A0A5K4FDJ0_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4FDJ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 435 aa.

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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
1M40Very low34.7Very low240 Ų240155.7 Ų155.7100%1.18279%0.789SS**  0142.80-74.6166.6158.300108.4
2K42.8Very low35Very low208 Ų208151.3 Ų151.390%0.90478%0.778SS**  trans47.885.7178.4-63.1-174.6177.5-177.60114.6
3S36Very low34.9Very low97 Ų97146.7 Ų146.768%0.67877%0.768SS**  72109.897.1-1570000111.8
4T35.2Very low34.7Very low114 Ų114146.1 Ų146.170%0.69977%0.766SS**  69.4123.252.9-49.80000112.5
5F37Very low34.7Very low185 Ų185145.1 Ų145.181%0.81176%0.762SS**  trans145.5138.2147.1-95.7-98.7000108.3
6Q32.6Very low34.5Very low127 Ų127146.4 Ų146.459%0.59376%0.762SS**  cis156.7134.1-21.2-96.3-95.790.100105
7F31.8Very low34.5Very low161 Ų161145.2 Ų145.271%0.70676%0.756SS**  trans65.1142159.5-75.1-128000116.9
8T29.5Very low34.5Very low114 Ų114144.7 Ų144.770%0.69975%0.75SS**  cis67.497.734.667.20000117
9K31.8Very low34.3Very low189 Ų189143.7 Ų143.782%0.82275%0.745SS**  -178.9155.2121.1-105.4-178.3175-174.90114.7
10T32.9Very low34.3Very low121 Ų121145.1 Ų145.174%0.74275%0.753SS**  trans42.7122.4151.952.80000120.5
11N31.8Very low34Very low157 Ų157142.4 Ų142.484%0.8475%0.747SS**  64148.660.6-103.824.6000115.4
12P38.2Very low33.6Very low102 Ų102136 Ų13666%0.66273%0.726SS**  -138.8-141.5-128.943.9-22.8000113.6
13S33.6Very low33.1Very low92 Ų92130.5 Ų130.564%0.64372%0.719SS**  trans71.8125.2158.558.40000120.2
14N33.3Very low32.9Very low139 Ų139131.9 Ų131.974%0.74372%0.719SS**  161.8156.4128.3-83.9-13.4000109.5
15N33.6Very low32.9Very low130 Ų130134.5 Ų134.570%0.69572%0.72SS**  cis-179.6155.2-33.3-104.5-1.5000106.1
16H31.7Very low32.7Very low166 Ų166131.9 Ų131.977%0.76971%0.714SS**  trans61.9172174.6-90.8-96.7000114.8
17L34.8Very low32.9Very low127 Ų127134.5 Ų134.567%0.66573%0.726SS**  cis-145.1143.511.7-155.6105.6000110.4
18E35.4Very low32.8Very low136 Ų136131.7 Ų131.764%0.63672%0.722SS**  trans46128.6145.9-73173.5-143.200125.7
19N30.4Very low33.1Very low125 Ų125132.6 Ų132.667%0.66873%0.732SS**  63.8156.3122.9-61.7-27.8000124.1
20L34.3Very low33Very low171 Ų171131.9 Ų131.990%0.89573%0.731SS**  trans68.1158.7167.4-57.9123.9000116.1
21S28.4Very low33.1Very low89 Ų89132.7 Ų132.762%0.62274%0.736SS**  cis-178.5149.7-35.1-177.30000105.8
22S30.8Very low33.3Very low106 Ų106133.7 Ų133.774%0.74174%0.736SS**  trans61.9104.6162.4-490000116
23A32.1Very low33.4Very low93 Ų93136.7 Ų136.777%0.76975%0.745SS**  91.51657300000113.7
24D31.3Very low33.7Very low125 Ų125138.5 Ų138.567%0.66875%0.754SS**  trans77.6132.9168.2-91.725.7000121
25K36Very low33.8Very low169 Ų169142.4 Ų142.474%0.73576%0.759SS**  trans69.2142155-66.5159.3-179.41070117.6
26L32.6Very low34.1Very low131 Ų131144.7 Ų144.769%0.68677%0.765SS**  cis175.5134.8-22.1-140.3129.9000102.9
27H37.2Very low34.3Very low181 Ų181142.9 Ų142.984%0.83876%0.761SS**  -176.3120.6128.3-108.3-73.1000111.5
28T28.8Very low34.5Very low103 Ų103141.3 Ų141.363%0.63276%0.76SS**  trans-82.6143.8169.2-49.50000109.8E30T28-E30 HydrophobicContact CG2-CG 4.38Å
29C35.4Very low34.4Very low133 Ų133142.7 Ų142.790%0.89977%0.773SS**  trans-151.3142.5144.4-96.90000108.6
30E31.3Very low34.7Very low173 Ų173139.9 Ų139.981%0.80877%0.773SS**  trans-102.5162.9-173.2-60.1156.8122.900111.1T28T28-E30 HydrophobicContact CG2-CG 4.38Å
31T35.3Very low34.6Very low138 Ų138139.2 Ų139.285%0.84777%0.769SS**  trans-158.7137.3141.3-660000110.1
32E34.6Very low35Very low179 Ų179140.2 Ų140.284%0.83677%0.771SS**  trans-65.1160.1-167.5-51.7166.5122.600117.1
33I41.5Very low35.3Very low165 Ų165142.3 Ų142.385%0.84677%0.769SS**  trans-134.7134.3147-61.5-176.6000107.2
34P38.8Very low35.6Very low129 Ų129145.2 Ų145.284%0.83876%0.764SS**  trans-84.1-170.3-168.833.9-37.8000115.6
35R35Very low36.1Very low222 Ų222143.8 Ų143.884%0.83876%0.764SS**  trans-141.7139.4-146.9167-165.5-172.3154.52113.2
36E39.8Very low36.2Very low178 Ų178142.3 Ų142.383%0.83276%0.764SS**  trans-159124.4155-102.9160.2-160.100106.8
37N36.8Very low36.3Very low127 Ų127142 Ų14268%0.67976%0.764SS**  67.813374-61.9-13.7000113.5
38S38.7Very low36.2Very low94 Ų94139.8 Ų139.866%0.65776%0.757SS**  cis-172.7143.1-9.151.90000113.6
39N34.3Very low36.2Very low166 Ų166143.8 Ų143.889%0.88877%0.766SS**  trans63.1148.1147-58.3-10.6000123.8
40G35Very low36.1Very low65 Ų65146 Ų14667%0.6776%0.763SS**  trans104.3107.6171.200000113.7
41I33.9Very low36.1Very low158 Ų158142.9 Ų142.981%0.8176%0.757SS**  cis6211942.9-35.2175.2000109.6
42T36.8Very low36Very low109 Ų109142.7 Ų142.767%0.66976%0.755SS**  -169139.757.4-36.10000112.8
43E36.8Very low36Very low151 Ų151140.4 Ų140.471%0.70676%0.759SS**  trans55.1168.1149-73.9-176.1158.800121.6
44K38Very low35.5Very low153 Ų153135.7 Ų135.767%0.66575%0.752SS**  cis-155.71566.1-138.8166.1-174.5111.40112.9
45S41.3Very low35.4Very low95 Ų95139 Ų13966%0.66475%0.753SS**  trans59.9148.9150.355.80000121.8
46N38.3Very low35.2Very low139 Ų139136.8 Ų136.874%0.74375%0.752SS**  cis-159.9145.3-11.6-102.13.3000110.5
47N35.5Very low34.9Very low125 Ų125134.6 Ų134.667%0.66874%0.742SS**  17.1148127.3-56.259.9000119.8
48D33.9Very low34.6Very low133 Ų133132.6 Ų132.671%0.71173%0.728SS**  cis-166.2-169.6-3-114-33.7000112.2
49F29.7Very low34.3Very low187 Ų187131.5 Ų131.582%0.8272%0.721SS**  trans-34.8154.2160.1-93.7-124000114.2
50E33.7Very low34.1Very low179 Ų179130 Ų13084%0.83672%0.717SS**  -161.9-162.357.5-143.7-177.1173.800114.4
51T31.1Very low33.9Very low109 Ų109132 Ų13267%0.66972%0.718SS**  trans-104.9170.9-16438.80000117.2
52T33.3Very low33.6Very low133 Ų133134.7 Ų134.782%0.81672%0.724SS**  trans85.5134.4147.8290000122.9
53S33.9Very low33.2Very low131 Ų131137 Ų13792%0.91673%0.731SS**  trans77.5126.5149.9-159.40000119.8
54G31.1Very low32.7Very low67 Ų67138 Ų13869%0.69174%0.74SS**  trans175.28.6166.900000126.5
55K36.1Very low32.2Very low197 Ų197135.9 Ų135.986%0.85775%0.745SS**  trans68.2133.8167.1-54.4172.7176.8175.50120.2
56H32.2Very low31.6Very low176 Ų176141.4 Ų141.482%0.81576%0.758SS**  trans57.1132.6147.6-69.1-29.2000119.7
57Q31.7Very low31.3Very low133 Ų133144.4 Ų144.462%0.62176%0.764SS**  cis-153.9169.919.7-79.2-140.290.800110.2
58Q31.9Very low30.9Very low84 Ų84146.9 Ų146.939%0.39377%0.771SS.*  cis-161.7151.3-24.5-175.2-167.911700108.4S297Q58-S297 PolarHBondContact O-OG 2.87Å
59S31Very low30.6Very low72 Ų72149.3 Ų149.350%0.50378%0.778SS.*  trans5676.8158.760.90000120.2
60V31.2Very low30.7Very low135 Ų135145.7 Ų145.782%0.81878%0.776SS**  2147108.4179.60000116.8
61P29.8Very low30.7Very low106 Ų106146.1 Ų146.169%0.68878%0.775SS**  cis-124.3146.61.930.9-12.8000115.8
62K28Very low30.8Very low214 Ų214147.8 Ų147.893%0.9378%0.78SS**  trans-112.270.6167.3-158.5171.7-170173.20111.3L64K62-L64 PolarHBondContact O-N 3.48Å
63L28Very low30.8Very low157 Ų157145.9 Ų145.982%0.82276%0.764SS**  trans-99.368.2-170.1-155.4161000112.2
64L28Very low30.8Very low172 Ų172146.5 Ų146.590%0.90176%0.757SS**  trans-168.673.9164.4-113.7165.6000111.2K62K62-L64 PolarHBondContact O-N 3.48Å
65S25.7Very low31Very low109 Ų109150.7 Ų150.776%0.76276%0.76SS**  trans-156.992.9166.1-170.40000111
66F28.8Very low30.8Very low212 Ų212143.3 Ų143.393%0.9373%0.732SS**  trans-112.5116.6161.9-102.9-80.2000108.7H68F66-H68 VanDerWaalsContact C-N 3.31Å; F66-H68 PolarHBondContact O-N 2.91Å
67K31.7Very low31.1Very low202 Ų202141.6 Ų141.688%0.87873%0.728SS**  trans-69.590.6168.7-83.2-175172.1-1780109.5
68H28.3Very low31.3Very low177 Ų177144 Ų14482%0.81973%0.732SS**  trans27.8101.8131-173.3-69.5000117.4F66F66-H68 VanDerWaalsContact C-N 3.31Å; F66-H68 PolarHBondContact O-N 2.91Å
69E27.9Very low31.4Very low183 Ų183147.9 Ų147.986%0.85575%0.753SS**  trans-146.1159.5156.4-132.2167-164.200114.3
70S31.3Very low31.4Very low112 Ų112150.6 Ų150.678%0.78376%0.762SS**  trans-11.3120.6-171.7-49.60000122.7
71K34Very low31.5Very low188 Ų188150.1 Ų150.182%0.81775%0.751SS**  trans-55.5149.9163.5-53.5152.4-177.5167.20114.5
72N32.9Very low31.7Very low144 Ų144146.7 Ų146.777%0.7774%0.735SS**  -168.7137.1122.8-89.9-35.3000109.2
73L34.4Very low31.9Very low92 Ų92141.9 Ų141.948%0.48272%0.718SS.*  cis90.898.839.4-167.9-180000112.4F251L73-F251 HydrophobicContact CD1-CE2 3.96Å; L73-F251 HydrophobicContact CD1-CZ 4.26Å; L73-F251 HydrophobicContact CD2-CE2 3.67Å; L73-F251 HydrophobicContact CD2-CZ 3.69Å; L73-F251 HydrophobicContact CG-CE2 3.81Å; L73-F251 HydrophobicContact CG-CZ 3.67Å
74L33.3Very low32.2Very low145 Ų145140.8 Ų140.876%0.75971%0.711SS**  trans-165.3145.9136.6-151.462.2000115.4
75M35.9Very low32.5Very low154 Ų154140.5 Ų140.576%0.75970%0.702SS**  trans107.9103.6156-66-153.5166.400120.2R254M75-R254 PolarHBondContact O-NH1 3.09Å; M75-R254 VanDerWaalsContact O-NH1 3.14Å
76T30.8Very low32.9Very low42 Ų42143.2 Ų143.226%0.25870%0.703SS.*  trans-154.9118.8132.518.50000110.2R254T76-R254 PolarHBondContact OG1-NH1 2.88Å
77N38.4Very low33.2Very low140 Ų140141.4 Ų141.475%0.74970%0.697SS**  trans-149.289.6157.9-85.5-38.2000104
78R36.8Very low33.5Very low185 Ų185138.6 Ų138.670%0.69869%0.691SS**  cis62.954.744-111.4-173.5-173.6-168.71112.5K253R78-K253 PolarHBondContact NH1-O 3.49Å
79I34.2Very low33.7Very low164 Ų164136.4 Ų136.484%0.84169%0.692SS**  trans-59.4130.5154.4-60.5164.9000107.9
80D30.4Very low34Very low129 Ų129139.3 Ų139.369%0.6970%0.695SS**  trans-147.991.3149.5-167.1-3.3000109.3G82D80-G82 PolarHBondContact OD1-N 3.03Å; D80-G82 VanDerWaalsContact OD1-N 3.17Å
81E32.8Very low34.2Very low126 Ų126140.6 Ų140.659%0.58969%0.693SS**  trans-125.949.8157.7-91.3-177.4-161.100109.4I83 R206E81-I83 HydrophobicContact CB-CD1 3.73Å; E81-I83 HydrophobicContact CB-CG1 4.09Å; E81-I83 HydrophobicContact CG-CD1 3.99Å; E81-I83 HydrophobicContact CG-CG1 4.3Å; E81-I83 WeakPolarHBondContact O-CD1 3.36Å; E81-I83 WeakPolarHBondContact O-CG1 3.24Å; E81-R206 IonicContact OE1-CZ 2.77Å; E81-R206 IonicContact OE1-NH1 4Å; E81-R206 PolarHBondContact OE1-NH1 3.25Å
