A0A096MVA2_PAPAN Loading...

Protein lin-54 homolog

AlphaFold DB , UniProt , Accession A0A096MVA2, Species PAPAN (Papio anubis, Olive baboon), Gene LIN54, Length 749 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M35.5Very low36.3Very low237 Ų237144.1 Ų144.1100%1.16781%0.81SS**  0153.80-169.6156.7168.200106.7
2E34.3Very low36.3Very low187 Ų187145.8 Ų145.887%0.87481%0.814SS**  trans64.9155.3-168.3-64.4-173.5102.300116.6
3V41.7Very low36.7Very low129 Ų129143.8 Ų143.878%0.78281%0.811SS**  trans-160.6172.6-164.6-172.80000105.7
4V34.6Very low36.9Very low128 Ų128146.9 Ų146.978%0.77682%0.815SS**  trans81.2137.4165.3-169.70000114.4
5P47.6Very low37Very low110 Ų110149.7 Ų149.771%0.71482%0.82SS**  cis-143.2179.5-32.943.5-25.8000116.4
6A35.9Very low37Very low72 Ų72150.7 Ų150.760%0.59582%0.822SS**  trans14.5150.6138.600000125.2
7E34.7Very low37.1Very low179 Ų179151 Ų15184%0.83682%0.819SS**  trans69.4152.1147.3-71154.8-151.700118.1
8V38.6Very low37Very low121 Ų121150.1 Ų150.173%0.73381%0.813SS**  cis-142140.38-1330000111.1
9N29.7Very low37Very low155 Ų155149.4 Ų149.483%0.82982%0.815SS**  trans-174.5100.6135.4-110.8-65.7000111.3
10S33.5Very low37Very low114 Ų114145.5 Ų145.580%0.79781%0.811SS**  trans-121107.5172.9-58.50000109
11L33.4Very low36.8Very low153 Ų153146.2 Ų146.280%0.80181%0.811SS**  trans-144.5138169.8-85.1-177.8000111.8
12L35.8Very low36.6Very low165 Ų165140.7 Ų140.786%0.86479%0.791SS**  trans79.1146.6172.8-56.9171.8000116.7
13P41.7Very low36.7Very low119 Ų119139.7 Ų139.777%0.77379%0.791SS**  trans-118.3172.5-147.217.56.8000115.1
14E39.5Very low36.5Very low187 Ų187140.2 Ų140.287%0.87479%0.794SS**  trans-85.7-172.5167.4-62.4-173111.100112.3
15E38.7Very low36.4Very low190 Ų190142 Ų14289%0.88880%0.799SS**  trans71.3139.1-163.6-53.7-165138.600112.9
16I37.1Very low35.7Very low165 Ų165144.8 Ų144.885%0.84681%0.808SS**  cis-122.313826.8-62.5160.6000111.9
17M38.3Very low35.8Very low156 Ų156147.9 Ų147.977%0.76882%0.815SS**  trans-94.8164.7169.4-80.3-179.156.300112.8
18D35.6Very low35.8Very low135 Ų135144.1 Ų144.172%0.72281%0.808SS**  trans43.6119.8157.5-82.7-62.1000120.8
19T37.3Very low35.5Very low137 Ų137146.9 Ų146.984%0.8482%0.817SS**  trans-130.168.4157.433.50000111.1I21T19-I21 PolarHBondContact O-N 3.28Å
20G37Very low35.5Very low71 Ų71148.4 Ų148.473%0.73282%0.819SS**  trans-70.6114.9159.200000109.9
21I31.9Very low35.3Very low160 Ų160147.5 Ų147.582%0.82182%0.819SS**PPolyproline II helixtrans-93.7118.5175.3-66.8178.7000109.2T19T19-I21 PolarHBondContact O-N 3.28Å
22T32.5Very low35Very low122 Ų122146.3 Ų146.375%0.74882%0.817SS**PPolyproline II helixtrans-72.9146.4170.742.60000111.1
23L35.5Very low34.7Very low165 Ų165145.4 Ų145.486%0.86481%0.812SS**PPolyproline II helixtrans-80.5148.2161.9-69.1169.6000108.8
24V37.3Very low34Very low141 Ų141146.1 Ų146.186%0.85581%0.813SS**PPolyproline II helixtrans-94.7128.9168-74.70000109.1
25D31.9Very low33.4Very low165 Ų165141.4 Ų141.488%0.88280%0.801SS**PPolyproline II helixtrans-82.4146.7167.7-67-70.5000110.1
26D34.1Very low33Very low168 Ų168138 Ų13890%0.89880%0.798SS**  trans-141.3138.3169.4-152.6-45.4000106.9
27D36.8Very low33Very low138 Ų138136.1 Ų136.174%0.73880%0.797SS**  trans-119.1161.1-157.4-159.3-67.3000112.6
28S35Very low32.7Very low100 Ų100136.1 Ų136.170%0.69980%0.798SS**  trans64.2104.6162.3-72.60000119.2
29I32.1Very low32.8Very low179 Ų179135.4 Ų135.492%0.91880%0.801SS**  trans-136150.2136.548171000110.9
30E29.6Very low32.4Very low187 Ų187136.1 Ų136.187%0.87480%0.797SS**  trans-81.1156.6-160.3-59.5169.9104.300115.6V32E30-V32 PolarHBondContact O-N 3.42Å
31A29.4Very low32Very low95 Ų95141.3 Ų141.379%0.78580%0.802SS**  trans-8997.3170.500000111.3I33A31-I33 PolarHBondContact O-N 3.17Å
32V27.5Very low32.1Very low127 Ų127139.7 Ų139.777%0.7780%0.8SS**  trans-71.4115.4175.7-179.40000110.7E30 V34E30-V32 PolarHBondContact O-N 3.42Å; V32-V34 HydrophobicContact CG1-CG2 4.2Å
33I30.1Very low32Very low147 Ų147143.1 Ų143.175%0.75481%0.807SS**  trans-82124.1172.7-57.7173.2000109.1A31A31-I33 PolarHBondContact O-N 3.17Å
34V27.3Very low31.8Very low133 Ų133142.6 Ų142.681%0.80681%0.805SS**  trans-122.2122.7165.3-176.70000108.5V32V32-V34 HydrophobicContact CG1-CG2 4.2Å
35S27.3Very low31.5Very low89 Ų89144 Ų14462%0.62280%0.802SS**  trans-119.4154.9-175.8-66.40000111.7
36S29.4Very low31.3Very low117 Ų117144.2 Ų144.282%0.81880%0.798SS**  trans84.7154.1167.8-33.80000116.8
37P37.2Very low31.1Very low126 Ų126142.7 Ų142.782%0.81879%0.788SS**  cis-128.3-176.7-22.328.8-7.4000113.8
38I31.5Very low30.7Very low156 Ų156142.5 Ų142.580%0.879%0.792SS**  trans-104.3144.7178.9-54.1161.8000109.8M40I38-M40 HydrophobicContact CG2-CB 4.2Å
39P38Very low30.4Very low120 Ų120145 Ų14578%0.77980%0.797SS**  -128.7145.6117.336.3-29.6000110.6
40M28.6Very low30.2Very low152 Ų152143.5 Ų143.575%0.74979%0.789SS**  cis84.880.821.6-158.8-148.382.900116.6I38I38-M40 HydrophobicContact CG2-CB 4.2Å
41E29.4Very low30.1Very low180 Ų180141.7 Ų141.784%0.84179%0.786SS**  trans-139.8139.3144.7-59.7-170.5135.600105.8
42T33.2Very low30Very low127 Ų127142.5 Ų142.578%0.77979%0.785SS**  52.5134.2744.30000112.1
43E30.3Very low29.9Very low193 Ų193143.3 Ų143.390%0.90279%0.791SS**  cis-135.2-154.146.3-53.6-172126.600115
44L31.1Very low29.8Very low155 Ų155139.9 Ų139.981%0.81279%0.792SS**  trans-137.2177.7-159-15570.4000114
45E32.7Very low29.7Very low170 Ų170140.8 Ų140.879%0.79479%0.792SS**  trans75.3154.1165-64171.8178.600116.8
46E26.7Very low30Very low170 Ų170141.3 Ų141.379%0.79480%0.796SS**  cis-140.8-162.64.2-145.5-155.9127.700113.2
47I30Very low29.9Very low136 Ų136140.6 Ų140.670%0.69780%0.797SS**  trans-115136.7-159.2-57.7153.5000113
48V28Very low29.4Very low134 Ų134139.3 Ų139.381%0.81280%0.797SS**  trans-144.4134.9144.8-177.60000110I50V48-I50 HydrophobicContact CG1-CG1 4.33Å
49N28.8Very low29.1Very low151 Ų151138.3 Ų138.381%0.80780%0.798SS**  trans-142.8111.3178.3-159.227.5000109.7
50I28.9Very low29.2Very low149 Ų149138.1 Ų138.176%0.76480%0.797SS**  trans-141.3128.3177.1-55.2-179.1000110.9V48V48-I50 HydrophobicContact CG1-CG1 4.33Å
51N26.6Very low29.1Very low149 Ų149138.6 Ų138.680%0.79780%0.801SS**  trans-110.8140.1167.9-86.4-25.4000110.3
52S27.5Very low28.9Very low111 Ų111134.9 Ų134.978%0.77680%0.795SS**  trans-173.4137.9148.9-77.50000107.4
53T26.3Very low28.6Very low145 Ų145135.4 Ų135.489%0.8980%0.798SS**  cis84.1114.928.8-47.60000113.6
54G27.3Very low28.2Very low75 Ų75134.8 Ų134.877%0.77380%0.795SS**  trans165.4144.4178.900000110.5
55D26.1Very low28.6Very low152 Ų152132.2 Ų132.281%0.81379%0.788SS**  trans-165.7171.7-170-177.546.9000113.6
56S31.8Very low28.2Very low100 Ų100131.2 Ų131.270%0.69979%0.786SS**  trans85.5160.9150.7-91.30000121.8
57A28.3Very low28.1Very low101 Ų101129.2 Ų129.284%0.83579%0.786SS**  trans78.7139.6176.200000118.2
58A27Very low27.8Very low100 Ų100129.3 Ų129.383%0.82679%0.793SS**  cis-159.8-176.5-9.900000113.4
59T23.8Very low27.6Very low134 Ų134132.9 Ų132.982%0.82279%0.793SS**  trans-89.3-165.5-177.549.10000112.7
60P40.9Very low27.5Very low117 Ų117129.7 Ų129.776%0.7678%0.782SS**  cis-115.8-1504.626.60.4000114.1
61I27Very low27.5Very low162 Ų162128.9 Ų128.983%0.83178%0.78SS**  cis-146.717930.5-72.7175.4000111.4
62S24.1Very low27.7Very low101 Ų101129.7 Ų129.771%0.70678%0.778SS**  trans-123156.1-176.2175.30000113.8
63T26.6Very low27.7Very low139 Ų139129.9 Ų129.985%0.85378%0.775SS**  trans-173.2141.7146.725.40000114.6
64E22.9Very low27.7Very low180 Ų180129.9 Ų129.984%0.84177%0.77SS**  trans-106-160.6155.4-68.5-163.2119.100108.8
65P38.4Very low27.8Very low100 Ų100134.3 Ų134.365%0.64977%0.77SS**  cis-150.2-162.82.745.7-23.4000118.6
66I24.7Very low27.9Very low150 Ų150132.9 Ų132.977%0.76977%0.767SS**  trans75142.7155.5-70.5168.7000119.1
67T24.1Very low27.6Very low128 Ų128132.2 Ų132.279%0.78577%0.767SS**  cis-148.7-92.3-42.447.10000110.9
68V24.4Very low27.5Very low138 Ų138133.1 Ų133.184%0.83676%0.762SS**  trans67.9136.6178.2-179.20000116.2
69Y24.2Very low27.5Very low208 Ų208135.2 Ų135.282%0.81676%0.76SS**  cis-155.7-111-23-176.617.6000112.3
70S25.7Very low27.7Very low84 Ų84133.7 Ų133.759%0.58775%0.75SS**  trans-156.2174.1-169.4-56.20000112.6
71N28.9Very low27.1Very low133 Ų133134.3 Ų134.371%0.71175%0.752SS**  cis-160.4168.727.6-128-17.5000115.7
72H32.1Very low27.2Very low166 Ų166134 Ų13477%0.76975%0.75SS**  trans-17.4162.5172.8-67.4-70.7000123.3
73T27.3Very low27.4Very low115 Ų115134.6 Ų134.671%0.70675%0.75SS**  -179.2139.572.4-57.90000116.9
74N26.9Very low27.5Very low145 Ų145137.5 Ų137.578%0.77575%0.751SS**  trans52.5173.7156.8-65-10.3000124.5
75Q29.1Very low27.8Very low167 Ų167132.9 Ų132.978%0.7874%0.743SS**  -173.5172.8-60.5-147.9-170.88100110.9
76V26.7Very low27.2Very low122 Ų122135 Ų13574%0.73975%0.749SS**  trans75.2127.4169.6-165.90000114.7
77A25.8Very low27.4Very low87 Ų87132.4 Ų132.472%0.71975%0.745SS**  cis91.5146.429.500000114.2
78V27.7Very low27.5Very low120 Ų120133.7 Ų133.773%0.72775%0.747SS**  cis-165.4165.5-8.5119.80000109.8
79N26.9Very low27.7Very low144 Ų144132 Ų13277%0.7774%0.737SS**  trans73.2161.1163.6-82.7-16000121.1
80T27.4Very low27.7Very low102 Ų102128.1 Ų128.163%0.62674%0.735SS**  cis-176.2157.1-33.1-95.80000112.4
81T28.1Very low27.8Very low130 Ų130130.1 Ų130.180%0.79874%0.743SS**  trans68.2166.5172.2420000118
82I29.3Very low27.6Very low154 Ų154132.9 Ų132.979%0.7975%0.749SS**  cis-136.7-155.310.5-153.3163.3000113.5
83T27.8Very low28Very low115 Ų115130.4 Ų130.471%0.70675%0.748SS**  trans-149.1180-165.161.50000115.4
84K28.7Very low27.8Very low199 Ų199129.7 Ų129.787%0.86575%0.753SS**  trans89.8154.9174.2-59.6178.7-178.6-179.50116.8
85A28.6Very low28.1Very low83 Ų83132.6 Ų132.669%0.68676%0.759SS**  cis-176.2180-25.100000108.1
86D26.8Very low28.4Very low144 Ų144129.7 Ų129.777%0.7776%0.755SS**  cis-162.4173.7-3.6-142.8-69.3000112.6
87S29Very low28.3Very low97 Ų97129.8 Ų129.868%0.67876%0.761SS**  trans52.3104146.3-74.70000126.6
88N25.9Very low28.2Very low154 Ų154128.9 Ų128.982%0.82476%0.761SS**  81.4147111.5-148.412.5000125
89T28Very low28.2Very low104 Ų104130.6 Ų130.664%0.63877%0.765SS**  trans97.690.6152.6-340000122.7
90T24.2Very low28.1Very low126 Ų126131.5 Ų131.577%0.77376%0.764SS**  60.6144.4128-35.10000124.4
91V28.6Very low28.1Very low125 Ų125135.4 Ų135.476%0.75877%0.773SS**  trans93.394.9163.3-162.80000119.6
92K24.4Very low27.9Very low192 Ų192136.9 Ų136.984%0.83578%0.775SS**  26.4147.7121.3-145.6-173.8-177.7-1760120.1
93P40.2Very low27.7Very low114 Ų114133.1 Ų133.174%0.7477%0.774SS**  cis-128.4158-47.739.8-26.1000113.1
94A22.9Very low27.6Very low100 Ų100132.3 Ų132.383%0.82678%0.779SS**  trans-154.4133.7171.500000115.3
95F33.4Very low27.6Very low205 Ų205132.1 Ų132.190%0.89978%0.781SS**  trans-88.1164.2138.9-76.4-85.9000107
96P36.5Very low27.5Very low106 Ų106134.2 Ų134.269%0.68879%0.786SS**  cis-144.5-165.627.943.4-23.3000115.4
97S24.3Very low27.7Very low124 Ų124133.1 Ų133.187%0.86779%0.786SS**  trans65.4162.4160.7-58.80000116.3
98G23.6Very low27.6Very low69 Ų69135 Ų13571%0.71179%0.793SS**  cis160.6169.1-4.100000110.4
99L26.6Very low27.6Very low155 Ų155133.9 Ų133.981%0.81279%0.792SS**  trans70.2111.8171.3-113.272.7000120.5
100Q26.3Very low27.7Very low163 Ų163136.2 Ų136.276%0.76280%0.799SS**  26.4125128.7-51.9175.71900120.9
101K27.5Very low27.8Very low185 Ų185135.5 Ų135.580%0.80480%0.799SS**  -174.8179.9102.8-107.9-178.2173.61780113.2
102L24.3Very low28Very low161 Ų161133.7 Ų133.784%0.84380%0.798SS**  trans-14.8150.6170.2-74.865.8000117
103G25Very low28.3Very low74 Ų74131.7 Ų131.776%0.76380%0.796SS**  cis165.7173.410.500000109.9
104A24.8Very low28Very low98 Ų98135 Ų13581%0.8180%0.801SS**  trans-73140.5-17000000114.2
105Q28Very low28.7Very low195 Ų195137.6 Ų137.691%0.91180%0.8SS**  trans-130.5141.1135.3-71.9-158.145.700109.2
106T27.9Very low28.7Very low128 Ų128134.8 Ų134.879%0.78579%0.793SS**PPolyproline II helixtrans-81.1155.5-177.938.90000112.2
107P30.2Very low28.5Very low121 Ų121137.3 Ų137.379%0.78680%0.8SS**PPolyproline II helixtrans-70148.9-178.730-36.4000112.6
108V26.5Very low29Very low135 Ų135138.7 Ų138.782%0.81880%0.797SS**PPolyproline II helixtrans-82.9125.7164.8175.60000109
109T25.6Very low29.5Very low131 Ų131144.1 Ų144.180%0.80480%0.801SS**PPolyproline II helixtrans-67.7128175.2-54.20000111.1
110I30Very low29.7Very low154 Ų154142.9 Ų142.979%0.7980%0.8SS**  trans-116141.2158.4-63.4-178.8000107.7
111S28.3Very low29.9Very low111 Ų111139 Ų13978%0.77679%0.791SS**  trans-70.9150.5-172.141.30000113.5
112A31.2Very low30Very low87 Ų87139 Ų13972%0.71979%0.793SS**  trans-76138.2-178.200000112.7
113N32.2Very low30.3Very low150 Ų150137.7 Ų137.780%0.80279%0.792SS**  173.979.7127.4-87.1-18.2000112.1
114Q33Very low30.7Very low182 Ų182140 Ų14085%0.8580%0.797SS**  trans-170.4142.6154.7-110147.9102.800110.7
115I37.2Very low30.8Very low155 Ų155142.7 Ų142.780%0.79580%0.798SS**  trans-135.6130.5169.6-62178.6000107.2
116I34.2Very low30.9Very low146 Ų146141.3 Ų141.375%0.74980%0.796SS**  trans-116123.7174.8-61.5176.1000107.8
117L31.8Very low30.9Very low160 Ų160143.9 Ų143.984%0.83880%0.796SS**  trans-101.8102.9178.9-82.7159.5000110.2
118N34.2Very low30.8Very low152 Ų152145.9 Ų145.981%0.81380%0.799SS**  trans-79.5117.6168-100-2000110.1V120N118-V120 PolarHBondContact O-N 2.92Å
119K34.4Very low30.7Very low183 Ų183142.8 Ų142.880%0.79679%0.794SS**  trans-85.7105.5176.8-178.4-176.9176.2-177.10110.5S121K119-S121 PolarHBondContact O-N 3.05Å
120V31.3Very low30.8Very low129 Ų129144.1 Ų144.178%0.78280%0.797SS**  trans-73.8121.4166.6179.90000108.8N118N118-V120 PolarHBondContact O-N 2.92Å
121S30.6Very low30.8Very low82 Ų82144.9 Ų144.957%0.57380%0.797SS**  trans-113.9125.4169.2-55.30000108.3K119K119-S121 PolarHBondContact O-N 3.05Å
122Q29.2Very low30.6Very low184 Ų184145.2 Ų145.286%0.8679%0.794SS**  trans-101.8110.2170.4-70.6-1753.300109.6
123T30.8Very low30.4Very low134 Ų134147.9 Ų147.982%0.82280%0.796SS**  trans-148.7137.4162.1450000108.4
124S32.4Very low30.2Very low123 Ų123149.7 Ų149.786%0.8680%0.797SS**  trans-75.7156.6-165.5-440000115.2
125D28.1Very low30.6Very low155 Ų155146.9 Ų146.983%0.82979%0.794SS**  trans-58.2149.7171.3-85.5-86.8000115.2
126L30.2Very low30.2Very low165 Ų165147.5 Ų147.586%0.86480%0.799SS**  -162.6117124-105.4168.5000111.9
127K28.5Very low30Very low182 Ų182143.4 Ų143.479%0.79179%0.793SS**  trans10.9144.7148.7-90.9178179.6176.90119.6
128L26.6Very low29.9Very low164 Ų164145.4 Ų145.486%0.85980%0.798SS**  cis-168150.518.8176.768.6000108.9
129G25.2Very low29.7Very low69 Ų69146.5 Ų146.571%0.71180%0.795SS**  trans-176.65-179.900000126.7
130N27.6Very low29.3Very low159 Ų159146.4 Ų146.485%0.8580%0.803SS**  trans62.8137.8165.3-87.5-24.9000122.6
131Q29.1Very low29.3Very low171 Ų171146.5 Ų146.580%0.79980%0.797SS**  trans72.9119161.6-63.1-162.3107.800118.3
132T25.4Very low29Very low117 Ų117150.9 Ų150.972%0.71881%0.813SS**  82.7114.959.8-66.60000110
133L26.8Very low29.2Very low143 Ų143148 Ų14875%0.74981%0.808SS**  cis-151.7155.321.4-114.9160.3000114
134K28.5Very low29.1Very low189 Ų189147.7 Ų147.782%0.82281%0.807SS**  trans17.1152.5157.3-79.4177-179.2-178.30124.3
135P40.8Very low28.9Very low123 Ų123150.3 Ų150.380%0.79981%0.81SS**  trans-96.2163.5178.540.2-35.8000114.5
136D27.9Very low29.1Very low167 Ų167146.4 Ų146.489%0.89381%0.806SS**  trans-137.7163.3146.2-152.4-27.5000108.1
137G31.5Very low29.1Very low60 Ų60148.2 Ų148.262%0.61981%0.807SS**  trans-146.5156-17100000114
138Q29Very low29.3Very low203 Ų203145.4 Ų145.495%0.94981%0.81SS**  trans-139.9145.6176.1-137155.666.100112.7
139K29.3Very low30Very low174 Ų174141.5 Ų141.576%0.75781%0.81SS**  trans-75147.4-170.1-63.8177.3178.3176.80111.9I141K139-I141 HydrophobicContact CB-CG1 4.49Å; K139-I141 HydrophobicContact CD-CD1 4.41Å
140L25.9Very low30.5Very low182 Ų182143 Ų14395%0.95381%0.81SS**  trans-116.5136.9143.9-74.8170.9000108.6
141I31.2Very low30.7Very low130 Ų130141.4 Ų141.467%0.66781%0.807SS**  trans-114.4134.3179.2-61.1173.7000106.9K139K139-I141 HydrophobicContact CB-CG1 4.49Å; K139-I141 HydrophobicContact CD-CD1 4.41Å
142L25.3Very low30.8Very low174 Ų174140.3 Ų140.391%0.91181%0.806SS**  trans-137.2117.1168.8-156.274.1000109.9
143T33Very low31.1Very low123 Ų123141.2 Ų141.276%0.75581%0.811SS**  trans-92.2140.4-177.4-530000110.3
144T29.5Very low31.1Very low128 Ų128142 Ų14279%0.78582%0.815SS**  trans-104.8137170.850.80000111.3
145L28.5Very low31.1Very low179 Ų179137.4 Ų137.494%0.93781%0.812SS**  trans-134.9145159.3-140.976.3000107.5
146G31Very low30.6Very low72 Ų72138.9 Ų138.974%0.74281%0.812SS**  trans-106-175.3-156.100000117.5
147K30.9Very low30.8Very low204 Ų204136.7 Ų136.789%0.88781%0.807SS**  trans89.988.8175.4-57.3-178.3179.7177.80116.9
148S33Very low30.8Very low123 Ų123142.1 Ų142.186%0.8682%0.816SS**  trans42.1118.2136.7580000120.2
149G41.6Very low30.7Very low82 Ų82138.4 Ų138.485%0.84581%0.813SS**  trans-178.1-21.3163.600000120
150S34Very low30.6Very low101 Ų101139 Ų13971%0.70682%0.818SS**  trans-155.4155.6-170.751.40000114.5
151P32Very low30.6Very low124 Ų124138.1 Ų138.181%0.80581%0.814SS**  trans-80139.6176.132.4-33.9000111.8
152I32.7Very low31.2Very low149 Ų149136.9 Ų136.976%0.76481%0.814SS**  trans-106124.1174.7-60.8175.6000108.8
153V31.2Very low31.4Very low136 Ų136138 Ų13882%0.82482%0.815SS**  trans-88124.9173.3178.50000109.1
154L26.4Very low31.2Very low158 Ų158136.5 Ų136.583%0.82782%0.815SS**  trans-103.4109.8174.8-76164.7000109.8
155A27.8Very low31.3Very low93 Ų93139.6 Ų139.677%0.76982%0.82SS**PPolyproline II helixtrans-88.6131.9173.300000110.8
156L30.6Very low31.3Very low154 Ų154140 Ų14081%0.80681%0.814SS**PPolyproline II helixtrans-91.4125.5175.4-78.7146.7000110.3
157P32Very low31Very low121 Ų121142.4 Ų142.479%0.78681%0.814SS**PPolyproline II helixtrans-70.1136171.429.8-33.2000110.3
158H31.7Very low31Very low175 Ų175138.2 Ų138.281%0.8181%0.806SS**PPolyproline II helixtrans-86.7133.3171.6-82.752.2000110.6
159S27.5Very low30.8Very low125 Ų125138 Ų13887%0.87480%0.799SS**PPolyproline II helixtrans-82.4128.6167.1-58.60000110.3
160Q27.4Very low30.2Very low186 Ų186142.6 Ų142.687%0.86980%0.799SS**  trans-136.9143.8167.3-78.4-167.4-23.900111
161L25.8Very low30Very low164 Ų164141.8 Ų141.886%0.85980%0.799SS**  trans-168.9149.7-176-161.1132.6000107.8
162P43.3Very low29.8Very low103 Ų103144.5 Ų144.567%0.66980%0.801SS**  cis-121.5174.5-23.438.7-25.4000112.7
163Q28.7Very low29.5Very low199 Ų199143.6 Ų143.693%0.9381%0.807SS**  -162.4168.5129.4-110.9172.718.500111
164A28.7Very low29.3Very low91 Ų91140.4 Ų140.475%0.75280%0.802SS**  trans-140.2145.5-154.900000115.6
165Q32.4Very low30.1Very low192 Ų192141 Ų14190%0.89781%0.806SS**  trans-169.4118152.3-98.5154.227.100105.8
166K29Very low30.2Very low188 Ų188140.6 Ų140.682%0.81780%0.803SS**  96.394.159.3-172.4-176.6177.7-174.40112.6
167V25.4Very low30.1Very low122 Ų122141.8 Ų141.874%0.73980%0.802SS**  trans41.2120.6133.3-167.40000116.7
168T29Very low29.9Very low117 Ų117142.8 Ų142.872%0.71880%0.799SS**  -163160.355.4-23.70000113.4
169T28.8Very low30Very low117 Ų117140 Ų14072%0.71880%0.797SS**  trans-8.9153.5157.7550000120.6
170Q29.9Very low30.4Very low179 Ų179138.3 Ų138.384%0.83678%0.783SS**  cis-165.6149.325.9-138.6170.820.100114.3
171A29.2Very low30.5Very low85 Ų85137.7 Ų137.770%0.70278%0.78SS**  trans54.3114.5147.200000125.4
172Q27.8Very low30.8Very low181 Ų181139 Ų13985%0.84678%0.782SS**  trans76.3138.6137-67-169.4-1.800123.8
173S27.5Very low30.2Very low129 Ų129142 Ų14290%0.90279%0.791SS**  trans63.5156.1171.373.40000116.4
174G26.9Very low30.1Very low70 Ų70141.8 Ų141.872%0.72279%0.787SS**  cis169.5115.2-7.600000111.3
175D43.6Very low29.9Very low170 Ų170143.7 Ų143.791%0.90979%0.788SS**  trans22.295.9173.3-130.8-59.8000120.5
176A28.3Very low29.7Very low84 Ų84140.1 Ų140.169%0.69478%0.779SS**  trans-146.6132.6152.200000107.2
177K30.1Very low29.7Very low180 Ų180137.9 Ų137.978%0.78378%0.782SS**  cis71.114737.9-156.4-171.2177.6178.50112.9
178L26.3Very low30Very low141 Ų141139.6 Ų139.674%0.73879%0.785SS**  trans94.6159.7168.1-49.5178.3000115.1
179P34.3Very low29.9Very low117 Ų117137.8 Ų137.876%0.7679%0.79SS**  -135.7-103.4-96.628.4-0.4000119.1
180P37Very low29.8Very low90 Ų90136 Ų13658%0.58479%0.794SS**  -130.9-157.6-122.241.8-19.6000114.9
181Q28.6Very low29.7Very low173 Ų173138.6 Ų138.681%0.80880%0.796SS**  trans68.5106.5164.2-65.3159.96.900115
182Q32.6Very low30.3Very low190 Ų190140 Ų14089%0.88880%0.799SS**  59.595.853.9-61.6-166.6-10.100116.1
183I30.9Very low30.3Very low168 Ų168139.9 Ų139.986%0.86280%0.798SS**  trans-137.2144.3147.6-63.2-172.6000109.8
184K26.3Very low30.3Very low194 Ų194139.2 Ų139.284%0.84379%0.788SS**  trans-25158.4172.5-60.9172.2-179.5174.60117.4
