1 D LEU 93 tp -61.0 -56.2 Favored ?
603 1 D ASP 94 m-20 -55.8 -49.8 Favored ?
604 1 D ALA 95 ? -59.0 -44.7 Favored ?
605 1 D MET 96 tpp -62.0 -41.3 Favored ?
606 1 D LYS 97 mttt -66.3 -39.5 Favored ?
607 1 D ALA 98 ? -64.7 -41.7 Favored ?
608 1 D ALA 99 ? -66.3 -32.5 Favored ?
609 1 D ILE 100 tt -84.9 -26.4 Favored ?
610 1 D VAL 101 t -53.8 -47.1 Favored ?
611 1 D LEU 102 tp -55.6 -48.6 Favored ?
612 1 D GLU 103 mm-40 -70.4 -35.6 Favored ?
613 1 D LYS 104 mttt -72.5 -23.0 Favored ?
614 1 D SER 105 p -89.3 -28.2 Favored ?
615 1 D LEU 106 mt -62.9 -41.5 Favored ?
616 1 D ASN 107 t30 -68.5 -32.9 Favored ?
617 1 D GLN 108 tp60 -77.7 -29.7 Favored ?
618 1 D ALA 109 ? -65.0 -39.1 Favored ?
619 1 D LEU 110 mt -65.9 -43.9 Favored ?
620 1 D LEU 111 mt -62.5 -37.6 Favored ?
621 1 D ASP 112 m-20 -65.2 -46.4 Favored ?
622 1 D LEU 113 tp -61.5 -38.5 Favored ?
623 1 D HIS 114 t-80 -61.1 -47.3 Favored ?
624 1 D ALA 115 ? -60.9 -42.9 Favored ?
625 1 D LEU 116 tp -59.8 -39.7 Favored ?
626 1 D GLY 117 ? -69.1 -25.0 Favored ?
627 1 D SER 118 m -79.7 -46.6 Favored ?
628 1 D ALA 119 ? -52.8 -56.2 Favored ?
629 1 D GLN 120 mm-40 -73.7 -3.5 Favored ?
630 1 D ALA 121 ? 53.9 69.8 Allowed ?
631 1 D ASP 122 t0 -121.2 75.7 Favored ?
632 1 D PRO 123 Cg_endo -53.6 -37.0 Favored ?
633 1 D HIS 124 t-80 -65.9 -39.1 Favored ?
634 1 D LEU 125 tp -66.4 -36.3 Favored ?
635 1 D CYS 126 m -74.8 -46.5 Favored ?
636 1 D ASP 127 OUTLIER -56.5 -30.5 Favored ?
637 1 D PHE 128 t80 -70.1 -55.9 Favored ?
638 1 D LEU 129 mt -64.1 -21.9 Favored ?
639 1 D GLU 130 mt-10 -71.3 -53.3 Favored ?
640 1 D SER 131 OUTLIER -57.0 -47.5 Favored ?
641 1 D HIS 132 m-70 -111.7 -9.1 Favored Y
642 1 D PHE 133 m-85 -125.4 -50.6 Allowed ?
643 1 D LEU 134 mt -53.1 -53.9 Favored ?
644 1 D ASP 135 t70 -64.1 -41.3 Favored ?
645 1 D GLU 136 mt-10 -61.2 -46.6 Favored ?
646 1 D GLU 137 mm-40 -65.0 -43.6 Favored ?
647 1 D VAL 138 t -59.9 -47.2 Favored ?
648 1 D LYS 139 mttm -62.4 -41.5 Favored ?
649 1 D LEU 140 tp -65.0 -42.0 Favored ?
650 1 D ILE 141 mt -72.2 -29.1 Favored ?
651 1 D LYS 142 tptp -75.6 -36.1 Favored ?
652 1 D LYS 143 ttpt -59.2 -39.4 Favored ?
653 1 D MET 144 mtt -77.4 -35.2 Favored ?
654 1 D GLY 145 ? -64.1 -38.1 Favored ?
655 1 D ASP 146 m-20 -62.3 -52.1 Favored ?
656 1 D HIS 147 m-70 -55.5 -47.0 Favored ?
657 1 D LEU 148 mt -58.9 -48.3 Favored ?
658 1 D THR 149 m -60.1 -40.0 Favored ?