82G34.4Very low34.6Very low34 Ų34136.9 Ų136.935%0.35169%0.687SS.*  trans-108.456.4156.100000109.3D80 H369D80-G82 PolarHBondContact OD1-N 3.03Å; D80-G82 VanDerWaalsContact OD1-N 3.17Å; G82-H369 PolarHBondContact O-CE1 3.01Å; G82-H369 PolarHBondContact O-NE2 3.45Å
83I32.3Very low35.1Very low112 Ų112140.6 Ų140.657%0.57469%0.69SS**  34.487.686.8-56.7175.6000111.5E81E81-I83 HydrophobicContact CB-CD1 3.73Å; E81-I83 HydrophobicContact CB-CG1 4.09Å; E81-I83 HydrophobicContact CG-CD1 3.99Å; E81-I83 HydrophobicContact CG-CG1 4.3Å; E81-I83 WeakPolarHBondContact O-CD1 3.36Å; E81-I83 WeakPolarHBondContact O-CG1 3.24Å
84M34.9Very low35Very low135 Ų135140.9 Ų140.967%0.66569%0.688SS**  trans-119111.2156.1-171.5156165.600110.6
85K34.6Very low35.4Very low165 Ų165142.1 Ų142.172%0.71769%0.69SS**  trans-73.9158.1168.4-60.9169.3-178.8168.70109
86Q33.6Very low35.3Very low166 Ų166139.5 Ų139.578%0.77668%0.679SS**  trans88.3114.5161.1-51.5171.9-300119.2
87H35Very low35.7Very low174 Ų174145 Ų14581%0.80671%0.707SS**  -144.7119.1128.1-103.9-89.8000106.2
88L37.2Very low35.9Very low144 Ų144142.8 Ų142.875%0.75470%0.7SS**  64.1124.383.7-98.174.6000115.7
89P32.4Very low36.2Very low130 Ų130142.6 Ų142.684%0.84471%0.707SS**  trans-95.4177.6175.138.5-35.1000114.1
90R35.4Very low36.4Very low244 Ų244139.1 Ų139.192%0.92170%0.698SS**  trans-143.4159.4-174.7-169.3-176.9-174.7-170.64.5111.4
91N35.2Very low37Very low139 Ų139139.7 Ų139.774%0.74370%0.696SS**  trans-144.2-164.2179.2-147.121.8000110.3
92V42.7Very low37.5Very low111 Ų111140.5 Ų140.567%0.67370%0.697SS**  cis-138-87.517.5-171.10000114.6
93R43.3Very low37.7Very low222 Ų222144.8 Ų144.884%0.83871%0.713SS**  trans-155.9160.4-163.5-77.3173.1179175.8-4.6110.3
94Q32.8Very low38.3Very low97 Ų97145.1 Ų145.145%0.45372%0.72SS.*  cis84.8115-0.4-164.4-177.9500120.7E174 L177Q94-E174 WeakPolarHBondContact CG-OE1 3.48Å; Q94-E174 PolarHBondContact NE2-OE1 2.93Å; Q94-L177 HydrophobicContact CG-CD1 3.94Å
95Q40.9Very low38.4Very low171 Ų171144.5 Ų144.580%0.79972%0.719SS**  trans-174.2139.7155.4-174.3165.3-9.400113.9
96N34.6Very low38.7Very low99 Ų99143.6 Ų143.653%0.52972%0.72SS.*  trans-172148.7160-105.4-8.2000111.8
97N37.4Very low38.9Very low158 Ų158141.3 Ų141.385%0.84572%0.721SS**  trans-166.2-171.2177.6-141.527.5000114
98P43.7Very low39.1Very low93 Ų93136 Ų13660%0.60471%0.713SS**  -133.6-171.5-97.646.6-29.8000117
99H42.2Very low39.1Very low182 Ų182136 Ų13684%0.84371%0.714SS**  trans-167167.5142.2-109.6-80.1000107
100S40.1Very low39.4Very low91 Ų91137.9 Ų137.964%0.63671%0.711SS**  cis-160.1179.5-4.3-135.20000106.5
101E42.8Very low39.7Very low140 Ų140129.9 Ų129.965%0.65469%0.693SS**  cis-163.5-178.7-10.2-145.2-162.815500108.6
102K42.3Very low39.9Very low143 Ų143129.4 Ų129.462%0.62269%0.691SS**  trans48.5136.7157.6-64.2-171.8169.266.30121
103D39.3Very low39.8Very low125 Ų125130.2 Ų130.267%0.66869%0.691SS**  cis-163.7157.2-3.1-109.6-26000112.5
104V43.4Very low39.6Very low119 Ų119125.6 Ų125.672%0.72168%0.683SS**  trans62.9132.2150.6169.60000119
105N38.4Very low39.8Very low122 Ų122133.2 Ų133.265%0.65271%0.707SS**  cis-165.4152.6-7.7-114.9-9.6000112.4
106I39.4Very low39.8Very low146 Ų146131.1 Ų131.175%0.74970%0.7SS**  trans49.4136.7133.6-62.6171.3000119.6
107C39.1Very low40Very low117 Ų117132.5 Ų132.579%0.79171%0.707SS**  cis-156.5152.217.9-154.40000115
108G37.9Very low40.1Very low62 Ų62133 Ų13364%0.63970%0.702SS**  trans67.6166.4144.400000121.3
109N37.7Very low39.9Very low144 Ų144135.8 Ų135.877%0.7771%0.707SS**  cis-167.4153.1-22.4-116.8-0.5000110.9
110H39.2Very low39.6Very low170 Ų170137.4 Ų137.479%0.78771%0.711SS**  trans61.6158.2165.9-83.6-64.8000118.7
111S41Very low39.5Very low77 Ų77139.2 Ų139.254%0.53871%0.713SS.*  cis-163.2158.2-25.2-138.10000110.6
112D40.7Very low39.2Very low129 Ų129141.2 Ų141.269%0.6972%0.72SS**  trans58.2162.4147.3-66.9-57.9000122.2
113N38.8Very low38.8Very low128 Ų128144.9 Ų144.968%0.68473%0.73SS**  -158.7176.7-52.1-131.1-46.7000110.9
114N40.3Very low38.5Very low125 Ų125146 Ų14667%0.66874%0.736SS**  trans61.7110.7161.1-72.5-46000121.4
115R37.6Very low38.1Very low256 Ų256146.3 Ų146.397%0.96674%0.738SS**  trans-140.8117.2137.9-106.6-170.9178.9-164.6-0.3110.2
116I39.6Very low37.7Very low127 Ų127145.5 Ų145.565%0.65174%0.741SS**  trans-124.4126.4-166.7-94.5174.4000111.6
117L39.6Very low37.5Very low128 Ų128148.8 Ų148.867%0.6775%0.746SS**  trans59.3166.6158.7-81.444.5000117.1
118K38.1Very low37.4Very low169 Ų169150.5 Ų150.574%0.73574%0.742SS**  cis-142.8116.1-6-127149.9-172171.60106.6
119Q40.9Very low37.2Very low151 Ų151156.2 Ų156.271%0.70675%0.752SS**  53106.887.6-77.8-172.4-18.800117.2
120K36.5Very low37.3Very low216 Ų216155.1 Ų155.194%0.93975%0.745SS**  -114.694.6129.4-74.9-178.7176.6177.60105.3
121L36.2Very low37.4Very low129 Ų129152.8 Ų152.868%0.67574%0.742SS**  61.898.659.4-162.879.8000113.4
122K37.8Very low37.2Very low183 Ų183155.2 Ų155.280%0.79675%0.75SS**  trans-158.9102.7144.7-115.1176.2-177.1-1800109.9
123R34.4Very low36.9Very low219 Ų219155.5 Ų155.583%0.82676%0.756SS**  trans53.7101.3157-61.5169.3-178.31480.1115.5
124N32.5Very low36.8Very low148 Ų148158.6 Ų158.679%0.79176%0.764SS**  44.4101.864.4-68.424.2000114
125V34.5Very low36.6Very low126 Ų126158.4 Ų158.476%0.76477%0.772SS**  -132.6137.6125.9178.70000105.9Y127V125-Y127 HydrophobicContact CG1-CD2 4.05Å; V125-Y127 HydrophobicContact CG1-CE2 3.65Å
126S31Very low36.7Very low105 Ų105151.7 Ų151.773%0.73476%0.759SS**  trans-140.5132.5175.6-178.90000107.6
127Y34Very low36.5Very low215 Ų215151.8 Ų151.884%0.84376%0.761SS**  trans-117.4127.5164.6-72.1-75.4000107.3V125V125-Y127 HydrophobicContact CG1-CD2 4.05Å; V125-Y127 HydrophobicContact CG1-CE2 3.65Å
128H36.4Very low36.2Very low154 Ų154152.1 Ų152.171%0.71376%0.763SS**  trans-141.6104.1-178.8179.4-67.6000108I130H128-I130 WeakPolarHBondContact ND1-CG1 3.41Å
129E34.7Very low36.1Very low181 Ų181149.1 Ų149.185%0.84676%0.763SS**  trans-142.5100.8-179.1-161.8162.9-161.600101.9
130I39.9Very low36.2Very low121 Ų121146.6 Ų146.662%0.62176%0.763SS**  67149.361.2-51.1174.2000110.1H128H128-I130 WeakPolarHBondContact ND1-CG1 3.41Å
131V40.7Very low36.3Very low121 Ų121143.6 Ų143.673%0.73376%0.757SS**  trans77.8128.8-177.6-169.70000113.8
132D37.4Very low36.5Very low129 Ų129142 Ų14269%0.6976%0.762SS**  cis-164.1175.5-31.4-115.3-49.7000109
133T34.2Very low36.4Very low135 Ų135144.3 Ų144.383%0.82877%0.766SS**  172.9107.7129.227.80000113.1
134K37.5Very low36.9Very low193 Ų193138 Ų13884%0.83976%0.755SS**SBend-173.8137.6118.6-106.2173.8-178.8-179.30111.3
135S35Very low37.3Very low120 Ų120139.4 Ų139.484%0.83975%0.754SS**  trans66135.8-173.385.90000112.2
136V39.2Very low37.5Very low116 Ų116138.2 Ų138.270%0.70374%0.744SS**  cis-137.7146.86.4175.20000109.6
137D36Very low38Very low128 Ų128141.8 Ų141.868%0.68474%0.742SS**  trans62.4116.8156.3-72.710.9000125.4
138N34.4Very low38.4Very low136 Ų136141.7 Ų141.773%0.72774%0.742SS**  90.7137.3119.6-69.2-29.5000124.3
139S36Very low38.4Very low105 Ų105138.6 Ų138.673%0.73474%0.738SS**  trans83.188.8154.168.30000120.8
140S42.3Very low38.6Very low99 Ų99136.2 Ų136.269%0.69274%0.741SS**  62.7120.2121.765.30000122.6
141N38.7Very low38.6Very low152 Ų152135.9 Ų135.981%0.81375%0.75SS**  68.385.8126.6-61.4-15.3000121.1
142A39.3Very low38.5Very low95 Ų95135.8 Ų135.879%0.78575%0.754SS**  72.2158.8106.900000122.3
143R36.5Very low38.6Very low233 Ų233134.2 Ų134.288%0.87975%0.753SS**  trans72.699.4156.3-99.1-172.9164.3-177.8-3.4119.4
144S44.1Very low38.9Very low85 Ų85134.8 Ų134.859%0.59476%0.757SS**  99.2151.4107.280.80000120.4
145K41.6Very low39Very low178 Ų178134.2 Ų134.277%0.77476%0.759SS**  trans76.4148.8159.2-61.1166.9-173.4177.60117.6
146N39.5Very low39.2Very low102 Ų102133.8 Ų133.855%0.54576%0.756SS.*  cis-175163.7-30.5-104.20000108.3
147Y40.8Very low39.2Very low179 Ų179132.6 Ų132.670%0.70275%0.753SS**  trans65.1152.3164.4-42.1-56.5000115.6
148Y41.8Very low39.4Very low213 Ų213132.8 Ų132.884%0.83576%0.759SS**  cis-126.7139.28.5-79.8-107.6000109
149S37.1Very low39.8Very low89 Ų89131.7 Ų131.762%0.62276%0.757SS**  71.9105.251.5-66.90000115
150S39.4Very low39.9Very low132 Ų132134.8 Ų134.892%0.92376%0.76SS**  trans-160.988.3157.6-79.50000108.6
151S38.7Very low39.8Very low114 Ų114136 Ų13680%0.79777%0.769SS**  trans-111.4144.8-175.5-60.80000111
152S38.7Very low39.8Very low119 Ų119133.7 Ų133.783%0.83276%0.764SS**  trans-161.192.1162.1-179.70000107.7
153S39.3Very low40Very low96 Ų96135.4 Ų135.467%0.67177%0.765SS**  cis81.592.14488.60000114.8
154T41.5Very low40.3Very low146 Ų146130 Ų13090%0.89676%0.763SS**  trans-132.2132148.4-45.70000106.6
155M40.2Very low40.2Very low181 Ų181135.2 Ų135.289%0.89278%0.778SS**  trans-107.9-175.1-169.8-72.7-179.86200112.7
156S38Very low40.2Very low111 Ų111135.7 Ų135.778%0.77678%0.78SS**  trans99.3126.4172.3-1440000113.9
157S40Very low40.4Very low91 Ų91140.7 Ų140.764%0.63679%0.793SS**  cis-176.8148.7-7.237.50000110.7
158V40.2Very low40.5Very low133 Ų133137.2 Ų137.281%0.80679%0.79SS**  trans66.3130.6147.5165.60000116.5
159T42.1Very low40.7Very low112 Ų112133.9 Ų133.969%0.68779%0.787SS**  cis-149.1170.66.7-3.20000112.8
160E37.9Very low41.1Very low170 Ų170134.8 Ų134.879%0.79479%0.793SS**  trans-20142161.5-62.3155.4134.700117.4
161S40Very low41.7Very low126 Ų126135.5 Ų135.588%0.88179%0.791SS**  -167.4161.875.538.50000113.7
162S40Very low42.1Very low102 Ų102134 Ų13471%0.71378%0.781SS**  trans-106.8150.5-17456.10000113
163T43.8Very low43.2Very low131 Ų131132.4 Ų132.480%0.80477%0.768SS**  171.3155.512033.30000115.2
164S42.6Very low44.1Very low120 Ų120130.3 Ų130.384%0.83975%0.747SS**  trans74119.4160.780.30000119
165Q40.1Very low44.8Very low195 Ų195126.9 Ų126.991%0.91173%0.734SS**  trans-119.8125.9172.9169.8-171.57.900105.8
166K41.8Very low45.7Very low187 Ų187125.9 Ų125.981%0.81373%0.727SS**  trans-149.7107.4179.3-146.9167.7-172.91790115.8
167Y43.7Very low47.1Very low207 Ų207124 Ų12481%0.81271%0.708SS**  trans72.5165.1153.7-81.8-114.4000118.8
168T43.8Very low48.3Very low106 Ų106123.2 Ų123.265%0.6570%0.702SS**  trans-141.8177.1-144.646.10000113
169D45.3Very low49.6Very low144 Ų144124.4 Ų124.477%0.7770%0.697SS**  trans74.1145158.8-45.4-54000119.2