185V25.2Very low30.7Very low130 Ų130145.5 Ų145.579%0.78880%0.796SS**  -157130.458.8163.60000114.8
186V27.1Very low30.3Very low117 Ų117142.7 Ų142.771%0.70979%0.787SS**  trans47.1119.6150.7-1800000122I188V186-I188 HydrophobicContact CG1-CG1 4.18Å
187T30.2Very low30.2Very low141 Ų141144.8 Ų144.887%0.86579%0.791SS**  -125.4152.7127-550000108
188I30.1Very low30.1Very low158 Ų158144.2 Ų144.281%0.8179%0.794SS**  trans-86.9117.5-170.7-62.1171.7000112.3V186V186-I188 HydrophobicContact CG1-CG1 4.18Å
189G27.2Very low30.1Very low80 Ų80140.8 Ų140.883%0.82579%0.793SS**  trans72.3140.9162.300000117.3
190G27Very low29.8Very low78 Ų78141.4 Ų141.480%0.80479%0.794SS**  cis-176.1114-8.300000112.5
191R27.9Very low29.3Very low234 Ų234142.7 Ų142.788%0.88381%0.806SS**  trans17.9132.5168.7-83.4-167.1177.8-171.7-0122.7
192P40.6Very low29.3Very low116 Ų116138.4 Ų138.475%0.75380%0.8SS**  trans-99.3-169.3138.638.9-32000112.9
193E27.9Very low29.1Very low178 Ų178137.5 Ų137.583%0.83280%0.8SS**  trans71.4150.9-178.3-63.4-124.5100.400115.6
194V28.7Very low29.1Very low115 Ų115135.6 Ų135.670%0.69780%0.797SS**  cis-157.6158.549.1162.90000111.9
195K34.6Very low29.9Very low202 Ų202132.4 Ų132.488%0.87880%0.796SS**  trans-92.8136.6163.4-81.2-175.6175.9178.80113.2
196P36.4Very low30Very low110 Ų110129.1 Ų129.171%0.71479%0.788SS**  trans-143.3125.2144.333.6-16.1000116.3
197V26.1Very low30.3Very low128 Ų128128.6 Ų128.678%0.77679%0.789SS**  35.2128.6123.5-1770000121.5
198I27.8Very low30.3Very low168 Ų168129.3 Ų129.386%0.86278%0.783SS**  trans72.4132.1162.8-70163000117.7
199G24.8Very low30.3Very low69 Ų69128.4 Ų128.471%0.71178%0.779SS**  trans170.126.817500000123.4
200V28Very low30.4Very low130 Ų130131.6 Ų131.679%0.78878%0.775SS**  trans39.9121.7153.9-176.90000121.8
201S27.6Very low30.4Very low118 Ų118134.6 Ų134.683%0.82577%0.773SS**  trans72.2156.3156.9-64.70000118.8
202A28.4Very low30.5Very low82 Ų82129.6 Ų129.668%0.67877%0.769SS**  cis-148.3165.513.400000115.4
203L28.8Very low29.9Very low171 Ų171129.4 Ų129.490%0.89577%0.766SS**  trans70.594.8151.1-68.8161.9000122.1
204T31.5Very low30.1Very low129 Ų129127.3 Ų127.379%0.79177%0.765SS**  trans-65.9-179.6134.5220000111.7
205P42.8Very low30.1Very low127 Ų127130.2 Ų130.283%0.82577%0.771SS**  cis-128.9-173.615.539.9-20.2000114.8
206G27.3Very low30.9Very low60 Ų60125.3 Ų125.362%0.61976%0.76SS**  cis-156.21745.600000112.5
207S32.3Very low30.5Very low107 Ų107125 Ų12575%0.74876%0.76SS**  62.5129.386.8-66.20000113.8
208Q29.9Very low30.6Very low156 Ų156125 Ų12573%0.72976%0.761SS**  cis-139.5146.210.9-71.2-59.729.300110
209L29.8Very low30.6Very low138 Ų138123.9 Ų123.972%0.72376%0.755SS**  92.214661.2-135.4-163.5000113.3
210I31Very low31Very low147 Ų147128.5 Ų128.575%0.75476%0.758SS**  trans99.4140.8163.3-53.3170.1000117.9
211N26.9Very low31Very low142 Ų142128.2 Ų128.276%0.75976%0.757SS**  trans-94-168.5-172.1-67.2-28.5000113.7
212T28.8Very low31.3Very low128 Ų128130.2 Ų130.279%0.78575%0.754SS**  trans88.3151.9156.974.40000117.1
213T28.3Very low31.5Very low113 Ų113133.1 Ų133.169%0.69375%0.753SS**  cis-168.2172.7-23.5-88.30000107.1
214T32Very low31.6Very low134 Ų134133.1 Ų133.182%0.82275%0.753SS**  trans75113.1161.523.60000121.2
215Q29.3Very low31.8Very low176 Ų176135.7 Ų135.782%0.82275%0.753SS**  trans-37.3179.6138-90.8-165.624.800117.5
216P50.5Low31.2Very low98 Ų98136.1 Ų136.164%0.63675%0.754SS**  cis-143.2-166.2-14.431.8-8000116.2
217S28Very low31.5Very low103 Ų103139.1 Ų139.172%0.7276%0.76SS**  trans80.4121.1151.1-600000118.7
218V28.8Very low31.2Very low130 Ų130142.1 Ų142.179%0.78876%0.762SS**  82.5107.251.5-176.50000114.7
219L28.7Very low31.3Very low143 Ų143142 Ų14275%0.74977%0.765SS**  trans168.9145.2133.6-94.8156.8000115.3
220Q32.1Very low31.3Very low166 Ų166139.7 Ų139.778%0.77677%0.766SS**  trans41.3140.9153.9-71164.7-6.800122.1
221T29.2Very low31.2Very low124 Ų124142.3 Ų142.376%0.76177%0.772SS**  cis103.213720.5-56.10000114.6
222Q33.1Very low31.4Very low161 Ų161144.8 Ų144.875%0.75278%0.776SS**  trans84154.5176.8-52.3-159.575.500116.9
223Q32.9Very low31.9Very low143 Ų143144.1 Ų144.167%0.66877%0.774SS**  cis-168.9157.1-25.7-105.7-157.569.100108.4
224L29.6Very low31.8Very low171 Ų171150.4 Ų150.490%0.89578%0.784SS**  trans-170.3174.1137.4-127.968.8000114.2
225K35.7Very low31.8Very low182 Ų182149.9 Ų149.979%0.79178%0.781SS**  trans-147.6166.8-174.1-97.4-177.9174.7176.20112.7
226T31.8Very low32.7Very low137 Ų137147 Ų14784%0.8478%0.778SS**  trans112.1150.7162.2-50.70000115.1
227V32.1Very low31.7Very low123 Ų123148.9 Ų148.975%0.74579%0.788SS**  -172.5165.6-55.8131.70000111
228Q27.6Very low31.8Very low169 Ų169149.6 Ų149.679%0.7979%0.793SS**  trans98.6145.6-179.3-58.7-169.599.500115.7
229I30.8Very low31.8Very low153 Ų153146.2 Ų146.279%0.78578%0.784SS**  cis93.7132.517.5-59.4164.7000113.2
230A29.5Very low32.6Very low90 Ų90145.8 Ų145.874%0.74479%0.79SS**  cis-119.1-122.8800000114
231K29Very low32.5Very low203 Ų203144.1 Ų144.188%0.88379%0.791SS**  cis-156.8-158.63.7-146.8165.5-174.8176.10111.8
232K31.6Very low32.5Very low194 Ų194144.7 Ų144.784%0.84379%0.788SS**  trans-160.1171.7-179.1-109.5175.3-177.8174.20109.2
233P38.5Very low32.3Very low114 Ų114143 Ų14374%0.7479%0.788SS**  cis-159.6170.540.845.6-23.3000122.5
234R27.6Very low32Very low244 Ų244144.7 Ų144.792%0.92179%0.794SS**  trans70.8164139.9-91.5-174.7175.7176.8-0.9127.2
235T30.6Very low32Very low123 Ų123143.1 Ų143.176%0.75579%0.785SS**  trans-102.6-178.2-166.753.20000112.5
236P48.2Very low31.7Very low115 Ų115140.6 Ų140.675%0.74778%0.779SS**  cis-144.8-168.344.441.5-16.6000115.6
237T29.6Very low31.5Very low138 Ų138143.3 Ų143.385%0.84778%0.78SS**  cis-130.4-121.713-37.90000113.6
238S31.6Very low31.2Very low119 Ų119141.6 Ų141.683%0.83278%0.779SS**  cis-152.4-168.35.4-160.30000112
239G28.2Very low31.3Very low59 Ų59143.2 Ų143.261%0.60878%0.783SS**  trans-166.9-163.7-177.500000114.7
240P46.1Very low31.8Very low133 Ų133141 Ų14186%0.86478%0.779SS**  cis-106.3-114.211.234.4-17.8000115
241V29.4Very low31.9Very low131 Ų131144.3 Ų144.379%0.79478%0.782SS**  cis-143.5-146.915.769.80000112.6
242I29.5Very low31.8Very low137 Ų137141.5 Ų141.570%0.70378%0.777SS**  trans-137.5136.2-160.9-61.7172.1000110
243T28.3Very low31.7Very low124 Ų124137.2 Ų137.276%0.76177%0.771SS**  -171126.194-62.30000114.2
244K27.4Very low31.2Very low180 Ų180141.6 Ų141.678%0.78378%0.779SS**  trans13.9153.5140.2-64.1174168.3-177.60120.6
245L28.6Very low31.2Very low137 Ų137134.5 Ų134.572%0.71777%0.772SS**  cis-161.7141.521.7-154.474.8000115.5
246I30.3Very low31Very low130 Ų130134.7 Ų134.767%0.66777%0.773SS**  trans36.1119.2142.3-60172.6000124.3
247F27.1Very low29.9Very low193 Ų193135.9 Ų135.985%0.84678%0.778SS**  trans22.8140132.8-58-87.3000126.9
248A26Very low29.9Very low88 Ų88132.6 Ų132.673%0.72777%0.772SS**  trans87.9116.3130.400000124.6
249K30.2Very low29.7Very low202 Ų202136 Ų13688%0.87878%0.775SS**  37153.8112.5-76.6-179.5179.9-1790121.1
250P41.1Very low29.7Very low108 Ų108138.1 Ų138.170%0.70178%0.776SS**  cis-148.6-170.5-10.340.4-16.9000117.9
251I30.6Very low28.9Very low159 Ų159137.3 Ų137.382%0.81577%0.769SS**  trans31.8124.6158.450165.5000126.3
252N27.7Very low28.9Very low144 Ų144139 Ų13977%0.7777%0.768SS**  65.1115.7123.4-164.418000123.1
253S28.3Very low28.8Very low103 Ų103138.4 Ų138.472%0.7277%0.771SS**  158.3133.6107.256.90000119.2
254K28.9Very low28.7Very low206 Ų206137.4 Ų137.490%0.89677%0.769SS**  trans46.3157144.2-76.9-167.9173.5-173.30126.7
255A26.6Very low30Very low95 Ų95134 Ų13479%0.78577%0.765SS**  trans85.2150.3166.700000116.1
256V26.8Very low30.9Very low128 Ų128133 Ų13378%0.77677%0.767SS**  cis-155.7139.944.6152.80000115.1
257T26.2Very low30.9Very low139 Ų139132.4 Ų132.485%0.85377%0.769SS**  trans37140.2155.962.80000128.4
258G28.3Very low31.1Very low70 Ų70131.4 Ų131.472%0.72277%0.77SS**  trans171116.1142.200000109.7
259Q28.7Very low31.3Very low190 Ų190132.1 Ų132.189%0.88878%0.777SS**  66.3127.660.5-73.5-161.9-21.900114.5
260T28.1Very low31.1Very low103 Ų103125.9 Ų125.963%0.63277%0.769SS**  cis-164.6168.1-3.4-70.30000110.4
261T29.6Very low30.6Very low117 Ų117132.3 Ų132.372%0.71878%0.78SS**  trans69.3145.9159.533.70000120
262Q28.1Very low30.5Very low167 Ų167130.1 Ų130.178%0.7877%0.773SS**  cis-167.7166.3-20.2-135.9-170.927.700113.8
263V27.2Very low30.6Very low123 Ų123130.7 Ų130.775%0.74578%0.776SS**  trans64.2151.2162.6-121.70000122.3
264S26.6Very low30.6Very low104 Ų104130 Ų13073%0.72777%0.771SS**  trans-146.9-165.8177.8-46.30000108.9
265P54.2Low30.7Very low107 Ų107128.7 Ų128.770%0.69577%0.768SS**  -103.3-133.8-74.540.7-24.1000109.3V267P265-V267 HydrophobicContact CB-CG2 4.22Å; P265-V267 HydrophobicContact CG-CG2 4.34Å
266P48.5Very low30.7Very low117 Ų117130 Ų13076%0.7677%0.771SS**  cis-105.3169.114.710.116000113
267V30Very low30.8Very low117 Ų117130.3 Ų130.371%0.70977%0.773SS**  cis77.9113.731.3-168.50000115.7P265P265-V267 HydrophobicContact CB-CG2 4.22Å; P265-V267 HydrophobicContact CG-CG2 4.34Å
268I32.3Very low31.5Very low172 Ų172129.8 Ų129.888%0.88277%0.773SS**  176.9154.9130-91.6166.7000110.6
269A28.5Very low31.5Very low104 Ų104130 Ų13086%0.8678%0.775SS**  trans-103.5175-159.200000116.5
270G26.8Very low31.6Very low70 Ų70127.5 Ų127.572%0.72277%0.773SS**  trans168.5113.4155.300000118.2
271R31.7Very low32.5Very low243 Ų243127.4 Ų127.492%0.91777%0.773SS**  trans32.5157.9136.3-77.2-176.7165.4160.7-5.5122.5
272V28.4Very low32.4Very low113 Ų113126.6 Ų126.669%0.68577%0.773SS**  cis170146.6-27.1130.70000108
273L28.3Very low32.7Very low157 Ų157127.7 Ų127.782%0.82278%0.775SS**  trans64.8162.5176.9-63.6160.7000115.8
274S29.6Very low32.7Very low87 Ų87127.9 Ų127.961%0.60878%0.777SS**  cis-166.9161.4-29.4-105.80000112.7
275Q29.4Very low33Very low180 Ų180129.8 Ų129.884%0.84178%0.777SS**  trans46.8125.8150.8-65.1176.84.100121.8
276S28Very low31.8Very low121 Ų121130.2 Ų130.285%0.84678%0.778SS**  164.1162.1109.751.80000114.2
277T28.6Very low31.2Very low135 Ų135131.7 Ų131.783%0.82878%0.778SS**  trans-131.5-175.7174.257.30000108.2
278P41Very low31.2Very low129 Ų129131.8 Ų131.884%0.83878%0.783SS**  cis-123.5-174.5-25.835.3-18000112.4
279G27.5Very low31.3Very low74 Ų74131.8 Ų131.876%0.76378%0.78SS**  trans171.6122163.700000119
280T31.9Very low31.6Very low138 Ų138131.8 Ų131.885%0.84777%0.774SS**  trans-115.5175.816154.40000107.8
281P46.2Very low31.8Very low100 Ų100131.7 Ų131.765%0.64977%0.773SS**  cis-157.8-173.128.346.9-23.7000121.1
282S28.9Very low31.8Very low100 Ų100126.5 Ų126.570%0.69977%0.767SS**  trans68.3117.4142.7-67.60000124.1
283K33.8Very low32Very low190 Ų190129 Ų12983%0.82678%0.775SS**  trans-168.8156.6154.5-83.4117.4-155.41160107.5
284T27.4Very low32Very low128 Ų128124.9 Ų124.979%0.78577%0.771SS**  cis-162.6174.6-12.5-82.80000108.4
285I33.1Very low32Very low143 Ų143126 Ų12673%0.73378%0.779SS**  trans-134.9166.4-173.7-9.3176.4000108.8
286T27.3Very low31.9Very low116 Ų116123.1 Ų123.171%0.71277%0.774SS**  cis-156.5121.527.7-58.90000110
287I36.7Very low32Very low149 Ų149124.6 Ų124.676%0.76477%0.771SS**  48.4120.8106.1-54.1174.8000118
288S31Very low32.1Very low118 Ų118124.8 Ų124.883%0.82577%0.767SS**  trans-180162.3157.7-770000110.5
289E34.4Very low31.5Very low172 Ų172123.4 Ų123.480%0.80476%0.761SS**  cis-159.4-144.1-43.1-142.1-128.161.200111.3
290S33.7Very low31.6Very low105 Ų105125.4 Ų125.473%0.73476%0.758SS**  trans-74170.2-174-58.10000116.4
291G31.1Very low31.6Very low68 Ų68124.2 Ų124.270%0.70175%0.751SS**  cis162176.9-700000114.3
292V31Very low31Very low133 Ų133128.2 Ų128.281%0.80676%0.761SS**  trans80.8110.2160.3-170.20000122.4
293I32.9Very low31.1Very low166 Ų166129.7 Ų129.785%0.85177%0.766SS**  trans20.5136.1135.1-32.6167.3000122
294G27.8Very low32Very low70 Ų70125.5 Ų125.572%0.72276%0.758SS**  trans146.790.8136.600000123.4
295S29.3Very low32.5Very low111 Ų111126.1 Ų126.178%0.77676%0.757SS**  trans45.5123.3136.3-54.80000126.6
296T27.4Very low32.5Very low120 Ų120127.8 Ų127.874%0.73676%0.758SS**  75.2121.912954.90000125.9
297L30.3Very low32.7Very low151 Ų151128.8 Ų128.879%0.79176%0.758SS**  trans66.7149.4136.5-60.1170.3000119.2
298N31.4Very low32.4Very low140 Ų140126 Ų12675%0.74976%0.757SS**  cis-129.8169.62.6-90.2-50.3000109.3
299S28.3Very low32.5Very low100 Ų100128.3 Ų128.370%0.69976%0.758SS**  cis-144.9-143.119.5-149.40000109.6
300T29.2Very low32.5Very low115 Ų115125.3 Ų125.371%0.70676%0.756SS**  cis-157.4163.88.3-21.60000111.8
301T32.7Very low32.8Very low114 Ų114125.6 Ų125.670%0.69976%0.755SS**  trans50.4102.8156.745.90000121.8
302Q33.8Very low32.8Very low184 Ų184129.9 Ų129.986%0.8676%0.762SS**  75.6133.1125.6-63.6-178.111.300122.6
303T31.4Very low32.8Very low130 Ų130132.5 Ų132.580%0.79876%0.762SS**  trans-106.1-174.7166.256.30000108.2
304P52.7Low32.7Very low102 Ų102130 Ų13066%0.66276%0.76SS**  cis-150173.713.645-24.3000120.3
305N37.9Very low33.6Very low142 Ų142132.9 Ų132.976%0.75977%0.765SS**  trans65.6118.5139.2-75.5-27000125.8
306K32.5Very low33.9Very low178 Ų178135 Ų13577%0.77477%0.768SS**  79.6126.6124.8-84.9-171.6156.6-170.60125.1
307I31.9Very low34.3Very low137 Ų137138.6 Ų138.670%0.70377%0.773SS**  trans88.997.8134.4-65.4172000121.3
308A29.1Very low34.4Very low89 Ų89135.5 Ų135.574%0.73677%0.769SS**  69.9166.8120.100000125.2
309I33.3Very low34.4Very low168 Ų168135.1 Ų135.186%0.86277%0.772SS**  trans89.8133.8167.9-51.4179.3000116.9
310S33.9Very low34.6Very low108 Ų108139.8 Ų139.876%0.75578%0.78SS**  trans-98.4166177.6-43.30000112.1
311P41.8Very low34.6Very low111 Ų111139.5 Ų139.572%0.72178%0.782SS**  -153.9143.1123.733.6-14.7000118.3
312L30.9Very low34.3Very low159 Ų159140.6 Ų140.683%0.83279%0.789SS**  trans54.9176139.9-79.182.6000121.3
313K30.7Very low34.1Very low188 Ų188138.1 Ų138.182%0.81779%0.786SS**  cis-179.8133.4-47.3-174.5170.9-175176.90109.5
314S29.6Very low34.2Very low114 Ų114140.5 Ų140.580%0.79779%0.788SS**  trans-86.4151.2-175.6-51.30000115.5
315P47.9Very low33Very low129 Ų129141 Ų14184%0.83879%0.789SS**  trans-88.1-172.7171.936.8-35.7000114
316N34.4Very low32.5Very low155 Ų155141.4 Ų141.483%0.82979%0.79SS**  trans-158.2172.3-161.3-162.5-26.7000112.1
317K37.4Very low32.4Very low197 Ų197138.6 Ų138.686%0.85779%0.788SS**  trans82.3154.8172-64.3-175.3176.4-178.60118.4
318A32.7Very low32.4Very low85 Ų85138.8 Ų138.870%0.70280%0.795SS**  cis-175.3-168.8-20.100000112.6
319V31.2Very low32.3Very low132 Ų132138.4 Ų138.480%0.880%0.8SS**  trans91.7119.3162.8-1690000115.2
320K31Very low32.1Very low199 Ų199133.9 Ų133.987%0.86579%0.794SS**  76144.357.4-81.4-170.6177.6-173.10114.7
321S29.5Very low31.8Very low109 Ų109135.6 Ų135.676%0.76280%0.8SS**  cis-172-170.8-9.6-166.10000112.2
322T26.6Very low31.2Very low137 Ų137135 Ų13584%0.8480%0.798SS**  trans100.2154165.4-48.60000119.4
323V30.6Very low31.1Very low131 Ų131133.8 Ų133.879%0.79480%0.798SS**  trans-162.7154.7-170.1640000115.2
324Q33.1Very low31Very low180 Ų180130.1 Ų130.184%0.84180%0.796SS**  trans-177.1174.5166.3-100.7176.482.700109.9
325T27.5Very low31Very low112 Ų112133.8 Ų133.869%0.68780%0.801SS**  cis-175.7175.1-36.3-82.60000109.9
326I27.6Very low30.1Very low152 Ų152137.5 Ų137.578%0.77980%0.804SS**  trans89.5130.3176.3-55.1179.4000114.7
327T30.1Very low29.8Very low119 Ų119140.1 Ų140.173%0.7381%0.808SS**  cis95.8148.16.7-19.80000115.9
328V31.5Very low29.5Very low141 Ų141136.7 Ų136.786%0.85580%0.804SS**  cis-157.3158.119.1-151.90000113.2
329G26.3Very low29.3Very low81 Ų81140.2 Ų140.284%0.83581%0.809SS**  trans95.5154154.600000119.1
330G29.5Very low29.3Very low72 Ų72141 Ų14174%0.74281%0.807SS**  cis174.1152.4-12.800000117
331V28.4Very low29.4Very low145 Ų145137.4 Ų137.488%0.87980%0.804SS**  trans70.5139.7155-130.20000125.1
332S28.8Very low29.3Very low98 Ų98140.8 Ų140.869%0.68581%0.813SS**  trans114.998.2138-62.40000124.7
333T28.6Very low29.6Very low134 Ų134138.5 Ų138.582%0.82281%0.808SS**  trans54.6111.6130.559.20000126.8
334S28.5Very low29.6Very low111 Ų111139.6 Ų139.678%0.77682%0.815SS**  58.6125.7117.6-158.80000124.9
335Q29.4Very low29.6Very low191 Ų191135.5 Ų135.589%0.89381%0.812SS**  -180169.7116.7-97-173.528.600113.8
336F29.8Very low30.2Very low206 Ų206135.7 Ų135.790%0.90482%0.815SS**  trans-115.9152.1-172-101.9-96.4000113.9
337K27.2Very low30.6Very low210 Ų210136 Ų13691%0.91382%0.819SS**  trans-156.1158.6156.1-149165.8-176.3175.70113.3
338T32.2Very low30.7Very low126 Ų126136.9 Ų136.977%0.77382%0.823SS**  trans-125.1141-166.3-56.80000112.8
339I29.1Very low31.2Very low159 Ų159139 Ų13982%0.81582%0.824SS**  trans-140.3121.7164.2-56.6-177.1000113.3
340I29.6Very low31.6Very low149 Ų149143.3 Ų143.376%0.76482%0.822SS**  trans1.4135.9148.7-49.8171.6000120.3
341P34.1Very low32Very low123 Ų123147.5 Ų147.580%0.79983%0.826SS**  trans-98.9161.1160.238.7-32.5000114.2
342L26.1Very low32.2Very low180 Ų180148.2 Ų148.294%0.94282%0.82SS**  trans-106.3153.9178.5-167.964.5000111.9
343A33.3Very low32.7Very low89 Ų89149.1 Ų149.174%0.73682%0.821SS**  trans-123.4160.6-167.500000115.1
344T30.4Very low32.9Very low153 Ų153148.5 Ų148.594%0.93982%0.819SS**  trans-147.4159.2169.5-41.70000110.3
345A34.3Very low33.9Very low95 Ų95147.3 Ų147.379%0.78583%0.825SS**  trans-89.6168-153.400000117.1
346P39.1Very low34.7Very low116 Ų116142.4 Ų142.475%0.75381%0.811SS**  trans-116.6130-165.737.7-25000116.3
347N35.4Very low35.3Very low159 Ų159142 Ų14285%0.8581%0.809SS**  trans-165.4102.9146.1-128.1-88.6000114.1
348V34.2Very low35.9Very low137 Ų137139.8 Ų139.883%0.8380%0.8SS**  trans-150124.1158.9-176.60000108.3
349Q40.8Very low36.3Very low185 Ų185142.8 Ų142.886%0.86480%0.804SS**  trans-85.9129.7166.4-76.8-179.9-25.600110.1
350Q34.9Very low36.8Very low171 Ų171145.1 Ų145.180%0.79981%0.805SS**  trans-94136.4173-71-177.1-29.500110.7
351I38.2Very low37.4Very low160 Ų160144.2 Ų144.282%0.82181%0.806SS**  trans-106.5117.7166.8-62.3177.5000107.8
352Q33.3Very low37.3Very low161 Ų161148.8 Ų148.875%0.75281%0.807SS**  trans-81.8119.8-177.5-173.373.8-1.600110.7
353V37.8Very low37.7Very low117 Ų117147.8 Ų147.871%0.70980%0.802SS**  trans-118.7111.1170.3-172.80000109.1G355V353-G355 PolarHBondContact O-N 3.48Å
354P32.7Very low37.7Very low120 Ų120148.4 Ų148.478%0.77980%0.797SS**THydrogen-bonded Turntrans-64.8132.9-178.3-2334.2000113.1
355G49.5Very low37.7Very low87 Ų87147.7 Ų147.790%0.89779%0.792SS**THydrogen-bonded Turntrans120.7-10.4160.900000117.9V353V353-G355 PolarHBondContact O-N 3.48Å
356S46.2Very low37.5Very low87 Ų87147.6 Ų147.661%0.60879%0.791SS**  trans-106.9146.8179.2-173.40000113.1
357K43.2Very low37Very low198 Ų198148.6 Ų148.686%0.86180%0.796SS**  trans-111.323.9178.6-78-165.6175.1-1750114.3
358F39.4Very low36.8Very low164 Ų164146.6 Ų146.672%0.71979%0.794SS**  trans-132.2136.8174.2-65.7-76.1000111.7
359H41.8Very low36.5Very low188 Ų188144.8 Ų144.887%0.8779%0.794SS**  trans-86.9138.1175.3-68.885.3000110
360Y38.4Very low35.9Very low208 Ų208142 Ų14282%0.81679%0.794SS**  trans-117.2134.5170.5-68.3-85.6000109.5
361V43Very low35.7Very low131 Ų131139.8 Ų139.879%0.79480%0.798SS**  trans-111.5122.6170.8-179.70000107.7L363V361-L363 HydrophobicContact CG1-CD1 4Å
362R32.3Very low35.3Very low218 Ų218137.4 Ų137.482%0.82380%0.795SS**  trans-103.5108.3173.8-178-174.7179.3-172.2-0.2108.6V364R362-V364 HydrophobicContact CG-CG2 3.93Å
363L33.2Very low35.1Very low159 Ų159136.8 Ų136.883%0.83280%0.803SS**  trans-68.4135.5163.5-91.263.7000108.7V361V361-L363 HydrophobicContact CG1-CD1 4Å
364V34.4Very low34.8Very low103 Ų103139.6 Ų139.662%0.62481%0.808SS**  trans-130.5119.1172.9-176.20000106.8R362 A366R362-V364 HydrophobicContact CG-CG2 3.93Å; V364-A366 PolarHBondContact O-N 3.47Å
365T29.8Very low35.1Very low137 Ų137138.9 Ų138.984%0.8480%0.803SS**  trans-72.4119.5169.537.90000109.1
366A30Very low34.1Very low94 Ų94141 Ų14178%0.77780%0.799SS**  trans-84.2130.1174.700000110.4V364V364-A366 PolarHBondContact O-N 3.47Å
367T28.7Very low33.3Very low137 Ų137141.3 Ų141.384%0.8480%0.801SS**  trans-93111.5173.6-47.20000109.1A369T367-A369 PolarHBondContact O-N 2.98Å
368S30.8Very low32.7Very low116 Ų116141 Ų14181%0.81180%0.803SS**  trans-72.4125.4174.4-57.10000110.7
369A28.8Very low32.1Very low100 Ų100140.3 Ų140.383%0.82681%0.806SS**  trans-111.9124.216900000109.2T367T367-A369 PolarHBondContact O-N 2.98Å
370S27.9Very low32.6Very low126 Ų126135.9 Ų135.988%0.88179%0.794SS**  trans-94.9135.3-178.7-53.90000111.2
371S30.4Very low32.1Very low125 Ų125130.7 Ų130.787%0.87479%0.788SS**  trans-129.6148.3160.457.60000109.5
372S30.2Very low31.5Very low110 Ų110130.4 Ų130.477%0.76979%0.787SS**  trans-111.2137.6-160.255.80000114
373T29.3Very low31.2Very low148 Ų148126.8 Ų126.891%0.90878%0.784SS**  trans-158159.1136.4150000111.2