659 1 D ASN 150 m-80 -70.3 -40.5 Favored ?
660 1 D ILE 151 mt -66.9 -41.8 Favored ?
661 1 D GLN 152 mt-30 -63.3 -37.0 Favored ?
662 1 D ARG 153 OUTLIER -71.3 -36.3 Favored ?
663 1 D LEU 154 mt -82.7 -8.8 Favored ?
664 1 D VAL 155 OUTLIER -98.5 -15.6 Favored ?
665 1 D GLY 156 ? -43.7 -64.5 Allowed ?
666 1 D SER 157 p -93.0 -92.5 Allowed ?
667 1 D GLN 158 OUTLIER -78.2 107.9 Favored ?
668 1 D ALA 159 ? -82.1 -48.7 Favored ?
669 1 D GLY 160 ? -54.8 -53.3 Favored ?
670 1 D LEU 161 tp -57.3 -46.2 Favored ?
671 1 D GLY 162 ? -63.0 -48.6 Favored ?
672 1 D GLU 163 tt0 -58.8 -42.9 Favored ?
673 1 D TYR 164 t80 -63.8 -50.8 Favored ?
674 1 D LEU 165 mt -59.8 -46.5 Favored ?
675 1 D PHE 166 t80 -57.9 -51.0 Favored ?
676 1 D GLU 167 tm-20 -59.8 -41.5 Favored ?
677 1 D ARG 168 mmp_? -75.9 -42.3 Favored ?
678 1 D LEU 169 mt -92.7 -41.3 Favored ?
679 1 D THR 170 m -94.7 -47.2 Favored ?
680 1 D LEU 171 mt ? ? ? ?
681 1 E SER 2 t ? ? ? ?
682 1 E GLN 3 pt20 -63.1 -12.6 Favored ?
683 1 E ILE 4 pt -115.6 -6.9 Favored ?
684 1 E ARG 5 ttt180 -67.1 120.6 Favored ?
685 1 E GLN 6 tt0 -139.1 121.0 Favored ?
686 1 E ASN 7 t30 55.5 41.6 Favored ?
687 1 E TYR 8 t80 -119.1 88.1 Favored ?
688 1 E SER 9 p -57.7 142.1 Favored ?
689 1 E THR 10 p -62.4 -11.2 Favored ?
690 1 E GLU 11 mp0 -76.0 -44.6 Favored ?
691 1 E VAL 12 t -75.3 -33.4 Favored ?
692 1 E GLU 13 tt0 -56.8 -50.8 Favored ?
693 1 E ALA 14 ? -66.1 -37.6 Favored ?
694 1 E ALA 15 ? -71.5 -25.2 Favored ?
695 1 E VAL 16 t -87.7 -30.3 Favored ?
696 1 E ASN 17 m-20 -63.5 -38.6 Favored ?
697 1 E ARG 18 mtp180 -73.1 -28.9 Favored ?
698 1 E LEU 19 tp -88.1 -23.8 Favored ?
699 1 E VAL 20 t -60.4 -41.4 Favored ?
700 1 E ASN 21 t-20 -67.6 -42.0 Favored ?
701 1 E LEU 22 tp -59.8 -40.9 Favored ?
702 1 E TYR 23 m-85 -72.1 -32.9 Favored ?
703 1 E LEU 24 mt -78.6 -32.3 Favored ?
704 1 E ARG 25 OUTLIER -62.3 -44.6 Favored ?
705 1 E ALA 26 ? -62.3 -44.6 Favored ?
706 1 E SER 27 t -58.8 -35.0 Favored ?
707 1 E TYR 28 t80 -69.1 -44.4 Favored ?
708 1 E THR 29 m -63.1 -43.2 Favored ?
709 1 E TYR 30 m-85 -65.3 -27.0 Favored ?
710 1 E LEU 31 tp -71.2 -41.8 Favored ?
711 1 E SER 32 t -61.5 -44.6 Favored ?
712 1 E LEU 33 mt -63.0 -47.2 Favored ?
713 1 E GLY 34 ? -53.3 -56.1 Favored ?
714 1 E PHE 35 m-85 -69.7 -14.5 Favored ?
715 1 E TYR 36 t80 -82.9 -33.9 Favored ?
716 1 E PHE 37 m-85 -78.9 -2.6 Favored ?