170S46.8Very low51Low107 Ų107124.7 Ų124.775%0.74869%0.693SS**  cis-161135.7-35.555.90000109.2
171V51.8Low52.8Low147 Ų147123.2 Ų123.289%0.89168%0.684SS**  trans-131.3118.6175.6179.50000110
172S47.3Very low54.3Low83 Ų83125.4 Ų125.458%0.5868%0.678SS**  trans-82.4126-170.6-169.90000113.3E174S172-E174 PolarHBondContact O-N 2.93Å
173P61.4Low55.9Low85 Ų85125.8 Ų125.855%0.55267%0.671SS**  trans-87.8-0.7-167.934.3-37.7000116.1A175P173-A175 PolarHBondContact O-N 2.87Å
174E58.4Low57.3Low52 Ų52126.1 Ų126.124%0.24366%0.663CS.*Hα-helixtrans-61.5-38.5-159.8-151.665.4-157.800114.7Q94 S172 H176 L177Q94-E174 WeakPolarHBondContact CG-OE1 3.48Å; Q94-E174 PolarHBondContact NE2-OE1 2.93Å; S172-E174 PolarHBondContact O-N 2.93Å; E174-H176 PolarHBondContact O-N 3.38Å; E174-L177 PolarHBondContact O-N 2.93Å
175A56.7Low58.7Low75 Ų75129.8 Ų129.862%0.6266%0.658SS**Hα-helixtrans-65.3-34.5-168.500000114.4P173 L177 S178P173-A175 PolarHBondContact O-N 2.87Å; A175-L177 VanDerWaalsContact C-N 3.31Å; A175-L177 PolarHBondContact O-N 3.4Å; A175-S178 PolarHBondContact O-OG 2.95Å
176H58.7Low60.2Low160 Ų160127.6 Ų127.674%0.74165%0.646SS**Hα-helixtrans-70.1-26.6-175.1-84.4-119.8000113.1E174 S178 L180E174-H176 PolarHBondContact O-N 3.38Å; H176-S178 VanDerWaalsContact C-N 3.3Å; H176-S178 PolarHBondContact O-N 3.14Å; H176-L180 PolarHBondContact O-N 3.16Å
177L66.4Low61.7Low72 Ų72121 Ų12138%0.37763%0.626SS.*Hα-helixtrans-65.7-31.5-176.8-60.7177.2000112.7Q94 E174 A175 K181Q94-L177 HydrophobicContact CG-CD1 3.94Å; E174-L177 PolarHBondContact O-N 2.93Å; A175-L177 VanDerWaalsContact C-N 3.31Å; A175-L177 PolarHBondContact O-N 3.4Å; L177-K181 WeakPolarHBondContact O-CB 3.37Å; L177-K181 PolarHBondContact O-N 3.42Å
178S66.3Low63Low73 Ų73113.7 Ų113.751%0.5161%0.605SS.*Hα-helixtrans-66.5-46.5-177.869.80000113.2A175 H176 K181 K182A175-S178 PolarHBondContact O-OG 2.95Å; H176-S178 VanDerWaalsContact C-N 3.3Å; H176-S178 PolarHBondContact O-N 3.14Å; S178-K181 PolarHBondContact O-N 2.82Å; S178-K182 PolarHBondContact O-N 3.07Å
179K67.8Low64.1Low159 Ų159118.4 Ų118.469%0.69161%0.611SS**Hα-helixtrans-65.3-44.3176-72.2179.7178.8173.80110.5K181 K182 I183K179-K181 VanDerWaalsContact C-N 3.3Å; K179-K181 PolarHBondContact O-N 3.05Å; K179-K182 PolarHBondContact O-N 3.32Å; K179-I183 WeakPolarHBondContact O-CG1 3.29Å; K179-I183 PolarHBondContact O-N 3.07Å
180L70.8Confident65.4Low118 Ų118120.1 Ų120.162%0.61861%0.607SS**Hα-helixtrans-57.8-41.8178.1-153.273.4000111.9H176 I183 H184H176-L180 PolarHBondContact O-N 3.16Å; L180-I183 PolarHBondContact O-N 3.34Å; L180-H184 WeakPolarHBondContact O-CB 3.44Å; L180-H184 PolarHBondContact O-N 2.9Å
181K74.5Confident66.5Low138 Ų138120.5 Ų120.560%0.660%0.595SS**Hα-helixtrans-65.4-37.1178.4-158.3168.5-169.2167.80113.2L177 S178 K179 R185L177-K181 WeakPolarHBondContact O-CB 3.37Å; L177-K181 PolarHBondContact O-N 3.42Å; S178-K181 PolarHBondContact O-N 2.82Å; K179-K181 VanDerWaalsContact C-N 3.3Å; K179-K181 PolarHBondContact O-N 3.05Å; K181-R185 PolarHBondContact O-N 3.47Å
182K73.3Confident67.5Low172 Ų172120 Ų12075%0.74858%0.581SS**Hα-helixtrans-67.4-43.3172.8-75.8-176.7177.5177.50111.5S178 K179 R185 K186S178-K182 PolarHBondContact O-N 3.07Å; K179-K182 PolarHBondContact O-N 3.32Å; K182-R185 PolarHBondContact O-N 3.31Å; K182-K186 PolarHBondContact O-N 3.44Å
183I73.5Confident68.7Low111 Ų111122.3 Ų122.357%0.56959%0.586SS**Hα-helixtrans-63.9-46.3177.5-65.4168.3000110.8K179 L180 R185 K186 A187K179-I183 WeakPolarHBondContact O-CG1 3.29Å; K179-I183 PolarHBondContact O-N 3.07Å; L180-I183 PolarHBondContact O-N 3.34Å; I183-R185 VanDerWaalsContact C-N 3.32Å; I183-R185 PolarHBondContact O-N 2.86Å; I183-K186 PolarHBondContact O-N 3.26Å; I183-A187 PolarHBondContact O-N 3.07Å
184H72.1Confident69.4Low138 Ų138126 Ų12664%0.63959%0.593SS**Hα-helixtrans-58.7-39.6179-170.8-104.7000112.6L180 A187 S188L180-H184 WeakPolarHBondContact O-CB 3.44Å; L180-H184 PolarHBondContact O-N 2.9Å; H184-A187 PolarHBondContact O-N 2.98Å; H184-S188 VanDerWaalsContact O-CB 3.27Å; H184-S188 WeakPolarHBondContact O-CB 3.22Å; H184-S188 PolarHBondContact O-N 2.87Å
185R71.3Confident70.1Confident197 Ų197131.5 Ų131.574%0.74361%0.613SS**Hα-helixtrans-63-40.5172.3-83.2-173.8168.7-173.6-2.1112.8K181 K182 I183 R189K181-R185 PolarHBondContact O-N 3.47Å; K182-R185 PolarHBondContact O-N 3.31Å; I183-R185 VanDerWaalsContact C-N 3.32Å; I183-R185 PolarHBondContact O-N 2.86Å; R185-R189 PolarHBondContact O-N 2.94Å
186K73.3Confident70.9Confident149 Ų149134.4 Ų134.465%0.64861%0.612SS**Hα-helixtrans-70.5-38.2178.7-162.2171.4-176.3176.70111.9K182 I183 R190K182-K186 PolarHBondContact O-N 3.44Å; I183-K186 PolarHBondContact O-N 3.26Å; K186-R190 PolarHBondContact O-N 3.48Å
187A71.8Confident71.9Confident47 Ų47134.9 Ų134.939%0.38861%0.612SS.*Hα-helixtrans-67.1-45.9174.500000112.5I183 H184 R189 R190 K191I183-A187 PolarHBondContact O-N 3.07Å; H184-A187 PolarHBondContact O-N 2.98Å; A187-R189 VanDerWaalsContact C-N 3.34Å; A187-R189 PolarHBondContact O-N 3.48Å; A187-R190 WeakPolarHBondContact O-CB 3.39Å; A187-R190 PolarHBondContact O-N 2.86Å; A187-K191 PolarHBondContact O-N 3.5Å
188S71Confident72.3Confident54 Ų54133.5 Ų133.538%0.37862%0.615SS.*Hα-helixtrans-59.7-40.7179.2-176.20000112.6H184 R190 K191 K192H184-S188 VanDerWaalsContact O-CB 3.27Å; H184-S188 WeakPolarHBondContact O-CB 3.22Å; H184-S188 PolarHBondContact O-N 2.87Å; S188-R190 VanDerWaalsContact C-N 3.34Å; S188-R190 PolarHBondContact O-N 3.28Å; S188-K191 PolarHBondContact O-N 2.92Å; S188-K192 PolarHBondContact O-N 3.46Å; S188-K192 VanDerWaalsContact O-N 3.15Å
189R67.5Low72.9Confident206 Ų206133.5 Ų133.578%0.77761%0.608SS**Hα-helixtrans-59.9-41.5172.7-75.2-175.6176.3-171.1-1.1112.3R185 A187 K192 L193R185-R189 PolarHBondContact O-N 2.94Å; A187-R189 VanDerWaalsContact C-N 3.34Å; A187-R189 PolarHBondContact O-N 3.48Å; R189-K192 PolarHBondContact O-N 3.27Å; R189-L193 PolarHBondContact O-N 2.88Å; R189-L193 VanDerWaalsContact O-N 3.15Å
190R73Confident73.4Confident179 Ų179133.1 Ų133.168%0.67561%0.607SS**Hα-helixtrans-66.5-41.8177.8-74.6-179.9168.5-175.6-5.6112.7K186 A187 S188 L193 K194K186-R190 PolarHBondContact O-N 3.48Å; A187-R190 WeakPolarHBondContact O-CB 3.39Å; A187-R190 PolarHBondContact O-N 2.86Å; S188-R190 VanDerWaalsContact C-N 3.34Å; S188-R190 PolarHBondContact O-N 3.28Å; R190-L193 PolarHBondContact O-N 3.44Å; R190-K194 PolarHBondContact O-N 3.21Å
191K70.5Confident73.7Confident115 Ų115131.1 Ų131.150%0.560%0.602SS.*Hα-helixtrans-59.4-47174.2-77.5-151175.1-159.30111.7A187 S188 L193 K194 Y195 D435A187-K191 PolarHBondContact O-N 3.5Å; S188-K191 PolarHBondContact O-N 2.92Å; K191-L193 PolarHBondContact O-N 3.34Å; K191-K194 PolarHBondContact O-N 2.72Å; K191-Y195 PolarHBondContact O-N 2.89Å; K191-D435 WeakPolarHBondContact CE-OD2 3.45Å; K191-D435 IonicContact NZ-OD2 3.9Å; K191-D435 PolarHBondContact NZ-OD2 2.86Å
192K71Confident73.7Confident138 Ų138130.1 Ų130.160%0.660%0.598SS**Hα-helixtrans-60.8-41.9178.4-69.4-167.9177.7-163.80113.1S188 R189 K194 Y195 F196S188-K192 PolarHBondContact O-N 3.46Å; S188-K192 VanDerWaalsContact O-N 3.15Å; R189-K192 PolarHBondContact O-N 3.27Å; K192-K194 PolarHBondContact O-N 3.02Å; K192-Y195 PolarHBondContact O-N 2.93Å; K192-F196 VanDerWaalsContact O-CD2 3.25Å; K192-F196 WeakPolarHBondContact O-CD2 3.3Å; K192-F196 PolarHBondContact O-N 3.46Å
193L72.7Confident73.9Confident130 Ų130126.1 Ų126.168%0.68158%0.584SS**Hα-helixtrans-65.6-36.8-179.9-167.768.1000112.7R189 R190 K191 K197R189-L193 PolarHBondContact O-N 2.88Å; R189-L193 VanDerWaalsContact O-N 3.15Å; R190-L193 PolarHBondContact O-N 3.44Å; K191-L193 PolarHBondContact O-N 3.34Å; L193-K197 PolarHBondContact O-N 3.44Å
194K77.3Confident74.1Confident163 Ų163122.7 Ų122.771%0.70957%0.57SS**Hα-helixtrans-58.9-48.8171.8-78.4-171.1170.1-167.30111.5R190 K191 K192 F196 K197 G198R190-K194 PolarHBondContact O-N 3.21Å; K191-K194 PolarHBondContact O-N 2.72Å; K192-K194 PolarHBondContact O-N 3.02Å; K194-F196 PolarHBondContact O-N 3.17Å; K194-K197 PolarHBondContact O-N 3.46Å; K194-G198 PolarHBondContact O-N 3.04Å
195Y73.2Confident74.5Confident167 Ų167119.6 Ų119.666%0.65556%0.561SS**Hα-helixtrans-61-44.9-179.1-172.5-110.5000112.2K191 K192 K197 G198 I199K191-Y195 PolarHBondContact O-N 2.89Å; K192-Y195 PolarHBondContact O-N 2.93Å; Y195-K197 PolarHBondContact O-N 3.16Å; Y195-G198 PolarHBondContact O-N 2.92Å; Y195-I199 HydrophobicContact CD1-CD1 3.77Å; Y195-I199 HydrophobicContact CE1-CD1 3.35Å; Y195-I199 HydrophobicContact CE1-CG1 4.43Å; Y195-I199 HydrophobicContact CE2-CD1 4.38Å; Y195-I199 HydrophobicContact CG-CD1 4.45Å; Y195-I199 PolarHBondContact O-N 3.35Å
196F73.7Confident74.9Confident137 Ų137116 Ų11660%0.60155%0.547SS*.Hα-helixtrans-62.3-40174.2-79.6-65.3000113.2K192 K194 G198 I199 F200K192-F196 VanDerWaalsContact O-CD2 3.25Å; K192-F196 WeakPolarHBondContact O-CD2 3.3Å; K192-F196 PolarHBondContact O-N 3.46Å; K194-F196 PolarHBondContact O-N 3.17Å; F196-G198 VanDerWaalsContact C-N 3.33Å; F196-G198 PolarHBondContact O-N 2.96Å; F196-I199 PolarHBondContact O-N 2.98Å; F196-F200 WeakPolarHBondContact O-CB 3.36Å; F196-F200 PolarHBondContact O-N 3.35Å
197K78.6Confident75.3Confident170 Ų170113.4 Ų113.474%0.73954%0.539SS*.Hα-helixtrans-64.3-38.1175-173174-179.6177.90111.9L193 K194 Y195 C201L193-K197 PolarHBondContact O-N 3.44Å; K194-K197 PolarHBondContact O-N 3.46Å; Y195-K197 PolarHBondContact O-N 3.16Å; K197-C201 WeakPolarHBondContact O-CB 3.44Å; K197-C201 PolarHBondContact O-N 3.32Å; K197-C201 VanDerWaalsContact O-N 3.12Å
198G75.2Confident75.9Confident43 Ų43116.1 Ų116.144%0.44355%0.546SS..Hα-helixtrans-61.9-51.3174.400000112.5K194 Y195 F196 F200 C201 F202K194-G198 PolarHBondContact O-N 3.04Å; Y195-G198 PolarHBondContact O-N 2.92Å; F196-G198 VanDerWaalsContact C-N 3.33Å; F196-G198 PolarHBondContact O-N 2.96Å; G198-F200 PolarHBondContact O-N 3.12Å; G198-C201 PolarHBondContact O-N 3.33Å; G198-F202 PolarHBondContact O-N 2.88Å