374Q30.6Very low31.1Very low176 Ų176124.6 Ų124.682%0.82278%0.777SS**  trans-100.3-174.1-179.3-69.9-90.53.300110
375P39.8Very low30.9Very low104 Ų104128.2 Ų128.268%0.67579%0.787SS**  -124.2-175.1-83.237.2-19.8000111.8
376V27.7Very low31.8Very low133 Ų133126.4 Ų126.481%0.80678%0.778SS**  trans169.8139136.3150.40000112.7
377S28.7Very low31.7Very low93 Ų93129 Ų12965%0.6578%0.778SS**  trans11.1140159.7-63.60000125.3
378Q31.4Very low31.9Very low192 Ų192129.4 Ų129.490%0.89777%0.771SS**  trans92157.4132.6-7816613.200121.3
379N27.7Very low32.2Very low149 Ų149131.9 Ų131.980%0.79777%0.769SS**  trans-148.9169.8-157.9-158.732.6000105.4
380P50.8Low32.3Very low95 Ų95131.5 Ų131.562%0.61777%0.766SS**  cis-126.8-148.5-23.428.3-4000110.9
381S29.7Very low32.3Very low98 Ų98135.1 Ų135.169%0.68577%0.766SS**  trans90.2150149.9-54.80000119.2
382T29.3Very low33Very low125 Ų125134.9 Ų134.977%0.76776%0.761SS**  cis-169.2161.1-29.837.40000110.2
383N27Very low33Very low142 Ų142135.5 Ų135.576%0.75976%0.76SS**  trans94.4150.9138.9-130.5-1.8000123.4
384T30.1Very low33.2Very low113 Ų113135.3 Ų135.369%0.69376%0.759SS**  trans47.7116.2155.740.20000121.3
385Q29.7Very low33.3Very low179 Ų179132.5 Ų132.584%0.83675%0.753SS**  53.9152.765.4-88.1-151.917.500116.7
386P49.3Very low32.8Very low99 Ų99134.6 Ų134.664%0.64376%0.758SS**  cis-148-174.6-19.940.7-20.8000117.3
387L28.8Very low33Very low149 Ų149133.4 Ų133.478%0.7875%0.752SS**  trans70.9125.3140-146.874.2000122.2
388Q32.9Very low33.2Very low146 Ų146135 Ų13568%0.68276%0.758SS**  169.3139.5108.4-89.4-178.295.300116.3
389Q36.3Very low33.7Very low167 Ų167131.8 Ų131.878%0.7875%0.754SS**  trans52.5156136.4-59.6-169.135.600122.1
390A30.5Very low33.8Very low92 Ų92130.9 Ų130.976%0.7675%0.753SS**  cis-163.6-174.5-21.500000111.1
391K28.2Very low32.8Very low203 Ų203137.3 Ų137.388%0.88377%0.765SS**  trans-79.4178.2-178.5-66.1180178.5176.20112.7
392P44.9Very low32.7Very low119 Ų119140.6 Ų140.677%0.77377%0.772SS**  cis-144.9172.114.142.9-22000121.1
393V31.5Very low32.7Very low123 Ų123139.9 Ų139.975%0.74577%0.772SS**  trans-14.2136.3156-1770000121.2
394V33.4Very low33Very low145 Ų145139.2 Ų139.288%0.87977%0.773SS**  trans-144.4162.5135.8-172.70000109.3
395V32.6Very low33.3Very low116 Ų116139.7 Ų139.770%0.70378%0.777SS**  trans-119.2144-175.51710000111.7
396N28.7Very low33.4Very low148 Ų148138.8 Ų138.879%0.79178%0.777SS**  trans-168.1140.9143.1-107.1-10.7000117.8
397T32.7Very low32.5Very low108 Ų108140.8 Ų140.866%0.66379%0.787SS**  trans16.8117.9150.558.20000123.8
398T32.3Very low32.7Very low128 Ų128139.2 Ų139.279%0.78579%0.788SS**  14.3156.7126.655.60000122.8
399P42.3Very low32.5Very low124 Ų124137 Ų13781%0.80580%0.795SS**  cis-133.1-172.5436.2-15.1000116
400V28.6Very low32.3Very low130 Ų130138.4 Ų138.479%0.78880%0.802SS**  trans-84.5145.1-174.6176.20000114
401R29.8Very low32.4Very low230 Ų230138.7 Ų138.787%0.86880%0.803SS**  trans-131.8127.8156.2-173.3176.3-177.9176.62110.7
402M28.5Very low32.6Very low167 Ų167135.6 Ų135.682%0.82380%0.802SS**  trans-84.8144.1175.5-69.1-79.5-76.800111.1
403S29.1Very low31.8Very low109 Ų109139.2 Ų139.276%0.76281%0.805SS**  trans-136.3139174.6-650000110.5
404V32.9Very low31.7Very low129 Ų129141.3 Ų141.378%0.78281%0.807SS**  trans-111.8136.4177.4-179.70000108.8
405P37.2Very low31.4Very low122 Ų122141.1 Ų141.179%0.79281%0.806SS**  trans-69.3140.9176.5-18.232.1000112.7
406I30.1Very low31.2Very low160 Ų160141.7 Ų141.782%0.82181%0.809SS**  trans-108.3143.9169.8-64.7170.9000107.9
407V32.2Very low32.1Very low141 Ų141140.6 Ų140.686%0.85581%0.81SS**  trans-124.1138.5168.2-178.60000108.7
408S31.4Very low32.1Very low116 Ų116144.4 Ų144.481%0.81182%0.817SS**  trans-94.9167.6-168.849.10000114.2
409A29.7Very low32.4Very low99 Ų99143.7 Ų143.782%0.81882%0.815SS**  trans-128156.7-173.700000114.1
410Q32.2Very low31.8Very low198 Ų198145.1 Ų145.193%0.92581%0.814SS**  trans-153.1154.1169.3-66.9-175.5-700107.2
411A32.3Very low32Very low97 Ų97146.1 Ų146.180%0.80282%0.815SS**  cis-156.1169.7-24.200000107.4
412V31.6Very low32.6Very low139 Ų139140 Ų14084%0.84281%0.805SS**  trans-124.3142.1-161.7177.80000114.3
413K29Very low32.5Very low194 Ų194137.7 Ų137.784%0.84380%0.801SS**  trans-172.5161.8145.1-104.5163.8-179.5-177.70111.2
414Q28.9Very low32.5Very low167 Ų167137.8 Ų137.878%0.7880%0.802SS**  cis178.9143.2-43-176.2172.520.100108.2
415V27Very low32.2Very low142 Ų142139.6 Ų139.686%0.86180%0.801SS**  trans166.8150.2151149.60000112.1
416V28.6Very low31.8Very low127 Ų127141 Ų14177%0.7780%0.801SS**  trans-163.7153.8-161167.30000108.2
417P47.6Very low31.6Very low125 Ų125138.5 Ų138.581%0.81279%0.792SS**  cis-134.3-142.6-20.142.1-21.2000114.7
418K32.4Very low31.4Very low188 Ų188137.9 Ų137.982%0.81779%0.789SS**  trans-98160.9-167.3-131.6174.2-172.8174.80115.2
419P38.9Very low31.3Very low114 Ų114139.1 Ų139.174%0.7479%0.792SS**  -145.3146.7106.231.5-12.5000114.7
420I29.8Very low31.4Very low154 Ų154139 Ų13979%0.7979%0.786SS**  8511175.1-58.6166.9000116.6
421N32.2Very low31.5Very low150 Ų150138.4 Ų138.480%0.80278%0.783SS**  trans17.4166.4144.7-115.725.2000123.2
422P42.6Very low31.9Very low101 Ų101139.4 Ų139.466%0.65678%0.781SS**  cis-148.8-170.720.738.6-13.8000119.9
423T27.8Very low31.9Very low119 Ų119142 Ų14273%0.7378%0.784SS**  trans100.9116.4144.4-57.70000122.5
424S27.6Very low32Very low112 Ų112142.2 Ų142.278%0.78379%0.788SS**  trans38.1142.8143.4-580000123.5
425Q27.1Very low32.3Very low167 Ų167145.6 Ų145.678%0.7879%0.794SS**  cis-143.6-123.5-5.6-152.1-171.338.600111.9
426I28Very low32.3Very low151 Ų151146.7 Ų146.777%0.77479%0.794SS**  cis-143.7-132.93-163.9160.8000112.4
427V27Very low32.7Very low107 Ų107147.7 Ų147.765%0.64879%0.793SS**  trans-140.5156-158.9-1770000114.7
428T27.3Very low31.6Very low129 Ų129150.1 Ų150.179%0.79180%0.796SS**  trans91.2147.6156.112.40000123.5
429T29.5Very low32Very low141 Ų141146.7 Ų146.787%0.86579%0.793SS**  trans73.5173.1159.4-153.40000119.5
430S31.1Very low31.7Very low98 Ų98146 Ų14669%0.68580%0.797SS**  trans-131.9-176.1-134.968.40000116.6
431Q35Very low31.8Very low185 Ų185145.4 Ų145.486%0.86480%0.8SS**  trans88.7162.7167.1-79.9-164.23.900118.6
432P39.9Very low32.3Very low118 Ų118144 Ų14477%0.76680%0.799SS**  trans-100.8178.3-141.440.1-39.1000116.6
433Q31.7Very low31.7Very low193 Ų193147.2 Ų147.290%0.90281%0.81SS**  trans-68.2138.7-175.9-63.9-177.8-26.500114.6
434Q32.5Very low32.2Very low199 Ų199147.3 Ų147.393%0.9381%0.813SS**  trans-131.9174.7159.2-78.3-160.7-500111.4
435R33.9Very low32.5Very low238 Ų238149.9 Ų149.990%0.89881%0.812SS**  trans-133.7115.9-152.7176.5-162-160.9-138.69.8111.4
436L28.3Very low32.8Very low164 Ų164149.9 Ų149.986%0.85982%0.816SS**  trans-122.1111.3173.8-108.580.8000114
437I35.4Very low33.4Very low148 Ų148149.9 Ų149.976%0.75981%0.813SS**  trans15.4135.9137.6-51.4170000119.3
438M26.5Very low33.7Very low177 Ų177150 Ų15087%0.87282%0.815SS**  trans-126.8152.8141.2-84.8-156.17200110.8
439P39.4Very low34.1Very low116 Ų116150.7 Ų150.775%0.75381%0.814SS**  trans-90.7171.6-170.637-37.1000114.2
440A32.4Very low34.8Very low99 Ų99150.8 Ų150.882%0.81881%0.809SS**  trans-121.9149.4-179.800000112.9
441T33.5Very low35.5Very low141 Ų141151 Ų15187%0.86581%0.806SS**  trans-137.4156.6167.9360000109.9
442P41.5Very low36.2Very low120 Ų120149.9 Ų149.978%0.77981%0.806SS**  trans-103.3158.5-151.138.1-35.8000116.3
443L30.5Very low36.5Very low170 Ų170149.5 Ų149.589%0.8980%0.797SS**  trans-125.4166.2162.3-108.779.7000110
444P38.7Very low37.3Very low121 Ų121144.5 Ų144.579%0.78678%0.781SS**PPolyproline II helixtrans-75.8153.3-155.6-2033.4000117.7
445Q33.3Very low37.7Very low166 Ų166141.7 Ų141.778%0.77678%0.78SS**PPolyproline II helixtrans-85.1120.4177175.7179.4-20.100111.6
446I34Very low38.7Very low166 Ų166133.1 Ų133.185%0.85177%0.766SS**PPolyproline II helixtrans-96.6118.7166.6-60.8177.6000108.2
447Q39.3Very low39.6Very low152 Ų152128.5 Ų128.571%0.7175%0.745SS**  trans-107.2117.9-175.5-175.6176.94.700110.7
448P34.5Very low40.3Very low108 Ų108127.2 Ų127.270%0.70174%0.743SS**  trans-70.6133.2171.528.9-32.7000110.3
449N34.6Very low41.1Very low144 Ų144124.3 Ų124.377%0.7773%0.731SS**  trans-85.7112.3-174.4-173-101.1000111T451N449-T451 PolarHBondContact OD1-OG1 3.47Å; N449-T451 VanDerWaalsContact OD1-OG1 3.09Å
450L44.4Very low41.4Very low144 Ų144122.7 Ų122.775%0.75473%0.727SS**  trans-9984.7-179.1-82162.9000110.4
451T46.9Very low42Very low101 Ų101124 Ų12462%0.6273%0.727SS**  trans-131.818.5-174.1-490000113.7N449N449-T451 PolarHBondContact OD1-OG1 3.47Å; N449-T451 VanDerWaalsContact OD1-OG1 3.09Å
452N49.2Very low42.6Very low162 Ų162121.1 Ų121.187%0.86672%0.718SS**  trans-145.3100.3164.6-91.3-67.3000111.2
453L46.9Very low42.6Very low110 Ų110122.1 Ų122.158%0.57673%0.725SS**  trans-136.1145.1164.7-75.4173.9000108T457L453-T457 HydrophobicContact CD1-CG2 4.36Å
454P48.3Very low43.2Very low88 Ų88117.2 Ų117.257%0.57172%0.715SS**  trans-67.7149.7179.128.6-34.5000111.6G456 T457P454-G456 PolarHBondContact O-N 3.47Å; P454-T457 PolarHBondContact O-OG1 3.17Å; P454-T457 VanDerWaalsContact O-OG1 3.06Å
455P41.2Very low43.7Very low140 Ų140119 Ų11991%0.90972%0.724SS**THydrogen-bonded Turntrans-54.3136.8176.8-25.634.6000112.4
456G53.6Low44.4Very low58 Ų58114.1 Ų114.160%0.59872%0.718SS**THydrogen-bonded Turntrans97.44.3179.100000116P454 V458P454-G456 PolarHBondContact O-N 3.47Å; G456-V458 PolarHBondContact O-N 2.82Å
457T47.1Very low44.7Very low67 Ų67114.3 Ų114.341%0.41172%0.72SS.*  trans-75.9118.3173.4-52.70000111L453 P454L453-T457 HydrophobicContact CD1-CG2 4.36Å; P454-T457 PolarHBondContact O-OG1 3.17Å; P454-T457 VanDerWaalsContact O-OG1 3.06Å
458V49.9Very low45.2Very low121 Ų121113.2 Ų113.273%0.73372%0.724SS**  trans-111.4130.3175.9-178.60000110.2G456G456-V458 PolarHBondContact O-N 2.82Å
459L43.5Very low45.5Very low116 Ų116111.1 Ų111.161%0.60772%0.722SS**  trans-99.9125.1176-67.6170.6000110.3Y470L459-Y470 HydrophobicContact CD2-CD1 4.22Å
460A46.1Very low46.3Very low82 Ų82112.7 Ų112.768%0.67872%0.718SS**  trans-118.4132176.400000110.8
461P44.3Very low46.3Very low126 Ų126110.3 Ų110.382%0.81872%0.72SS**  trans-69.9140.7173.3-17.831.7000112.3
462A46.3Very low46.3Very low81 Ų81111.7 Ų111.767%0.66973%0.728SS**  trans-78.1138.3170.600000111.2G464A462-G464 PolarHBondContact O-N 2.9Å; A462-G464 VanDerWaalsContact O-N 3.1Å
463P42.9Very low46Very low142 Ų142110.6 Ų110.692%0.92272%0.721SS**SBendtrans-76.697.1176.4-1127.3000111.4
464G42.9Very low45.9Very low66 Ų66110 Ų11068%0.6872%0.724SS**SBendtrans178.4133.8174.700000113.2A462 G466A462-G464 PolarHBondContact O-N 2.9Å; A462-G464 VanDerWaalsContact O-N 3.1Å; G464-G466 PolarHBondContact O-N 3.2Å; G464-G466 VanDerWaalsContact O-N 3.17Å
465T47.7Very low45.9Very low159 Ų159108.9 Ų108.998%0.97572%0.722SS**SBendtrans-85.383.8-178.151.30000111.8
466G48.2Very low46.2Very low63 Ų63111.2 Ų111.265%0.64972%0.721SS**SBendtrans164.5106.6166.900000116.1G464G464-G466 PolarHBondContact O-N 3.2Å; G464-G466 VanDerWaalsContact O-N 3.17Å
467N41.4Very low45.9Very low170 Ų170117.4 Ų117.491%0.90973%0.728SS**  trans64.1154175.8-76-55000117.5
468V50Low46.1Very low130 Ų130118.7 Ų118.779%0.78874%0.735SS**  trans-91.9131-170.1-69.80000112.6
469G39.6Very low46Very low64 Ų64119.2 Ų119.266%0.6674%0.738SS**  trans-149123.7169.800000109.7
470Y52.3Low46.1Very low176 Ų176121.8 Ų121.869%0.6975%0.748SS**  trans-103.5133.2177.1-62.7-81.6000109.9L459L459-Y470 HydrophobicContact CD2-CD1 4.22Å
471A43.6Very low45.9Very low95 Ų95125.2 Ų125.279%0.78575%0.753SS**  trans-105.7125.1168.900000109.1
472V48.4Very low45.7Very low130 Ų130127.4 Ų127.479%0.78875%0.753SS**  trans-93.2120.6175-179.20000108.5
473L42.2Very low45Very low138 Ų138132.9 Ų132.972%0.72377%0.765SS**  trans-112.2139.5175.5-77.3167.3000110.3
474P44.7Very low44.3Very low99 Ų99131 Ų13164%0.64376%0.755SS**  trans-61.1136.9173.8-23.534.5000112.2Q476 Y477P474-Q476 PolarHBondContact O-N 3.45Å; P474-Y477 PolarHBondContact O-N 2.85Å
475A49Very low43.7Very low64 Ų64133.1 Ų133.153%0.52976%0.759SS.*G310 helixtrans-59.6-21-17200000115.1Y477 V478A475-Y477 PolarHBondContact O-N 3.46Å; A475-Y477 VanDerWaalsContact O-N 3.08Å; A475-V478 PolarHBondContact O-N 2.9Å
476Q46.8Very low42.9Very low188 Ų188136.2 Ų136.288%0.87976%0.755SS**G310 helixtrans-65.9-7.4-179.4-69.7-172.6-25.800114.9P474P474-Q476 PolarHBondContact O-N 3.45Å
477Y46.5Very low42Very low189 Ų189139 Ų13974%0.74176%0.758SS**G310 helixtrans-103.2-2.8178-119.1-91.5000115P474 A475P474-Y477 PolarHBondContact O-N 2.85Å; A475-Y477 PolarHBondContact O-N 3.46Å; A475-Y477 VanDerWaalsContact O-N 3.08Å
478V51.2Low41.6Very low93 Ų93136.3 Ų136.356%0.56475%0.753SS**SBendtrans-87.9-28.6-170.5-176.50000112.9A475 Q480A475-V478 PolarHBondContact O-N 2.9Å; V478-Q480 VanDerWaalsContact C-N 3.31Å; V478-Q480 PolarHBondContact O-N 3.45Å
479T49.1Very low40.6Very low132 Ų132137.8 Ų137.881%0.8176%0.755SS**THydrogen-bonded Turntrans-78-3.6-172.341.50000115.6
480Q44.3Very low40.1Very low171 Ų171139.3 Ų139.380%0.79976%0.762SS**THydrogen-bonded Turntrans-10511.1-175.9-147.8174.635.100114.6V478V478-Q480 VanDerWaalsContact C-N 3.31Å; V478-Q480 PolarHBondContact O-N 3.45Å
481L41.9Very low39.1Very low153 Ų153136.5 Ų136.580%0.80177%0.767SS**SBendtrans-128.517-176.7-73.8174.3000115.3
482Q40.8Very low38.4Very low172 Ų172140 Ų14080%0.80477%0.773SS**  trans-113.775.7173.7-77.9-164.5-12.700113.6
483Q30.8Very low37.9Very low196 Ų196139.1 Ų139.192%0.91677%0.773SS**  trans178.6132.5147.1-96.8147.986.600106.6
484S29.6Very low37.2Very low103 Ų103138.7 Ų138.772%0.7278%0.776SS**  cis-145.6157.419.250.20000114.2
485S30.2Very low36.5Very low110 Ų110142.5 Ų142.577%0.76978%0.783SS**  trans24.1116.3154.857.60000120.5
486Y29.9Very low35.6Very low225 Ų225145.6 Ų145.688%0.88280%0.795SS**  trans-122.1144.3155.7-157.2-91.2000109.5
487V30.2Very low34.8Very low120 Ų120139.9 Ų139.973%0.72779%0.787SS**  trans-108.6129.2-178.8177.30000109.9
488S32.3Very low33.9Very low115 Ų115137.2 Ų137.280%0.80479%0.79SS**  trans-85.3137.1177.6-580000111.8
489I28.2Very low33.1Very low160 Ų160138.9 Ų138.982%0.82181%0.806SS**  trans-126.8128.5164.1-62.5-178.4000108.1
490A29.5Very low32.2Very low97 Ų97136.1 Ų136.180%0.80280%0.803SS**PPolyproline II helixtrans-91.6151.7176.700000111.4
491S31.2Very low31.8Very low116 Ų116136 Ų13681%0.81181%0.807SS**PPolyproline II helixtrans-97.7124.6-179.5-510000111.8
492N29.1Very low31.4Very low169 Ų169137.4 Ų137.490%0.90481%0.809SS**PPolyproline II helixtrans-101.6151.1162.6-89.1-15.7000110
493S37.6Very low31Very low111 Ų111135.6 Ų135.678%0.77681%0.81SS**  trans-116121-171.1-53.50000113.2
494T28.7Very low31.2Very low130 Ų130134.9 Ų134.980%0.79881%0.807SS**  trans-160.5150.9157.91.80000114
495F28.9Very low31.2Very low178 Ų178135 Ų13578%0.78181%0.813SS**  trans60.7105.1163.6-80.4-88.9000122.3
496T30.6Very low31.2Very low130 Ų130140.9 Ų140.980%0.79882%0.819SS**  29.1133.9129.763.90000122
497G29.5Very low31.6Very low67 Ų67137.4 Ų137.469%0.69182%0.815SS**  trans161.384.1152.200000118.4
498T28.7Very low31.8Very low134 Ų134137.7 Ų137.782%0.82282%0.819SS**  trans45.6129.7149.554.30000122.9
499S33.8Very low31.8Very low128 Ų128141.1 Ų141.190%0.89582%0.82SS**  trans71.1110.8141.5-58.10000120.9
500G31.3Very low32.6Very low73 Ų73139.9 Ų139.975%0.75382%0.815SS**  trans-177.7112.7162.800000112.4
501I35.6Very low33Very low169 Ų169137.8 Ų137.887%0.86780%0.802SS**  trans-81.2127.3-176.1-61.6171.7000110.4
502Q33.2Very low33.2Very low183 Ų183139.8 Ų139.886%0.85580%0.803SS**  trans-102.7113.4170.2-70.1-169.9-100111.6
503T31.3Very low33.7Very low134 Ų134136.1 Ų136.182%0.82278%0.782SS**  trans-83.7121.7169.3-57.80000109.7
504Q35.8Very low33.9Very low181 Ų181136.1 Ų136.185%0.84678%0.779SS**  trans-72135.9179.7-65.4-177.2-0.700112.2R506Q504-R506 PolarHBondContact O-N 3.24Å; Q504-R506 VanDerWaalsContact O-N 3.1Å
505A29.5Very low34.9Very low104 Ų104136 Ų13686%0.8678%0.783SS**  trans-73.698.6174.100000110.9
506R30.2Very low35.6Very low234 Ų234135.8 Ų135.888%0.88379%0.785SS**  trans-76.5126.2178.2-170.1-176.6-174.6-157.13.8111Q504Q504-R506 PolarHBondContact O-N 3.24Å; Q504-R506 VanDerWaalsContact O-N 3.1Å
507L39Very low36.3Very low153 Ų153135.8 Ų135.880%0.80179%0.791SS**  trans-59.2136.3172.3-66170.4000111.1F509L507-F509 PolarHBondContact O-N 2.98Å
508P33.9Very low36.7Very low126 Ų126136.3 Ų136.382%0.81879%0.788SS**  trans-75.487.7-179.230.2-34.7000111.7
509F31.3Very low37.6Very low187 Ų187135 Ų13582%0.8279%0.785SS**  trans-67.5131.2173.8-151.5-95.9000110.7L507 G511L507-F509 PolarHBondContact O-N 2.98Å; F509-G511 PolarHBondContact O-N 3.09Å; F509-G511 VanDerWaalsContact O-N 3.15Å
510N46.1Very low38.6Very low134 Ų134134.6 Ų134.672%0.71776%0.764SS**  trans-85.696.7-160.8-163.8-0.5000114.2
511G36.6Very low39.8Very low52 Ų52137.8 Ų137.854%0.53677%0.771SS.*  trans153.1134.7175.400000108.9F509F509-G511 PolarHBondContact O-N 3.09Å; F509-G511 VanDerWaalsContact O-N 3.15Å
512I37.4Very low41.7Very low159 Ų159136.5 Ų136.582%0.81576%0.755SS**  cis-127161.329.2-53.5100.3000110.5
513I38.6Very low44.4Very low92 Ų92136.9 Ų136.947%0.47275%0.754SS.*  trans-115121.7162-77.3-168000109
514P42.8Very low47.4Very low110 Ų110133.2 Ų133.271%0.71473%0.733SS**  trans-65.3154.1161.4-17.232000111E516P514-E516 PolarHBondContact O-N 3.39Å
515S48.9Very low50.3Low127 Ų127124.9 Ų124.989%0.88869%0.694SS**SBendtrans-76.484.6-171.655.50000113.9
516E42.5Very low53.5Low174 Ų174125.1 Ų125.181%0.81368%0.681SS**SBendtrans-121.4155.7154.2-76-167.512400110.5P514 A518P514-E516 PolarHBondContact O-N 3.39Å; E516-A518 PolarHBondContact O-N 3.43Å
517S45.8Very low56.8Low131 Ų131114.8 Ų114.892%0.91664%0.644SS**  trans-78.449.9-167.551.10000114.4S519S517-S519 PolarHBondContact O-N 3.2Å
518A38.1Very low59.5Low77 Ų77111.5 Ų111.564%0.63663%0.631SS**  trans-80.596.1167.700000109.8E516 R520E516-A518 PolarHBondContact O-N 3.43Å; A518-R520 PolarHBondContact O-N 3.23Å
519S47.4Very low62.5Low108 Ų108114.6 Ų114.676%0.75563%0.631SS**  trans-67.388.9179.9570000111.7S517S517-S519 PolarHBondContact O-N 3.2Å
520R55.4Low65.6Low119 Ų119106.1 Ų106.145%0.44960%0.595SS.*  trans-52.4130.3161.5-55.1-167.6-155.6-156.86.3107.5A518 R522A518-R520 PolarHBondContact O-N 3.23Å; R520-R522 PolarHBondContact O-N 2.9Å
521P56.5Low68.1Low139 Ų139102.8 Ų102.890%0.90358%0.577SS**  trans-52.6105.9179.2-29.536.4000111.4
522R76.2Confident71Confident143 Ų143100.3 Ų100.354%0.5455%0.552SS.*PPolyproline II helixtrans-76.8154176.2-61.7-55.2-159.3-165.81.3108.6R520 E544R520-R522 PolarHBondContact O-N 2.9Å; R522-E544 IonicContact CZ-OE1 2.79Å; R522-E544 IonicContact CZ-OE2 3.14Å; R522-E544 IonicContact NE-OE1 2.71Å; R522-E544 PolarHBondContact NE-OE1 3.11Å; R522-E544 IonicContact NE-OE2 2.75Å; R522-E544 PolarHBondContact NE-OE2 3.31Å; R522-E544 IonicContact NH2-OE1 3.66Å; R522-E544 PolarHBondContact NH2-OE1 3.08Å; R522-E544 IonicContact NH2-OE2 3.24Å
523K88.7Confident73.9Confident191 Ų19193.8 Ų93.883%0.8352%0.518SS*.PPolyproline II helixtrans-69126.4167.5-68.4-176.9178.9179.10108.1C525K523-C525 PolarHBondContact O-N 2.96Å
524P94.9Very high76.6Confident57 Ų5794.2 Ų94.237%0.3752%0.517SS..PPolyproline II helixtrans-65.1134.9176.426.9-34.1000109.8N526 N548P524-N526 PolarHBondContact O-ND2 3.33Å; P524-N526 VanDerWaalsContact O-ND2 3.16Å; P524-N548 WeakPolarHBondContact CB-O 3.32Å
525C97Very high79.1Confident6 Ų692.7 Ų92.74%0.04150%0.502CS..PPolyproline II helixtrans-77.8148.4175.477.60000110.9K523 C537 C549 N550 C551K523-C525 PolarHBondContact O-N 2.96Å; C525-C537 VanDerWaalsContact SG-SG 3.67Å; C525-C549 PolarHBondContact N-SG 2.93Å; C525-C549 VanDerWaalsContact N-SG 3.41Å; C525-N550 CarbonylContact O-C 3.56Å; C525-N550 WeakPolarHBondContact O-CA 3.33Å; C525-N550 PolarHBondContact O-N 3.31Å; C525-C551 PolarHBondContact O-N 2.82Å
526N97Very high81.3Confident108 Ų10896.1 Ų96.158%0.57850%0.497SS*.  trans-11640.1-176.3-55.9-91.5000110.1P524 N550P524-N526 PolarHBondContact O-ND2 3.33Å; P524-N526 VanDerWaalsContact O-ND2 3.16Å; N526-N550 VanDerWaalsContact OD1-CB 3.25Å; N526-N550 WeakPolarHBondContact OD1-CB 3.25Å; N526-N550 PolarHBondContact OD1-ND2 3.25Å
527C98Very high83.9Confident17 Ų1787.9 Ų87.912%0.11546%0.458CS..  trans-77.3134-170.4-74.30000112.5S530 C537 C551 T552C527-S530 WeakPolarHBondContact CB-OG 3.3Å; C527-C537 VanDerWaalsContact SG-CB 3.57Å; C527-C551 HydrophobicContact CB-CB 3.93Å; C527-C551 CarbonylContact O-C 3.45Å; C527-C551 WeakPolarHBondContact O-CA 3.33Å; C527-C551 WeakPolarHBondContact O-CB 3.41Å; C527-T552 PolarHBondContact O-N 2.83Å
528T97.3Very high86.2Confident85 Ų8587 Ų8752%0.52144%0.443SS..SBendtrans-123.8-31.9179.657.20000114.8T552T528-T552 WeakPolarHBondContact CA-OG1 3.36Å