717 1 E ASP 38 t70 -98.8 -4.7 Favored ?
718 1 E ARG 39 mtp180 -62.7 143.6 Favored ?
719 1 E ASP 40 OUTLIER -57.7 -32.9 Favored ?
720 1 E ASP 41 p-10 -90.6 1.3 Favored ?
721 1 E VAL 42 t -110.8 -53.7 Favored ?
722 1 E ALA 43 ? 44.4 65.0 Allowed ?
723 1 E LEU 44 mt -126.1 81.8 Favored ?
724 1 E GLU 45 tt0 -63.9 -24.3 Favored ?
725 1 E GLY 46 ? -73.7 -38.4 Favored ?
726 1 E VAL 47 t -72.0 -34.3 Favored ?
727 1 E CYS 48 t -71.8 -41.6 Favored ?
728 1 E HIS 49 m-70 -67.9 -27.3 Favored Y
729 1 E PHE 50 t80 -72.3 -43.0 Favored ?
730 1 E PHE 51 m-85 -79.1 -24.6 Favored ?
731 1 E ARG 52 mmm-85 -71.6 -38.1 Favored ?
732 1 E GLU 53 OUTLIER -67.0 -37.0 Favored ?
733 1 E LEU 54 mt -71.8 -22.9 Favored ?
734 1 E ALA 55 ? -78.5 -29.9 Favored ?
735 1 E GLU 56 tt0 -82.0 -37.7 Favored ?
736 1 E GLU 57 OUTLIER -58.6 -35.0 Favored ?
737 1 E LYS 58 mmtt -73.4 -40.1 Favored ?
738 1 E ARG 59 ttm105 -60.9 -44.3 Favored ?
739 1 E GLU 60 mt-10 -65.1 -27.7 Favored ?
740 1 E GLY 61 ? -69.9 -40.5 Favored ?
741 1 E ALA 62 ? -56.3 -49.3 Favored ?
742 1 E GLU 63 mt-10 -63.1 -38.7 Favored ?
743 1 E ARG 64 ttm180 -60.1 -44.9 Favored ?
744 1 E LEU 65 mt -66.3 -34.3 Favored ?
745 1 E LEU 66 mt -77.4 -33.3 Favored ?
746 1 E LYS 67 tptp -63.5 -42.2 Favored ?
747 1 E MET 68 tmm? -67.5 -37.6 Favored ?
748 1 E GLN 69 tp-100 -59.9 -43.7 Favored ?
749 1 E ASN 70 m-20 -67.7 -36.7 Favored ?
750 1 E GLN 71 mt-30 -64.3 -33.2 Favored ?
751 1 E ARG 72 mmm-85 -90.8 0.1 Favored ?
752 1 E GLY 73 ? 83.2 15.7 Favored ?
753 1 E GLY 74 ? -81.8 165.5 Favored ?
754 1 E ARG 75 mmt180 -115.1 114.8 Favored ?
755 1 E ALA 76 ? -51.6 125.7 Favored ?
756 1 E LEU 77 mt -126.6 113.2 Favored ?
757 1 E PHE 78 m-85 -89.1 142.5 Favored ?
758 1 E GLN 79 mm-40 -111.4 165.2 Favored ?
759 1 E ASP 80 m-20 -59.9 140.4 Favored ?
760 1 E LEU 81 mt -87.2 113.8 Favored ?
761 1 E GLN 82 tt0 -64.3 141.0 Favored ?
762 1 E LYS 83 OUTLIER -69.6 151.6 Favored ?
763 1 E PRO 84 Cg_exo -40.9 160.8 OUTLIER ?
764 1 E SER 85 p -95.5 -2.0 Favored ?
765 1 E GLN 86 mt-30 -141.1 158.2 Favored ?
766 1 E ASP 87 m-20 -100.1 -36.0 Favored ?
767 1 E GLU 88 mt-10 -115.9 139.6 Favored ?
768 1 E TRP 89 m95 -101.3 6.9 Favored ?
769 1 E GLY 90 ? 83.4 -145.1 Favored ?
770 1 E THR 91 p -94.6 174.8 Favored ?
771 1 E THR 92 m -59.6 -35.8 Favored ?
772 1 E LEU 93 tp -61.0 -56.2 Favored ?
773 1 E ASP 94 m-20 -55.8 -49.8 Favored ?