199I78Confident76.4Confident73 Ų73114.6 Ų114.637%0.37453%0.534SS..Hα-helixtrans-60-47.2176.8-69.2171.9000111.1Y195 F196 C201 F202 L203Y195-I199 HydrophobicContact CD1-CD1 3.77Å; Y195-I199 HydrophobicContact CE1-CD1 3.35Å; Y195-I199 HydrophobicContact CE1-CG1 4.43Å; Y195-I199 HydrophobicContact CE2-CD1 4.38Å; Y195-I199 HydrophobicContact CG-CD1 4.45Å; Y195-I199 PolarHBondContact O-N 3.35Å; F196-I199 PolarHBondContact O-N 2.98Å; I199-C201 VanDerWaalsContact C-N 3.27Å; I199-C201 PolarHBondContact O-N 2.84Å; I199-F202 PolarHBondContact O-N 2.94Å; I199-L203 WeakPolarHBondContact O-CB 3.3Å; I199-L203 PolarHBondContact O-N 2.95Å
200F78.5Confident77.2Confident151 Ų151109.4 Ų109.466%0.66252%0.521SS*.Hα-helixtrans-61.6-37.2-178.1-169.1-93000112.1F196 G198 S204F196-F200 WeakPolarHBondContact O-CB 3.36Å; F196-F200 PolarHBondContact O-N 3.35Å; G198-F200 PolarHBondContact O-N 3.12Å; F200-S204 VanDerWaalsContact O-CB 3.3Å; F200-S204 WeakPolarHBondContact O-CB 3.46Å; F200-S204 PolarHBondContact O-N 3.47Å; F200-S204 PolarHBondContact O-OG 3.39Å; F200-S204 VanDerWaalsContact O-OG 3.13Å
201C77.3Confident77.9Confident75 Ų75106.9 Ų106.951%0.50752%0.515SS..Hα-helixtrans-68.1-45.2174.8-168.80000112.7K197 G198 I199 L203 S204 V205K197-C201 WeakPolarHBondContact O-CB 3.44Å; K197-C201 PolarHBondContact O-N 3.32Å; K197-C201 VanDerWaalsContact O-N 3.12Å; G198-C201 PolarHBondContact O-N 3.33Å; I199-C201 VanDerWaalsContact C-N 3.27Å; I199-C201 PolarHBondContact O-N 2.84Å; C201-L203 VanDerWaalsContact C-N 3.34Å; C201-L203 PolarHBondContact O-N 3.36Å; C201-S204 PolarHBondContact O-OG 3.14Å; C201-S204 VanDerWaalsContact O-OG 3.11Å; C201-V205 WeakPolarHBondContact O-CB 3.49Å; C201-V205 VanDerWaalsContact O-CG2 3.31Å; C201-V205 WeakPolarHBondContact O-CG2 3.17Å; C201-V205 PolarHBondContact O-N 3.41Å; C201-V205 VanDerWaalsContact O-N 3.1Å
202F75.3Confident78.7Confident117 Ų117103.3 Ų103.351%0.51350%0.503SS..Hα-helixtrans-63.4-41.8176.4-179.2-94.3000111.9G198 I199 R206G198-F202 PolarHBondContact O-N 2.88Å; I199-F202 PolarHBondContact O-N 2.94Å; F202-R206 WeakPolarHBondContact O-CB 3.37Å; F202-R206 PolarHBondContact O-N 2.84Å
203L76.6Confident79.5Confident89 Ų8999.4 Ų99.447%0.46649%0.488SS..Hα-helixtrans-70.2-42.4-179.3-167.469.1000111.5I199 C201 R206 I207I199-L203 WeakPolarHBondContact O-CB 3.3Å; I199-L203 PolarHBondContact O-N 2.95Å; C201-L203 VanDerWaalsContact C-N 3.34Å; C201-L203 PolarHBondContact O-N 3.36Å; L203-R206 PolarHBondContact O-N 3.2Å; L203-I207 HydrophobicContact CD1-CD1 3.8Å; L203-I207 HydrophobicContact CD1-CG1 4.21Å; L203-I207 HydrophobicContact CD2-CD1 4.31Å; L203-I207 HydrophobicContact CG-CD1 3.7Å; L203-I207 HydrophobicContact CG-CG1 4.3Å; L203-I207 VanDerWaalsContact O-CB 3.29Å; L203-I207 WeakPolarHBondContact O-CB 3.44Å; L203-I207 VanDerWaalsContact O-CG1 3.3Å; L203-I207 WeakPolarHBondContact O-CG1 3.19Å; L203-I207 PolarHBondContact O-N 2.91Å
204S78.9Confident80.3Confident39 Ų3998.3 Ų98.327%0.27348%0.482SS..Hα-helixtrans-63.5-48.5176.566.50000111.4F200 C201 R206 I207 I208F200-S204 VanDerWaalsContact O-CB 3.3Å; F200-S204 WeakPolarHBondContact O-CB 3.46Å; F200-S204 PolarHBondContact O-N 3.47Å; F200-S204 PolarHBondContact O-OG 3.39Å; F200-S204 VanDerWaalsContact O-OG 3.13Å; C201-S204 PolarHBondContact O-OG 3.14Å; C201-S204 VanDerWaalsContact O-OG 3.11Å; S204-R206 VanDerWaalsContact C-N 3.34Å; S204-R206 PolarHBondContact O-N 2.94Å; S204-I207 PolarHBondContact O-N 3.22Å; S204-I208 VanDerWaalsContact O-CB 3.26Å; S204-I208 WeakPolarHBondContact O-CB 3.15Å; S204-I208 WeakPolarHBondContact O-CD1 3.31Å; S204-I208 WeakPolarHBondContact O-CG1 3.5Å; S204-I208 PolarHBondContact O-N 3.37Å
205V79.7Confident80.9Confident73 Ų7393 Ų9344%0.44246%0.461SS..Hα-helixtrans-59.2-43.4177.9172.50000111.5C201 L209C201-V205 WeakPolarHBondContact O-CB 3.49Å; C201-V205 VanDerWaalsContact O-CG2 3.31Å; C201-V205 WeakPolarHBondContact O-CG2 3.17Å; C201-V205 PolarHBondContact O-N 3.41Å; C201-V205 VanDerWaalsContact O-N 3.1Å; V205-L209 WeakPolarHBondContact O-CB 3.4Å; V205-L209 PolarHBondContact O-N 3.31Å
206R79.3Confident81.7Confident120 Ų12085.1 Ų85.145%0.45343%0.431SS..Hα-helixtrans-73.9-37.8-179.2-162.8175.2-174.3-165.1-2.6113E81 F202 L203 S204 L210E81-R206 IonicContact OE1-CZ 2.77Å; E81-R206 IonicContact OE1-NH1 4Å; E81-R206 PolarHBondContact OE1-NH1 3.25Å; F202-R206 WeakPolarHBondContact O-CB 3.37Å; F202-R206 PolarHBondContact O-N 2.84Å; L203-R206 PolarHBondContact O-N 3.2Å; S204-R206 VanDerWaalsContact C-N 3.34Å; S204-R206 PolarHBondContact O-N 2.94Å; R206-L210 WeakPolarHBondContact O-CG 3.43Å; R206-L210 PolarHBondContact O-N 2.99Å
207I82.8Confident82.4Confident95 Ų9583.3 Ų83.349%0.48743%0.426SS..Hα-helixtrans-73.2-44178.4-69.6-178.6000111.4L203 S204 L209 L210 F211L203-I207 HydrophobicContact CD1-CD1 3.8Å; L203-I207 HydrophobicContact CD1-CG1 4.21Å; L203-I207 HydrophobicContact CD2-CD1 4.31Å; L203-I207 HydrophobicContact CG-CD1 3.7Å; L203-I207 HydrophobicContact CG-CG1 4.3Å; L203-I207 VanDerWaalsContact O-CB 3.29Å; L203-I207 WeakPolarHBondContact O-CB 3.44Å; L203-I207 VanDerWaalsContact O-CG1 3.3Å; L203-I207 WeakPolarHBondContact O-CG1 3.19Å; L203-I207 PolarHBondContact O-N 2.91Å; S204-I207 PolarHBondContact O-N 3.22Å; I207-L209 VanDerWaalsContact C-N 3.28Å; I207-L209 PolarHBondContact O-N 3.43Å; I207-L210 PolarHBondContact O-N 2.83Å; I207-F211 WeakPolarHBondContact O-CB 3.21Å; I207-F211 PolarHBondContact O-N 2.88Å
208I83.8Confident83Confident104 Ų10479.7 Ų79.753%0.53341%0.414SS..Hα-helixtrans-58.9-43.6179.4-69.3165.7000110.2S204 L210 F211 T212S204-I208 VanDerWaalsContact O-CB 3.26Å; S204-I208 WeakPolarHBondContact O-CB 3.15Å; S204-I208 WeakPolarHBondContact O-CD1 3.31Å; S204-I208 WeakPolarHBondContact O-CG1 3.5Å; S204-I208 PolarHBondContact O-N 3.37Å; I208-L210 PolarHBondContact O-N 3.14Å; I208-F211 WeakPolarHBondContact O-CB 3.4Å; I208-F211 PolarHBondContact O-N 3.36Å; I208-F211 VanDerWaalsContact O-N 3.16Å; I208-T212 PolarHBondContact O-N 3.08Å; I208-T212 PolarHBondContact O-OG1 2.91Å
209L82.1Confident83.7Confident22 Ų2281.8 Ų81.812%0.11541%0.411CS..Hα-helixtrans-67-32.6179.6-172.362.6000113.7V205 I207 T212 L213 C245 L246 L249V205-L209 WeakPolarHBondContact O-CB 3.4Å; V205-L209 PolarHBondContact O-N 3.31Å; I207-L209 VanDerWaalsContact C-N 3.28Å; I207-L209 PolarHBondContact O-N 3.43Å; L209-T212 WeakPolarHBondContact CA-OG1 3.48Å; L209-T212 PolarHBondContact O-OG1 2.95Å; L209-L213 WeakPolarHBondContact O-CB 3.47Å; L209-L213 PolarHBondContact O-N 3.02Å; L209-C245 HydrophobicContact CD1-CB 4.05Å; L209-L246 HydrophobicContact CD1-CG 4.32Å; L209-L246 HydrophobicContact CD2-CD2 3.46Å; L209-L246 VanDerWaalsContact CD2-CD2 3.46Å; L209-L246 HydrophobicContact CD2-CG 3.77Å; L209-L246 HydrophobicContact CG-CD2 4.06Å; L209-L246 HydrophobicContact CG-CG 4.07Å; L209-L249 HydrophobicContact CD2-CD1 3.43Å; L209-L249 VanDerWaalsContact CD2-CD1 3.43Å
210L83.9Confident84.2Confident97 Ų9780.5 Ų80.551%0.50841%0.405SS..Hα-helixtrans-71.9-38.1171.2-71.5170000111.2R206 I207 I208 L213 I214R206-L210 WeakPolarHBondContact O-CG 3.43Å; R206-L210 PolarHBondContact O-N 2.99Å; I207-L210 PolarHBondContact O-N 2.83Å; I208-L210 PolarHBondContact O-N 3.14Å; L210-L213 PolarHBondContact O-N 2.87Å; L210-I214 VanDerWaalsContact O-CG1 3.3Å; L210-I214 WeakPolarHBondContact O-CG1 3.45Å; L210-I214 PolarHBondContact O-N 3.4Å
211F87.3Confident84.5Confident126 Ų12678 Ų7855%0.55340%0.398SS*.Hα-helixtrans-67.3-40.7178.2-173.3-109.9000112.4I207 I208 L213 I214 L215I207-F211 WeakPolarHBondContact O-CB 3.21Å; I207-F211 PolarHBondContact O-N 2.88Å; I208-F211 WeakPolarHBondContact O-CB 3.4Å; I208-F211 PolarHBondContact O-N 3.36Å; I208-F211 VanDerWaalsContact O-N 3.16Å; F211-L213 VanDerWaalsContact C-N 3.32Å; F211-L213 PolarHBondContact O-N 3.2Å; F211-I214 PolarHBondContact O-N 2.86Å; F211-L215 HydrophobicContact CD1-CD1 3.85Å; F211-L215 HydrophobicContact CD1-CG 4.47Å; F211-L215 HydrophobicContact CE1-CD1 3.47Å; F211-L215 VanDerWaalsContact CE1-CD1 3.47Å; F211-L215 HydrophobicContact CE1-CG 4.18Å; F211-L215 HydrophobicContact CZ-CD1 3.94Å; F211-L215 HydrophobicContact CZ-CD2 4.5Å; F211-L215 HydrophobicContact CZ-CG 4.25Å; F211-L215 WeakPolarHBondContact O-CB 3.36Å; F211-L215 WeakPolarHBondContact O-CG 3.42Å; F211-L215 PolarHBondContact O-N 3.31Å
212T86.9Confident85.2Confident41 Ų4176.9 Ų76.925%0.25239%0.389SS..Hα-helixtrans-64.4-35.9173.550.90000112.5I208 L209 S216 S242I208-T212 PolarHBondContact O-N 3.08Å; I208-T212 PolarHBondContact O-OG1 2.91Å; L209-T212 WeakPolarHBondContact CA-OG1 3.48Å; L209-T212 PolarHBondContact O-OG1 2.95Å; T212-S216 WeakPolarHBondContact O-CB 3.49Å; T212-S216 PolarHBondContact O-N 3.37Å; T212-S242 PolarHBondContact OG1-OG 3.35Å
213L87.5Confident85.8Confident55 Ų5571.3 Ų71.329%0.28836%0.364SS..Hα-helixtrans-67.2-43.7175.3-173.9151.2000111.4L209 L210 F211 S216 I217 L246L209-L213 WeakPolarHBondContact O-CB 3.47Å; L209-L213 PolarHBondContact O-N 3.02Å; L210-L213 PolarHBondContact O-N 2.87Å; F211-L213 VanDerWaalsContact C-N 3.32Å; F211-L213 PolarHBondContact O-N 3.2Å; L213-S216 PolarHBondContact O-N 3.49Å; L213-I217 HydrophobicContact CD2-CD1 3.68Å; L213-I217 WeakPolarHBondContact O-CG1 3.47Å; L213-I217 PolarHBondContact O-N 3.29Å; L213-L246 HydrophobicContact CD1-CD1 3.93Å
214I89.8Confident86.3Confident107 Ų10775.1 Ų75.155%0.54937%0.374SS..Hα-helixtrans-63.5-44.7175.8-68163.1000111L210 F211 S216 I217 L218L210-I214 VanDerWaalsContact O-CG1 3.3Å; L210-I214 WeakPolarHBondContact O-CG1 3.45Å; L210-I214 PolarHBondContact O-N 3.4Å; F211-I214 PolarHBondContact O-N 2.86Å; I214-S216 VanDerWaalsContact C-N 3.34Å; I214-S216 PolarHBondContact O-N 3.14Å; I214-I217 PolarHBondContact O-N 3.37Å; I214-L218 PolarHBondContact O-N 3.28Å
215L89.9Confident86.6Confident53 Ų5379.2 Ų79.228%0.27739%0.392SS..Hα-helixtrans-61.8-40.1174.8-77.4176.3000112.3F211 L218 F219 L238F211-L215 HydrophobicContact CD1-CD1 3.85Å; F211-L215 HydrophobicContact CD1-CG 4.47Å; F211-L215 HydrophobicContact CE1-CD1 3.47Å; F211-L215 VanDerWaalsContact CE1-CD1 3.47Å; F211-L215 HydrophobicContact CE1-CG 4.18Å; F211-L215 HydrophobicContact CZ-CD1 3.94Å; F211-L215 HydrophobicContact CZ-CD2 4.5Å; F211-L215 HydrophobicContact CZ-CG 4.25Å; F211-L215 WeakPolarHBondContact O-CB 3.36Å; F211-L215 WeakPolarHBondContact O-CG 3.42Å; F211-L215 PolarHBondContact O-N 3.31Å; L215-L218 PolarHBondContact O-N 3.32Å; L215-F219 HydrophobicContact CB-CD2 4.49Å; L215-F219 HydrophobicContact CB-CE2 4.44Å; L215-F219 WeakPolarHBondContact O-CD2 3.35Å; L215-F219 PolarHBondContact O-N 3.37Å; L215-L238 HydrophobicContact CB-CD2 4.39Å