529K96.8Very high89Confident190 Ų19083.9 Ų83.983%0.82642%0.417SS*.SBendtrans-1110-176.1-61.8-175.1-179.3-177.80114.7
530S95.9Very high91.3Very high10 Ų1078.8 Ų78.87%0.0738%0.381CS..SBendtrans-98.1-13.6-17959.30000114C527 C532 L533C527-S530 WeakPolarHBondContact CB-OG 3.3Å; S530-C532 PolarHBondContact O-N 2.74Å; S530-C532 VanDerWaalsContact O-N 3.1Å; S530-C532 PolarHBondContact OG-N 3.27Å; S530-L533 PolarHBondContact O-N 2.88Å
531L97.5Very high93.2Very high64 Ų6474.2 Ų74.234%0.33537%0.369SS..THydrogen-bonded Turntrans52.317.9-163.2-50.5178000113.2L533 N553 Y555L531-L533 HydrophobicContact CB-CG 4.45Å; L531-L533 PolarHBondContact O-N 3.5Å; L531-L533 VanDerWaalsContact O-N 3.16Å; L531-N553 WeakPolarHBondContact CA-O 3.43Å; L531-N553 HydrophobicContact CD2-CB 3.65Å; L531-N553 VanDerWaalsContact CD2-O 3.31Å; L531-N553 WeakPolarHBondContact CD2-O 3.21Å; L531-Y555 HydrophobicContact CB-CG 4.46Å; L531-Y555 HydrophobicContact CD1-CD2 4.24Å; L531-Y555 HydrophobicContact CD1-CE2 4.34Å; L531-Y555 PolarHBondContact O-N 2.74Å
532C98.3Very high94.9Very high0 Ų072.8 Ų72.80%035%0.354CS..THydrogen-bonded Turntrans57.411.8-164.5-57.10000115.2S530 K534 C537 F540 C546 C551 C554 N556S530-C532 PolarHBondContact O-N 2.74Å; S530-C532 VanDerWaalsContact O-N 3.1Å; S530-C532 PolarHBondContact OG-N 3.27Å; C532-K534 PolarHBondContact O-N 3.16Å; C532-C537 HydrophobicContact CB-CB 4.29Å; C532-F540 WeakPolarHBondContact O-CB 3.38Å; C532-F540 VanDerWaalsContact O-CD2 3.23Å; C532-F540 WeakPolarHBondContact O-CD2 3.41Å; C532-F540 WeakPolarHBondContact O-CG 3.47Å; C532-C546 VanDerWaalsContact SG-SG 3.7Å; C532-C551 VanDerWaalsContact SG-CB 3.51Å; C532-C554 VanDerWaalsContact SG-SG 3.64Å; C532-N556 HydrophobicContact CB-CB 3.43Å; C532-N556 VanDerWaalsContact CB-CB 3.43Å
533L97.5Very high95.8Very high22 Ų2267.6 Ų67.612%0.11535%0.345CS..  trans-97.827.9-178.8-66.5-171.4000114.1S530 L531 F540 Y555 E563 R564 A567S530-L533 PolarHBondContact O-N 2.88Å; L531-L533 HydrophobicContact CB-CG 4.45Å; L531-L533 PolarHBondContact O-N 3.5Å; L531-L533 VanDerWaalsContact O-N 3.16Å; L533-F540 HydrophobicContact CD2-CD2 4.37Å; L533-F540 HydrophobicContact CD2-CE2 4.08Å; L533-Y555 HydrophobicContact CD1-CD2 4.09Å; L533-Y555 HydrophobicContact CD1-CG 4.41Å; L533-Y555 WeakPolarHBondContact CD2-O 3.33Å; L533-E563 HydrophobicContact CD1-CB 3.83Å; L533-R564 HydrophobicContact CD2-CB 3.93Å; L533-R564 HydrophobicContact CD2-CG 4.1Å; L533-A567 HydrophobicContact CB-CB 3.82Å; L533-A567 HydrophobicContact CD1-CB 4.32Å; L533-A567 HydrophobicContact CD2-CB 4.25Å; L533-A567 HydrophobicContact CG-CB 4.36Å
534K96.8Very high96.1Very high101 Ų10161.9 Ų61.944%0.43932%0.321SS..SBendtrans-146.9150.6-176.6-58.7178-172.8167.50109.3C532 Y536 C537C532-K534 PolarHBondContact O-N 3.16Å; K534-Y536 HydrophobicContact CB-CD2 3.71Å; K534-Y536 HydrophobicContact CB-CE2 4.31Å; K534-Y536 HydrophobicContact CD-CD2 4.07Å; K534-Y536 HydrophobicContact CD-CE2 4.15Å; K534-Y536 PolarHBondContact O-N 3.1Å; K534-C537 WeakPolarHBondContact O-CB 3.24Å; K534-C537 PolarHBondContact O-N 2.93Å
535L95.1Very high96.2Very high78 Ų7863 Ų6341%0.40832%0.321SS..THydrogen-bonded Turntrans-62.63.4178.1-56.4175.8000115.2C537 F540 A541 A578 F579L535-C537 VanDerWaalsContact C-N 3.29Å; L535-F540 HydrophobicContact CD2-CD1 4.17Å; L535-F540 HydrophobicContact CD2-CE1 4.27Å; L535-A541 HydrophobicContact CD2-CB 4.1Å; L535-A578 HydrophobicContact CD1-CB 4.25Å; L535-F579 HydrophobicContact CD2-CD1 4.35Å; L535-F579 HydrophobicContact CD2-CE1 3.81Å; L535-F579 HydrophobicContact CD2-CZ 4.25Å
536Y94.8Very high96.2Very high199 Ų19963.8 Ų63.878%0.7833%0.326SS*.THydrogen-bonded Turntrans-78.8-10.6164.8-51-65.8000113.1K534K534-Y536 HydrophobicContact CB-CD2 3.71Å; K534-Y536 HydrophobicContact CB-CE2 4.31Å; K534-Y536 HydrophobicContact CD-CD2 4.07Å; K534-Y536 HydrophobicContact CD-CE2 4.15Å; K534-Y536 PolarHBondContact O-N 3.1Å
537C97.3Very high96.2Very high0 Ų064.3 Ų64.30%033%0.328CS..SBendtrans-101.6121172.2174.30000108.6C525 C527 C532 K534 L535 C539 F540 A541C525-C537 VanDerWaalsContact SG-SG 3.67Å; C527-C537 VanDerWaalsContact SG-CB 3.57Å; C532-C537 HydrophobicContact CB-CB 4.29Å; K534-C537 WeakPolarHBondContact O-CB 3.24Å; K534-C537 PolarHBondContact O-N 2.93Å; L535-C537 VanDerWaalsContact C-N 3.29Å; C537-C539 VanDerWaalsContact C-N 3.33Å; C537-C539 PolarHBondContact O-N 2.89Å; C537-F540 HydrophobicContact CB-CB 4.13Å; C537-F540 PolarHBondContact O-N 3.47Å; C537-A541 WeakPolarHBondContact O-CB 3.31Å; C537-A541 PolarHBondContact O-N 3.37Å
538D93.8Very high96Very high112 Ų11270.3 Ų70.360%0.59936%0.359SS*.Hα-helixtrans-64.3-35.6-176.7-58.1-56.7000112.7A541 N542D538-A541 PolarHBondContact O-N 2.99Å; D538-N542 PolarHBondContact O-N 3.21Å; D538-N542 PolarHBondContact O-ND2 3.2Å
539C96.1Very high96Very high12 Ų1267.8 Ų67.88%0.08135%0.345CS..Hα-helixtrans-58-54.6175.9-54.10000110.4C537 A541 N542 G543 E544 C546C537-C539 VanDerWaalsContact C-N 3.33Å; C537-C539 PolarHBondContact O-N 2.89Å; C539-A541 PolarHBondContact O-N 3.3Å; C539-N542 PolarHBondContact O-N 3.04Å; C539-N542 VanDerWaalsContact O-N 3.15Å; C539-G543 PolarHBondContact O-N 2.88Å; C539-E544 CarbonylContact C-O 2.97Å; C539-E544 VanDerWaalsContact C-O 3.24Å; C539-E544 PolarHBondContact O-N 3.21Å; C539-E544 VanDerWaalsContact O-O 3.06Å; C539-C546 VanDerWaalsContact CB-SG 3.58Å
540F96.8Very high96Very high1 Ų163.5 Ų63.50%0.00433%0.331CS..Hα-helixtrans-63.7-39.1178-175.8-92.1000112.6C532 L533 L535 C537 N542 G543 R564 A567 I568 F579C532-F540 WeakPolarHBondContact O-CB 3.38Å; C532-F540 VanDerWaalsContact O-CD2 3.23Å; C532-F540 WeakPolarHBondContact O-CD2 3.41Å; C532-F540 WeakPolarHBondContact O-CG 3.47Å; L533-F540 HydrophobicContact CD2-CD2 4.37Å; L533-F540 HydrophobicContact CD2-CE2 4.08Å; L535-F540 HydrophobicContact CD2-CD1 4.17Å; L535-F540 HydrophobicContact CD2-CE1 4.27Å; C537-F540 HydrophobicContact CB-CB 4.13Å; C537-F540 PolarHBondContact O-N 3.47Å; F540-N542 PolarHBondContact O-N 3.26Å; F540-G543 WeakPolarHBondContact O-CA 3.44Å; F540-G543 PolarHBondContact O-N 3.42Å; F540-R564 HydrophobicContact CE2-CG 4.39Å; F540-A567 HydrophobicContact CE2-CB 4.26Å; F540-A567 HydrophobicContact CZ-CB 3.94Å; F540-I568 HydrophobicContact CE2-CG1 3.83Å; F540-I568 HydrophobicContact CZ-CG1 3.92Å; F540-F579 HydrophobicContact CD1-CE1 4.08Å; F540-F579 HydrophobicContact CD1-CZ 4.45Å; F540-F579 AromaticContact CE1-CE1 3.82Å; F540-F579 HydrophobicContact CE1-CE1 3.82Å; F540-F579 AromaticContact CE1-CZ 3.74Å; F540-F579 HydrophobicContact CE1-CZ 3.74Å; F540-F579 HydrophobicContact CZ-CE1 4.28Å; F540-F579 AromaticContact CZ-CZ 3.96Å; F540-F579 HydrophobicContact CZ-CZ 3.96Å; F540-F579 VanDerWaalsContact O-CE1 3.27Å; F540-F579 WeakPolarHBondContact O-CE1 3.25Å
541A94.8Very high96.1Very high24 Ų2464.1 Ų64.120%0.19834%0.335CS..Hα-helixtrans-64-26.617600000113.4L535 C537 D538 C539 G543L535-A541 HydrophobicContact CD2-CB 4.1Å; C537-A541 WeakPolarHBondContact O-CB 3.31Å; C537-A541 PolarHBondContact O-N 3.37Å; D538-A541 PolarHBondContact O-N 2.99Å; C539-A541 PolarHBondContact O-N 3.3Å; A541-G543 VanDerWaalsContact C-N 3.35Å
542N93.2Very high96.1Very high108 Ų10864.6 Ų64.658%0.57834%0.34SS*.THydrogen-bonded Turntrans-86.1-2.7170.7-70.5-63.8000113.3D538 C539 F540 E544D538-N542 PolarHBondContact O-N 3.21Å; D538-N542 PolarHBondContact O-ND2 3.2Å; C539-N542 PolarHBondContact O-N 3.04Å; C539-N542 VanDerWaalsContact O-N 3.15Å; F540-N542 PolarHBondContact O-N 3.26Å; N542-E544 HydrophobicContact CB-CG 4.2Å; N542-E544 PolarHBondContact O-N 2.97Å
543G93.9Very high96Very high34 Ų3470.3 Ų70.335%0.35137%0.371SS..THydrogen-bonded Turntrans76.3-1-172.900000114.7C539 F540 A541 R564C539-G543 PolarHBondContact O-N 2.88Å; F540-G543 WeakPolarHBondContact O-CA 3.44Å; F540-G543 PolarHBondContact O-N 3.42Å; A541-G543 VanDerWaalsContact C-N 3.35Å; G543-R564 PolarHBondContact O-NH2 2.84Å
544E94.8Very high96Very high72 Ų7270.4 Ų70.434%0.33637%0.373SS..  trans-80145-178.9-62.6-178.817500110.8R522 C539 N542 N556R522-E544 IonicContact CZ-OE1 2.79Å; R522-E544 IonicContact CZ-OE2 3.14Å; R522-E544 IonicContact NE-OE1 2.71Å; R522-E544 PolarHBondContact NE-OE1 3.11Å; R522-E544 IonicContact NE-OE2 2.75Å; R522-E544 PolarHBondContact NE-OE2 3.31Å; R522-E544 IonicContact NH2-OE1 3.66Å; R522-E544 PolarHBondContact NH2-OE1 3.08Å; R522-E544 IonicContact NH2-OE2 3.24Å; C539-E544 CarbonylContact C-O 2.97Å; C539-E544 VanDerWaalsContact C-O 3.24Å; C539-E544 PolarHBondContact O-N 3.21Å; C539-E544 VanDerWaalsContact O-O 3.06Å; N542-E544 HydrophobicContact CB-CG 4.2Å; N542-E544 PolarHBondContact O-N 2.97Å; E544-N556 PolarHBondContact O-ND2 2.82Å
545F97.1Very high96.1Very high81 Ų8169.6 Ų69.636%0.35537%0.368SS..  trans-65.2153.6166.9-68.4-76.9000110.6N547 L558 R564F545-N547 PolarHBondContact O-N 3.44Å; F545-L558 HydrophobicContact CE1-CD2 3.98Å; F545-L558 HydrophobicContact CE1-CG 4.34Å; F545-L558 HydrophobicContact CE2-CD2 3.99Å; F545-L558 HydrophobicContact CZ-CD2 3.48Å; F545-L558 VanDerWaalsContact CZ-CD2 3.48Å; F545-L558 HydrophobicContact CZ-CG 4.24Å; F545-R564 VanDerWaalsContact CE1-NE 3.3Å
546C97.4Very high96.2Very high22 Ų2265.9 Ų65.915%0.14935%0.349CS..  trans-74.4112.6172.4-73.60000109.9C532 C539 C549 C554 N556C532-C546 VanDerWaalsContact SG-SG 3.7Å; C539-C546 VanDerWaalsContact CB-SG 3.58Å; C546-C549 HydrophobicContact CB-CB 4.23Å; C546-C554 VanDerWaalsContact CB-SG 3.57Å; C546-N556 HydrophobicContact CB-CB 4.5Å; C546-N556 PolarHBondContact N-ND2 3.27Å; C546-N556 PolarHBondContact N-O 2.9Å; C546-N556 PolarHBondContact SG-ND2 2.95Å
547N96.1Very high96.4Very high119 Ų11958.1 Ų58.164%0.63632%0.321SS*.  trans-116.2138174.1-166.710.3000110.4F545 C549F545-N547 PolarHBondContact O-N 3.44Å; N547-C549 PolarHBondContact O-N 3.14Å; N547-C549 VanDerWaalsContact O-N 3.09Å; N547-C549 PolarHBondContact O-SG 2.92Å
548N95Very high96.3Very high143 Ų14364.1 Ų64.177%0.76535%0.352SS*.SBendtrans41.841.9-175.4-60.1107.8000114.5P524P524-N548 WeakPolarHBondContact CB-O 3.32Å
549C97Very high96.5Very high31 Ų3165.5 Ų65.521%0.20936%0.355CS..  trans-98.2153.2-175.3-73.90000113.6C525 C546 N547 C551C525-C549 PolarHBondContact N-SG 2.93Å; C525-C549 VanDerWaalsContact N-SG 3.41Å; C546-C549 HydrophobicContact CB-CB 4.23Å; N547-C549 PolarHBondContact O-N 3.14Å; N547-C549 VanDerWaalsContact O-N 3.09Å; N547-C549 PolarHBondContact O-SG 2.92Å; C549-C551 VanDerWaalsContact CB-SG 3.52Å; C549-C551 PolarHBondContact O-N 2.85Å
550N97.1Very high96.5Very high101 Ų10167.3 Ų67.354%0.5436%0.362SS..  trans-89.126.4179.2-56.1-16.8000112.4C525 N526C525-N550 CarbonylContact O-C 3.56Å; C525-N550 WeakPolarHBondContact O-CA 3.33Å; C525-N550 PolarHBondContact O-N 3.31Å; N526-N550 VanDerWaalsContact OD1-CB 3.25Å; N526-N550 WeakPolarHBondContact OD1-CB 3.25Å; N526-N550 PolarHBondContact OD1-ND2 3.25Å
551C97.6Very high96.5Very high23 Ų2369.9 Ų69.916%0.15537%0.374CS..  trans-91.9133.1-17351.30000112.1C525 C527 C532 C549 C554C525-C551 PolarHBondContact O-N 2.82Å; C527-C551 HydrophobicContact CB-CB 3.93Å; C527-C551 CarbonylContact O-C 3.45Å; C527-C551 WeakPolarHBondContact O-CA 3.33Å; C527-C551 WeakPolarHBondContact O-CB 3.41Å; C532-C551 VanDerWaalsContact SG-CB 3.51Å; C549-C551 VanDerWaalsContact CB-SG 3.52Å; C549-C551 PolarHBondContact O-N 2.85Å; C551-C554 VanDerWaalsContact SG-CB 3.6Å; C551-C554 VanDerWaalsContact SG-SG 3.69Å
552T97.7Very high96.7Very high73 Ų7375.1 Ų75.145%0.44840%0.399SS..THydrogen-bonded Turntrans-87.4146.7175.163.50000111C527 T528 C554C527-T552 PolarHBondContact O-N 2.83Å; T528-T552 WeakPolarHBondContact CA-OG1 3.36Å; T552-C554 VanDerWaalsContact C-N 3.31Å; T552-C554 PolarHBondContact O-N 2.89Å
553N96.6Very high96.9Very high120 Ų12074 Ų7464%0.64239%0.39SS*.THydrogen-bonded Turntrans47.749.6-177.8-60-1.9000113L531 Y555L531-N553 WeakPolarHBondContact CA-O 3.43Å; L531-N553 HydrophobicContact CD2-CB 3.65Å; L531-N553 VanDerWaalsContact CD2-O 3.31Å; L531-N553 WeakPolarHBondContact CD2-O 3.21Å; N553-Y555 PolarHBondContact O-N 3.34Å
554C98.1Very high97.1Very high24 Ų2473.2 Ų73.216%0.16238%0.376CS..  trans-73.6120-178.5-171.30000111.8C532 C546 C551 T552 N556 N557C532-C554 VanDerWaalsContact SG-SG 3.64Å; C546-C554 VanDerWaalsContact CB-SG 3.57Å; C551-C554 VanDerWaalsContact SG-CB 3.6Å; C551-C554 VanDerWaalsContact SG-SG 3.69Å; T552-C554 VanDerWaalsContact C-N 3.31Å; T552-C554 PolarHBondContact O-N 2.89Å; C554-N556 PolarHBondContact SG-N 3.26Å; C554-N557 PolarHBondContact O-ND2 2.91Å
555Y98.2Very high97.2Very high84 Ų8474.4 Ų74.433%0.32938%0.382SS..  trans-107.410.6170.2-72.29000111.7L531 L533 N553 N557 H560 E563L531-Y555 HydrophobicContact CB-CG 4.46Å; L531-Y555 HydrophobicContact CD1-CD2 4.24Å; L531-Y555 HydrophobicContact CD1-CE2 4.34Å; L531-Y555 PolarHBondContact O-N 2.74Å; L533-Y555 HydrophobicContact CD1-CD2 4.09Å; L533-Y555 HydrophobicContact CD1-CG 4.41Å; L533-Y555 WeakPolarHBondContact CD2-O 3.33Å; N553-Y555 PolarHBondContact O-N 3.34Å; Y555-N557 VanDerWaalsContact C-N 3.26Å; Y555-N557 PolarHBondContact O-N 3.33Å; Y555-H560 HydrophobicContact CD1-CB 4.32Å; Y555-H560 AromaticContact CD1-CD2 3.41Å; Y555-H560 VanDerWaalsContact CD1-CD2 3.41Å; Y555-H560 WeakPolarHBondContact CD1-CD2 3.3Å; Y555-H560 AromaticContact CD1-CE1 3.67Å; Y555-H560 AromaticContact CD1-CG 3.57Å; Y555-H560 AromaticContact CD1-ND1 3.72Å; Y555-H560 AromaticContact CD1-NE2 3.47Å; Y555-H560 WeakPolarHBondContact CD1-NE2 3.49Å; Y555-H560 HydrophobicContact CD2-CB 4.3Å; Y555-H560 AromaticContact CD2-CD2 3.94Å; Y555-H560 AromaticContact CE1-CD2 3.44Å; Y555-H560 VanDerWaalsContact CE1-CD2 3.44Å; Y555-H560 WeakPolarHBondContact CE1-CD2 3.41Å; Y555-H560 AromaticContact CE1-CE1 3.83Å; Y555-H560 AromaticContact CE1-NE2 3.24Å; Y555-H560 WeakPolarHBondContact CE1-NE2 3.32Å; Y555-H560 AromaticContact CE2-CD2 3.96Å; Y555-H560 HydrophobicContact CG-CB 3.88Å; Y555-H560 AromaticContact CG-CD2 3.67Å; Y555-H560 AromaticContact CG-CG 3.63Å; Y555-H560 AromaticContact CZ-CD2 3.71Å; Y555-H560 AromaticContact CZ-NE2 3.83Å; Y555-E563 HydrophobicContact CD2-CB 4.12Å; Y555-E563 HydrophobicContact CD2-CG 4.05Å; Y555-E563 HydrophobicContact CE2-CG 4.27Å
556N97.8Very high97.3Very high0 Ų078.5 Ų78.50%040%0.4CS..SBendtrans-92.258.4173.1-174.439.4000110.9C532 E544 C546 C554 R564C532-N556 HydrophobicContact CB-CB 3.43Å; C532-N556 VanDerWaalsContact CB-CB 3.43Å; E544-N556 PolarHBondContact O-ND2 2.82Å; C546-N556 HydrophobicContact CB-CB 4.5Å; C546-N556 PolarHBondContact N-ND2 3.27Å; C546-N556 PolarHBondContact N-O 2.9Å; C546-N556 PolarHBondContact SG-ND2 2.95Å; C554-N556 PolarHBondContact SG-N 3.26Å; N556-R564 WeakPolarHBondContact OD1-CD 3.19Å; N556-R564 PolarHBondContact OD1-NE 3.09Å
557N97Very high97.3Very high36 Ų3678.2 Ų78.219%0.19340%0.399CS..SBendtrans-146.6177.5-175.354.78.3000109.5C554 Y555 E559 H560C554-N557 PolarHBondContact O-ND2 2.91Å; Y555-N557 VanDerWaalsContact C-N 3.26Å; Y555-N557 PolarHBondContact O-N 3.33Å; N557-E559 VanDerWaalsContact C-N 3.32Å; N557-E559 WeakPolarHBondContact CB-OE2 3.39Å; N557-E559 PolarHBondContact ND2-OE2 3.14Å; N557-H560 PolarHBondContact OD1-ND1 3.23Å
558L96.3Very high97.3Very high126 Ų12674 Ų7466%0.6638%0.376SS*.SBendtrans-75.2-25.2-174.1-70.9169.6000112.4F545 H560F545-L558 HydrophobicContact CE1-CD2 3.98Å; F545-L558 HydrophobicContact CE1-CG 4.34Å; F545-L558 HydrophobicContact CE2-CD2 3.99Å; F545-L558 HydrophobicContact CZ-CD2 3.48Å; F545-L558 VanDerWaalsContact CZ-CD2 3.48Å; F545-L558 HydrophobicContact CZ-CG 4.24Å; L558-H560 VanDerWaalsContact C-N 3.31Å; L558-H560 PolarHBondContact O-N 3.09Å
559E97.4Very high97.4Very high142 Ų14274.7 Ų74.766%0.66437%0.372SS*.THydrogen-bonded Turntrans-68.5-30.7-177.8-59.472-156.900112.1N557N557-E559 VanDerWaalsContact C-N 3.32Å; N557-E559 WeakPolarHBondContact CB-OE2 3.39Å; N557-E559 PolarHBondContact ND2-OE2 3.14Å
560H97.2Very high97.4Very high50 Ų5075 Ų7523%0.23138%0.377CS..THydrogen-bonded Turntrans-113.133.1-178.7-53.586.8000112Y555 N557 L558 N562 E563 R564Y555-H560 HydrophobicContact CD1-CB 4.32Å; Y555-H560 AromaticContact CD1-CD2 3.41Å; Y555-H560 VanDerWaalsContact CD1-CD2 3.41Å; Y555-H560 WeakPolarHBondContact CD1-CD2 3.3Å; Y555-H560 AromaticContact CD1-CE1 3.67Å; Y555-H560 AromaticContact CD1-CG 3.57Å; Y555-H560 AromaticContact CD1-ND1 3.72Å; Y555-H560 AromaticContact CD1-NE2 3.47Å; Y555-H560 WeakPolarHBondContact CD1-NE2 3.49Å; Y555-H560 HydrophobicContact CD2-CB 4.3Å; Y555-H560 AromaticContact CD2-CD2 3.94Å; Y555-H560 AromaticContact CE1-CD2 3.44Å; Y555-H560 VanDerWaalsContact CE1-CD2 3.44Å; Y555-H560 WeakPolarHBondContact CE1-CD2 3.41Å; Y555-H560 AromaticContact CE1-CE1 3.83Å; Y555-H560 AromaticContact CE1-NE2 3.24Å; Y555-H560 WeakPolarHBondContact CE1-NE2 3.32Å; Y555-H560 AromaticContact CE2-CD2 3.96Å; Y555-H560 HydrophobicContact CG-CB 3.88Å; Y555-H560 AromaticContact CG-CD2 3.67Å; Y555-H560 AromaticContact CG-CG 3.63Å; Y555-H560 AromaticContact CZ-CD2 3.71Å; Y555-H560 AromaticContact CZ-NE2 3.83Å; N557-H560 PolarHBondContact OD1-ND1 3.23Å; L558-H560 VanDerWaalsContact C-N 3.31Å; L558-H560 PolarHBondContact O-N 3.09Å; H560-N562 PolarHBondContact O-N 3.18Å; H560-N562 VanDerWaalsContact O-N 3.17Å; H560-E563 HydrophobicContact CB-CB 4.43Å; H560-E563 PolarHBondContact O-N 3.29Å; H560-R564 WeakPolarHBondContact O-CB 3.4Å; H560-R564 PolarHBondContact O-N 2.93Å
561E96.9Very high97.4Very high54 Ų5471 Ų7125%0.25236%0.356SS..Hα-helixtrans-60.9-26.8-175-178.162.2-175.200112.8R564 Q565E561-R564 IonicContact OE1-NH1 3.27Å; E561-R564 PolarHBondContact OE1-NH1 2.88Å; E561-R564 WeakPolarHBondContact OE2-CD 3.11Å; E561-R564 IonicContact OE2-CZ 2.69Å; E561-R564 IonicContact OE2-NE 3.72Å; E561-R564 IonicContact OE2-NH1 2.74Å; E561-R564 PolarHBondContact OE2-NH1 3.13Å; E561-Q565 HydrophobicContact CG-CG 4.18Å; E561-Q565 VanDerWaalsContact O-CB 3.3Å; E561-Q565 WeakPolarHBondContact O-CB 3.39Å; E561-Q565 WeakPolarHBondContact O-CG 3.08Å; E561-Q565 PolarHBondContact O-N 3.24Å; E561-Q565 WeakPolarHBondContact OE1-CG 3.42Å; E561-Q565 PolarHBondContact OE1-NE2 3.26Å
562N97.5Very high97.3Very high134 Ų13473.3 Ų73.372%0.71737%0.367SS*.Hα-helixtrans-66.9-49.7174.9-73-72.3000112.1H560 R564 Q565 K566H560-N562 PolarHBondContact O-N 3.18Å; H560-N562 VanDerWaalsContact O-N 3.17Å; N562-R564 VanDerWaalsContact C-N 3.28Å; N562-R564 PolarHBondContact O-N 3.04Å; N562-Q565 PolarHBondContact O-N 3.34Å; N562-K566 WeakPolarHBondContact O-CB 3.48Å; N562-K566 PolarHBondContact O-N 3.46Å
563E97.9Very high97.2Very high86 Ų8676.3 Ų76.340%0.40238%0.381SS..Hα-helixtrans-62.3-40.2175.5-67.861.5-140.400110.3L533 Y555 H560 K566 A567L533-E563 HydrophobicContact CD1-CB 3.83Å; Y555-E563 HydrophobicContact CD2-CB 4.12Å; Y555-E563 HydrophobicContact CD2-CG 4.05Å; Y555-E563 HydrophobicContact CE2-CG 4.27Å; H560-E563 HydrophobicContact CB-CB 4.43Å; H560-E563 PolarHBondContact O-N 3.29Å; E563-K566 PolarHBondContact O-N 2.67Å; E563-A567 WeakPolarHBondContact O-CB 3.34Å; E563-A567 PolarHBondContact O-N 3.33Å
564R98.1Very high97.2Very high16 Ų1680.4 Ų80.46%0.0639%0.387CS..Hα-helixtrans-64.6-48.5177.2-173.6174.9168.3-86.1-3.6112.4L533 F540 G543 F545 N556 H560 E561 N562 K566 A567 I568L533-R564 HydrophobicContact CD2-CB 3.93Å; L533-R564 HydrophobicContact CD2-CG 4.1Å; F540-R564 HydrophobicContact CE2-CG 4.39Å; G543-R564 PolarHBondContact O-NH2 2.84Å; F545-R564 VanDerWaalsContact CE1-NE 3.3Å; N556-R564 WeakPolarHBondContact OD1-CD 3.19Å; N556-R564 PolarHBondContact OD1-NE 3.09Å; H560-R564 WeakPolarHBondContact O-CB 3.4Å; H560-R564 PolarHBondContact O-N 2.93Å; E561-R564 IonicContact OE1-NH1 3.27Å; E561-R564 PolarHBondContact OE1-NH1 2.88Å; E561-R564 WeakPolarHBondContact OE2-CD 3.11Å; E561-R564 IonicContact OE2-CZ 2.69Å; E561-R564 IonicContact OE2-NE 3.72Å; E561-R564 IonicContact OE2-NH1 2.74Å; E561-R564 PolarHBondContact OE2-NH1 3.13Å; N562-R564 VanDerWaalsContact C-N 3.28Å; N562-R564 PolarHBondContact O-N 3.04Å; R564-K566 VanDerWaalsContact C-N 3.35Å; R564-K566 PolarHBondContact O-N 3Å; R564-A567 WeakPolarHBondContact O-CB 3.43Å; R564-A567 PolarHBondContact O-N 3.04Å; R564-A567 VanDerWaalsContact O-N 3.17Å; R564-I568 HydrophobicContact CG-CD1 3.98Å; R564-I568 VanDerWaalsContact O-CG1 3.3Å; R564-I568 WeakPolarHBondContact O-CG1 3.45Å; R564-I568 PolarHBondContact O-N 3.01Å
565Q97.8Very high96.9Very high97 Ų9781.9 Ų81.945%0.45339%0.393SS..Hα-helixtrans-63.3-40.1175.7-74.3-67.5-1300111.9E561 N562 A567 I568 K569E561-Q565 HydrophobicContact CG-CG 4.18Å; E561-Q565 VanDerWaalsContact O-CB 3.3Å; E561-Q565 WeakPolarHBondContact O-CB 3.39Å; E561-Q565 WeakPolarHBondContact O-CG 3.08Å; E561-Q565 PolarHBondContact O-N 3.24Å; E561-Q565 WeakPolarHBondContact OE1-CG 3.42Å; E561-Q565 PolarHBondContact OE1-NE2 3.26Å; N562-Q565 PolarHBondContact O-N 3.34Å; Q565-A567 VanDerWaalsContact C-N 3.31Å; Q565-A567 PolarHBondContact O-N 3.12Å; Q565-I568 PolarHBondContact O-N 3.15Å; Q565-K569 WeakPolarHBondContact O-CB 3.19Å; Q565-K569 PolarHBondContact O-N 2.88Å
566K97.9Very high96.6Very high168 Ų16882.5 Ų82.573%0.7341%0.408SS*.Hα-helixtrans-59.8-40.7172.8-172.9175.8-178.2176.80111.8N562 E563 R564 A570N562-K566 WeakPolarHBondContact O-CB 3.48Å; N562-K566 PolarHBondContact O-N 3.46Å; E563-K566 PolarHBondContact O-N 2.67Å; R564-K566 VanDerWaalsContact C-N 3.35Å; R564-K566 PolarHBondContact O-N 3Å; K566-A570 WeakPolarHBondContact O-CB 3.27Å; K566-A570 PolarHBondContact O-N 3.07Å
567A97.7Very high96.2Very high16 Ų1687.1 Ų87.113%0.13243%0.429CS..Hα-helixtrans-70.7-40.2176.100000113.3L533 F540 E563 R564 Q565 A570 C571L533-A567 HydrophobicContact CB-CB 3.82Å; L533-A567 HydrophobicContact CD1-CB 4.32Å; L533-A567 HydrophobicContact CD2-CB 4.25Å; L533-A567 HydrophobicContact CG-CB 4.36Å; F540-A567 HydrophobicContact CE2-CB 4.26Å; F540-A567 HydrophobicContact CZ-CB 3.94Å; E563-A567 WeakPolarHBondContact O-CB 3.34Å; E563-A567 PolarHBondContact O-N 3.33Å; R564-A567 WeakPolarHBondContact O-CB 3.43Å; R564-A567 PolarHBondContact O-N 3.04Å; R564-A567 VanDerWaalsContact O-N 3.17Å; Q565-A567 VanDerWaalsContact C-N 3.31Å; Q565-A567 PolarHBondContact O-N 3.12Å; A567-A570 PolarHBondContact O-N 3.37Å; A567-C571 PolarHBondContact O-N 3.39Å; A567-C571 PolarHBondContact O-SG 3.24Å
568I97.2Very high96Very high30 Ų3086 Ų8615%0.15443%0.425CS..Hα-helixtrans-61.1-49.9174.8-71.5165.9000109.9F540 R564 Q565 A570 C571 L572 F579F540-I568 HydrophobicContact CE2-CG1 3.83Å; F540-I568 HydrophobicContact CZ-CG1 3.92Å; R564-I568 HydrophobicContact CG-CD1 3.98Å; R564-I568 VanDerWaalsContact O-CG1 3.3Å; R564-I568 WeakPolarHBondContact O-CG1 3.45Å; R564-I568 PolarHBondContact O-N 3.01Å; Q565-I568 PolarHBondContact O-N 3.15Å; I568-A570 PolarHBondContact O-N 2.98Å; I568-C571 PolarHBondContact O-N 2.74Å; I568-C571 VanDerWaalsContact O-N 3.09Å; I568-L572 HydrophobicContact CG2-CD1 4.1Å; I568-L572 PolarHBondContact O-N 3.37Å; I568-F579 HydrophobicContact CB-CE2 4.36Å; I568-F579 HydrophobicContact CB-CZ 4.37Å; I568-F579 HydrophobicContact CG1-CZ 4.12Å; I568-F579 HydrophobicContact CG2-CD2 4.48Å; I568-F579 HydrophobicContact CG2-CE2 3.88Å; I568-F579 HydrophobicContact CG2-CZ 4.32Å
569K96.9Very high95.8Very high158 Ų15882.6 Ų82.669%0.68741%0.405SS*.Hα-helixtrans-56.5-48.9175.4-175.5175.8179.2177.90111.3Q565 C571 L572 D573Q565-K569 WeakPolarHBondContact O-CB 3.19Å; Q565-K569 PolarHBondContact O-N 2.88Å; K569-C571 PolarHBondContact O-N 3.41Å; K569-L572 PolarHBondContact O-N 3.45Å; K569-D573 VanDerWaalsContact O-CB 3.25Å; K569-D573 WeakPolarHBondContact O-CB 3.19Å; K569-D573 PolarHBondContact O-N 2.97Å
570A97.3Very high95.3Very high37 Ų3781.3 Ų81.331%0.30640%0.397SS..Hα-helixtrans-67.9-15.3178.900000114.6K566 A567 I568 R574K566-A570 WeakPolarHBondContact O-CB 3.27Å; K566-A570 PolarHBondContact O-N 3.07Å; A567-A570 PolarHBondContact O-N 3.37Å; I568-A570 PolarHBondContact O-N 2.98Å; A570-R574 WeakPolarHBondContact O-CD 3.48Å; A570-R574 WeakPolarHBondContact O-CG 3.49Å
571C96.3Very high94.7Very high16 Ų1684 Ų8411%0.10842%0.419CS..Hα-helixtrans-86.1-41.3170.1-70.10000112A567 I568 K569 R574 N575 A578 F579A567-C571 PolarHBondContact O-N 3.39Å; A567-C571 PolarHBondContact O-SG 3.24Å; I568-C571 PolarHBondContact O-N 2.74Å; I568-C571 VanDerWaalsContact O-N 3.09Å; K569-C571 PolarHBondContact O-N 3.41Å; C571-R574 PolarHBondContact O-N 2.95Å; C571-N575 PolarHBondContact O-N 3.26Å; C571-N575 VanDerWaalsContact O-N 3.14Å; C571-A578 HydrophobicContact CB-CB 4.37Å; C571-F579 HydrophobicContact CB-CE2 3.75Å; C571-F579 HydrophobicContact CB-CZ 3.74Å
572L95.4Very high94.1Very high72 Ų7287.2 Ų87.238%0.37743%0.432SS..Hα-helixtrans-66.1-40.1176-77.1169.5000112.6I568 K569 R574 N575 P576 F579I568-L572 HydrophobicContact CG2-CD1 4.1Å; I568-L572 PolarHBondContact O-N 3.37Å; K569-L572 PolarHBondContact O-N 3.45Å; L572-R574 VanDerWaalsContact C-N 3.25Å; L572-R574 PolarHBondContact O-N 3.18Å; L572-N575 WeakPolarHBondContact CA-O 3.23Å; L572-N575 CarbonylContact O-C 3.48Å; L572-N575 PolarHBondContact O-N 3.48Å; L572-N575 VanDerWaalsContact O-N 3.08Å; L572-P576 WeakPolarHBondContact O-CA 3.2Å; L572-P576 VanDerWaalsContact O-N 3.11Å; L572-F579 HydrophobicContact CD1-CD2 4.43Å; L572-F579 HydrophobicContact CD2-CD2 3.88Å; L572-F579 HydrophobicContact CD2-CE2 4.44Å; L572-F579 HydrophobicContact CG-CD2 3.87Å; L572-F579 HydrophobicContact CG-CE2 3.97Å
573D96.4Very high93.5Very high137 Ų13783 Ų8373%0.73341%0.409SS*.THydrogen-bonded Turntrans-56-38.3176.1-176.175.5000112.5K569K569-D573 VanDerWaalsContact O-CB 3.25Å; K569-D573 WeakPolarHBondContact O-CB 3.19Å; K569-D573 PolarHBondContact O-N 2.97Å
574R95.6Very high92.3Very high206 Ų20680.1 Ų80.178%0.77740%0.403SS*.THydrogen-bonded Turntrans-83.9-21176.8-63.4173.3-175.3154.81.8114A570 C571 L572A570-R574 WeakPolarHBondContact O-CD 3.48Å; A570-R574 WeakPolarHBondContact O-CG 3.49Å; C571-R574 PolarHBondContact O-N 2.95Å; L572-R574 VanDerWaalsContact C-N 3.25Å; L572-R574 PolarHBondContact O-N 3.18Å
575N91.8Very high90.7Very high54 Ų5489 Ų8929%0.28944%0.442SS..  trans-163.3105.6179174.521.9000109.6C571 L572 E577 A578C571-N575 PolarHBondContact O-N 3.26Å; C571-N575 VanDerWaalsContact O-N 3.14Å; L572-N575 WeakPolarHBondContact CA-O 3.23Å; L572-N575 CarbonylContact O-C 3.48Å; L572-N575 PolarHBondContact O-N 3.48Å; L572-N575 VanDerWaalsContact O-N 3.08Å; N575-E577 PolarHBondContact O-N 3.33Å; N575-E577 PolarHBondContact OD1-N 3.16Å; N575-E577 VanDerWaalsContact OD1-N 3.07Å; N575-A578 HydrophobicContact CB-CB 4.27Å; N575-A578 WeakPolarHBondContact ND2-CA 3.37Å; N575-A578 PolarHBondContact ND2-N 3.2Å; N575-A578 WeakPolarHBondContact O-CB 3.3Å; N575-A578 PolarHBondContact O-N 2.98Å
576P92.8Very high88.7Confident98 Ų9886.2 Ų86.264%0.63644%0.439SS*.THydrogen-bonded Turntrans-65.9-9.8-17927.4-35.5000113.3L572L572-P576 WeakPolarHBondContact O-CA 3.2Å; L572-P576 VanDerWaalsContact O-N 3.11Å
577E89.6Confident86.6Confident96 Ų9686.4 Ų86.445%0.44944%0.44SS..THydrogen-bonded Turntrans-99.99.1173.9-50.8-144.2123.500113.6N575 F579 K580N575-E577 PolarHBondContact O-N 3.33Å; N575-E577 PolarHBondContact OD1-N 3.16Å; N575-E577 VanDerWaalsContact OD1-N 3.07Å; E577-F579 PolarHBondContact O-N 2.91Å; E577-F579 VanDerWaalsContact O-N 3.12Å; E577-K580 HydrophobicContact CB-CB 4.37Å; E577-K580 HydrophobicContact CB-CD 4.01Å; E577-K580 HydrophobicContact CB-CG 4.33Å; E577-K580 HydrophobicContact CG-CD 3.94Å; E577-K580 PolarHBondContact O-N 2.96Å; E577-K580 WeakPolarHBondContact OE1-CD 3.12Å; E577-K580 WeakPolarHBondContact OE1-CE 3.44Å; E577-K580 IonicContact OE1-NZ 3.89Å; E577-K580 PolarHBondContact OE1-NZ 3.36Å
578A91.1Very high84.1Confident14 Ų1495.6 Ų95.612%0.11648%0.48CS..THydrogen-bonded Turntrans-53.8-35.1-173.900000114.9L535 C571 N575L535-A578 HydrophobicContact CD1-CB 4.25Å; C571-A578 HydrophobicContact CB-CB 4.37Å; N575-A578 HydrophobicContact CB-CB 4.27Å; N575-A578 WeakPolarHBondContact ND2-CA 3.37Å; N575-A578 PolarHBondContact ND2-N 3.2Å; N575-A578 WeakPolarHBondContact O-CB 3.3Å; N575-A578 PolarHBondContact O-N 2.98Å
579F91.9Very high82.3Confident54 Ų5498.4 Ų98.424%0.23752%0.516CS..THydrogen-bonded Turntrans-111.912.1-180-54.6-78.6000112.9L535 F540 I568 C571 L572 E577L535-F579 HydrophobicContact CD2-CD1 4.35Å; L535-F579 HydrophobicContact CD2-CE1 3.81Å; L535-F579 HydrophobicContact CD2-CZ 4.25Å; F540-F579 HydrophobicContact CD1-CE1 4.08Å; F540-F579 HydrophobicContact CD1-CZ 4.45Å; F540-F579 AromaticContact CE1-CE1 3.82Å; F540-F579 HydrophobicContact CE1-CE1 3.82Å; F540-F579 AromaticContact CE1-CZ 3.74Å; F540-F579 HydrophobicContact CE1-CZ 3.74Å; F540-F579 HydrophobicContact CZ-CE1 4.28Å; F540-F579 AromaticContact CZ-CZ 3.96Å; F540-F579 HydrophobicContact CZ-CZ 3.96Å; F540-F579 VanDerWaalsContact O-CE1 3.27Å; F540-F579 WeakPolarHBondContact O-CE1 3.25Å; I568-F579 HydrophobicContact CB-CE2 4.36Å; I568-F579 HydrophobicContact CB-CZ 4.37Å; I568-F579 HydrophobicContact CG1-CZ 4.12Å; I568-F579 HydrophobicContact CG2-CD2 4.48Å; I568-F579 HydrophobicContact CG2-CE2 3.88Å; I568-F579 HydrophobicContact CG2-CZ 4.32Å; C571-F579 HydrophobicContact CB-CE2 3.75Å; C571-F579 HydrophobicContact CB-CZ 3.74Å; L572-F579 HydrophobicContact CD1-CD2 4.43Å; L572-F579 HydrophobicContact CD2-CD2 3.88Å; L572-F579 HydrophobicContact CD2-CE2 4.44Å; L572-F579 HydrophobicContact CG-CD2 3.87Å; L572-F579 HydrophobicContact CG-CE2 3.97Å; E577-F579 PolarHBondContact O-N 2.91Å; E577-F579 VanDerWaalsContact O-N 3.12Å
580K87.1Confident80.2Confident114 Ų11496.8 Ų96.850%0.49651%0.511SS..SBendtrans-79.3148168.7-66.9-173.1-168.3178.20109.5E577 K582E577-K580 HydrophobicContact CB-CB 4.37Å; E577-K580 HydrophobicContact CB-CD 4.01Å; E577-K580 HydrophobicContact CB-CG 4.33Å; E577-K580 HydrophobicContact CG-CD 3.94Å; E577-K580 PolarHBondContact O-N 2.96Å; E577-K580 WeakPolarHBondContact OE1-CD 3.12Å; E577-K580 WeakPolarHBondContact OE1-CE 3.44Å; E577-K580 IonicContact OE1-NZ 3.89Å; E577-K580 PolarHBondContact OE1-NZ 3.36Å; K580-K582 PolarHBondContact O-N 2.93Å; K580-K582 VanDerWaalsContact O-N 3.13Å
581P85.7Confident78.2Confident107 Ų107101 Ų10170%0.69554%0.539SS*.  trans-55.8119.2175.1-26.635.4000112.2I583P581-I583 PolarHBondContact O-N 3.08Å; P581-I583 VanDerWaalsContact O-N 3.12Å
582K85.1Confident76.8Confident121 Ų121102.1 Ų102.153%0.52654%0.544SS..SBendtrans-60.3-22.2-177.2-63.6-176.7-179178.60114.6K580 H595 S596 E612K580-K582 PolarHBondContact O-N 2.93Å; K580-K582 VanDerWaalsContact O-N 3.13Å; K582-H595 WeakPolarHBondContact O-CA 2.82Å; K582-H595 PolarHBondContact O-CD2 3.23Å; K582-S596 PolarHBondContact O-N 3.24Å; K582-S596 PolarHBondContact O-OG 2.67Å; K582-E612 IonicContact NZ-OE1 3.85Å; K582-E612 PolarHBondContact NZ-OE1 3Å
583I83.4Confident76.1Confident46 Ų46105.7 Ų105.724%0.23655%0.552CS.*BIsolated β-bridgetrans-101.6119.2178.2-49.9-64.4000107.7P581 K585 R593 H595 A616 I618P581-I583 PolarHBondContact O-N 3.08Å; P581-I583 VanDerWaalsContact O-N 3.12Å; I583-K585 PolarHBondContact O-N 3.22Å; I583-R593 HydrophobicContact CG2-CB 4.23Å; I583-H595 HydrophobicContact CD1-CB 4.25Å; I583-A616 HydrophobicContact CD1-CB 3.5Å; I583-A616 VanDerWaalsContact CD1-CB 3.5Å; I583-A616 HydrophobicContact CG1-CB 4Å; I583-I618 HydrophobicContact CD1-CD1 3.67Å; I583-I618 HydrophobicContact CD1-CG1 4.45Å
584G73Confident75.5Confident25 Ų25104.4 Ų104.426%0.25854%0.537SS..  trans-59.2137.1177.200000111.5G586 R594G584-G586 PolarHBondContact O-N 3.38Å; G584-G586 VanDerWaalsContact O-N 3.14Å; G584-R594 PolarHBondContact N-O 3.12Å
585K63.7Low75.1Confident203 Ų20394.7 Ų94.788%0.88350%0.5SS*.  trans-66.3108.2156.8-65.4-178-178.2-179.60105.9I583 K587I583-K585 PolarHBondContact O-N 3.22Å; K585-K587 PolarHBondContact O-N 3.37Å
586G57.3Low74.8Confident39 Ų3995.5 Ų95.540%0.40251%0.51SS..  trans-54.9138.9173.200000109.5G584G584-G586 PolarHBondContact O-N 3.38Å; G584-G586 VanDerWaalsContact O-N 3.14Å
587K54.3Low74.6Confident172 Ų17298.3 Ų98.375%0.74851%0.512SS*.  trans-67.1140173-69-178.8179.6178.10108K585 G589 E590K585-K587 PolarHBondContact O-N 3.37Å; K587-G589 PolarHBondContact O-N 3.23Å; K587-E590 PolarHBondContact O-N 2.86Å
588E45Very low74.8Confident209 Ų20993.8 Ų93.898%0.97749%0.492SS*.THydrogen-bonded Turntrans-60.6109176.3-170162.6-153.500109.1
589G59.6Low75Confident88 Ų8893.2 Ų93.291%0.90749%0.486SS*.THydrogen-bonded Turntrans120.6-24.9-170.500000115.4K587K587-G589 PolarHBondContact O-N 3.23Å
590E52.8Low75.2Confident125 Ų12595.4 Ų95.458%0.58450%0.501SS*.  trans-114.7108.5175.2-164.5179.2174.500110K587 D592K587-E590 PolarHBondContact O-N 2.86Å; E590-D592 VanDerWaalsContact C-N 3.34Å; E590-D592 PolarHBondContact O-N 2.98Å
591S54.7Low75.7Confident126 Ų12690.7 Ų90.788%0.88148%0.482SS*.  trans-74.7-11.1-157.551.40000116.6
592D66.4Low76.3Confident39 Ų3993.2 Ų93.221%0.20948%0.482CS..  trans-100.2109.7-166.9-164.2-2.8000113.2E590 R594E590-D592 VanDerWaalsContact C-N 3.34Å; E590-D592 PolarHBondContact O-N 2.98Å; D592-R594 HydrophobicContact CB-CG 4.24Å; D592-R594 VanDerWaalsContact CG-NE 3.31Å; D592-R594 PolarHBondContact O-N 3.13Å; D592-R594 IonicContact OD2-CZ 2.98Å; D592-R594 IonicContact OD2-NE 3.76Å; D592-R594 PolarHBondContact OD2-NE 2.84Å; D592-R594 IonicContact OD2-NH2 2.68Å; D592-R594 PolarHBondContact OD2-NH2 2.83Å
593R81.6Confident76.8Confident147 Ų14799 Ų9956%0.55550%0.501SS*.  trans-75.890.5177.6-62.6171.577.4167.94.4109.1I583 I618I583-R593 HydrophobicContact CG2-CB 4.23Å; R593-I618 HydrophobicContact CB-CG2 4.1Å; R593-I618 WeakPolarHBondContact O-CB 3.42Å; R593-I618 WeakPolarHBondContact O-CD1 3.34Å; R593-I618 WeakPolarHBondContact O-CG2 3.48Å
594R83.9Confident77.4Confident109 Ų10997.6 Ų97.641%0.41150%0.495SS..  trans-91.2150.7-172-71173172.1170.76.2114G584 D592 S596G584-R594 PolarHBondContact N-O 3.12Å; D592-R594 HydrophobicContact CB-CG 4.24Å; D592-R594 VanDerWaalsContact CG-NE 3.31Å; D592-R594 PolarHBondContact O-N 3.13Å; D592-R594 IonicContact OD2-CZ 2.98Å; D592-R594 IonicContact OD2-NE 3.76Å; D592-R594 PolarHBondContact OD2-NE 2.84Å; D592-R594 IonicContact OD2-NH2 2.68Å; D592-R594 PolarHBondContact OD2-NH2 2.83Å; R594-S596 PolarHBondContact O-N 2.69Å
595H85.5Confident78.6Confident3 Ų397.3 Ų97.31%0.01449%0.492CS..BIsolated β-bridgetrans-78.5110.7171.4-174.1-110.9000109.5K582 I583 K597 G598 E612 I618 I623K582-H595 WeakPolarHBondContact O-CA 2.82Å; K582-H595 PolarHBondContact O-CD2 3.23Å; I583-H595 HydrophobicContact CD1-CB 4.25Å; H595-K597 PolarHBondContact O-N 3.43Å; H595-G598 PolarHBondContact CE1-O 2.85Å; H595-G598 VanDerWaalsContact CE1-O 3.26Å; H595-G598 PolarHBondContact ND1-N 3.28Å; H595-G598 PolarHBondContact ND1-O 2.98Å; H595-G598 PolarHBondContact O-N 2.95Å; H595-E612 IonicContact CE1-OE2 3.7Å; H595-E612 PolarHBondContact CE1-OE2 3.26Å; H595-E612 VanDerWaalsContact CE1-OE2 3.24Å; H595-E612 IonicContact NE2-OE1 3.88Å; H595-E612 IonicContact NE2-OE2 2.67Å; H595-I618 HydrophobicContact CB-CD1 3.94Å; H595-I623 WeakPolarHBondContact O-CD1 3.47Å
596S86.9Confident80.2Confident71 Ų7187.7 Ų87.750%0.49745%0.45SS..THydrogen-bonded Turntrans-58.1-25.3-165.2-49.90000114.8K582 R594 I623K582-S596 PolarHBondContact O-N 3.24Å; K582-S596 PolarHBondContact O-OG 2.67Å; R594-S596 PolarHBondContact O-N 2.69Å; S596-I623 WeakPolarHBondContact O-CD1 3.5Å
597K88.8Confident82Confident157 Ų15786.8 Ų86.868%0.68344%0.436SS*.THydrogen-bonded Turntrans-99.3-10.1179.5-170.8165.4-178.1169.90114.4H595H595-K597 PolarHBondContact O-N 3.43Å
598G92.6Very high84Confident1 Ų184.2 Ų84.21%0.0143%0.425CS..  trans63.7175.5-164.700000113.1H595H595-G598 PolarHBondContact CE1-O 2.85Å; H595-G598 VanDerWaalsContact CE1-O 3.26Å; H595-G598 PolarHBondContact ND1-N 3.28Å; H595-G598 PolarHBondContact ND1-O 2.98Å; H595-G598 PolarHBondContact O-N 2.95Å
599C95.8Very high86.4Confident1 Ų178.9 Ų78.91%0.00740%0.403CS..  trans-112164.7174.973.20000111.8C611 C624 K625C599-C611 VanDerWaalsContact SG-SG 3.6Å; C599-C624 PolarHBondContact N-SG 2.93Å; C599-C624 VanDerWaalsContact N-SG 3.39Å; C599-C624 CarbonylContact O-C 3.24Å; C599-C624 WeakPolarHBondContact O-CA 3.36Å; C599-K625 CarbonylContact O-C 3.48Å; C599-K625 PolarHBondContact O-N 2.68Å
600N96.8Very high88Confident100 Ų10084.2 Ų84.254%0.53540%0.397SS..  trans-12331.1-175.4-63.9-90.3000112.3
601C97.9Very high90.1Very high16 Ų1678.2 Ų78.211%0.10837%0.369CS..  trans-67.1131-171.1-670000113.2S604 C611 C626 I627C601-S604 WeakPolarHBondContact CB-OG 3.48Å; C601-C611 VanDerWaalsContact SG-CB 3.52Å; C601-C611 VanDerWaalsContact SG-SG 3.62Å; C601-C626 HydrophobicContact CB-CB 4.14Å; C601-C626 CarbonylContact O-C 3.52Å; C601-C626 VanDerWaalsContact O-CA 3.27Å; C601-C626 WeakPolarHBondContact O-CA 3.36Å; C601-I627 PolarHBondContact O-N 2.92Å
602K96.9Very high92Very high160 Ų16075.6 Ų75.670%0.69634%0.343SS*.SBendtrans-111.3-21.3178-59.7-170.8179.8-177.30115.9I627K602-I627 HydrophobicContact CD-CD1 4.26Å; K602-I627 HydrophobicContact CG-CD1 4.05Å; K602-I627 HydrophobicContact CG-CG1 4.47Å
603R96.8Very high93.3Very high243 Ų24373.8 Ų73.892%0.91733%0.333SS*.SBendtrans-131.3-11.9-171.3-64.5-168-66.2-177.5-0.8115.6
604S95.9Very high94Very high16 Ų1669 Ų6911%0.11232%0.315CS..SBendtrans-84-8.6-176.353.70000114.1C601 C606 L607C601-S604 WeakPolarHBondContact CB-OG 3.48Å; S604-C606 PolarHBondContact O-N 3.28Å; S604-C606 PolarHBondContact OG-N 2.69Å; S604-L607 PolarHBondContact O-N 3.34Å; S604-L607 VanDerWaalsContact O-N 3.07Å
605G96.5Very high94.5Very high19 Ų1969.1 Ų69.120%0.19632%0.32CS..THydrogen-bonded Turntrans58.511.1-164.200000113.5L607 G628 K630G605-L607 PolarHBondContact O-N 3.42Å; G605-G628 WeakPolarHBondContact CA-O 3.34Å; G605-K630 WeakPolarHBondContact O-CA 3.43Å; G605-K630 WeakPolarHBondContact O-CB 3.49Å; G605-K630 PolarHBondContact O-N 3.07Å
606C97.8Very high94.8Very high0 Ų071 Ų710%034%0.337CS..THydrogen-bonded Turntrans56.614.3-164.6-56.40000115.3S604 C611 Y614 C626 N631S604-C606 PolarHBondContact O-N 3.28Å; S604-C606 PolarHBondContact OG-N 2.69Å; C606-C611 HydrophobicContact CB-CB 4.37Å; C606-Y614 WeakPolarHBondContact O-CB 3.37Å; C606-Y614 WeakPolarHBondContact O-CD2 3.17Å; C606-C626 WeakPolarHBondContact SG-CB 3.49Å; C606-N631 HydrophobicContact CB-CB 3.4Å; C606-N631 VanDerWaalsContact CB-CB 3.4Å; C606-N631 WeakPolarHBondContact O-CB 3.44Å
607L95.6Very high95Very high20 Ų2074 Ų7411%0.10534%0.341CS..  trans-11033.1178.7-67.7179000112.9S604 G605 Y614 K630 N631 E637 R638 L641S604-L607 PolarHBondContact O-N 3.34Å; S604-L607 VanDerWaalsContact O-N 3.07Å; G605-L607 PolarHBondContact O-N 3.42Å; L607-Y614 HydrophobicContact CB-CE2 4.32Å; L607-Y614 HydrophobicContact CD2-CD2 3.86Å; L607-Y614 HydrophobicContact CD2-CE2 3.67Å; L607-K630 HydrophobicContact CD1-CB 3.49Å; L607-K630 VanDerWaalsContact CD1-CB 3.49Å; L607-K630 HydrophobicContact CD1-CD 4.42Å; L607-K630 WeakPolarHBondContact CD2-O 3.48Å; L607-K630 HydrophobicContact CG-CB 3.91Å; L607-N631 HydrophobicContact CD2-CB 4.23Å; L607-E637 HydrophobicContact CD1-CB 3.64Å; L607-R638 HydrophobicContact CD2-CB 3.91Å; L607-R638 HydrophobicContact CD2-CG 4.16Å; L607-L641 HydrophobicContact CB-CD1 3.96Å; L607-L641 HydrophobicContact CD1-CD1 4.13Å; L607-L641 HydrophobicContact CD2-CD1 4.5Å; L607-L641 HydrophobicContact CG-CD1 4.43Å
608K95.4Very high95.2Very high119 Ų11967.4 Ų67.452%0.51731%0.313SS..SBendtrans-144.4153.3176.6-59.2-172.5179.9-172.20108.9Y610 C611 Y614K608-Y610 HydrophobicContact CB-CD2 3.75Å; K608-Y610 HydrophobicContact CB-CE2 4.32Å; K608-Y610 HydrophobicContact CD-CD2 4.16Å; K608-Y610 HydrophobicContact CD-CE2 4.12Å; K608-Y610 PolarHBondContact O-N 2.96Å; K608-C611 WeakPolarHBondContact O-CB 3.23Å; K608-C611 PolarHBondContact O-N 3.45Å; K608-Y614 VanDerWaalsContact C-CD1 3.45Å
609N95.2Very high95.2Very high97 Ų9769 Ų6952%0.51932%0.321SS..THydrogen-bonded Turntrans-61.8-9.8-178.1-61.4-29.8000114.4C611N609-C611 PolarHBondContact O-N 2.95Å
610Y95.1Very high95.2Very high199 Ų19970 Ų7078%0.7833%0.327SS*.THydrogen-bonded Turntrans-62.4-1.7164-48.8-63.8000114.5K608K608-Y610 HydrophobicContact CB-CD2 3.75Å; K608-Y610 HydrophobicContact CB-CE2 4.32Å; K608-Y610 HydrophobicContact CD-CD2 4.16Å; K608-Y610 HydrophobicContact CD-CE2 4.12Å; K608-Y610 PolarHBondContact O-N 2.96Å
611C96.7Very high95.1Very high0 Ų066 Ų660%031%0.307CS..SBendtrans-116114.7176.51800000109.5C599 C601 C606 K608 N609 C613 Y614 E615C599-C611 VanDerWaalsContact SG-SG 3.6Å; C601-C611 VanDerWaalsContact SG-CB 3.52Å; C601-C611 VanDerWaalsContact SG-SG 3.62Å; C606-C611 HydrophobicContact CB-CB 4.37Å; K608-C611 WeakPolarHBondContact O-CB 3.23Å; K608-C611 PolarHBondContact O-N 3.45Å; N609-C611 PolarHBondContact O-N 2.95Å; C611-C613 PolarHBondContact O-N 2.94Å; C611-C613 VanDerWaalsContact O-N 3.12Å; C611-Y614 PolarHBondContact O-N 3.46Å; C611-E615 PolarHBondContact O-N 3.31Å
612E93.4Very high94.8Very high71 Ų7171 Ų7133%0.33234%0.342SS..Hα-helixtrans-51.6-39-178.4-62.7175.1113.500112.4K582 H595 A616K582-E612 IonicContact NZ-OE1 3.85Å; K582-E612 PolarHBondContact NZ-OE1 3Å; H595-E612 IonicContact CE1-OE2 3.7Å; H595-E612 PolarHBondContact CE1-OE2 3.26Å; H595-E612 VanDerWaalsContact CE1-OE2 3.24Å; H595-E612 IonicContact NE2-OE1 3.88Å; H595-E612 IonicContact NE2-OE2 2.67Å; E612-A616 VanDerWaalsContact O-CB 3.27Å; E612-A616 WeakPolarHBondContact O-CB 3.31Å; E612-A616 PolarHBondContact O-N 3.02Å