216S90.3Very high87Confident1 Ų180.9 Ų80.91%0.00740%0.398CS..Hα-helixtrans-60.9-46175.9169.30000111.9T212 L213 I214 L218 F219 L220 G235 S239T212-S216 WeakPolarHBondContact O-CB 3.49Å; T212-S216 PolarHBondContact O-N 3.37Å; L213-S216 PolarHBondContact O-N 3.49Å; I214-S216 VanDerWaalsContact C-N 3.34Å; I214-S216 PolarHBondContact O-N 3.14Å; S216-L218 VanDerWaalsContact C-N 3.31Å; S216-L218 PolarHBondContact O-N 2.94Å; S216-F219 PolarHBondContact O-N 2.92Å; S216-L220 WeakPolarHBondContact O-CB 3.48Å; S216-L220 VanDerWaalsContact O-CG 3.3Å; S216-L220 WeakPolarHBondContact O-CG 3.32Å; S216-L220 PolarHBondContact O-N 2.92Å; S216-G235 PolarHBondContact OG-O 2.95Å; S216-S239 WeakPolarHBondContact OG-CA 3.36Å; S216-S239 WeakPolarHBondContact OG-CB 3.32Å; S216-S239 PolarHBondContact OG-N 3.13Å
217I88.7Confident87.1Confident99 Ų9982.9 Ų82.951%0.50841%0.412SS..Hα-helixtrans-61.7-40.8175.3-66.3170.7000110.8L213 I214 L220 L221L213-I217 HydrophobicContact CD2-CD1 3.68Å; L213-I217 WeakPolarHBondContact O-CG1 3.47Å; L213-I217 PolarHBondContact O-N 3.29Å; I214-I217 PolarHBondContact O-N 3.37Å; I217-L220 PolarHBondContact O-N 2.85Å; I217-L221 WeakPolarHBondContact O-CB 3.44Å; I217-L221 PolarHBondContact O-N 3.37Å
218L90.8Very high87.2Confident93 Ų9382 Ų8249%0.48741%0.407SS..Hα-helixtrans-64.6-43.3176.9-174.563000112.1I214 L215 S216 L221 V222I214-L218 PolarHBondContact O-N 3.28Å; L215-L218 PolarHBondContact O-N 3.32Å; S216-L218 VanDerWaalsContact C-N 3.31Å; S216-L218 PolarHBondContact O-N 2.94Å; L218-L221 PolarHBondContact O-N 3.17Å; L218-V222 HydrophobicContact CD1-CG2 4.2Å; L218-V222 HydrophobicContact CG-CG2 4.44Å; L218-V222 WeakPolarHBondContact O-CB 3.38Å; L218-V222 VanDerWaalsContact O-CG2 3.29Å; L218-V222 WeakPolarHBondContact O-CG2 3.5Å; L218-V222 PolarHBondContact O-N 3.43Å
219F89.9Confident87.4Confident88 Ų8886 Ų8639%0.38642%0.416SS..Hα-helixtrans-67.8-36175.4-76.2-57.9000112.8L215 S216 G223 I231 L238L215-F219 HydrophobicContact CB-CD2 4.49Å; L215-F219 HydrophobicContact CB-CE2 4.44Å; L215-F219 WeakPolarHBondContact O-CD2 3.35Å; L215-F219 PolarHBondContact O-N 3.37Å; S216-F219 PolarHBondContact O-N 2.92Å; F219-G223 WeakPolarHBondContact O-CA 3.41Å; F219-G223 PolarHBondContact O-N 3.47Å; F219-I231 HydrophobicContact CB-CG2 4.35Å; F219-I231 HydrophobicContact CD1-CG2 3.92Å; F219-I231 WeakPolarHBondContact O-CG2 3.45Å; F219-L238 HydrophobicContact CD2-CD2 4.33Å
220L88.8Confident87.6Confident46 Ų4690.8 Ų90.824%0.24144%0.441CS..Hα-helixtrans-60.9-48.5171.5-75.1169.1000111S216 I217 Y224 L232 C236S216-L220 WeakPolarHBondContact O-CB 3.48Å; S216-L220 VanDerWaalsContact O-CG 3.3Å; S216-L220 WeakPolarHBondContact O-CG 3.32Å; S216-L220 PolarHBondContact O-N 2.92Å; I217-L220 PolarHBondContact O-N 2.85Å; L220-Y224 WeakPolarHBondContact O-CB 3.29Å; L220-Y224 PolarHBondContact O-N 3.05Å; L220-L232 HydrophobicContact CD2-CD1 4.03Å; L220-C236 HydrophobicContact CD2-CB 4.41Å; L220-C236 WeakPolarHBondContact CD2-SG 3.35Å
221L85.5Confident87.7Confident97 Ų9788.4 Ų88.451%0.50843%0.429SS..Hα-helixtrans-63.8-48.3179.7-17466000111.9I217 L218 Y224 L225I217-L221 WeakPolarHBondContact O-CB 3.44Å; I217-L221 PolarHBondContact O-N 3.37Å; L218-L221 PolarHBondContact O-N 3.17Å; L221-Y224 PolarHBondContact O-N 2.74Å; L221-L225 HydrophobicContact CD1-CD1 4.13Å; L221-L225 HydrophobicContact CD1-CG 4.44Å; L221-L225 HydrophobicContact CG-CD1 3.93Å; L221-L225 WeakPolarHBondContact O-CB 3.47Å; L221-L225 VanDerWaalsContact O-CG 3.24Å; L221-L225 WeakPolarHBondContact O-CG 3.21Å; L221-L225 PolarHBondContact O-N 3.18Å
222V90.8Very high87.7Confident52 Ų5285.3 Ų85.332%0.31542%0.417SS..Hα-helixtrans-67.4-40.1179.1171.40000111.7L218 Y224 L225 L226L218-V222 HydrophobicContact CD1-CG2 4.2Å; L218-V222 HydrophobicContact CG-CG2 4.44Å; L218-V222 WeakPolarHBondContact O-CB 3.38Å; L218-V222 VanDerWaalsContact O-CG2 3.29Å; L218-V222 WeakPolarHBondContact O-CG2 3.5Å; L218-V222 PolarHBondContact O-N 3.43Å; V222-Y224 VanDerWaalsContact C-N 3.34Å; V222-L225 PolarHBondContact O-N 3.09Å; V222-L226 HydrophobicContact CG1-CD1 3.68Å; V222-L226 HydrophobicContact CG1-CG 4.29Å; V222-L226 WeakPolarHBondContact O-CB 3.37Å; V222-L226 WeakPolarHBondContact O-CG 3.38Å; V222-L226 PolarHBondContact O-N 3.38Å
223G87.6Confident87.8Confident0 Ų087.5 Ų87.50%043%0.427CS..Hα-helixtrans-67.6-32.7176.900000113.3F219 H227 I228F219-G223 WeakPolarHBondContact O-CA 3.41Å; F219-G223 PolarHBondContact O-N 3.47Å; G223-H227 CarbonylContact O-C 3.48Å; G223-H227 WeakPolarHBondContact O-CA 3.3Å; G223-H227 PolarHBondContact O-N 3.39Å; G223-I228 PolarHBondContact O-N 2.96Å; G223-I228 VanDerWaalsContact O-N 3.14Å
224Y87Confident87.9Confident169 Ų16988.5 Ų88.566%0.66344%0.435SS*.Hα-helixtrans-71-51.1171.6-175.2-102.5000111.3L220 L221 V222 L226 H227L220-Y224 WeakPolarHBondContact O-CB 3.29Å; L220-Y224 PolarHBondContact O-N 3.05Å; L221-Y224 PolarHBondContact O-N 2.74Å; V222-Y224 VanDerWaalsContact C-N 3.34Å; Y224-L226 PolarHBondContact O-N 3.02Å; Y224-H227 PolarHBondContact O-N 3.27Å; Y224-H227 VanDerWaalsContact O-N 3.09Å
225L85.6Confident87.9Confident126 Ų12683.4 Ų83.466%0.6641%0.409SS*.Hα-helixtrans-64.9-39.5-177.6-72.6172.1000113.9L221 V222 H227L221-L225 HydrophobicContact CD1-CD1 4.13Å; L221-L225 HydrophobicContact CD1-CG 4.44Å; L221-L225 HydrophobicContact CG-CD1 3.93Å; L221-L225 WeakPolarHBondContact O-CB 3.47Å; L221-L225 VanDerWaalsContact O-CG 3.24Å; L221-L225 WeakPolarHBondContact O-CG 3.21Å; L221-L225 PolarHBondContact O-N 3.18Å; V222-L225 PolarHBondContact O-N 3.09Å; L225-H227 VanDerWaalsContact C-N 3.27Å
226L88Confident87.9Confident108 Ų10883.6 Ų83.657%0.56541%0.414SS*.THydrogen-bonded Turntrans-84.5-3175.1-61.3177000112.6V222 Y224 I228V222-L226 HydrophobicContact CG1-CD1 3.68Å; V222-L226 HydrophobicContact CG1-CG 4.29Å; V222-L226 WeakPolarHBondContact O-CB 3.37Å; V222-L226 WeakPolarHBondContact O-CG 3.38Å; V222-L226 PolarHBondContact O-N 3.38Å; Y224-L226 PolarHBondContact O-N 3.02Å; L226-I228 HydrophobicContact CB-CD1 3.79Å; L226-I228 HydrophobicContact CB-CG1 3.82Å; L226-I228 HydrophobicContact CD1-CD1 4Å; L226-I228 WeakPolarHBondContact O-CG1 3.28Å; L226-I228 PolarHBondContact O-N 2.93Å
227H81.2Confident87.9Confident162 Ų16288.3 Ų88.375%0.7544%0.438SS*.  trans5714.5-174.8-141.2-76.8000115.2G223 Y224 L225 R229G223-H227 CarbonylContact O-C 3.48Å; G223-H227 WeakPolarHBondContact O-CA 3.3Å; G223-H227 PolarHBondContact O-N 3.39Å; Y224-H227 PolarHBondContact O-N 3.27Å; Y224-H227 VanDerWaalsContact O-N 3.09Å; L225-H227 VanDerWaalsContact C-N 3.27Å; H227-R229 PolarHBondContact O-N 2.82Å; H227-R229 VanDerWaalsContact O-N 3.07Å
228I86.5Confident87.9Confident75 Ų7586.3 Ų86.339%0.38543%0.428SS..  trans-78.396.3-177.7-57.8172.4000109.2G223 L226 N230 I231 L232G223-I228 PolarHBondContact O-N 2.96Å; G223-I228 VanDerWaalsContact O-N 3.14Å; L226-I228 HydrophobicContact CB-CD1 3.79Å; L226-I228 HydrophobicContact CB-CG1 3.82Å; L226-I228 HydrophobicContact CD1-CD1 4Å; L226-I228 WeakPolarHBondContact O-CG1 3.28Å; L226-I228 PolarHBondContact O-N 2.93Å; I228-N230 HydrophobicContact CG2-CB 4.4Å; I228-N230 PolarHBondContact O-N 3Å; I228-N230 VanDerWaalsContact O-N 3.07Å; I228-I231 HydrophobicContact CB-CB 4.38Å; I228-I231 HydrophobicContact CB-CD1 4.02Å; I228-I231 HydrophobicContact CB-CG1 4.15Å; I228-I231 HydrophobicContact CD1-CD1 3.83Å; I228-I231 HydrophobicContact CG2-CB 4.34Å; I228-I231 HydrophobicContact CG2-CD1 3.94Å; I228-I231 HydrophobicContact CG2-CG1 3.76Å; I228-I231 PolarHBondContact O-N 3.32Å; I228-L232 PolarHBondContact O-N 3.23Å; I228-L232 VanDerWaalsContact O-N 3.16Å
229R86.9Confident87.8Confident190 Ų19083.8 Ų83.872%0.71742%0.418SS*.Hα-helixtrans-45-42.7179.9-66.4176.967.3-178.80.7113.4H227 I231 L232 I233H227-R229 PolarHBondContact O-N 2.82Å; H227-R229 VanDerWaalsContact O-N 3.07Å; R229-I231 PolarHBondContact O-N 3.11Å; R229-L232 PolarHBondContact O-N 2.89Å; R229-I233 WeakPolarHBondContact O-CB 3.29Å; R229-I233 WeakPolarHBondContact O-CD1 3.35Å; R229-I233 WeakPolarHBondContact O-CG1 3.38Å; R229-I233 PolarHBondContact O-N 3.48Å
230N86Confident87.8Confident121 Ų12185.7 Ų85.765%0.64743%0.432SS*.Hα-helixtrans-63.7-38.4-178.9-640.5000113I228 T234I228-N230 HydrophobicContact CG2-CB 4.4Å; I228-N230 PolarHBondContact O-N 3Å; I228-N230 VanDerWaalsContact O-N 3.07Å; N230-T234 WeakPolarHBondContact O-CB 3.46Å; N230-T234 PolarHBondContact O-N 3.06Å; N230-T234 PolarHBondContact O-OG1 3.13Å
231I86Confident87.8Confident48 Ų4887.8 Ų87.825%0.24645%0.447CS..Hα-helixtrans-72.7-42178.1-60.2178.3000109.8F219 I228 R229 T234 G235F219-I231 HydrophobicContact CB-CG2 4.35Å; F219-I231 HydrophobicContact CD1-CG2 3.92Å; F219-I231 WeakPolarHBondContact O-CG2 3.45Å; I228-I231 HydrophobicContact CB-CB 4.38Å; I228-I231 HydrophobicContact CB-CD1 4.02Å; I228-I231 HydrophobicContact CB-CG1 4.15Å; I228-I231 HydrophobicContact CD1-CD1 3.83Å; I228-I231 HydrophobicContact CG2-CB 4.34Å; I228-I231 HydrophobicContact CG2-CD1 3.94Å; I228-I231 HydrophobicContact CG2-CG1 3.76Å; I228-I231 PolarHBondContact O-N 3.32Å; R229-I231 PolarHBondContact O-N 3.11Å; I231-T234 PolarHBondContact O-N 3.1Å; I231-G235 PolarHBondContact O-N 3.43Å
232L87.3Confident87.9Confident60 Ų6083.4 Ų83.431%0.31442%0.424SS..Hα-helixtrans-60-47.3175.5-17370.7000111.7L220 I228 R229 T234 G235 C236L220-L232 HydrophobicContact CD2-CD1 4.03Å; I228-L232 PolarHBondContact O-N 3.23Å; I228-L232 VanDerWaalsContact O-N 3.16Å; R229-L232 PolarHBondContact O-N 2.89Å; L232-T234 VanDerWaalsContact C-N 3.34Å; L232-T234 PolarHBondContact O-N 2.79Å; L232-G235 PolarHBondContact O-N 3.38Å; L232-C236 PolarHBondContact O-N 2.86Å; L232-C236 PolarHBondContact O-SG 3.46Å