613C95Very high94.7Very high0 Ų067.3 Ų67.30%033%0.329CS..Hα-helixtrans-62.2-45.6175.7-51.60000112.8C611 A616 K617 I618C611-C613 PolarHBondContact O-N 2.94Å; C611-C613 VanDerWaalsContact O-N 3.12Å; C613-A616 CarbonylContact O-C 3.46Å; C613-A616 PolarHBondContact O-N 3.41Å; C613-K617 PolarHBondContact O-N 3.39Å; C613-K617 VanDerWaalsContact O-N 3.13Å; C613-I618 CarbonylContact C-O 3.36Å; C613-I618 HydrophobicContact CB-CD1 4.47Å; C613-I618 HydrophobicContact CB-CG1 4.11Å; C613-I618 WeakPolarHBondContact O-CG1 3.46Å; C613-I618 PolarHBondContact O-N 2.79Å; C613-I618 VanDerWaalsContact O-O 3.11Å
614Y95.4Very high94.6Very high46 Ų4656.5 Ų56.518%0.1829%0.291CS..Hα-helixtrans-74.9-37.2-177.4-176.7-92.2000112.2C606 L607 K608 C611 A616 K617C606-Y614 WeakPolarHBondContact O-CB 3.37Å; C606-Y614 WeakPolarHBondContact O-CD2 3.17Å; L607-Y614 HydrophobicContact CB-CE2 4.32Å; L607-Y614 HydrophobicContact CD2-CD2 3.86Å; L607-Y614 HydrophobicContact CD2-CE2 3.67Å; K608-Y614 VanDerWaalsContact C-CD1 3.45Å; C611-Y614 PolarHBondContact O-N 3.46Å; Y614-A616 VanDerWaalsContact C-N 3.34Å; Y614-K617 PolarHBondContact O-N 2.84Å; Y614-K617 PolarHBondContact O-NZ 3.4Å
615E93.8Very high94.7Very high112 Ų11263.6 Ų63.652%0.52332%0.32SS..Hα-helixtrans-56.9-50.3170.4-179.4167.5-135.200110.2C611 K617C611-E615 PolarHBondContact O-N 3.31Å; E615-K617 PolarHBondContact O-N 3.12Å; E615-K617 VanDerWaalsContact O-N 3.11Å; E615-K617 PolarHBondContact O-NZ 3.38Å
616A91.9Very high94.7Very high43 Ų4364 Ų6436%0.35532%0.319SS..THydrogen-bonded Turntrans-71.44.7174.400000115.3I583 E612 C613 Y614 I618I583-A616 HydrophobicContact CD1-CB 3.5Å; I583-A616 VanDerWaalsContact CD1-CB 3.5Å; I583-A616 HydrophobicContact CG1-CB 4Å; E612-A616 VanDerWaalsContact O-CB 3.27Å; E612-A616 WeakPolarHBondContact O-CB 3.31Å; E612-A616 PolarHBondContact O-N 3.02Å; C613-A616 CarbonylContact O-C 3.46Å; C613-A616 PolarHBondContact O-N 3.41Å; Y614-A616 VanDerWaalsContact C-N 3.34Å; A616-I618 HydrophobicContact CB-CG1 4.21Å; A616-I618 PolarHBondContact O-N 2.99Å
617K92.4Very high94.7Very high133 Ų13369.1 Ų69.158%0.57835%0.345SS*.THydrogen-bonded Turntrans63.912.4177.7-57.7-70.4156.6-68.60116.3C613 Y614 E615C613-K617 PolarHBondContact O-N 3.39Å; C613-K617 VanDerWaalsContact O-N 3.13Å; Y614-K617 PolarHBondContact O-N 2.84Å; Y614-K617 PolarHBondContact O-NZ 3.4Å; E615-K617 PolarHBondContact O-N 3.12Å; E615-K617 VanDerWaalsContact O-N 3.11Å; E615-K617 PolarHBondContact O-NZ 3.38Å
618I92.9Very high94.7Very high19 Ų1970.9 Ų70.910%0.09737%0.368CS..PPolyproline II helixtrans-97.1172178.661.1162.4000111.2I583 R593 H595 C613 A616 N631 R638I583-I618 HydrophobicContact CD1-CD1 3.67Å; I583-I618 HydrophobicContact CD1-CG1 4.45Å; R593-I618 HydrophobicContact CB-CG2 4.1Å; R593-I618 WeakPolarHBondContact O-CB 3.42Å; R593-I618 WeakPolarHBondContact O-CD1 3.34Å; R593-I618 WeakPolarHBondContact O-CG2 3.48Å; H595-I618 HydrophobicContact CB-CD1 3.94Å; C613-I618 CarbonylContact C-O 3.36Å; C613-I618 HydrophobicContact CB-CD1 4.47Å; C613-I618 HydrophobicContact CB-CG1 4.11Å; C613-I618 WeakPolarHBondContact O-CG1 3.46Å; C613-I618 PolarHBondContact O-N 2.79Å; C613-I618 VanDerWaalsContact O-O 3.11Å; A616-I618 HydrophobicContact CB-CG1 4.21Å; A616-I618 PolarHBondContact O-N 2.99Å; I618-N631 PolarHBondContact O-ND2 3.39Å; I618-R638 PolarHBondContact O-NH1 3Å
619M93.1Very high94.8Very high36 Ų3667 Ų6718%0.17736%0.355CS..PPolyproline II helixtrans-87.1162.8176.9-69.9174.4-78.600111.6E633M619-E633 VanDerWaalsContact CE-OE2 3.23Å; M619-E633 WeakPolarHBondContact CE-OE2 3.45Å; M619-E633 VanDerWaalsContact SD-CA 3.58Å; M619-E633 HydrophobicContact SD-CB 3.66Å; M619-E633 HydrophobicContact SD-CG 4.4Å; M619-E633 PolarHBondContact SD-N 3.25Å; M619-E633 VanDerWaalsContact SD-N 3.43Å; M619-E633 VanDerWaalsContact SD-OE2 3.4Å
620C95.3Very high94.9Very high20 Ų2066.4 Ų66.414%0.13535%0.348CS..PPolyproline II helixtrans-81.9117.2168.7-71.90000109.4C624 N631C620-C624 HydrophobicContact CB-CB 4.06Å; C620-N631 HydrophobicContact CB-CB 4.47Å; C620-N631 PolarHBondContact N-ND2 3.05Å; C620-N631 PolarHBondContact N-O 3.4Å; C620-N631 PolarHBondContact SG-ND2 3.42Å; C620-N631 VanDerWaalsContact SG-ND2 3.44Å
621S93.4Very high94.9Very high16 Ų1657 Ų5711%0.11231%0.311CS..PPolyproline II helixtrans-84.8173.6172.954.30000112.3I623 C624S621-I623 PolarHBondContact O-N 3.49Å; S621-I623 VanDerWaalsContact OG-CG1 3.25Å; S621-I623 WeakPolarHBondContact OG-CG1 3.35Å; S621-C624 VanDerWaalsContact O-CB 3.28Å; S621-C624 WeakPolarHBondContact O-CB 3.31Å; S621-C624 PolarHBondContact O-N 3.45Å; S621-C624 PolarHBondContact O-SG 2.9Å
622S92.9Very high94.8Very high122 Ų12260.9 Ų60.985%0.85333%0.328SS*.THydrogen-bonded Turntrans-56.3-20.7-178.850.30000115.7C624S622-C624 VanDerWaalsContact C-N 3.31Å
623I93.8Very high94.5Very high82 Ų8262.2 Ų62.242%0.42133%0.334SS..THydrogen-bonded Turntrans-79.3-8.7174.352.9172000113.6H595 S596 S621 K625H595-I623 WeakPolarHBondContact O-CD1 3.47Å; S596-I623 WeakPolarHBondContact O-CD1 3.5Å; S621-I623 PolarHBondContact O-N 3.49Å; S621-I623 VanDerWaalsContact OG-CG1 3.25Å; S621-I623 WeakPolarHBondContact OG-CG1 3.35Å; I623-K625 PolarHBondContact O-N 3.42Å
624C96.2Very high94.3Very high16 Ų1668.5 Ų68.511%0.10836%0.364CS..  trans-76.4117.1173.7-61.10000111.5C599 C620 S621 S622 C626C599-C624 PolarHBondContact N-SG 2.93Å; C599-C624 VanDerWaalsContact N-SG 3.39Å; C599-C624 CarbonylContact O-C 3.24Å; C599-C624 WeakPolarHBondContact O-CA 3.36Å; C620-C624 HydrophobicContact CB-CB 4.06Å; S621-C624 VanDerWaalsContact O-CB 3.28Å; S621-C624 WeakPolarHBondContact O-CB 3.31Å; S621-C624 PolarHBondContact O-N 3.45Å; S621-C624 PolarHBondContact O-SG 2.9Å; S622-C624 VanDerWaalsContact C-N 3.31Å; C624-C626 VanDerWaalsContact CB-SG 3.53Å; C624-C626 PolarHBondContact O-N 2.96Å
625K96.8Very high94.1Very high166 Ų16666.3 Ų66.372%0.72236%0.355SS*.  trans-85.445174.1-55.7-176.2-178.3-175.50111.4C599 I623C599-K625 CarbonylContact O-C 3.48Å; C599-K625 PolarHBondContact O-N 2.68Å; I623-K625 PolarHBondContact O-N 3.42Å
626C97.5Very high94Very high26 Ų2665 Ų6518%0.17636%0.356CS..  trans-91.5136-175.950.20000112.6C601 C606 C624 C629C601-C626 HydrophobicContact CB-CB 4.14Å; C601-C626 CarbonylContact O-C 3.52Å; C601-C626 VanDerWaalsContact O-CA 3.27Å; C601-C626 WeakPolarHBondContact O-CA 3.36Å; C606-C626 WeakPolarHBondContact SG-CB 3.49Å; C624-C626 VanDerWaalsContact CB-SG 3.53Å; C624-C626 PolarHBondContact O-N 2.96Å; C626-C629 HydrophobicContact CB-CB 4.44Å; C626-C629 VanDerWaalsContact SG-CB 3.57Å; C626-C629 VanDerWaalsContact SG-SG 3.67Å
627I97.1Very high94Very high109 Ų10966.1 Ų66.156%0.55936%0.355SS*.THydrogen-bonded Turntrans-96132179.5-53.3179000109C601 K602C601-I627 PolarHBondContact O-N 2.92Å; K602-I627 HydrophobicContact CD-CD1 4.26Å; K602-I627 HydrophobicContact CG-CD1 4.05Å; K602-I627 HydrophobicContact CG-CG1 4.47Å
628G95.9Very high93.9Very high57 Ų5761.9 Ų61.959%0.58834%0.335SS*.THydrogen-bonded Turntrans64.538.618000000113.3G605 K630G605-G628 WeakPolarHBondContact CA-O 3.34Å; G628-K630 PolarHBondContact O-N 2.9Å
629C97.5Very high93.8Very high36 Ų3665.2 Ų65.224%0.24335%0.349CS..  trans-64.7131.2-177.9-168.50000112.1C626 N631 F632C626-C629 HydrophobicContact CB-CB 4.44Å; C626-C629 VanDerWaalsContact SG-CB 3.57Å; C626-C629 VanDerWaalsContact SG-SG 3.67Å; C629-N631 PolarHBondContact SG-N 3.44Å; C629-N631 VanDerWaalsContact SG-N 3.42Å; C629-F632 WeakPolarHBondContact O-CE1 3.34Å
630K96.6Very high93.7Very high86 Ų8667.3 Ų67.337%0.37436%0.364SS..  trans-119.615.3171.8-56.9-175.5170.9-150.40111.8G605 L607 G628 S635 E637G605-K630 WeakPolarHBondContact O-CA 3.43Å; G605-K630 WeakPolarHBondContact O-CB 3.49Å; G605-K630 PolarHBondContact O-N 3.07Å; L607-K630 HydrophobicContact CD1-CB 3.49Å; L607-K630 VanDerWaalsContact CD1-CB 3.49Å; L607-K630 HydrophobicContact CD1-CD 4.42Å; L607-K630 WeakPolarHBondContact CD2-O 3.48Å; L607-K630 HydrophobicContact CG-CB 3.91Å; G628-K630 PolarHBondContact O-N 2.9Å; K630-S635 WeakPolarHBondContact O-CB 3.44Å; K630-S635 PolarHBondContact O-OG 2.93Å; K630-E637 HydrophobicContact CD-CG 4.23Å; K630-E637 WeakPolarHBondContact CD-OE1 3.49Å; K630-E637 VanDerWaalsContact CE-OE1 3.31Å; K630-E637 WeakPolarHBondContact CE-OE1 3.21Å; K630-E637 IonicContact NZ-OE1 2.65Å; K630-E637 PolarHBondContact NZ-OE1 3.04Å
631N95.9Very high93.4Very high0 Ų069.8 Ų69.80%038%0.375CS..  trans-106.359-176.5-169.149.1000111.7C606 L607 I618 C620 C629 R638C606-N631 HydrophobicContact CB-CB 3.4Å; C606-N631 VanDerWaalsContact CB-CB 3.4Å; C606-N631 WeakPolarHBondContact O-CB 3.44Å; L607-N631 HydrophobicContact CD2-CB 4.23Å; I618-N631 PolarHBondContact O-ND2 3.39Å; C620-N631 HydrophobicContact CB-CB 4.47Å; C620-N631 PolarHBondContact N-ND2 3.05Å; C620-N631 PolarHBondContact N-O 3.4Å; C620-N631 PolarHBondContact SG-ND2 3.42Å; C620-N631 VanDerWaalsContact SG-ND2 3.44Å; C629-N631 PolarHBondContact SG-N 3.44Å; C629-N631 VanDerWaalsContact SG-N 3.42Å; N631-R638 PolarHBondContact OD1-NH1 3.35Å
632F93.4Very high93.1Very high82 Ų8274.1 Ų74.136%0.3640%0.395SS..SBendtrans-130.3163.3177.559.7-90.8000109.6C629 E634 S635C629-F632 WeakPolarHBondContact O-CE1 3.34Å; F632-E634 VanDerWaalsContact C-N 3.34Å; F632-E634 HydrophobicContact CD2-CB 4.13Å; F632-E634 HydrophobicContact CE2-CB 4Å; F632-E634 PolarHBondContact O-N 2.86Å; F632-S635 VanDerWaalsContact CE2-N 3.28Å; F632-S635 PolarHBondContact O-N 2.85Å
633E88.8Confident93Very high99 Ų9974.1 Ų74.146%0.46338%0.381SS..THydrogen-bonded Turntrans-56.4-44.2-169.5-171.760.5-104.100112.4M619 S635 K639M619-E633 VanDerWaalsContact CE-OE2 3.23Å; M619-E633 WeakPolarHBondContact CE-OE2 3.45Å; M619-E633 VanDerWaalsContact SD-CA 3.58Å; M619-E633 HydrophobicContact SD-CB 3.66Å; M619-E633 HydrophobicContact SD-CG 4.4Å; M619-E633 PolarHBondContact SD-N 3.25Å; M619-E633 VanDerWaalsContact SD-N 3.43Å; M619-E633 VanDerWaalsContact SD-OE2 3.4Å; E633-S635 PolarHBondContact O-N 3.04Å; E633-K639 WeakPolarHBondContact O-CE 3.44Å; E633-K639 PolarHBondContact O-NZ 3.12Å
634E89Confident92.8Very high132 Ų13275.5 Ų75.562%0.61739%0.389SS*.THydrogen-bonded Turntrans-83-2-176.4-59.471.9-155.600114.7F632 P636F632-E634 VanDerWaalsContact C-N 3.34Å; F632-E634 HydrophobicContact CD2-CB 4.13Å; F632-E634 HydrophobicContact CE2-CB 4Å; F632-E634 PolarHBondContact O-N 2.86Å; E634-P636 WeakPolarHBondContact O-CD 3.41Å
635S92.5Very high92.5Very high0 Ų077.3 Ų77.30%041%0.405CS..  trans-63.4122.6-175.1164.90000111.3K630 F632 E633 E637 R638 K639K630-S635 WeakPolarHBondContact O-CB 3.44Å; K630-S635 PolarHBondContact O-OG 2.93Å; F632-S635 VanDerWaalsContact CE2-N 3.28Å; F632-S635 PolarHBondContact O-N 2.85Å; E633-S635 PolarHBondContact O-N 3.04Å; S635-E637 VanDerWaalsContact C-N 3.26Å; S635-E637 PolarHBondContact O-N 2.92Å; S635-E637 PolarHBondContact OG-N 3.46Å; S635-E637 PolarHBondContact OG-OE2 2.96Å; S635-R638 PolarHBondContact O-N 2.96Å; S635-R638 PolarHBondContact OG-N 3.37Å; S635-K639 WeakPolarHBondContact O-CG 3.25Å; S635-K639 PolarHBondContact O-N 3.38Å
636P91.4Very high92.2Very high84 Ų8472.5 Ų72.555%0.54539%0.387SS..Hα-helixtrans-64.1-35.1175.426-32.8000111E634 K639 T640E634-P636 WeakPolarHBondContact O-CD 3.41Å; P636-K639 PolarHBondContact O-N 2.95Å; P636-T640 WeakPolarHBondContact O-CB 3.28Å; P636-T640 PolarHBondContact O-N 3.3Å; P636-T640 PolarHBondContact O-OG1 3.37Å
637E91.6Very high92Very high68 Ų6873.7 Ų73.732%0.31840%0.398SS..Hα-helixtrans-68.8-36.7178.2-5196.3143.900112.6L607 K630 S635 L641L607-E637 HydrophobicContact CD1-CB 3.64Å; K630-E637 HydrophobicContact CD-CG 4.23Å; K630-E637 WeakPolarHBondContact CD-OE1 3.49Å; K630-E637 VanDerWaalsContact CE-OE1 3.31Å; K630-E637 WeakPolarHBondContact CE-OE1 3.21Å; K630-E637 IonicContact NZ-OE1 2.65Å; K630-E637 PolarHBondContact NZ-OE1 3.04Å; S635-E637 VanDerWaalsContact C-N 3.26Å; S635-E637 PolarHBondContact O-N 2.92Å; S635-E637 PolarHBondContact OG-N 3.46Å; S635-E637 PolarHBondContact OG-OE2 2.96Å; E637-L641 WeakPolarHBondContact O-CB 3.35Å; E637-L641 WeakPolarHBondContact O-CG 3.41Å; E637-L641 PolarHBondContact O-N 3.26Å
638R91Very high91.7Very high43 Ų4370.4 Ų70.416%0.16239%0.388CS..Hα-helixtrans-63.1-46.6171.4-175.3175.1157.5107.51.1110.7L607 I618 N631 S635 L641 M642L607-R638 HydrophobicContact CD2-CB 3.91Å; L607-R638 HydrophobicContact CD2-CG 4.16Å; I618-R638 PolarHBondContact O-NH1 3Å; N631-R638 PolarHBondContact OD1-NH1 3.35Å; S635-R638 PolarHBondContact O-N 2.96Å; S635-R638 PolarHBondContact OG-N 3.37Å; R638-L641 PolarHBondContact O-N 3.16Å; R638-M642 WeakPolarHBondContact O-CB 3.27Å; R638-M642 PolarHBondContact O-N 3.12Å
639K89.4Confident91.5Very high90 Ų9074.2 Ų74.239%0.39139%0.39SS..Hα-helixtrans-63.8-42.4179.7-68.3-178-171.6-1720112.1E633 S635 P636 M642 H643E633-K639 WeakPolarHBondContact O-CE 3.44Å; E633-K639 PolarHBondContact O-NZ 3.12Å; S635-K639 WeakPolarHBondContact O-CG 3.25Å; S635-K639 PolarHBondContact O-N 3.38Å; P636-K639 PolarHBondContact O-N 2.95Å; K639-M642 PolarHBondContact O-N 3.19Å; K639-H643 VanDerWaalsContact O-CG 3.26Å; K639-H643 PolarHBondContact O-N 3.06Å
640T91.4Very high91.3Very high80 Ų8076.9 Ų76.949%0.49141%0.405SS..Hα-helixtrans-59.5-46.9173.1-57.40000111.7P636 M642 L644P636-T640 WeakPolarHBondContact O-CB 3.28Å; P636-T640 PolarHBondContact O-N 3.3Å; P636-T640 PolarHBondContact O-OG1 3.37Å; T640-M642 VanDerWaalsContact C-N 3.34Å; T640-M642 PolarHBondContact O-N 3.38Å; T640-L644 HydrophobicContact CG2-CD1 4.17Å; T640-L644 WeakPolarHBondContact O-CB 3.49Å; T640-L644 WeakPolarHBondContact O-CD1 3.27Å; T640-L644 PolarHBondContact O-N 3.43Å
641L89.4Confident91Very high72 Ų7280.3 Ų80.338%0.37742%0.416SS..Hα-helixtrans-64.7-36.2178.2-75.8171.3000113.1L607 E637 R638 A645L607-L641 HydrophobicContact CB-CD1 3.96Å; L607-L641 HydrophobicContact CD1-CD1 4.13Å; L607-L641 HydrophobicContact CD2-CD1 4.5Å; L607-L641 HydrophobicContact CG-CD1 4.43Å; E637-L641 WeakPolarHBondContact O-CB 3.35Å; E637-L641 WeakPolarHBondContact O-CG 3.41Å; E637-L641 PolarHBondContact O-N 3.26Å; R638-L641 PolarHBondContact O-N 3.16Å; L641-A645 PolarHBondContact O-N 2.91Å; L641-A645 VanDerWaalsContact O-N 3.12Å
642M87.9Confident90.8Very high106 Ų10684.3 Ų84.352%0.52244%0.44SS..Hα-helixtrans-65.1-54.2175.7-177.8165.7166.100111R638 K639 T640 L644 A645 D646R638-M642 WeakPolarHBondContact O-CB 3.27Å; R638-M642 PolarHBondContact O-N 3.12Å; K639-M642 PolarHBondContact O-N 3.19Å; T640-M642 VanDerWaalsContact C-N 3.34Å; T640-M642 PolarHBondContact O-N 3.38Å; M642-L644 PolarHBondContact O-N 3.44Å; M642-L644 VanDerWaalsContact O-N 3.16Å; M642-A645 WeakPolarHBondContact O-CA 3.24Å; M642-A645 WeakPolarHBondContact O-CB 3.44Å; M642-A645 PolarHBondContact O-N 2.97Å; M642-D646 PolarHBondContact O-N 2.98Å
643H89.4Confident90.6Very high122 Ų12286.9 Ų86.957%0.56545%0.453SS*.Hα-helixtrans-59-32.7178.2-60.3165.4000113K639 A647K639-H643 VanDerWaalsContact O-CG 3.26Å; K639-H643 PolarHBondContact O-N 3.06Å; H643-A647 WeakPolarHBondContact O-CB 3.41Å; H643-A647 PolarHBondContact O-N 3.37Å
644L90.9Very high90.7Very high111 Ų11188.8 Ų88.858%0.58146%0.462SS*.Hα-helixtrans-68.9-33.9173.6-100.265.8000112.9T640 M642 A648T640-L644 HydrophobicContact CG2-CD1 4.17Å; T640-L644 WeakPolarHBondContact O-CB 3.49Å; T640-L644 WeakPolarHBondContact O-CD1 3.27Å; T640-L644 PolarHBondContact O-N 3.43Å; M642-L644 PolarHBondContact O-N 3.44Å; M642-L644 VanDerWaalsContact O-N 3.16Å; L644-A648 WeakPolarHBondContact O-CB 3.43Å; L644-A648 PolarHBondContact O-N 3.36Å; L644-A648 VanDerWaalsContact O-N 3.16Å
645A89.1Confident90.7Very high54 Ų5489 Ų8945%0.44646%0.463SS..Hα-helixtrans-71.2-47.2173.500000110.9L641 M642 A647 A648 E649L641-A645 PolarHBondContact O-N 2.91Å; L641-A645 VanDerWaalsContact O-N 3.12Å; M642-A645 WeakPolarHBondContact O-CA 3.24Å; M642-A645 WeakPolarHBondContact O-CB 3.44Å; M642-A645 PolarHBondContact O-N 2.97Å; A645-A647 VanDerWaalsContact C-N 3.33Å; A645-A647 PolarHBondContact O-N 2.92Å; A645-A648 CarbonylContact O-C 3.6Å; A645-A648 WeakPolarHBondContact O-CA 3.45Å; A645-A648 WeakPolarHBondContact O-CB 3.36Å; A645-A648 PolarHBondContact O-N 2.95Å; A645-E649 PolarHBondContact O-N 3.14Å
646D90.9Very high90.4Very high66 Ų6692.8 Ų92.835%0.35349%0.486SS..Hα-helixtrans-58.4-45.4177.9-52.4-31.3000110.7M642 A648 E649 V650M642-D646 PolarHBondContact O-N 2.98Å; D646-A648 VanDerWaalsContact C-N 3.27Å; D646-A648 PolarHBondContact O-N 3.18Å; D646-E649 PolarHBondContact O-N 3.48Å; D646-V650 WeakPolarHBondContact O-CG2 3.5Å; D646-V650 PolarHBondContact O-N 3.33Å
647A92.1Very high90.1Very high50 Ų5091.7 Ų91.741%0.41348%0.484SS..Hα-helixtrans-71.2-16175.900000114.3H643 A645 R651H643-A647 WeakPolarHBondContact O-CB 3.41Å; H643-A647 PolarHBondContact O-N 3.37Å; A645-A647 VanDerWaalsContact C-N 3.33Å; A645-A647 PolarHBondContact O-N 2.92Å; A647-R651 WeakPolarHBondContact O-CG 3.43Å; A647-R651 PolarHBondContact O-NE 3.44Å
648A92.4Very high89.6Confident40 Ų4090.9 Ų90.933%0.33149%0.489SS..Hα-helixtrans-82.4-44.3168.600000110.8L644 A645 D646 R651 V652L644-A648 WeakPolarHBondContact O-CB 3.43Å; L644-A648 PolarHBondContact O-N 3.36Å; L644-A648 VanDerWaalsContact O-N 3.16Å; A645-A648 CarbonylContact O-C 3.6Å; A645-A648 WeakPolarHBondContact O-CA 3.45Å; A645-A648 WeakPolarHBondContact O-CB 3.36Å; A645-A648 PolarHBondContact O-N 2.95Å; D646-A648 VanDerWaalsContact C-N 3.27Å; D646-A648 PolarHBondContact O-N 3.18Å; A648-R651 PolarHBondContact O-N 3.38Å; A648-V652 WeakPolarHBondContact O-CG2 3.44Å; A648-V652 PolarHBondContact O-N 3.49Å
649E91.9Very high89.1Confident137 Ų13796.6 Ų96.664%0.6452%0.515SS*.Hα-helixtrans-62.3-45178-174159.9-158.100111.7A645 D646 R651 V652 Q653A645-E649 PolarHBondContact O-N 3.14Å; D646-E649 PolarHBondContact O-N 3.48Å; E649-R651 VanDerWaalsContact C-N 3.29Å; E649-R651 PolarHBondContact O-N 2.71Å; E649-V652 PolarHBondContact O-N 3.05Å; E649-Q653 WeakPolarHBondContact O-CB 3.11Å; E649-Q653 PolarHBondContact O-N 2.76Å
650V91.4Very high88.5Confident92 Ų9296.5 Ų96.556%0.55852%0.522SS*.Hα-helixtrans-57.4-40.6173.3169.90000111.9D646 Q653 Q654D646-V650 WeakPolarHBondContact O-CG2 3.5Å; D646-V650 PolarHBondContact O-N 3.33Å; V650-Q653 PolarHBondContact O-N 3.28Å; V650-Q654 VanDerWaalsContact O-CB 3.31Å; V650-Q654 WeakPolarHBondContact O-CB 3.38Å; V650-Q654 PolarHBondContact O-N 3.13Å
651R91Very high87.7Confident158 Ų15899.3 Ų99.360%0.59653%0.528SS*.Hα-helixtrans-70.7-40.5177.5-76.7-174.3-67.3169.32.7112.5A647 A648 E649 Q653 Q654 Q655A647-R651 WeakPolarHBondContact O-CG 3.43Å; A647-R651 PolarHBondContact O-NE 3.44Å; A648-R651 PolarHBondContact O-N 3.38Å; E649-R651 VanDerWaalsContact C-N 3.29Å; E649-R651 PolarHBondContact O-N 2.71Å; R651-Q653 VanDerWaalsContact C-N 3.32Å; R651-Q654 PolarHBondContact O-N 2.86Å; R651-Q655 WeakPolarHBondContact O-CB 3.42Å; R651-Q655 VanDerWaalsContact O-CG 3.3Å; R651-Q655 WeakPolarHBondContact O-CG 3.41Å; R651-Q655 PolarHBondContact O-N 3.42Å
652V91.4Very high86.5Confident84 Ų84100.9 Ų100.951%0.50954%0.536SS..Hα-helixtrans-63.4-40.3173.5171.80000110.5A648 E649 Q655 T656A648-V652 WeakPolarHBondContact O-CG2 3.44Å; A648-V652 PolarHBondContact O-N 3.49Å; E649-V652 PolarHBondContact O-N 3.05Å; V652-Q655 PolarHBondContact O-N 2.97Å; V652-T656 VanDerWaalsContact O-CB 3.3Å; V652-T656 WeakPolarHBondContact O-CB 3.45Å; V652-T656 PolarHBondContact O-N 3.49Å; V652-T656 PolarHBondContact O-OG1 3.07Å
653Q90.5Very high85.5Confident137 Ų13799 Ų9964%0.6453%0.533SS*.Hα-helixtrans-69.2-38.3177.5-165.2172.124.200112E649 V650 R651 T656 A657E649-Q653 WeakPolarHBondContact O-CB 3.11Å; E649-Q653 PolarHBondContact O-N 2.76Å; V650-Q653 PolarHBondContact O-N 3.28Å; R651-Q653 VanDerWaalsContact C-N 3.32Å; Q653-T656 PolarHBondContact O-N 2.92Å; Q653-A657 WeakPolarHBondContact O-CB 3.18Å; Q653-A657 PolarHBondContact O-N 3.21Å
654Q90.1Very high84.2Confident138 Ų13895.7 Ų95.765%0.64552%0.524SS*.Hα-helixtrans-66.6-43.6173.9-169.7177.730.200112V650 R651 T656 A657 A658V650-Q654 VanDerWaalsContact O-CB 3.31Å; V650-Q654 WeakPolarHBondContact O-CB 3.38Å; V650-Q654 PolarHBondContact O-N 3.13Å; R651-Q654 PolarHBondContact O-N 2.86Å; Q654-T656 VanDerWaalsContact C-N 3.34Å; Q654-A657 PolarHBondContact O-N 3.07Å; Q654-A658 WeakPolarHBondContact O-CB 3.13Å; Q654-A658 PolarHBondContact O-N 3.11Å
655Q88.3Confident82.9Confident138 Ų13895 Ų9565%0.64552%0.518SS*.Hα-helixtrans-61.7-40.8171.7-75176.3-1300111.8R651 V652 A658 K659R651-Q655 WeakPolarHBondContact O-CB 3.42Å; R651-Q655 VanDerWaalsContact O-CG 3.3Å; R651-Q655 WeakPolarHBondContact O-CG 3.41Å; R651-Q655 PolarHBondContact O-N 3.42Å; V652-Q655 PolarHBondContact O-N 2.97Å; Q655-A658 PolarHBondContact O-N 3.06Å; Q655-K659 VanDerWaalsContact O-CB 3.31Å; Q655-K659 WeakPolarHBondContact O-CB 3.35Å; Q655-K659 PolarHBondContact O-N 2.8Å