233I90.3Very high87.7Confident87 Ų8784.4 Ų84.445%0.44643%0.43SS..Hα-helixtrans-60.5-43.6176.3-70.1163.7000110.7R229 G235 C236 I237R229-I233 WeakPolarHBondContact O-CB 3.29Å; R229-I233 WeakPolarHBondContact O-CD1 3.35Å; R229-I233 WeakPolarHBondContact O-CG1 3.38Å; R229-I233 PolarHBondContact O-N 3.48Å; I233-G235 PolarHBondContact O-N 3.16Å; I233-C236 WeakPolarHBondContact O-CB 3.46Å; I233-C236 PolarHBondContact O-N 3.48Å; I233-I237 HydrophobicContact CG2-CD1 3.75Å; I233-I237 HydrophobicContact CG2-CG1 4.45Å; I233-I237 VanDerWaalsContact O-CG1 3.31Å; I233-I237 WeakPolarHBondContact O-CG1 3.38Å; I233-I237 PolarHBondContact O-N 3.37Å
234T89.9Confident87.7Confident77 Ų7785.9 Ų85.947%0.47245%0.445SS..Hα-helixtrans-61.4-43.6175.9-56.70000111.4N230 I231 L232 C236 I237 L238N230-T234 WeakPolarHBondContact O-CB 3.46Å; N230-T234 PolarHBondContact O-N 3.06Å; N230-T234 PolarHBondContact O-OG1 3.13Å; I231-T234 PolarHBondContact O-N 3.1Å; L232-T234 VanDerWaalsContact C-N 3.34Å; L232-T234 PolarHBondContact O-N 2.79Å; T234-C236 PolarHBondContact O-N 2.92Å; T234-I237 PolarHBondContact O-N 2.92Å; T234-L238 WeakPolarHBondContact O-CB 3.29Å; T234-L238 PolarHBondContact O-N 3.31Å
235G89.2Confident87.5Confident0 Ų080.1 Ų80.10%043%0.429CS..Hα-helixtrans-59.5-44.1174.600000112.9S216 I231 L232 I233 L238 S239S216-G235 PolarHBondContact OG-O 2.95Å; I231-G235 PolarHBondContact O-N 3.43Å; L232-G235 PolarHBondContact O-N 3.38Å; I233-G235 PolarHBondContact O-N 3.16Å; G235-L238 PolarHBondContact O-N 3.3Å; G235-S239 WeakPolarHBondContact O-CB 3.29Å; G235-S239 PolarHBondContact O-N 3.45Å
236C89.5Confident87.4Confident56 Ų5677 Ų7738%0.37841%0.413SS..Hα-helixtrans-61.4-49175.1-74.50000112.3L220 L232 I233 T234 L238 S239 L240L220-C236 HydrophobicContact CD2-CB 4.41Å; L220-C236 WeakPolarHBondContact CD2-SG 3.35Å; L232-C236 PolarHBondContact O-N 2.86Å; L232-C236 PolarHBondContact O-SG 3.46Å; I233-C236 WeakPolarHBondContact O-CB 3.46Å; I233-C236 PolarHBondContact O-N 3.48Å; T234-C236 PolarHBondContact O-N 2.92Å; C236-L238 VanDerWaalsContact C-N 3.34Å; C236-L238 PolarHBondContact O-N 3.31Å; C236-S239 WeakPolarHBondContact O-CB 3.4Å; C236-S239 PolarHBondContact O-N 3.26Å; C236-L240 WeakPolarHBondContact O-CG 3.42Å; C236-L240 PolarHBondContact O-N 3.47Å
237I90.6Very high87.1Confident101 Ų10174.5 Ų74.552%0.51840%0.402SS..Hα-helixtrans-60.3-46.5178.7-68.1166000110I233 T234 S239 L240 T241I233-I237 HydrophobicContact CG2-CD1 3.75Å; I233-I237 HydrophobicContact CG2-CG1 4.45Å; I233-I237 VanDerWaalsContact O-CG1 3.31Å; I233-I237 WeakPolarHBondContact O-CG1 3.38Å; I233-I237 PolarHBondContact O-N 3.37Å; T234-I237 PolarHBondContact O-N 2.92Å; I237-S239 VanDerWaalsContact C-N 3.29Å; I237-S239 PolarHBondContact O-N 3.38Å; I237-L240 PolarHBondContact O-N 2.78Å; I237-T241 WeakPolarHBondContact O-CB 3.37Å; I237-T241 PolarHBondContact O-N 2.85Å; I237-T241 PolarHBondContact O-OG1 3.48Å
238L89.1Confident87.2Confident56 Ų5673.1 Ų73.129%0.29340%0.396SS..Hα-helixtrans-63.4-35.1178.6-156.971.4000112.1L215 F219 T234 G235 C236 S242L215-L238 HydrophobicContact CB-CD2 4.39Å; F219-L238 HydrophobicContact CD2-CD2 4.33Å; T234-L238 WeakPolarHBondContact O-CB 3.29Å; T234-L238 PolarHBondContact O-N 3.31Å; G235-L238 PolarHBondContact O-N 3.3Å; C236-L238 VanDerWaalsContact C-N 3.34Å; C236-L238 PolarHBondContact O-N 3.31Å; L238-S242 VanDerWaalsContact O-CB 3.29Å; L238-S242 WeakPolarHBondContact O-CB 3.19Å; L238-S242 PolarHBondContact O-N 3.5Å
239S88.1Confident86.6Confident40 Ų4072 Ų7228%0.2839%0.391SS..Hα-helixtrans-63.8-53.5174.4-1690000111S216 G235 C236 I237 T241 S242 V243S216-S239 WeakPolarHBondContact OG-CA 3.36Å; S216-S239 WeakPolarHBondContact OG-CB 3.32Å; S216-S239 PolarHBondContact OG-N 3.13Å; G235-S239 WeakPolarHBondContact O-CB 3.29Å; G235-S239 PolarHBondContact O-N 3.45Å; C236-S239 WeakPolarHBondContact O-CB 3.4Å; C236-S239 PolarHBondContact O-N 3.26Å; I237-S239 VanDerWaalsContact C-N 3.29Å; I237-S239 PolarHBondContact O-N 3.38Å; S239-T241 VanDerWaalsContact C-N 3.32Å; S239-T241 PolarHBondContact O-N 3.36Å; S239-S242 PolarHBondContact O-N 2.9Å; S239-S242 VanDerWaalsContact O-N 3.12Å; S239-V243 WeakPolarHBondContact O-CB 3.15Å; S239-V243 WeakPolarHBondContact O-CG2 3.3Å; S239-V243 PolarHBondContact O-N 2.84Å
240L90.9Very high86Confident128 Ų12864.5 Ų64.567%0.6737%0.367SS*.Hα-helixtrans-60.4-40.3179.8-70.1170.3000111.8C236 I237 G244C236-L240 WeakPolarHBondContact O-CG 3.42Å; C236-L240 PolarHBondContact O-N 3.47Å; I237-L240 PolarHBondContact O-N 2.78Å; L240-G244 PolarHBondContact O-N 2.93Å
241T89Confident85.3Confident91 Ų9163 Ų6356%0.55836%0.355SS*.Hα-helixtrans-64.8-44.1173.8-580000111.9I237 S239 C245I237-T241 WeakPolarHBondContact O-CB 3.37Å; I237-T241 PolarHBondContact O-N 2.85Å; I237-T241 PolarHBondContact O-OG1 3.48Å; S239-T241 VanDerWaalsContact C-N 3.32Å; S239-T241 PolarHBondContact O-N 3.36Å; T241-C245 VanDerWaalsContact O-CB 3.29Å; T241-C245 WeakPolarHBondContact O-CB 3.5Å; T241-C245 PolarHBondContact O-N 3.29Å
242S87Confident84.3Confident5 Ų564.3 Ų64.34%0.03537%0.365CS..Hα-helixtrans-67.1-40.9179.4-161.40000112.2T212 L238 S239 L246T212-S242 PolarHBondContact OG1-OG 3.35Å; L238-S242 VanDerWaalsContact O-CB 3.29Å; L238-S242 WeakPolarHBondContact O-CB 3.19Å; L238-S242 PolarHBondContact O-N 3.5Å; S239-S242 PolarHBondContact O-N 2.9Å; S239-S242 VanDerWaalsContact O-N 3.12Å; S242-L246 WeakPolarHBondContact O-CB 3.39Å; S242-L246 WeakPolarHBondContact O-CG 3.42Å; S242-L246 PolarHBondContact O-N 3.44Å
243V86Confident82.9Confident72 Ų7267.4 Ų67.444%0.43638%0.376SS..Hα-helixtrans-69.9-42.6176174.50000111.1S239 C245 L246 V247S239-V243 WeakPolarHBondContact O-CB 3.15Å; S239-V243 WeakPolarHBondContact O-CG2 3.3Å; S239-V243 PolarHBondContact O-N 2.84Å; V243-C245 VanDerWaalsContact C-N 3.33Å; V243-C245 PolarHBondContact O-N 2.84Å; V243-L246 WeakPolarHBondContact O-CB 3.43Å; V243-L246 PolarHBondContact O-N 3.44Å; V243-V247 WeakPolarHBondContact O-CG2 3.26Å; V243-V247 PolarHBondContact O-N 2.85Å
244G87Confident81.2Confident31 Ų3170.3 Ų70.332%0.3238%0.382SS..Hα-helixtrans-58.5-43.7173.500000112.3L240 V247 Q248L240-G244 PolarHBondContact O-N 2.93Å; G244-V247 PolarHBondContact O-N 3.43Å; G244-Q248 VanDerWaalsContact O-CG 3.32Å; G244-Q248 WeakPolarHBondContact O-CG 3.31Å; G244-Q248 PolarHBondContact O-N 3.16Å
245C84Confident79.3Confident48 Ų4870.6 Ų70.632%0.32439%0.387SS..Hα-helixtrans-64.4-43.5174.5-170.20000112.1L209 T241 V243 V247 Q248 L249L209-C245 HydrophobicContact CD1-CB 4.05Å; T241-C245 VanDerWaalsContact O-CB 3.29Å; T241-C245 WeakPolarHBondContact O-CB 3.5Å; T241-C245 PolarHBondContact O-N 3.29Å; V243-C245 VanDerWaalsContact C-N 3.33Å; V243-C245 PolarHBondContact O-N 2.84Å; C245-V247 VanDerWaalsContact C-N 3.35Å; C245-V247 PolarHBondContact O-N 2.84Å; C245-Q248 PolarHBondContact O-N 2.89Å; C245-L249 WeakPolarHBondContact O-CB 3.37Å; C245-L249 VanDerWaalsContact O-CG 3.3Å; C245-L249 WeakPolarHBondContact O-CG 3.12Å; C245-L249 PolarHBondContact O-N 2.9Å
246L82.3Confident77.2Confident62 Ų6274.7 Ų74.733%0.32542%0.415SS..Hα-helixtrans-56.6-46173.3-81.8163.7000112L209 L213 S242 V243 L249 C250L209-L246 HydrophobicContact CD1-CG 4.32Å; L209-L246 HydrophobicContact CD2-CD2 3.46Å; L209-L246 VanDerWaalsContact CD2-CD2 3.46Å; L209-L246 HydrophobicContact CD2-CG 3.77Å; L209-L246 HydrophobicContact CG-CD2 4.06Å; L209-L246 HydrophobicContact CG-CG 4.07Å; L213-L246 HydrophobicContact CD1-CD1 3.93Å; S242-L246 WeakPolarHBondContact O-CB 3.39Å; S242-L246 WeakPolarHBondContact O-CG 3.42Å; S242-L246 PolarHBondContact O-N 3.44Å; V243-L246 WeakPolarHBondContact O-CB 3.43Å; V243-L246 PolarHBondContact O-N 3.44Å; L246-L249 PolarHBondContact O-N 3.37Å; L246-C250 PolarHBondContact O-N 2.92Å; L246-C250 PolarHBondContact O-SG 3.23Å
247V82.9Confident75.1Confident55 Ų5577.4 Ų77.433%0.33344%0.435SS..Hα-helixtrans-64.8-45.7178.3172.80000111V243 G244 C245 L249 C250 F251V243-V247 WeakPolarHBondContact O-CG2 3.26Å; V243-V247 PolarHBondContact O-N 2.85Å; G244-V247 PolarHBondContact O-N 3.43Å; C245-V247 VanDerWaalsContact C-N 3.35Å; C245-V247 PolarHBondContact O-N 2.84Å; V247-L249 VanDerWaalsContact C-N 3.3Å; V247-L249 PolarHBondContact O-N 3.49Å; V247-C250 WeakPolarHBondContact O-CB 3.27Å; V247-C250 PolarHBondContact O-N 3.45Å; V247-C250 VanDerWaalsContact O-N 3.13Å; V247-F251 HydrophobicContact CG1-CD2 3.85Å; V247-F251 HydrophobicContact CG1-CE2 3.76Å; V247-F251 VanDerWaalsContact O-CD2 3.29Å; V247-F251 WeakPolarHBondContact O-CD2 3.41Å; V247-F251 PolarHBondContact O-N 3.47Å
248Q82Confident72.8Confident132 Ų13278.1 Ų78.162%0.61744%0.44SS*.Hα-helixtrans-59.2-38.9173.9-72.7174.93.900112.3G244 C245 F251 T252G244-Q248 VanDerWaalsContact O-CG 3.32Å; G244-Q248 WeakPolarHBondContact O-CG 3.31Å; G244-Q248 PolarHBondContact O-N 3.16Å; C245-Q248 PolarHBondContact O-N 2.89Å; Q248-F251 PolarHBondContact O-N 3.42Å; Q248-T252 WeakPolarHBondContact O-CB 3.42Å; Q248-T252 WeakPolarHBondContact O-CG2 3.5Å; Q248-T252 PolarHBondContact O-N 3.11Å; Q248-T252 PolarHBondContact O-OG1 3.33Å
249L75.6Confident70.9Confident52 Ų5284 Ų8427%0.27246%0.463SS..Hα-helixtrans-69.6-30.1175.8-74.3166.6000113L209 C245 L246 V247 T252 K253L209-L249 HydrophobicContact CD2-CD1 3.43Å; L209-L249 VanDerWaalsContact CD2-CD1 3.43Å; C245-L249 WeakPolarHBondContact O-CB 3.37Å; C245-L249 VanDerWaalsContact O-CG 3.3Å; C245-L249 WeakPolarHBondContact O-CG 3.12Å; C245-L249 PolarHBondContact O-N 2.9Å; L246-L249 PolarHBondContact O-N 3.37Å; V247-L249 VanDerWaalsContact C-N 3.3Å; V247-L249 PolarHBondContact O-N 3.49Å; L249-T252 WeakPolarHBondContact CA-OG1 3.3Å; L249-T252 PolarHBondContact O-OG1 3.12Å; L249-K253 WeakPolarHBondContact O-CB 3.32Å; L249-K253 VanDerWaalsContact O-CG 3.27Å; L249-K253 WeakPolarHBondContact O-CG 3.43Å; L249-K253 PolarHBondContact O-N 3.14Å
250C73Confident68.8Low33 Ų3388.8 Ų88.822%0.22348%0.479CS..Hα-helixtrans-69.1-40.6171.9-65.30000111.7L246 V247L246-C250 PolarHBondContact O-N 2.92Å; L246-C250 PolarHBondContact O-SG 3.23Å; V247-C250 WeakPolarHBondContact O-CB 3.27Å; V247-C250 PolarHBondContact O-N 3.45Å; V247-C250 VanDerWaalsContact O-N 3.13Å
251F71.7Confident66.8Low89 Ų8986.3 Ų86.339%0.3947%0.466SS..Hα-helixtrans-75.8-42178-77.1-68.1000113.7L73 V247 Q248 K253 R254 S255L73-F251 HydrophobicContact CD1-CE2 3.96Å; L73-F251 HydrophobicContact CD1-CZ 4.26Å; L73-F251 HydrophobicContact CD2-CE2 3.67Å; L73-F251 HydrophobicContact CD2-CZ 3.69Å; L73-F251 HydrophobicContact CG-CE2 3.81Å; L73-F251 HydrophobicContact CG-CZ 3.67Å; V247-F251 HydrophobicContact CG1-CD2 3.85Å; V247-F251 HydrophobicContact CG1-CE2 3.76Å; V247-F251 VanDerWaalsContact O-CD2 3.29Å; V247-F251 WeakPolarHBondContact O-CD2 3.41Å; V247-F251 PolarHBondContact O-N 3.47Å; Q248-F251 PolarHBondContact O-N 3.42Å; F251-K253 VanDerWaalsContact C-N 3.26Å; F251-K253 PolarHBondContact O-N 2.83Å; F251-R254 CarbonylContact O-C 3.52Å; F251-R254 WeakPolarHBondContact O-CA 3.44Å; F251-R254 WeakPolarHBondContact O-CB 3.37Å; F251-R254 PolarHBondContact O-N 3.31Å; F251-S255 PolarHBondContact O-N 3.12Å; F251-S255 PolarHBondContact O-OG 2.97Å
252T65.1Low65.1Low76 Ų7686.8 Ų86.847%0.46647%0.471SS..Hα-helixtrans-64.2-29177.449.50000112.9Q248 L249 R254 S255 S256Q248-T252 WeakPolarHBondContact O-CB 3.42Å; Q248-T252 WeakPolarHBondContact O-CG2 3.5Å; Q248-T252 PolarHBondContact O-N 3.11Å; Q248-T252 PolarHBondContact O-OG1 3.33Å; L249-T252 WeakPolarHBondContact CA-OG1 3.3Å; L249-T252 PolarHBondContact O-OG1 3.12Å; T252-R254 PolarHBondContact O-N 3.49Å; T252-S255 WeakPolarHBondContact CA-OG 3.35Å; T252-S255 CarbonylContact O-C 3.25Å; T252-S255 VanDerWaalsContact O-C 3.25Å; T252-S256 PolarHBondContact O-N 3.01Å
253K58.7Low63.5Low125 Ų12594.7 Ų94.754%0.54351%0.507SS..THydrogen-bonded Turntrans-69.9-12.4167.9-78.1179178.4-179.70114.7R78 L249 F251R78-K253 PolarHBondContact NH1-O 3.49Å; L249-K253 WeakPolarHBondContact O-CB 3.32Å; L249-K253 VanDerWaalsContact O-CG 3.27Å; L249-K253 WeakPolarHBondContact O-CG 3.43Å; L249-K253 PolarHBondContact O-N 3.14Å; F251-K253 VanDerWaalsContact C-N 3.26Å; F251-K253 PolarHBondContact O-N 2.83Å
254R53.6Low61.9Low148 Ų14894.7 Ų94.756%0.55851%0.511SS*.THydrogen-bonded Turntrans-103.3-30.7174.8-152.3169.7-174.1171.8-4.8111.4M75 T76 F251 T252 S256M75-R254 PolarHBondContact O-NH1 3.09Å; M75-R254 VanDerWaalsContact O-NH1 3.14Å; T76-R254 PolarHBondContact OG1-NH1 2.88Å; F251-R254 CarbonylContact O-C 3.52Å; F251-R254 WeakPolarHBondContact O-CA 3.44Å; F251-R254 WeakPolarHBondContact O-CB 3.37Å; F251-R254 PolarHBondContact O-N 3.31Å; T252-R254 PolarHBondContact O-N 3.49Å; R254-S256 VanDerWaalsContact C-N 3.29Å; R254-S256 PolarHBondContact O-N 2.92Å
255S50.7Low60Low83 Ų8395.9 Ų95.958%0.5851%0.512SS*.SBendtrans-92.146.4164.573.40000111.9F251 T252 S257F251-S255 PolarHBondContact O-N 3.12Å; F251-S255 PolarHBondContact O-OG 2.97Å; T252-S255 WeakPolarHBondContact CA-OG 3.35Å; T252-S255 CarbonylContact O-C 3.25Å; T252-S255 VanDerWaalsContact O-C 3.25Å; S255-S257 PolarHBondContact O-N 3.11Å; S255-S257 VanDerWaalsContact O-N 3.15Å
256S44.9Very low58.3Low85 Ų8599 Ų9959%0.59453%0.531SS*.  trans-57.1121167.554.20000108.1T252 R254 N258T252-S256 PolarHBondContact O-N 3.01Å; R254-S256 VanDerWaalsContact C-N 3.29Å; R254-S256 PolarHBondContact O-N 2.92Å; S256-N258 PolarHBondContact O-N 3.39Å
257S45.4Very low56.7Low114 Ų114103.9 Ų103.980%0.79755%0.55SS**  trans-43.7115-171.2-178.30000111.1S255 K259S255-S257 PolarHBondContact O-N 3.11Å; S255-S257 VanDerWaalsContact O-N 3.15Å; S257-K259 PolarHBondContact O-N 2.92Å
258N42.9Very low54.9Low116 Ų116105.8 Ų105.862%0.6257%0.572SS**  trans-72.5104.6-167.5-170.4-11.8000108.8S256 F260S256-N258 PolarHBondContact O-N 3.39Å; N258-F260 WeakPolarHBondContact ND2-CD2 3.45Å; N258-F260 PolarHBondContact O-N 3.02Å; N258-F260 VanDerWaalsContact OD1-CD2 3.3Å; N258-F260 WeakPolarHBondContact OD1-CD2 3.34Å; N258-F260 PolarHBondContact OD1-N 3.15Å
259K47.8Very low53.1Low179 Ų179105.9 Ų105.978%0.77858%0.576SS**  trans-72.527-179.7-68.4-172.4178.1-179.60113.7S257 N261S257-K259 PolarHBondContact O-N 2.92Å; K259-N261 PolarHBondContact O-N 3.26Å
260F45.1Very low51.4Low140 Ų140105.9 Ų105.961%0.61458%0.584SS**  trans-61.591.8148-77.8-52.3000108.4N258 P262 V265N258-F260 WeakPolarHBondContact ND2-CD2 3.45Å; N258-F260 PolarHBondContact O-N 3.02Å; N258-F260 VanDerWaalsContact OD1-CD2 3.3Å; N258-F260 WeakPolarHBondContact OD1-CD2 3.34Å; N258-F260 PolarHBondContact OD1-N 3.15Å; F260-P262 WeakPolarHBondContact O-CD 3.44Å; F260-V265 HydrophobicContact CD1-CG2 3.82Å; F260-V265 HydrophobicContact CE1-CG2 4.05Å
261N47.4Very low50.3Low76 Ų76109.7 Ų109.741%0.40661%0.606SS.*  trans-58.3121.2150.9174.90.7000106K259 Q263 S264K259-N261 PolarHBondContact O-N 3.26Å; N261-Q263 PolarHBondContact O-N 2.98Å; N261-Q263 WeakPolarHBondContact OD1-CB 3.37Å; N261-Q263 PolarHBondContact OD1-N 3.47Å; N261-S264 PolarHBondContact O-N 3.12Å; N261-S264 PolarHBondContact O-OG 2.89Å
262P53.4Low49.3Very low101 Ų101113.4 Ų113.466%0.65662%0.624SS**THydrogen-bonded Turntrans-61-17-179.924.6-34000112.6F260F260-P262 WeakPolarHBondContact O-CD 3.44Å
263Q53.2Low48.3Very low171 Ų171114.3 Ų114.380%0.79963%0.626SS**THydrogen-bonded Turntrans-87.7-8.6174-55.5174.1-20.700113.9N261N261-Q263 PolarHBondContact O-N 2.98Å; N261-Q263 WeakPolarHBondContact OD1-CB 3.37Å; N261-Q263 PolarHBondContact OD1-N 3.47Å
264S52.4Low47.7Very low72 Ų72114.8 Ų114.850%0.50363%0.634SS.*SBendtrans-97.7-2.5178740000114.1N261 P266N261-S264 PolarHBondContact O-N 3.12Å; N261-S264 PolarHBondContact O-OG 2.89Å; S264-P266 WeakPolarHBondContact O-CD 3.4Å
265V48Very low47.4Very low56 Ų56112.5 Ų112.534%0.33964%0.638SS.*SBendtrans-89110.9159.7178.90000106.2F260 F267F260-V265 HydrophobicContact CD1-CG2 3.82Å; F260-V265 HydrophobicContact CE1-CG2 4.05Å; V265-F267 HydrophobicContact CB-CE2 4.3Å; V265-F267 HydrophobicContact CG1-CE2 4.39Å; V265-F267 WeakPolarHBondContact O-CD2 3.4Å; V265-F267 PolarHBondContact O-N 3.32Å
266P49Very low47Very low114 Ų114115.7 Ų115.774%0.7465%0.649SS**  trans-68.5100.4172.428.1-32.2000108S264 A268S264-P266 WeakPolarHBondContact O-CD 3.4Å; P266-A268 PolarHBondContact O-N 3.08Å
267F47.3Very low46.7Very low164 Ų164118.2 Ų118.272%0.71966%0.661SS**  trans-6778.5163.8-70.8-84.8000108.5V265 L269V265-F267 HydrophobicContact CB-CE2 4.3Å; V265-F267 HydrophobicContact CG1-CE2 4.39Å; V265-F267 WeakPolarHBondContact O-CD2 3.4Å; V265-F267 PolarHBondContact O-N 3.32Å; F267-L269 PolarHBondContact O-N 3.49Å
268A45.5Very low46.4Very low95 Ų95116 Ų11679%0.78566%0.656SS**  trans-68.775.4164.400000108.2P266 A270P266-A268 PolarHBondContact O-N 3.08Å; A268-A270 PolarHBondContact O-N 3.33Å
269L44Very low46.2Very low134 Ų134116.7 Ų116.770%0.70266%0.66SS**  trans-55.2105.6155.8-82.8159.5000106.4F267 V271F267-L269 PolarHBondContact O-N 3.49Å; L269-V271 PolarHBondContact O-N 2.89Å; L269-V271 VanDerWaalsContact O-N 3.15Å
270A40.4Very low45.6Very low53 Ų53118 Ų11844%0.43867%0.666SS.*  trans-60.4116.2160.900000106A268 E272 D273A268-A270 PolarHBondContact O-N 3.33Å; A270-E272 PolarHBondContact O-N 3.27Å; A270-D273 PolarHBondContact O-N 3.46Å
271V49Very low45Very low113 Ų113116.3 Ų116.369%0.68567%0.667SS**G310 helixtrans-64.1-10-177.8176.40000111.5L269L269-V271 PolarHBondContact O-N 2.89Å; L269-V271 VanDerWaalsContact O-N 3.15Å
272E51.6Low44.2Very low166 Ų166121.2 Ų121.278%0.77669%0.692SS**G310 helixtrans-77.3-19.6173.2-56.5-179150.100114.1A270 L274A270-E272 PolarHBondContact O-N 3.27Å; E272-L274 PolarHBondContact O-N 3.23Å
273D44.8Very low43.6Very low96 Ų96123.1 Ų123.151%0.51370%0.695SS.*G310 helixtrans-78.82.8174-94.4-6000112A270 R348A270-D273 PolarHBondContact O-N 3.46Å; D273-R348 IonicContact OD1-NH2 3.33Å; D273-R348 IonicContact OD2-CZ 2.96Å; D273-R348 IonicContact OD2-NH1 2.93Å; D273-R348 PolarHBondContact OD2-NH1 3.42Å; D273-R348 IonicContact OD2-NH2 2.62Å; D273-R348 PolarHBondContact OD2-NH2 3.21Å
274L44.4Very low42.8Very low134 Ų134120.4 Ų120.470%0.70269%0.692SS**SBendtrans-90.5123.3178.2-16775.2000110.6E272 N276E272-L274 PolarHBondContact O-N 3.23Å; L274-N276 PolarHBondContact O-N 3.27Å
275P48.4Very low41.8Very low101 Ų101122 Ų12266%0.65670%0.703SS**  trans-63.6121.9-179.525.6-33.7000110.6T277P275-T277 PolarHBondContact O-N 3.33Å
276N42.4Very low41.1Very low149 Ų149126.6 Ų126.680%0.79773%0.725SS**  trans-71.495-174-170.44.8000110.8L274 G278L274-N276 PolarHBondContact O-N 3.27Å; N276-G278 PolarHBondContact O-N 3.27Å
277T38.9Very low40.1Very low138 Ų138127 Ų12785%0.84773%0.725SS**THydrogen-bonded Turntrans-72.963-176.251.30000112.9P275P275-T277 PolarHBondContact O-N 3.33Å
278G38.2Very low39.6Very low68 Ų68126.2 Ų126.270%0.70173%0.727SS**THydrogen-bonded Turntrans-109.6-17.8176.600000114.7N276N276-G278 PolarHBondContact O-N 3.27Å
279N38.5Very low38.9Very low130 Ų130124.2 Ų124.270%0.69572%0.716SS**SBendtrans-102122.8-17850.9-10.4000112.5T281N279-T281 PolarHBondContact O-N 3.02Å
280K34.7Very low38.3Very low208 Ų208124.9 Ų124.990%0.90473%0.726SS**  trans-75.9100-179.8-62169.6-177.6171.80110.9
281T33.3Very low37.9Very low104 Ų104127.5 Ų127.564%0.63874%0.741SS**  trans-134.4107.8166.1-420000110.2N279 I283N279-T281 PolarHBondContact O-N 3.02Å; T281-I283 HydrophobicContact CG2-CD1 3.96Å; T281-I283 HydrophobicContact CG2-CG1 3.94Å; T281-I283 PolarHBondContact O-N 3.32Å
282L31.3Very low37.1Very low179 Ų179129.6 Ų129.694%0.93775%0.748SS**  trans-72.4111.2173.2-66.6103000109.4
283I39.5Very low36.3Very low140 Ų140130.5 Ų130.572%0.71875%0.752SS**  trans-130.4131.3171.2-59.6-175.5000106.3T281T281-I283 HydrophobicContact CG2-CD1 3.96Å; T281-I283 HydrophobicContact CG2-CG1 3.94Å; T281-I283 PolarHBondContact O-N 3.32Å
284P37.3Very low35.6Very low115 Ų115133.3 Ų133.375%0.74777%0.767SS**  trans-79153.1-143.128-36.5000114.8L286P284-L286 PolarHBondContact O-N 2.92Å; P284-L286 VanDerWaalsContact O-N 3.14Å
285S31Very low35.2Very low104 Ų104133 Ų13373%0.72777%0.766SS**  trans-54.6114.9162.350.70000109.9T287S285-T287 VanDerWaalsContact C-N 3.31Å; S285-T287 PolarHBondContact O-N 3.15Å
286L33.1Very low34.4Very low154 Ų154133.9 Ų133.981%0.80677%0.769SS**  trans-71.687.8177-170.575000109.7P284 I288P284-L286 PolarHBondContact O-N 2.92Å; P284-L286 VanDerWaalsContact O-N 3.14Å; L286-I288 PolarHBondContact O-N 3.29Å