656T87.5Confident81.7Confident78 Ų7897.1 Ų97.148%0.47952%0.521SS..Hα-helixtrans-64.8-47176.1-55.90000110.8V652 Q653 Q654 A658 K659 T660V652-T656 VanDerWaalsContact O-CB 3.3Å; V652-T656 WeakPolarHBondContact O-CB 3.45Å; V652-T656 PolarHBondContact O-N 3.49Å; V652-T656 PolarHBondContact O-OG1 3.07Å; Q653-T656 PolarHBondContact O-N 2.92Å; Q654-T656 VanDerWaalsContact C-N 3.34Å; T656-A658 VanDerWaalsContact C-N 3.34Å; T656-A658 PolarHBondContact O-N 2.81Å; T656-K659 PolarHBondContact O-N 3.17Å; T656-T660 WeakPolarHBondContact O-CB 3.41Å; T656-T660 PolarHBondContact O-N 2.84Å; T656-T660 PolarHBondContact O-OG1 2.85Å
657A84.1Confident80.2Confident61 Ų6196.8 Ų96.850%0.50452%0.523SS..Hα-helixtrans-61.3-40.8176.800000112.3Q653 Q654 K661Q653-A657 WeakPolarHBondContact O-CB 3.18Å; Q653-A657 PolarHBondContact O-N 3.21Å; Q654-A657 PolarHBondContact O-N 3.07Å; A657-K661 VanDerWaalsContact O-CB 3.26Å; A657-K661 WeakPolarHBondContact O-CB 3.47Å; A657-K661 PolarHBondContact O-N 2.76Å
658A81.8Confident78.3Confident52 Ų5299.2 Ų99.243%0.4353%0.529SS..Hα-helixtrans-64.2-43.7173.300000112Q654 Q655 T656 K661 L662Q654-A658 WeakPolarHBondContact O-CB 3.13Å; Q654-A658 PolarHBondContact O-N 3.11Å; Q655-A658 PolarHBondContact O-N 3.06Å; T656-A658 VanDerWaalsContact C-N 3.34Å; T656-A658 PolarHBondContact O-N 2.81Å; A658-K661 PolarHBondContact O-N 3.26Å; A658-L662 WeakPolarHBondContact O-CB 3.38Å; A658-L662 PolarHBondContact O-N 2.77Å
659K80.9Confident76.6Confident163 Ų163104.1 Ų104.171%0.70955%0.549SS*.Hα-helixtrans-64.5-41.1176.3-176171.7-179.6174.30112.1Q655 T656 S663Q655-K659 VanDerWaalsContact O-CB 3.31Å; Q655-K659 WeakPolarHBondContact O-CB 3.35Å; Q655-K659 PolarHBondContact O-N 2.8Å; T656-K659 PolarHBondContact O-N 3.17Å; K659-S663 VanDerWaalsContact O-CB 3.23Å; K659-S663 WeakPolarHBondContact O-CB 3.21Å; K659-S663 PolarHBondContact O-N 3.11Å
660T76.6Confident74.8Confident87 Ų87102.6 Ų102.653%0.53455%0.545SS..Hα-helixtrans-66.4-39.1174.3-61.70000111.3T656 S663 S664T656-T660 WeakPolarHBondContact O-CB 3.41Å; T656-T660 PolarHBondContact O-N 2.84Å; T656-T660 PolarHBondContact O-OG1 2.85Å; T660-S663 PolarHBondContact O-N 3.42Å; T660-S664 WeakPolarHBondContact O-CB 3.5Å; T660-S664 PolarHBondContact O-N 2.95Å; T660-S664 PolarHBondContact O-OG 3.38Å
661K74.1Confident73Confident140 Ų140103.5 Ų103.561%0.60955%0.551SS**Hα-helixtrans-69.3-36.6177.2-168.4174-176.6179.80112.9A657 A658 S664 Q665A657-K661 VanDerWaalsContact O-CB 3.26Å; A657-K661 WeakPolarHBondContact O-CB 3.47Å; A657-K661 PolarHBondContact O-N 2.76Å; A658-K661 PolarHBondContact O-N 3.26Å; K661-S664 PolarHBondContact O-OG 2.91Å; K661-S664 VanDerWaalsContact O-OG 3.06Å; K661-Q665 WeakPolarHBondContact O-CB 3.48Å; K661-Q665 VanDerWaalsContact O-CG 3.25Å; K661-Q665 WeakPolarHBondContact O-CG 3.49Å; K661-Q665 PolarHBondContact O-N 3Å
662L64.9Low70.8Confident104 Ų104105.2 Ų105.255%0.54556%0.557SS.*Hα-helixtrans-67.2-43.4168.6-81.5167.2000111.3A658 S664 Q665 I666A658-L662 WeakPolarHBondContact O-CB 3.38Å; A658-L662 PolarHBondContact O-N 2.77Å; L662-S664 VanDerWaalsContact C-N 3.34Å; L662-S664 PolarHBondContact O-N 3.45Å; L662-Q665 PolarHBondContact O-N 3.5Å; L662-I666 VanDerWaalsContact O-CG1 3.26Å; L662-I666 WeakPolarHBondContact O-CG1 3.24Å; L662-I666 PolarHBondContact O-N 3.03Å
663S66.2Low68.4Low67 Ų67106.6 Ų106.647%0.46957%0.568SS.*Hα-helixtrans-63.3-39.1177.8-168.40000112.1K659 T660 I666 S667K659-S663 VanDerWaalsContact O-CB 3.23Å; K659-S663 WeakPolarHBondContact O-CB 3.21Å; K659-S663 PolarHBondContact O-N 3.11Å; T660-S663 PolarHBondContact O-N 3.42Å; S663-I666 PolarHBondContact O-N 3.23Å; S663-S667 PolarHBondContact O-N 2.73Å; S663-S667 PolarHBondContact O-OG 2.91Å
664S61.8Low66.3Low53 Ų53106.2 Ų106.237%0.37158%0.575SS.*Hα-helixtrans-68.9-42.117570.30000110.9T660 K661 L662 I666 S667 D668T660-S664 WeakPolarHBondContact O-CB 3.5Å; T660-S664 PolarHBondContact O-N 2.95Å; T660-S664 PolarHBondContact O-OG 3.38Å; K661-S664 PolarHBondContact O-OG 2.91Å; K661-S664 VanDerWaalsContact O-OG 3.06Å; L662-S664 VanDerWaalsContact C-N 3.34Å; L662-S664 PolarHBondContact O-N 3.45Å; S664-I666 VanDerWaalsContact C-N 3.3Å; S664-I666 PolarHBondContact O-N 3.31Å; S664-S667 CarbonylContact O-C 3.51Å; S664-S667 PolarHBondContact O-N 2.88Å; S664-S667 VanDerWaalsContact O-N 3.16Å; S664-D668 WeakPolarHBondContact O-CB 3.35Å; S664-D668 VanDerWaalsContact O-CG 3.22Å; S664-D668 PolarHBondContact O-N 2.75Å
665Q64.3Low64.1Low97 Ų97104 Ų10445%0.45357%0.573SS.*Hα-helixtrans-60-37.7173.3-76.4174.6-22.800112.7K661 L662 L669K661-Q665 WeakPolarHBondContact O-CB 3.48Å; K661-Q665 VanDerWaalsContact O-CG 3.25Å; K661-Q665 WeakPolarHBondContact O-CG 3.49Å; K661-Q665 PolarHBondContact O-N 3Å; L662-Q665 PolarHBondContact O-N 3.5Å; Q665-L669 WeakPolarHBondContact O-CB 3.37Å; Q665-L669 VanDerWaalsContact O-CG 3.23Å; Q665-L669 WeakPolarHBondContact O-CG 3.41Å; Q665-L669 PolarHBondContact O-N 2.92Å
666I62.5Low62Low98 Ų98101.8 Ų101.850%0.50358%0.578SS.*Hα-helixtrans-69.1-41.7174.3-67.8162.7000110.8L662 S663 S664 L669 L670L662-I666 VanDerWaalsContact O-CG1 3.26Å; L662-I666 WeakPolarHBondContact O-CG1 3.24Å; L662-I666 PolarHBondContact O-N 3.03Å; S663-I666 PolarHBondContact O-N 3.23Å; S664-I666 VanDerWaalsContact C-N 3.3Å; S664-I666 PolarHBondContact O-N 3.31Å; I666-L669 PolarHBondContact O-N 3.29Å; I666-L670 HydrophobicContact CG2-CD1 4.22Å; I666-L670 VanDerWaalsContact O-CG 3.31Å; I666-L670 WeakPolarHBondContact O-CG 3.3Å; I666-L670 PolarHBondContact O-N 3.2Å; I666-L670 VanDerWaalsContact O-N 3.15Å
667S59.5Low59.9Low59 Ų59105.5 Ų105.541%0.41359%0.594SS.*Hα-helixtrans-65.2-38.2173.5-67.20000112.9S663 S664 L670 T671S663-S667 PolarHBondContact O-N 2.73Å; S663-S667 PolarHBondContact O-OG 2.91Å; S664-S667 CarbonylContact O-C 3.51Å; S664-S667 PolarHBondContact O-N 2.88Å; S664-S667 VanDerWaalsContact O-N 3.16Å; S667-L670 CarbonylContact O-C 3.58Å; S667-L670 PolarHBondContact O-N 2.91Å; S667-L670 VanDerWaalsContact O-N 3.13Å; S667-T671 WeakPolarHBondContact O-CB 3.23Å; S667-T671 PolarHBondContact O-N 3.23Å; S667-T671 PolarHBondContact O-OG1 3.31Å
668D52.9Low58.3Low100 Ų100110 Ų11054%0.53561%0.61SS.*Hα-helixtrans-66-40.1175.6-71.7-37.1000110.8S664 L670 T671 R672S664-D668 WeakPolarHBondContact O-CB 3.35Å; S664-D668 VanDerWaalsContact O-CG 3.22Å; S664-D668 PolarHBondContact O-N 2.75Å; D668-L670 PolarHBondContact O-N 3.15Å; D668-T671 PolarHBondContact O-N 3.17Å; D668-T671 VanDerWaalsContact O-N 3.16Å; D668-R672 VanDerWaalsContact O-CB 3.22Å; D668-R672 WeakPolarHBondContact O-CB 3.28Å; D668-R672 PolarHBondContact O-N 3.43Å
669L55.8Low56.6Low143 Ų143112.9 Ų112.975%0.74963%0.627SS**Hα-helixtrans-63.3-24.2171.8-75.6167.7000113.3Q665 I666Q665-L669 WeakPolarHBondContact O-CB 3.37Å; Q665-L669 VanDerWaalsContact O-CG 3.23Å; Q665-L669 WeakPolarHBondContact O-CG 3.41Å; Q665-L669 PolarHBondContact O-N 2.92Å; I666-L669 PolarHBondContact O-N 3.29Å
670L55.7Low55.1Low106 Ų106109.6 Ų109.656%0.55564%0.64SS**Hα-helixtrans-92-13.6175.2-67.4167.3000113.7I666 S667 D668 F686I666-L670 HydrophobicContact CG2-CD1 4.22Å; I666-L670 VanDerWaalsContact O-CG 3.31Å; I666-L670 WeakPolarHBondContact O-CG 3.3Å; I666-L670 PolarHBondContact O-N 3.2Å; I666-L670 VanDerWaalsContact O-N 3.15Å; S667-L670 CarbonylContact O-C 3.58Å; S667-L670 PolarHBondContact O-N 2.91Å; S667-L670 VanDerWaalsContact O-N 3.13Å; D668-L670 PolarHBondContact O-N 3.15Å; L670-F686 HydrophobicContact CD2-CD1 4.39Å; L670-F686 HydrophobicContact CD2-CE1 3.72Å; L670-F686 HydrophobicContact CD2-CZ 3.99Å
671T53.7Low53.7Low111 Ų111108.8 Ų108.868%0.68165%0.649SS**Hα-helixtrans-117.5-18.4-172.4-45.30000113.2S667 D668S667-T671 WeakPolarHBondContact O-CB 3.23Å; S667-T671 PolarHBondContact O-N 3.23Å; S667-T671 PolarHBondContact O-OG1 3.31Å; D668-T671 PolarHBondContact O-N 3.17Å; D668-T671 VanDerWaalsContact O-N 3.16Å
672R43.2Very low52.5Low193 Ų193105.9 Ų105.973%0.72866%0.658SS**SBendtrans-79.6127.5176.9-163.8-177-169.5-149.21110.6D668 T674D668-R672 VanDerWaalsContact O-CB 3.22Å; D668-R672 WeakPolarHBondContact O-CB 3.28Å; D668-R672 PolarHBondContact O-N 3.43Å; R672-T674 PolarHBondContact O-N 2.77Å
673P41.5Very low52Low113 Ų113108.9 Ų108.973%0.73467%0.667SS**PPolyproline II helixtrans-56.9132.7165-21.733000109.8
674T47.7Very low51.5Low130 Ų130112.1 Ų112.180%0.79868%0.678SS**PPolyproline II helixtrans-58.8135.2173.229.10000109.9R672 A676R672-T674 PolarHBondContact O-N 2.77Å; T674-A676 PolarHBondContact O-N 3.06Å
675P43.3Very low51.1Low90 Ų90114.3 Ų114.358%0.58469%0.691SS**PPolyproline II helixtrans-59.6139.4163.628.5-33.5000108.1L677P675-L677 PolarHBondContact O-N 3.31Å
676A44.8Very low50.5Low93 Ų93117.1 Ų117.177%0.76970%0.702SS**  trans-68.398.3-177.500000110.7T674T674-A676 PolarHBondContact O-N 3.06Å
677L43.1Very low50.5Low155 Ų155116.4 Ų116.481%0.81270%0.702SS**  trans-76.3120.5158.9-105.679000108.3P675 S679P675-L677 PolarHBondContact O-N 3.31Å; L677-S679 PolarHBondContact O-N 3.01Å
678N50.3Low50.8Low155 Ų155116.2 Ų116.283%0.82969%0.694SS**  trans-71.989.1171.1-74.90000110.1
679S45.9Very low52Low114 Ų114116.2 Ų116.280%0.79770%0.698SS**SBendtrans-161.1140.1158.2-82.20000110.7L677 G681L677-S679 PolarHBondContact O-N 3.01Å; S679-G681 PolarHBondContact O-N 3.26Å
680G49.5Very low53.4Low94 Ų94112.1 Ų112.197%0.96968%0.678SS**  trans-71.7117.2-174.800000113.1
681G46.3Very low54.9Low70 Ų70114.2 Ų114.272%0.72268%0.683SS**  trans-158.2132.1171.900000110.1S679S679-G681 PolarHBondContact O-N 3.26Å
682G50.6Low56.4Low78 Ų78116 Ų11680%0.80468%0.684SS**PPolyproline II helixtrans-64.7136.2-170.200000113.7L684G682-L684 PolarHBondContact O-N 2.65Å
683K53.8Low58.6Low167 Ų167109 Ų10973%0.72666%0.662SS**PPolyproline II helixtrans-61127.7177.1-68.5-176.3179.1178.70111.2
684L55.7Low61Low135 Ų135105.6 Ų105.671%0.70764%0.644SS**PPolyproline II helixtrans-71.5151.8175.7-70.9174.2000111.3G682 F686 T687G682-L684 PolarHBondContact O-N 2.65Å; L684-F686 PolarHBondContact O-N 3.12Å; L684-T687 PolarHBondContact O-N 3.27Å; L684-T687 PolarHBondContact O-OG1 3.26Å
685P53.5Low63Low99 Ų99103.9 Ų103.964%0.64363%0.627SS**G310 helixtrans-64.3-12.6-167.924.1-35.1000115.7T687 F688P685-T687 PolarHBondContact O-N 3.06Å; P685-T687 VanDerWaalsContact O-N 3.12Å; P685-F688 PolarHBondContact O-N 3.13Å
686F51.3Low65.3Low157 Ų157102.1 Ų102.169%0.68962%0.62SS**G310 helixtrans-62.9-18.1-178.9-148.7-86000113.6L670 L684 F688L670-F686 HydrophobicContact CD2-CD1 4.39Å; L670-F686 HydrophobicContact CD2-CE1 3.72Å; L670-F686 HydrophobicContact CD2-CZ 3.99Å; L684-F686 PolarHBondContact O-N 3.12Å; F686-F688 VanDerWaalsContact C-N 3.31Å; F686-F688 PolarHBondContact O-N 3.4Å
687T61.9Low67.7Low82 Ų8298.9 Ų98.950%0.50359%0.59SS.*G310 helixtrans-78-6-179.561.40000115.1L684 P685L684-T687 PolarHBondContact O-N 3.27Å; L684-T687 PolarHBondContact O-OG1 3.26Å; P685-T687 PolarHBondContact O-N 3.06Å; P685-T687 VanDerWaalsContact O-N 3.12Å
688F65.8Low70.1Confident55 Ų5594.7 Ų94.724%0.24157%0.573CS.*SBendtrans-100.5-22.2-174-70.9-82.3000114.8P685 F686 T690 A737 A740P685-F688 PolarHBondContact O-N 3.13Å; F686-F688 VanDerWaalsContact C-N 3.31Å; F686-F688 PolarHBondContact O-N 3.4Å; F688-T690 VanDerWaalsContact C-N 3.34Å; F688-T690 PolarHBondContact O-N 3.47Å; F688-A737 HydrophobicContact CB-CB 4.18Å; F688-A737 HydrophobicContact CD1-CB 3.84Å; F688-A737 HydrophobicContact CD2-CB 3.84Å; F688-A737 HydrophobicContact CE1-CB 4.2Å; F688-A737 HydrophobicContact CE2-CB 4.19Å; F688-A737 HydrophobicContact CG-CB 3.66Å; F688-A737 HydrophobicContact CZ-CB 4.36Å; F688-A740 HydrophobicContact CE1-CB 3.58Å; F688-A740 HydrophobicContact CZ-CB 3.54Å
689V79.5Confident72.3Confident101 Ų10192.3 Ų92.361%0.61256%0.561SS**SBendtrans-95.769.2175.2-170.40000108.5V733V689-V733 HydrophobicContact CG2-CG1 4.4Å
690T84.5Confident74.6Confident56 Ų5689.8 Ų89.834%0.34454%0.543SS..  trans-69.3163.1172.770.30000110.3F688 E692 V693 A694F688-T690 VanDerWaalsContact C-N 3.34Å; F688-T690 PolarHBondContact O-N 3.47Å; T690-E692 PolarHBondContact O-N 3.29Å; T690-E692 PolarHBondContact OG1-N 3.12Å; T690-V693 PolarHBondContact O-N 3.44Å; T690-V693 VanDerWaalsContact O-N 3.13Å; T690-V693 WeakPolarHBondContact OG1-CG2 3.48Å; T690-V693 PolarHBondContact OG1-N 2.98Å; T690-A694 PolarHBondContact O-N 3.43Å
691K86.5Confident76.8Confident151 Ų15187 Ų8766%0.65751%0.505SS*.Hα-helixtrans-51.3-42.3171.8-178.8-173.7163.9-169.50111.6A694 E695K691-A694 PolarHBondContact O-N 3.24Å; K691-E695 WeakPolarHBondContact CE-OE1 3.37Å; K691-E695 WeakPolarHBondContact CE-OE2 3.13Å; K691-E695 HydrophobicContact CG-CG 4.42Å; K691-E695 IonicContact NZ-OE1 3.4Å; K691-E695 PolarHBondContact NZ-OE1 3.01Å; K691-E695 WeakPolarHBondContact O-CB 3.46Å; K691-E695 WeakPolarHBondContact O-CG 3.31Å; K691-E695 PolarHBondContact O-N 3.36Å
692E86.3Confident79.2Confident148 Ų14889.3 Ų89.369%0.69250%0.5SS*.Hα-helixtrans-64.9-40-179.5-60.4163.6166.700112T690 E695 A696T690-E692 PolarHBondContact O-N 3.29Å; T690-E692 PolarHBondContact OG1-N 3.12Å; E692-E695 PolarHBondContact O-N 3.14Å; E692-A696 VanDerWaalsContact O-CB 3.24Å; E692-A696 WeakPolarHBondContact O-CB 3.39Å; E692-A696 PolarHBondContact O-N 2.98Å
693V89.3Confident81.3Confident45 Ų4587.9 Ų87.927%0.27348%0.481SS..Hα-helixtrans-67.1-37.5175.4170.60000111.3T690 T697 V733T690-V693 PolarHBondContact O-N 3.44Å; T690-V693 VanDerWaalsContact O-N 3.13Å; T690-V693 WeakPolarHBondContact OG1-CG2 3.48Å; T690-V693 PolarHBondContact OG1-N 2.98Å; V693-T697 WeakPolarHBondContact O-CB 3.49Å; V693-T697 PolarHBondContact O-N 2.95Å; V693-T697 PolarHBondContact O-OG1 3.06Å; V693-V733 HydrophobicContact CG1-CG2 3.6Å
694A91Very high83.3Confident43 Ų4381.2 Ų81.236%0.35545%0.452SS..Hα-helixtrans-67.2-45.6173.100000112T690 K691 T697 C698T690-A694 PolarHBondContact O-N 3.43Å; K691-A694 PolarHBondContact O-N 3.24Å; A694-T697 WeakPolarHBondContact O-CB 3.37Å; A694-T697 PolarHBondContact O-N 3.42Å; A694-C698 PolarHBondContact O-N 3.32Å; A694-C698 PolarHBondContact O-SG 3.29Å; A694-C698 VanDerWaalsContact O-SG 3.37Å
695E91.4Very high85.1Confident93 Ų9376.1 Ų76.144%0.43543%0.43SS..Hα-helixtrans-64-42177.3-74.6176.3153.200111.8K691 E692 C698 N699K691-E695 WeakPolarHBondContact CE-OE1 3.37Å; K691-E695 WeakPolarHBondContact CE-OE2 3.13Å; K691-E695 HydrophobicContact CG-CG 4.42Å; K691-E695 IonicContact NZ-OE1 3.4Å; K691-E695 PolarHBondContact NZ-OE1 3.01Å; K691-E695 WeakPolarHBondContact O-CB 3.46Å; K691-E695 WeakPolarHBondContact O-CG 3.31Å; K691-E695 PolarHBondContact O-N 3.36Å; E692-E695 PolarHBondContact O-N 3.14Å; E695-C698 PolarHBondContact O-N 3.39Å; E695-N699 WeakPolarHBondContact O-CB 3.34Å; E695-N699 VanDerWaalsContact O-CG 3.25Å; E695-N699 PolarHBondContact O-N 2.96Å; E695-N699 PolarHBondContact O-ND2 3.46Å; E695-N699 VanDerWaalsContact O-ND2 3.11Å
696A91.3Very high87.1Confident53 Ų5376.3 Ų76.344%0.43842%0.422SS..Hα-helixtrans-60.5-44.2172.600000112E692 N699 C700E692-A696 VanDerWaalsContact O-CB 3.24Å; E692-A696 WeakPolarHBondContact O-CB 3.39Å; E692-A696 PolarHBondContact O-N 2.98Å; A696-N699 PolarHBondContact O-N 2.87Å; A696-C700 PolarHBondContact O-N 3.32Å; A696-C700 PolarHBondContact O-SG 3.06Å; A696-C700 VanDerWaalsContact O-SG 3.38Å
697T93.5Very high89Confident25 Ų2572.4 Ų72.415%0.15341%0.406CS..Hα-helixtrans-60.2-48.9175.8-60.50000111V693 A694 N699 C700 L701 F726 C729V693-T697 WeakPolarHBondContact O-CB 3.49Å; V693-T697 PolarHBondContact O-N 2.95Å; V693-T697 PolarHBondContact O-OG1 3.06Å; A694-T697 WeakPolarHBondContact O-CB 3.37Å; A694-T697 PolarHBondContact O-N 3.42Å; T697-N699 VanDerWaalsContact C-N 3.32Å; T697-N699 PolarHBondContact O-N 2.97Å; T697-C700 WeakPolarHBondContact O-CB 2.81Å; T697-C700 PolarHBondContact O-N 3.33Å; T697-L701 WeakPolarHBondContact O-CG 3.42Å; T697-L701 PolarHBondContact O-N 2.97Å; T697-L701 VanDerWaalsContact O-N 3.12Å; T697-F726 HydrophobicContact CG2-CD2 4.17Å; T697-F726 HydrophobicContact CG2-CE2 4.32Å; T697-C729 HydrophobicContact CG2-CB 3.76Å
698C95.1Very high90.5Very high67 Ų6768.5 Ų68.545%0.45338%0.382SS..Hα-helixtrans-58.1-42.9176.5-720000112.2A694 E695 C700 L701 L702A694-C698 PolarHBondContact O-N 3.32Å; A694-C698 PolarHBondContact O-SG 3.29Å; A694-C698 VanDerWaalsContact O-SG 3.37Å; E695-C698 PolarHBondContact O-N 3.39Å; C698-C700 VanDerWaalsContact C-N 3.34Å; C698-C700 PolarHBondContact O-N 2.92Å; C698-L701 PolarHBondContact O-N 3.39Å; C698-L701 VanDerWaalsContact O-N 3.16Å; C698-L702 VanDerWaalsContact O-CD1 3.24Å; C698-L702 WeakPolarHBondContact O-CD1 3.49Å; C698-L702 PolarHBondContact O-N 2.9Å
699N95.8Very high91.7Very high106 Ų10671.6 Ų71.657%0.56740%0.401SS*.Hα-helixtrans-62.6-38.1177.7-72.6-33.5000112.4E695 A696 T697 L702 A703E695-N699 WeakPolarHBondContact O-CB 3.34Å; E695-N699 VanDerWaalsContact O-CG 3.25Å; E695-N699 PolarHBondContact O-N 2.96Å; E695-N699 PolarHBondContact O-ND2 3.46Å; E695-N699 VanDerWaalsContact O-ND2 3.11Å; A696-N699 PolarHBondContact O-N 2.87Å; T697-N699 VanDerWaalsContact C-N 3.32Å; T697-N699 PolarHBondContact O-N 2.97Å; N699-L702 PolarHBondContact O-N 3.16Å; N699-A703 WeakPolarHBondContact O-CB 3.48Å; N699-A703 PolarHBondContact O-N 2.86Å
700C94.4Very high92.4Very high61 Ų6173.7 Ų73.741%0.41240%0.402SS..Hα-helixtrans-61.8-43.1172.1-67.40000112.2A696 T697 C698 A703 Q704A696-C700 PolarHBondContact O-N 3.32Å; A696-C700 PolarHBondContact O-SG 3.06Å; A696-C700 VanDerWaalsContact O-SG 3.38Å; T697-C700 WeakPolarHBondContact O-CB 2.81Å; T697-C700 PolarHBondContact O-N 3.33Å; C698-C700 VanDerWaalsContact C-N 3.34Å; C698-C700 PolarHBondContact O-N 2.92Å; C700-A703 PolarHBondContact O-N 3.35Å; C700-Q704 WeakPolarHBondContact O-CB 3.47Å; C700-Q704 PolarHBondContact O-N 2.8Å
701L96.5Very high92.7Very high35 Ų3576.6 Ų76.618%0.18341%0.41CS..Hα-helixtrans-64.7-42.3177.8-59-177000112.2T697 C698 Q704 A705 I722 E725 F726T697-L701 WeakPolarHBondContact O-CG 3.42Å; T697-L701 PolarHBondContact O-N 2.97Å; T697-L701 VanDerWaalsContact O-N 3.12Å; C698-L701 PolarHBondContact O-N 3.39Å; C698-L701 VanDerWaalsContact O-N 3.16Å; L701-Q704 PolarHBondContact O-N 2.9Å; L701-A705 PolarHBondContact O-N 3.32Å; L701-I722 HydrophobicContact CB-CG2 4.24Å; L701-I722 HydrophobicContact CD2-CG2 4.06Å; L701-I722 WeakPolarHBondContact CD2-O 3.49Å; L701-E725 HydrophobicContact CD2-CB 4.27Å; L701-F726 HydrophobicContact CD1-CD2 4.06Å; L701-F726 HydrophobicContact CD2-CB 3.77Å; L701-F726 HydrophobicContact CD2-CD2 4.45Å
702L95.7Very high92.9Very high118 Ų11872.8 Ų72.862%0.61841%0.413SS*.Hα-helixtrans-64.4-44.5176.4-92.171.9000111.7C698 N699 Q704 A705 E706C698-L702 VanDerWaalsContact O-CD1 3.24Å; C698-L702 WeakPolarHBondContact O-CD1 3.49Å; C698-L702 PolarHBondContact O-N 2.9Å; N699-L702 PolarHBondContact O-N 3.16Å; L702-Q704 PolarHBondContact O-N 2.93Å; L702-A705 PolarHBondContact O-N 3.29Å; L702-E706 PolarHBondContact O-N 3.16Å
703A95.3Very high93.2Very high49 Ų4970.2 Ų70.241%0.40540%0.4SS..Hα-helixtrans-63.4-30176.500000112.7N699 C700 Q707N699-A703 WeakPolarHBondContact O-CB 3.48Å; N699-A703 PolarHBondContact O-N 2.86Å; C700-A703 PolarHBondContact O-N 3.35Å; A703-Q707 WeakPolarHBondContact O-CB 3.41Å; A703-Q707 WeakPolarHBondContact O-CG 3.44Å; A703-Q707 PolarHBondContact O-N 2.99Å; A703-Q707 PolarHBondContact O-NE2 2.99Å
704Q94.6Very high93.5Very high26 Ų2672 Ų7212%0.12141%0.414CS..Hα-helixtrans-79.4-36.6175.7-164.476-41.500112.6C700 L701 L702 Q707 A708 M721 E725C700-Q704 WeakPolarHBondContact O-CB 3.47Å; C700-Q704 PolarHBondContact O-N 2.8Å; L701-Q704 PolarHBondContact O-N 2.9Å; L702-Q704 PolarHBondContact O-N 2.93Å; Q704-Q707 PolarHBondContact O-N 3.18Å; Q704-A708 PolarHBondContact O-N 2.9Å; Q704-M721 VanDerWaalsContact CD-SD 3.53Å; Q704-M721 HydrophobicContact CG-CB 4.4Å; Q704-M721 HydrophobicContact CG-CG 3.5Å; Q704-M721 VanDerWaalsContact CG-CG 3.5Å; Q704-M721 HydrophobicContact CG-SD 3.66Å; Q704-M721 VanDerWaalsContact NE2-CG 3.34Å; Q704-E725 HydrophobicContact CB-CG 3.96Å; Q704-E725 VanDerWaalsContact CD-CG 3.46Å; Q704-E725 HydrophobicContact CG-CB 4.37Å; Q704-E725 HydrophobicContact CG-CG 3.48Å; Q704-E725 VanDerWaalsContact CG-CG 3.48Å; Q704-E725 PolarHBondContact NE2-OE1 3.45Å
705A94Very high93.5Very high29 Ų2977.4 Ų77.424%0.2443%0.43CS..Hα-helixtrans-60.1-49.9171.200000111.1L701 L702 Q707 A708 D709 I722L701-A705 PolarHBondContact O-N 3.32Å; L702-A705 PolarHBondContact O-N 3.29Å; A705-Q707 PolarHBondContact O-N 3.22Å; A705-A708 WeakPolarHBondContact O-CB 2.81Å; A705-A708 PolarHBondContact O-N 3.48Å; A705-D709 PolarHBondContact O-N 3.39Å; A705-I722 HydrophobicContact CB-CD1 3.72Å; A705-I722 HydrophobicContact CB-CG1 4.16Å
706E94.8Very high93.5Very high102 Ų10275.6 Ų75.648%0.47743%0.43SS..Hα-helixtrans-60.4-34.9177.7-159.9-149.9-166.400112L702 K710L702-E706 PolarHBondContact O-N 3.16Å; E706-K710 HydrophobicContact CG-CD 4.33Å; E706-K710 VanDerWaalsContact O-CB 3.31Å; E706-K710 WeakPolarHBondContact O-CB 3.47Å; E706-K710 VanDerWaalsContact O-CG 3.23Å; E706-K710 WeakPolarHBondContact O-CG 3.49Å; E706-K710 PolarHBondContact O-N 2.8Å; E706-K710 WeakPolarHBondContact OE1-CE 3.36Å; E706-K710 IonicContact OE1-NZ 2.67Å; E706-K710 PolarHBondContact OE1-NZ 2.85Å; E706-K710 IonicContact OE2-NZ 2.69Å; E706-K710 PolarHBondContact OE2-NZ 3.46Å
707Q92.3Very high93.6Very high76 Ų7674.2 Ų74.236%0.35542%0.419SS..Hα-helixtrans-69.5-31.7172.1-84.7-173.979.500114.1A703 Q704 A705 K711A703-Q707 WeakPolarHBondContact O-CB 3.41Å; A703-Q707 WeakPolarHBondContact O-CG 3.44Å; A703-Q707 PolarHBondContact O-N 2.99Å; A703-Q707 PolarHBondContact O-NE2 2.99Å; Q704-Q707 PolarHBondContact O-N 3.18Å; A705-Q707 PolarHBondContact O-N 3.22Å; Q707-K711 VanDerWaalsContact O-CB 3.3Å; Q707-K711 WeakPolarHBondContact O-CB 3.46Å; Q707-K711 WeakPolarHBondContact O-CD 3.21Å; Q707-K711 WeakPolarHBondContact O-CG 3.43Å; Q707-K711 PolarHBondContact O-N 3.49Å
708A93.1Very high93.5Very high0 Ų073.5 Ų73.50%042%0.416CS..Hα-helixtrans-69.9-42.5175.800000110.8Q704 A705 K711 G712 K713 A718 M721Q704-A708 PolarHBondContact O-N 2.9Å; A705-A708 WeakPolarHBondContact O-CB 2.81Å; A705-A708 PolarHBondContact O-N 3.48Å; A708-K711 CarbonylContact O-C 3.6Å; A708-K711 PolarHBondContact O-N 3.16Å; A708-G712 PolarHBondContact O-N 2.79Å; A708-K713 HydrophobicContact CB-CB 4.43Å; A708-K713 PolarHBondContact O-N 2.82Å; A708-A718 HydrophobicContact CB-CB 3.56Å; A708-M721 HydrophobicContact CB-SD 4.16Å
709D91.9Very high93.4Very high120 Ų12074.6 Ų74.664%0.64241%0.414SS*.Hα-helixtrans-64.4-48.3175.3-68.4-18.8000111.5A705 K711 G712A705-D709 PolarHBondContact O-N 3.39Å; D709-K711 PolarHBondContact O-N 2.88Å; D709-K711 VanDerWaalsContact O-N 3.14Å; D709-G712 PolarHBondContact O-N 2.68Å
710K93.4Very high93.3Very high145 Ų14576.7 Ų76.763%0.6341%0.414SS*.Hα-helixtrans-59.3-23.9174.2-76.2170.7179.8171.20113.7E706E706-K710 HydrophobicContact CG-CD 4.33Å; E706-K710 VanDerWaalsContact O-CB 3.31Å; E706-K710 WeakPolarHBondContact O-CB 3.47Å; E706-K710 VanDerWaalsContact O-CG 3.23Å; E706-K710 WeakPolarHBondContact O-CG 3.49Å; E706-K710 PolarHBondContact O-N 2.8Å; E706-K710 WeakPolarHBondContact OE1-CE 3.36Å; E706-K710 IonicContact OE1-NZ 2.67Å; E706-K710 PolarHBondContact OE1-NZ 2.85Å; E706-K710 IonicContact OE2-NZ 2.69Å; E706-K710 PolarHBondContact OE2-NZ 3.46Å
711K91.4Very high93.3Very high117 Ų11774.8 Ų74.851%0.50940%0.399SS..THydrogen-bonded Turntrans-96.18.9176.1-66.9166.3-162166.30112.6Q707 A708 D709 K713Q707-K711 VanDerWaalsContact O-CB 3.3Å; Q707-K711 WeakPolarHBondContact O-CB 3.46Å; Q707-K711 WeakPolarHBondContact O-CD 3.21Å; Q707-K711 WeakPolarHBondContact O-CG 3.43Å; Q707-K711 PolarHBondContact O-N 3.49Å; A708-K711 CarbonylContact O-C 3.6Å; A708-K711 PolarHBondContact O-N 3.16Å; D709-K711 PolarHBondContact O-N 2.88Å; D709-K711 VanDerWaalsContact O-N 3.14Å; K711-K713 HydrophobicContact CB-CG 4.16Å; K711-K713 PolarHBondContact O-N 3.18Å
712G90.9Very high93.2Very high70 Ų7075.5 Ų75.572%0.72240%0.403SS*.THydrogen-bonded Turntrans60.127.4176.800000114.2A708 D709A708-G712 PolarHBondContact O-N 2.79Å; D709-G712 PolarHBondContact O-N 2.68Å
713K92.2Very high93.2Very high95 Ų9575.5 Ų75.541%0.41340%0.403SS..  trans-72.6145.4-173.7-69.1-160.1172.3-1590111.6A708 K711 A717 M721A708-K713 HydrophobicContact CB-CB 4.43Å; A708-K713 PolarHBondContact O-N 2.82Å; K711-K713 HydrophobicContact CB-CG 4.16Å; K711-K713 PolarHBondContact O-N 3.18Å; K713-A717 HydrophobicContact CB-CB 4.33Å; K713-A717 HydrophobicContact CD-CB 4.42Å; K713-M721 HydrophobicContact CD-CE 3.62Å; K713-M721 VanDerWaalsContact CE-CE 3.45Å
714S94.7Very high93.2Very high81 Ų8178.4 Ų78.457%0.56641%0.408SS*.  trans-62.9150.2170.163.30000110.8A716 A717 A718S714-A716 VanDerWaalsContact C-N 3.31Å; S714-A716 PolarHBondContact O-N 3.38Å; S714-A717 CarbonylContact O-C 3.59Å; S714-A717 WeakPolarHBondContact O-CA 3.36Å; S714-A717 WeakPolarHBondContact O-CB 3.39Å; S714-A717 PolarHBondContact O-N 3.42Å; S714-A718 PolarHBondContact O-N 3.18Å
715K91.1Very high93.2Very high158 Ų15879 Ų7969%0.68741%0.411SS*.Hα-helixtrans-49.7-47.9-176.5178.6171.6170.9175.40113.1A717 A718 E719K715-A717 PolarHBondContact O-N 2.91Å; K715-A717 VanDerWaalsContact O-N 3.13Å; K715-A718 WeakPolarHBondContact O-CB 3.41Å; K715-A718 PolarHBondContact O-N 3.48Å; K715-A718 VanDerWaalsContact O-N 3.09Å; K715-E719 WeakPolarHBondContact CE-OE1 3.4Å; K715-E719 HydrophobicContact CG-CG 4.34Å; K715-E719 WeakPolarHBondContact CG-OE1 3.35Å; K715-E719 IonicContact NZ-OE1 3.68Å; K715-E719 WeakPolarHBondContact O-CG 3.45Å; K715-E719 PolarHBondContact O-N 3.43Å
716A92.4Very high93.3Very high54 Ų5481.8 Ų81.845%0.44642%0.418SS..Hα-helixtrans-69.9-4.7177.900000115S714 R720S714-A716 VanDerWaalsContact C-N 3.31Å; S714-A716 PolarHBondContact O-N 3.38Å; A716-R720 PolarHBondContact O-NE 2.94Å; A716-R720 PolarHBondContact O-NH2 2.96Å; A716-R720 VanDerWaalsContact O-NH2 3.11Å
717A91.6Very high93.4Very high24 Ų2478.7 Ų78.720%0.19841%0.413CS..Hα-helixtrans-104-26.8169.600000112.3K713 S714 K715 M721K713-A717 HydrophobicContact CB-CB 4.33Å; K713-A717 HydrophobicContact CD-CB 4.42Å; S714-A717 CarbonylContact O-C 3.59Å; S714-A717 WeakPolarHBondContact O-CA 3.36Å; S714-A717 WeakPolarHBondContact O-CB 3.39Å; S714-A717 PolarHBondContact O-N 3.42Å; K715-A717 PolarHBondContact O-N 2.91Å; K715-A717 VanDerWaalsContact O-N 3.13Å; A717-M721 WeakPolarHBondContact O-CB 3.42Å; A717-M721 PolarHBondContact O-N 3.34Å
718A92.3Very high93.5Very high11 Ų1182.4 Ų82.49%0.09142%0.424CS..Hα-helixtrans-68.3-48167.300000111.2A708 S714 K715 R720 M721 I722A708-A718 HydrophobicContact CB-CB 3.56Å; S714-A718 PolarHBondContact O-N 3.18Å; K715-A718 WeakPolarHBondContact O-CB 3.41Å; K715-A718 PolarHBondContact O-N 3.48Å; K715-A718 VanDerWaalsContact O-N 3.09Å; A718-R720 VanDerWaalsContact C-N 3.34Å; A718-R720 PolarHBondContact O-N 3.47Å; A718-M721 WeakPolarHBondContact O-CB 3.3Å; A718-M721 PolarHBondContact O-N 2.98Å; A718-M721 VanDerWaalsContact O-N 3.08Å; A718-I722 WeakPolarHBondContact O-CG1 3.23Å; A718-I722 PolarHBondContact O-N 3.33Å
719E94Very high93.5Very high89 Ų8983.3 Ų83.342%0.41643%0.43SS..Hα-helixtrans-56.5-44.9177.7-72.5166.816300112.1K715 I722 L723K715-E719 WeakPolarHBondContact CE-OE1 3.4Å; K715-E719 HydrophobicContact CG-CG 4.34Å; K715-E719 WeakPolarHBondContact CG-OE1 3.35Å; K715-E719 IonicContact NZ-OE1 3.68Å; K715-E719 WeakPolarHBondContact O-CG 3.45Å; K715-E719 PolarHBondContact O-N 3.43Å; E719-I722 PolarHBondContact O-N 3.1Å; E719-L723 VanDerWaalsContact O-CG 3.31Å; E719-L723 WeakPolarHBondContact O-CG 3.37Å; E719-L723 PolarHBondContact O-N 3.41Å
720R93.1Very high93.5Very high151 Ų15181.4 Ų81.457%0.5742%0.42SS*.Hα-helixtrans-60.6-45.6173.3-89.6-179.4-75.7167.7-7112.6A716 A718 I722 L723 E724A716-R720 PolarHBondContact O-NE 2.94Å; A716-R720 PolarHBondContact O-NH2 2.96Å; A716-R720 VanDerWaalsContact O-NH2 3.11Å; A718-R720 VanDerWaalsContact C-N 3.34Å; A718-R720 PolarHBondContact O-N 3.47Å; R720-I722 VanDerWaalsContact C-N 3.3Å; R720-I722 PolarHBondContact O-N 2.81Å; R720-L723 PolarHBondContact O-N 2.9Å; R720-E724 WeakPolarHBondContact O-CB 3.3Å; R720-E724 WeakPolarHBondContact O-CG 3.31Å; R720-E724 PolarHBondContact O-N 2.91Å
721M93.2Very high93.3Very high20 Ų2079.7 Ų79.710%0.09942%0.415CS..Hα-helixtrans-62.3-37.2179.7-168-168.9-78.100112.3Q704 A708 K713 A717 A718 E725Q704-M721 VanDerWaalsContact CD-SD 3.53Å; Q704-M721 HydrophobicContact CG-CB 4.4Å; Q704-M721 HydrophobicContact CG-CG 3.5Å; Q704-M721 VanDerWaalsContact CG-CG 3.5Å; Q704-M721 HydrophobicContact CG-SD 3.66Å; Q704-M721 VanDerWaalsContact NE2-CG 3.34Å; A708-M721 HydrophobicContact CB-SD 4.16Å; K713-M721 HydrophobicContact CD-CE 3.62Å; K713-M721 VanDerWaalsContact CE-CE 3.45Å; A717-M721 WeakPolarHBondContact O-CB 3.42Å; A717-M721 PolarHBondContact O-N 3.34Å; A718-M721 WeakPolarHBondContact O-CB 3.3Å; A718-M721 PolarHBondContact O-N 2.98Å; A718-M721 VanDerWaalsContact O-N 3.08Å; M721-E725 PolarHBondContact O-N 3.35Å
722I95.8Very high93Very high50 Ų5077.6 Ų77.626%0.25642%0.415SS..Hα-helixtrans-69.7-42.1176.2-63.7161.4000110.7L701 A705 A718 E719 R720 E725 F726L701-I722 HydrophobicContact CB-CG2 4.24Å; L701-I722 HydrophobicContact CD2-CG2 4.06Å; L701-I722 WeakPolarHBondContact CD2-O 3.49Å; A705-I722 HydrophobicContact CB-CD1 3.72Å; A705-I722 HydrophobicContact CB-CG1 4.16Å; A718-I722 WeakPolarHBondContact O-CG1 3.23Å; A718-I722 PolarHBondContact O-N 3.33Å; E719-I722 PolarHBondContact O-N 3.1Å; R720-I722 VanDerWaalsContact C-N 3.3Å; R720-I722 PolarHBondContact O-N 2.81Å; I722-E725 PolarHBondContact O-N 3.36Å; I722-F726 PolarHBondContact O-N 2.87Å
723L95.4Very high92.9Very high118 Ų11875.9 Ų75.962%0.61839%0.39SS*.Hα-helixtrans-66.1-36.3176.4-71169.1000112.7E719 R720 F726 G727E719-L723 VanDerWaalsContact O-CG 3.31Å; E719-L723 WeakPolarHBondContact O-CG 3.37Å; E719-L723 PolarHBondContact O-N 3.41Å; R720-L723 PolarHBondContact O-N 2.9Å; L723-F726 PolarHBondContact O-N 3.45Å; L723-G727 PolarHBondContact O-N 2.9Å
724E94.8Very high92.7Very high110 Ų11076.3 Ų76.351%0.51440%0.396SS..Hα-helixtrans-61-47.1173.2-76.9169.2-145.500111.5R720 G727 R728R720-E724 WeakPolarHBondContact O-CB 3.3Å; R720-E724 WeakPolarHBondContact O-CG 3.31Å; R720-E724 PolarHBondContact O-N 2.91Å; E724-G727 PolarHBondContact O-N 3.05Å; E724-R728 WeakPolarHBondContact O-CG 3.31Å; E724-R728 PolarHBondContact O-N 3.3Å
725E95.7Very high92.2Very high40 Ų4076.6 Ų76.619%0.18739%0.391CS..Hα-helixtrans-68-35175.7-65.8-52.212400112.9L701 Q704 M721 I722 G727 R728 C729L701-E725 HydrophobicContact CD2-CB 4.27Å; Q704-E725 HydrophobicContact CB-CG 3.96Å; Q704-E725 VanDerWaalsContact CD-CG 3.46Å; Q704-E725 HydrophobicContact CG-CB 4.37Å; Q704-E725 HydrophobicContact CG-CG 3.48Å; Q704-E725 VanDerWaalsContact CG-CG 3.48Å; Q704-E725 PolarHBondContact NE2-OE1 3.45Å; M721-E725 PolarHBondContact O-N 3.35Å; I722-E725 PolarHBondContact O-N 3.36Å; E725-G727 VanDerWaalsContact C-N 3.28Å; E725-G727 PolarHBondContact O-N 3.3Å; E725-R728 PolarHBondContact O-N 3.06Å; E725-R728 VanDerWaalsContact O-N 3.12Å; E725-R728 WeakPolarHBondContact OE1-CD 3.31Å; E725-R728 IonicContact OE1-CZ 3.45Å; E725-R728 IonicContact OE1-NE 3.71Å; E725-R728 PolarHBondContact OE1-NE 3.28Å; E725-R728 IonicContact OE1-NH2 3.89Å; E725-R728 WeakPolarHBondContact OE2-CD 3.35Å; E725-R728 IonicContact OE2-NE 3.43Å; E725-C729 PolarHBondContact O-N 3.42Å; E725-C729 PolarHBondContact O-SG 2.79Å; E725-C729 VanDerWaalsContact O-SG 3.41Å
726F96.4Very high91.7Very high86 Ų8672.2 Ų72.238%0.37738%0.381SS..Hα-helixtrans-59.2-42.3172.1-173.2-123.2000111.2T697 L701 I722 L723 C729 L730T697-F726 HydrophobicContact CG2-CD2 4.17Å; T697-F726 HydrophobicContact CG2-CE2 4.32Å; L701-F726 HydrophobicContact CD1-CD2 4.06Å; L701-F726 HydrophobicContact CD2-CB 3.77Å; L701-F726 HydrophobicContact CD2-CD2 4.45Å; I722-F726 PolarHBondContact O-N 2.87Å; L723-F726 PolarHBondContact O-N 3.45Å; F726-C729 PolarHBondContact O-N 3.16Å; F726-L730 HydrophobicContact CD1-CD1 3.98Å; F726-L730 HydrophobicContact CE1-CD1 3.61Å; F726-L730 HydrophobicContact CE1-CG 4.35Å; F726-L730 HydrophobicContact CE2-CD1 4.37Å; F726-L730 HydrophobicContact CE2-CD2 4.4Å; F726-L730 HydrophobicContact CE2-CG 4.24Å; F726-L730 HydrophobicContact CZ-CD1 3.82Å; F726-L730 HydrophobicContact CZ-CD2 4.26Å; F726-L730 HydrophobicContact CZ-CG 4.15Å; F726-L730 WeakPolarHBondContact O-CB 3.25Å; F726-L730 WeakPolarHBondContact O-CG 3.42Å; F726-L730 PolarHBondContact O-N 2.96Å
727G95.5Very high91.1Very high37 Ų3770.7 Ų70.738%0.38137%0.368SS..Hα-helixtrans-59.3-43.8171.400000113.2L723 E724 E725 M731L723-G727 PolarHBondContact O-N 2.9Å; E724-G727 PolarHBondContact O-N 3.05Å; E725-G727 VanDerWaalsContact C-N 3.28Å; E725-G727 PolarHBondContact O-N 3.3Å; G727-M731 WeakPolarHBondContact O-CB 3.01Å; G727-M731 PolarHBondContact O-N 3.13Å
728R94Very high90.1Very high155 Ų15571.5 Ų71.559%0.58538%0.379SS*.Hα-helixtrans-62.6-45.6175.2-64.3-173-156.9-90.5-6.2112.3E724 E725 M731 S732E724-R728 WeakPolarHBondContact O-CG 3.31Å; E724-R728 PolarHBondContact O-N 3.3Å; E725-R728 PolarHBondContact O-N 3.06Å; E725-R728 VanDerWaalsContact O-N 3.12Å; E725-R728 WeakPolarHBondContact OE1-CD 3.31Å; E725-R728 IonicContact OE1-CZ 3.45Å; E725-R728 IonicContact OE1-NE 3.71Å; E725-R728 PolarHBondContact OE1-NE 3.28Å; E725-R728 IonicContact OE1-NH2 3.89Å; E725-R728 WeakPolarHBondContact OE2-CD 3.35Å; E725-R728 IonicContact OE2-NE 3.43Å; R728-M731 PolarHBondContact O-N 2.87Å; R728-S732 WeakPolarHBondContact O-CB 3.33Å; R728-S732 PolarHBondContact O-N 2.74Å
729C93.6Very high89Confident18 Ų1877.9 Ų77.912%0.12240%0.404CS..Hα-helixtrans-60-49.2177.4-72.30000111.2T697 E725 F726 M731 S732 V733T697-C729 HydrophobicContact CG2-CB 3.76Å; E725-C729 PolarHBondContact O-N 3.42Å; E725-C729 PolarHBondContact O-SG 2.79Å; E725-C729 VanDerWaalsContact O-SG 3.41Å; F726-C729 PolarHBondContact O-N 3.16Å; C729-M731 PolarHBondContact O-N 2.87Å; C729-S732 WeakPolarHBondContact O-CB 3.26Å; C729-S732 PolarHBondContact O-N 3.36Å; C729-V733 WeakPolarHBondContact O-CG2 3.48Å; C729-V733 PolarHBondContact O-N 2.68Å
730L92.1Very high87.4Confident81 Ų8176.7 Ų76.742%0.42441%0.41SS..Hα-helixtrans-58.6-46176.2-72.7176.6000112F726 S732 V733 I734F726-L730 HydrophobicContact CD1-CD1 3.98Å; F726-L730 HydrophobicContact CE1-CD1 3.61Å; F726-L730 HydrophobicContact CE1-CG 4.35Å; F726-L730 HydrophobicContact CE2-CD1 4.37Å; F726-L730 HydrophobicContact CE2-CD2 4.4Å; F726-L730 HydrophobicContact CE2-CG 4.24Å; F726-L730 HydrophobicContact CZ-CD1 3.82Å; F726-L730 HydrophobicContact CZ-CD2 4.26Å; F726-L730 HydrophobicContact CZ-CG 4.15Å; F726-L730 WeakPolarHBondContact O-CB 3.25Å; F726-L730 WeakPolarHBondContact O-CG 3.42Å; F726-L730 PolarHBondContact O-N 2.96Å; L730-S732 VanDerWaalsContact C-N 3.29Å; L730-S732 PolarHBondContact O-N 3.15Å; L730-V733 PolarHBondContact O-N 3.3Å; L730-I734 VanDerWaalsContact O-CG1 3.28Å; L730-I734 WeakPolarHBondContact O-CG1 3.49Å; L730-I734 PolarHBondContact O-N 3.02Å
731M89Confident85.6Confident109 Ų10977.4 Ų77.454%0.53742%0.417SS..Hα-helixtrans-63.7-35.4178.2-162.667.3-175.500112.1G727 R728 C729 I734 N735G727-M731 WeakPolarHBondContact O-CB 3.01Å; G727-M731 PolarHBondContact O-N 3.13Å; R728-M731 PolarHBondContact O-N 2.87Å; C729-M731 PolarHBondContact O-N 2.87Å; M731-I734 PolarHBondContact O-N 3.27Å; M731-N735 VanDerWaalsContact O-CB 3.3Å; M731-N735 WeakPolarHBondContact O-CB 3.26Å; M731-N735 PolarHBondContact O-N 2.93Å; M731-N735 PolarHBondContact O-ND2 2.97Å
732S86.4Confident83.8Confident73 Ų7380.1 Ų80.151%0.5144%0.438SS..Hα-helixtrans-65.6-42.8174.6-166.40000112R728 C729 L730 N735 S736R728-S732 WeakPolarHBondContact O-CB 3.33Å; R728-S732 PolarHBondContact O-N 2.74Å; C729-S732 WeakPolarHBondContact O-CB 3.26Å; C729-S732 PolarHBondContact O-N 3.36Å; L730-S732 VanDerWaalsContact C-N 3.29Å; L730-S732 PolarHBondContact O-N 3.15Å; S732-N735 PolarHBondContact O-N 3.4Å; S732-S736 WeakPolarHBondContact O-CB 3.38Å; S732-S736 PolarHBondContact O-N 2.97Å; S732-S736 PolarHBondContact O-OG 3.16Å
733V88.6Confident81.3Confident33 Ų3383.9 Ų83.920%0.246%0.458CS..Hα-helixtrans-63.8-45175.2173.40000111.1V689 V693 C729 L730 S736 A737V689-V733 HydrophobicContact CG2-CG1 4.4Å; V693-V733 HydrophobicContact CG1-CG2 3.6Å; C729-V733 WeakPolarHBondContact O-CG2 3.48Å; C729-V733 PolarHBondContact O-N 2.68Å; L730-V733 PolarHBondContact O-N 3.3Å; V733-S736 PolarHBondContact O-N 2.84Å; V733-A737 WeakPolarHBondContact O-CB 3.32Å; V733-A737 PolarHBondContact O-N 3.36Å
734I86.6Confident79.1Confident104 Ų10484.1 Ų84.153%0.53347%0.467SS..Hα-helixtrans-60.7-47.8176.4-68.6163.5000110.9L730 M731 S736 A737 G738L730-I734 VanDerWaalsContact O-CG1 3.28Å; L730-I734 WeakPolarHBondContact O-CG1 3.49Å; L730-I734 PolarHBondContact O-N 3.02Å; M731-I734 PolarHBondContact O-N 3.27Å; I734-S736 VanDerWaalsContact C-N 3.3Å; I734-S736 PolarHBondContact O-N 3.46Å; I734-A737 PolarHBondContact O-N 3.34Å; I734-G738 PolarHBondContact O-N 3.44Å
735N84.5Confident76.4Confident87 Ų8784.9 Ų84.947%0.46548%0.483SS..Hα-helixtrans-62.5-36.7178-74-23.8000112.4M731 S732 G738 K739M731-N735 VanDerWaalsContact O-CB 3.3Å; M731-N735 WeakPolarHBondContact O-CB 3.26Å; M731-N735 PolarHBondContact O-N 2.93Å; M731-N735 PolarHBondContact O-ND2 2.97Å; S732-N735 PolarHBondContact O-N 3.4Å; N735-G738 PolarHBondContact O-N 3.3Å; N735-K739 WeakPolarHBondContact O-CG 3.23Å; N735-K739 PolarHBondContact O-N 3.08Å
736S81.8Confident74Confident66 Ų6687 Ų8746%0.46251%0.507SS..Hα-helixtrans-69.7-42.1177.5-570000111.7S732 V733 I734 G738 K739 A740S732-S736 WeakPolarHBondContact O-CB 3.38Å; S732-S736 PolarHBondContact O-N 2.97Å; S732-S736 PolarHBondContact O-OG 3.16Å; V733-S736 PolarHBondContact O-N 2.84Å; I734-S736 VanDerWaalsContact C-N 3.3Å; I734-S736 PolarHBondContact O-N 3.46Å; S736-G738 VanDerWaalsContact C-N 3.28Å; S736-G738 PolarHBondContact O-N 3.32Å; S736-K739 PolarHBondContact O-N 3.5Å; S736-A740 PolarHBondContact O-N 3.29Å; S736-A740 VanDerWaalsContact O-N 3.14Å
737A78.2Confident71.3Confident22 Ų2291.1 Ų91.118%0.18253%0.53CS..Hα-helixtrans-66.7-27.3172.900000113.2F688 V733 I734F688-A737 HydrophobicContact CB-CB 4.18Å; F688-A737 HydrophobicContact CD1-CB 3.84Å; F688-A737 HydrophobicContact CD2-CB 3.84Å; F688-A737 HydrophobicContact CE1-CB 4.2Å; F688-A737 HydrophobicContact CE2-CB 4.19Å; F688-A737 HydrophobicContact CG-CB 3.66Å; F688-A737 HydrophobicContact CZ-CB 4.36Å; V733-A737 WeakPolarHBondContact O-CB 3.32Å; V733-A737 PolarHBondContact O-N 3.36Å; I734-A737 PolarHBondContact O-N 3.34Å
738G72.2Confident68.5Low41 Ų4196.5 Ų96.542%0.42355%0.55SS.*Hα-helixtrans-70.2-52171.300000112.6I734 N735 S736 A740 K741I734-G738 PolarHBondContact O-N 3.44Å; N735-G738 PolarHBondContact O-N 3.3Å; S736-G738 VanDerWaalsContact C-N 3.28Å; S736-G738 PolarHBondContact O-N 3.32Å; G738-A740 VanDerWaalsContact C-N 3.29Å; G738-A740 PolarHBondContact O-N 3.06Å; G738-K741 WeakPolarHBondContact O-CB 3.42Å; G738-K741 PolarHBondContact O-N 3.01Å
739K69.1Low65.7Low145 Ų14599.2 Ų99.263%0.6359%0.591SS**Hα-helixtrans-59.6-37.4179.3-74.2-173.9175.2-168.90113.1N735 S736 K741 S742N735-K739 WeakPolarHBondContact O-CG 3.23Å; N735-K739 PolarHBondContact O-N 3.08Å; S736-K739 PolarHBondContact O-N 3.5Å; K739-K741 PolarHBondContact O-N 3.17Å; K739-S742 PolarHBondContact O-N 3.1Å; K739-S742 PolarHBondContact O-OG 3.45Å
740A59.3Low64.3Low64 Ų64103.3 Ų103.353%0.52961%0.614SS.*THydrogen-bonded Turntrans-64.1-1.2175.100000115F688 S736 G738F688-A740 HydrophobicContact CE1-CB 3.58Å; F688-A740 HydrophobicContact CZ-CB 3.54Å; S736-A740 PolarHBondContact O-N 3.29Å; S736-A740 VanDerWaalsContact O-N 3.14Å; G738-A740 VanDerWaalsContact C-N 3.29Å; G738-A740 PolarHBondContact O-N 3.06Å
741K56.7Low62.8Low167 Ų167104.5 Ų104.573%0.72662%0.624SS**THydrogen-bonded Turntrans-106.9-7.2169.6-63.1-177.2177.9-177.40114.1G738 K739G738-K741 WeakPolarHBondContact O-CB 3.42Å; G738-K741 PolarHBondContact O-N 3.01Å; K739-K741 PolarHBondContact O-N 3.17Å
742S53.7Low61.4Low76 Ų76104.2 Ų104.253%0.53163%0.629SS.*THydrogen-bonded Turntrans-108.3-3.7-172.4600000115.5K739 P744K739-S742 PolarHBondContact O-N 3.1Å; K739-S742 PolarHBondContact O-OG 3.45Å; S742-P744 VanDerWaalsContact C-CD 3.48Å; S742-P744 WeakPolarHBondContact O-CD 3.22Å
743D43.5Very low59.9Low129 Ų129106.1 Ų106.169%0.6964%0.636SS**  trans-103.987.8-178.8-71.9-43.5000112.9C745D743-C745 PolarHBondContact O-N 3.09Å
744P50Low58.1Low124 Ų124110.6 Ų110.681%0.80566%0.663SS**  trans-77.671.7162.934.3-34.3000109.5S742 A746S742-P744 VanDerWaalsContact C-CD 3.48Å; S742-P744 WeakPolarHBondContact O-CD 3.22Å; P744-A746 PolarHBondContact O-N 3.47Å
745C38.7Very low56.2Low125 Ų125111.1 Ų111.185%0.84567%0.672SS**  trans-72.4115.7-176.8-162.20000111.2D743D743-C745 PolarHBondContact O-N 3.09Å
746A45.2Very low54.2Low84 Ų84112.8 Ų112.869%0.69469%0.686SS**  trans-106.2113.6-178.800000112P744P744-A746 PolarHBondContact O-N 3.47Å
747M38.3Very low52Low173 Ų173116.4 Ų116.485%0.85270%0.704SS**  trans-148.8138.9147.8-76.9-55.1165.800106.2
748N37.4Very low49.9Very low151 Ų151124.3 Ų124.381%0.80775%0.747SS**  cis60.268.243-80.6-5.5000114.4
749C34.3Very low47.8Very low212 Ų212131.8 Ų131.8100%1.43278%0.777SS**  -1620122.1-107.60000110.3

Retrieved 749 of 749 residues in 1675.4 ms (Link to these results)