287T28.7Very low34Very low121 Ų121130.4 Ų130.474%0.74276%0.757SS**  trans-61.499.8170.9-58.10000108.9S285 G289S285-T287 VanDerWaalsContact C-N 3.31Å; S285-T287 PolarHBondContact O-N 3.15Å; T287-G289 VanDerWaalsContact C-N 3.25Å; T287-G289 PolarHBondContact O-N 2.87Å
288I36.5Very low33.7Very low148 Ų148126.2 Ų126.276%0.75973%0.733SS**  trans-71.788.1172.5-58.9179.5000107.3L286 T290L286-I288 PolarHBondContact O-N 3.29Å; I288-T290 PolarHBondContact O-N 3.14Å
289G31.3Very low33.6Very low53 Ų53128.6 Ų128.655%0.54673%0.729SS.*  trans-62.3122.5179.300000111.2T287 S291T287-G289 VanDerWaalsContact C-N 3.25Å; T287-G289 PolarHBondContact O-N 2.87Å; G289-S291 PolarHBondContact O-N 3.34Å; G289-S291 VanDerWaalsContact O-N 3.09Å
290T31.5Very low33.4Very low149 Ų149126.9 Ų126.991%0.91473%0.727SS**  trans-78.685.8173.150.40000110.2I288I288-T290 PolarHBondContact O-N 3.14Å
291S32.2Very low33.2Very low107 Ų107122.6 Ų122.675%0.74872%0.718SS**  trans-137.1147.1169.255.50000111.8G289G289-S291 PolarHBondContact O-N 3.34Å; G289-S291 VanDerWaalsContact O-N 3.09Å
292N32.4Very low33.4Very low157 Ų157123.9 Ų123.984%0.8473%0.726SS**  trans-93.3165.9-179.2-63.5-55.1000111
293Q34Very low33.6Very low185 Ų185121.1 Ų121.186%0.86472%0.717SS**  trans93.7101171.9-51.8-168.126.800118.5
294L30.1Very low33.5Very low155 Ų155121.3 Ų121.381%0.81272%0.719SS**  39.3139.8122.2-91.568000124
295N36Very low33.4Very low129 Ų129123.6 Ų123.669%0.6972%0.72SS**  trans97.183.2140.9-64.2-0.4000123.2
296T32.2Very low33.5Very low118 Ų118124.7 Ų124.772%0.72472%0.722SS**  58.7121.4119.354.50000124.6
297S32.5Very low33.6Very low76 Ų76120.4 Ų120.453%0.53172%0.715SS.*  trans68.2149139.9-64.50000119.4Q58Q58-S297 PolarHBondContact O-OG 2.87Å
298S34.4Very low33.9Very low50 Ų50121.3 Ų121.335%0.3572%0.72SS.*  cis-171.2176.7-4.341.60000110.7
299I35.4Very low33.8Very low118 Ų118118.4 Ų118.461%0.60571%0.713SS**  trans76.7152.6167.6-52.1174000115.8
300S33.8Very low33.9Very low95 Ų95122.6 Ų122.666%0.66472%0.723SS**  cis-171152.7-42.3-80.60000111.2
301T31.4Very low34.1Very low118 Ų118120.3 Ų120.372%0.72471%0.708SS**  trans39.8121.3149.3-41.20000123.5
302T37Very low34.4Very low130 Ų130121.6 Ų121.680%0.79871%0.707SS**  173.2115.5116.639.20000110.7
303V35.4Very low34.5Very low122 Ų122119.9 Ų119.974%0.73970%0.698SS**  59.9117.591.3-165.90000116.6
304N38.3Very low34.4Very low143 Ų143118.1 Ų118.177%0.76569%0.694SS**  trans153.6160.3144.6-83.35.6000111.7
305E33.9Very low35Very low164 Ų164114.6 Ų114.677%0.76670%0.696SS**  cis-167166-48.3-144.1-161.4151.500110.8
306V34Very low34.8Very low126 Ų126116 Ų11676%0.76470%0.703SS**  trans66.1140.1159.4-176.30000121.6
307G34.5Very low34.9Very low65 Ų65118.5 Ų118.567%0.6771%0.711SS**  trans128.692.8158.600000115.6
308V35Very low34.8Very low140 Ų140121.5 Ų121.585%0.84872%0.721SS**  cis67.9121.545.3-175.30000111.4
309S34.1Very low34.8Very low87 Ų87128.8 Ų128.861%0.60875%0.746SS**  cis-172.6161-1.1175.80000112.1
310N33.9Very low34.9Very low141 Ų141128.7 Ų128.775%0.75475%0.751SS**  trans64158.7152.5-76.7-1.3000120
311T36.5Very low35.1Very low100 Ų100130.1 Ų130.161%0.61376%0.758SS**  cis-161148.5-8.419.90000112.3
312N36.7Very low35.1Very low135 Ų135131.6 Ų131.672%0.72276%0.756SS**  trans68.1124.5135.9-66.611.8000124.7
313N34.8Very low34.7Very low120 Ų120128.8 Ų128.864%0.64275%0.753SS**  98.2123.7126.5-76.645.2000123.3
314D33.1Very low34.5Very low148 Ų148128.9 Ų128.979%0.79176%0.76SS**  trans63.7111.3134.4-49.1-21.9000121.4
315G42.1Very low34.3Very low82 Ų82127 Ų12785%0.84576%0.758SS**  trans17636.8173.500000116.3L317G315-L317 PolarHBondContact O-N 3.49Å
316N31.7Very low34Very low157 Ų157123.8 Ų123.884%0.8476%0.759SS**  trans-84.2103.4-169.3-175.113000114.2
317L33.7Very low34Very low172 Ų172123.7 Ų123.790%0.90176%0.758SS**  trans-163.7117.7157-114160.1000112.3G315G315-L317 PolarHBondContact O-N 3.49Å
318L31.3Very low33.6Very low139 Ų139129 Ų12973%0.72877%0.766SS**  trans-109.8140.7-169.4-145.7169.2000111.9V320L318-V320 HydrophobicContact CD2-CG2 4.47Å
319K33.2Very low33.4Very low203 Ų203129.6 Ų129.688%0.88376%0.763SS**  trans-142.6138.2169.7-150.7170.3-175.2177.50111.9
320V38.9Very low33.2Very low116 Ų116131.5 Ų131.570%0.70377%0.771SS**  trans-99154.4-159.2-171.80000112.8L318L318-V320 HydrophobicContact CD2-CG2 4.47Å
321P38.2Very low33.3Very low124 Ų124129.1 Ų129.181%0.80576%0.762SS**  trans-133.1150133.137.1-26.8000114.8
322E30.1Very low33.1Very low149 Ų149129.1 Ų129.170%0.69677%0.766SS**  trans-85.1144.3172.9-54.1167106.300110.5R412E322-R412 IonicContact OE2-CZ 2.89Å; E322-R412 IonicContact OE2-NH1 3.74Å; E322-R412 PolarHBondContact OE2-NH1 3.18Å
323G30.2Very low33.3Very low71 Ų71127.4 Ų127.473%0.73277%0.771SS**  trans-172.379.9-179.600000117.8
324S29.6Very low33.5Very low125 Ų125128.9 Ų128.987%0.87478%0.779SS**  trans16.7126.5151.759.10000121.8
325S34.3Very low33.6Very low104 Ų104126.3 Ų126.373%0.72777%0.769SS**  -155.3137.6127.7-169.10000111.6
326A28Very low33.4Very low96 Ų96127.9 Ų127.979%0.79376%0.764SS**  trans-128.4115169.100000107.9Q328A326-Q328 PolarHBondContact O-N 2.84Å
327V34.1Very low33.5Very low124 Ų124126.9 Ų126.975%0.75276%0.758SS**  trans-76.4114.3-170.3177.70000110.6L329V327-L329 HydrophobicContact CG1-CD1 4.28Å
328Q26.2Very low33.8Very low177 Ų177124.9 Ų124.983%0.82775%0.752SS**  trans-69.4142.5159.1-73.3-176.4-26.700109.7A326A326-Q328 PolarHBondContact O-N 2.84Å
329L31.9Very low34.6Very low152 Ų152123.9 Ų123.980%0.79675%0.746SS**  trans-148.5121.4154.8-110.9152.6000110.6V327V327-L329 HydrophobicContact CG1-CD1 4.28Å
330T28.4Very low34.9Very low126 Ų126117.3 Ų117.377%0.77374%0.736SS**  trans-95.5132.2176.249.40000110.7
331T36.7Very low35.7Very low91 Ų91116.4 Ų116.456%0.55873%0.727SS**  trans-149.5119.9162.3210000106.7
332S31.2Very low37Very low101 Ų101114.5 Ų114.571%0.70671%0.71SS**  66.1120.266.7-163.80000111.9N334S332-N334 VanDerWaalsContact C-N 3.31Å; S332-N334 PolarHBondContact O-N 3.42Å
333A41.6Very low38.6Very low99 Ų99114.6 Ų114.682%0.81871%0.71SS**THydrogen-bonded Turntrans-77.9-5.2-155.900000116.3
334N38.6Very low40.3Very low150 Ų150115.4 Ų115.480%0.80270%0.696SS**THydrogen-bonded Turntrans-11812.7-159.4-67.2-11000115.3S332S332-N334 VanDerWaalsContact C-N 3.31Å; S332-N334 PolarHBondContact O-N 3.42Å
335T36.3Very low42.2Very low95 Ų95113.6 Ų113.658%0.58367%0.674SS**SBendtrans-126.5132.3172.846.50000111.8L337T335-L337 PolarHBondContact O-N 2.99Å
336P37.8Very low43.7Very low115 Ų115110.6 Ų110.675%0.74766%0.656SS**  trans-71.7112.6176.428.9-32.7000109.7V338P336-V338 VanDerWaalsContact C-N 3.34Å; P336-V338 PolarHBondContact O-N 3.33Å
337L32.9Very low45.4Very low135 Ų135114 Ų11471%0.70765%0.648SS**  trans-7188.9175.2-172.273.4000109.8T335 I339T335-L337 PolarHBondContact O-N 2.99Å; L337-I339 VanDerWaalsContact C-N 3.3Å; L337-I339 HydrophobicContact CD2-CD1 4.16Å; L337-I339 HydrophobicContact CD2-CG1 3.97Å; L337-I339 HydrophobicContact CG-CG1 4.02Å; L337-I339 PolarHBondContact O-N 3.06Å
338V39.6Very low46.9Very low130 Ų130114.3 Ų114.379%0.78864%0.636SS**  trans-71.587.9173.2-177.20000108.7P336 G340P336-V338 VanDerWaalsContact C-N 3.34Å; P336-V338 PolarHBondContact O-N 3.33Å; V338-G340 PolarHBondContact O-N 3.49Å
339I48.3Very low49.2Very low118 Ų118110.2 Ų110.261%0.60562%0.619SS**  trans-68.3103.2171.2-59.2175.8000107.4L337 I341L337-I339 VanDerWaalsContact C-N 3.3Å; L337-I339 HydrophobicContact CD2-CD1 4.16Å; L337-I339 HydrophobicContact CD2-CG1 3.97Å; L337-I339 HydrophobicContact CG-CG1 4.02Å; L337-I339 PolarHBondContact O-N 3.06Å; I339-I341 HydrophobicContact CG2-CG1 4.33Å; I339-I341 PolarHBondContact O-N 3.41Å
340G40.8Very low51Low65 Ų65106 Ų10667%0.6760%0.602SS**  trans-65.595.7169.100000109.9V338 D342V338-G340 PolarHBondContact O-N 3.49Å; G340-D342 PolarHBondContact O-N 3.15Å; G340-D342 VanDerWaalsContact O-N 3.07Å
341I54.8Low52.9Low97 Ų97104 Ų10450%0.49759%0.585SS.*  trans-72.4101.8174.8-56.8179.6000107.6I339 Q345 A346I339-I341 HydrophobicContact CG2-CG1 4.33Å; I339-I341 PolarHBondContact O-N 3.41Å; I341-Q345 HydrophobicContact CG2-CB 3.7Å; I341-A346 HydrophobicContact CG2-CB 4.03Å
342D66.9Low54.4Low85 Ų85102.1 Ų102.146%0.45558%0.579SS.*  trans-55.2151176.2175.337.6000111.6G340 I344 Q345 A346G340-D342 PolarHBondContact O-N 3.15Å; G340-D342 VanDerWaalsContact O-N 3.07Å; D342-I344 PolarHBondContact O-N 3.41Å; D342-I344 VanDerWaalsContact O-N 3.1Å; D342-Q345 HydrophobicContact CB-CG 4.31Å; D342-Q345 CarbonylContact O-C 3.57Å; D342-Q345 WeakPolarHBondContact O-CA 3.38Å; D342-Q345 WeakPolarHBondContact O-CB 3.34Å; D342-Q345 PolarHBondContact O-N 3.27Å; D342-A346 PolarHBondContact O-N 3.47Å
343H61.7Low56.3Low151 Ų151102.2 Ų102.270%0.69957%0.571SS**Hα-helixtrans-58.4-30.7-174-166.9-40.6000111.9R347H343-R347 VanDerWaalsContact O-CB 3.29Å; H343-R347 WeakPolarHBondContact O-CB 3.37Å; H343-R347 PolarHBondContact O-N 3.48Å
344I67.8Low57.6Low87 Ų87103 Ų10345%0.44656%0.557SS.*Hα-helixtrans-67.5-44.2173.5-59.7175000110.6D342 R347 R348D342-I344 PolarHBondContact O-N 3.41Å; D342-I344 VanDerWaalsContact O-N 3.1Å; I344-R347 PolarHBondContact O-N 3.15Å; I344-R348 WeakPolarHBondContact O-CB 3.36Å; I344-R348 WeakPolarHBondContact O-CG 3.49Å; I344-R348 PolarHBondContact O-N 3.32Å
345Q67.7Low58.7Low88 Ų88101.5 Ų101.541%0.41155%0.545SS..Hα-helixtrans-66.2-41.8176.9-60-177.815.900111.6I341 D342 R347 R348 L349I341-Q345 HydrophobicContact CG2-CB 3.7Å; D342-Q345 HydrophobicContact CB-CG 4.31Å; D342-Q345 CarbonylContact O-C 3.57Å; D342-Q345 WeakPolarHBondContact O-CA 3.38Å; D342-Q345 WeakPolarHBondContact O-CB 3.34Å; D342-Q345 PolarHBondContact O-N 3.27Å; Q345-R347 VanDerWaalsContact C-N 3.31Å; Q345-R347 PolarHBondContact O-N 3.06Å; Q345-R348 PolarHBondContact O-N 2.97Å; Q345-L349 VanDerWaalsContact O-CB 3.29Å; Q345-L349 WeakPolarHBondContact O-CB 3.16Å; Q345-L349 PolarHBondContact O-N 3.3Å
346A66.2Low59.6Low41 Ų41102.8 Ų102.834%0.33955%0.548SS..Hα-helixtrans-60.8-39.6174.600000111.7I341 D342 L349 S350I341-A346 HydrophobicContact CG2-CB 4.03Å; D342-A346 PolarHBondContact O-N 3.47Å; A346-L349 PolarHBondContact O-N 2.89Å; A346-S350 WeakPolarHBondContact O-CB 3.39Å; A346-S350 PolarHBondContact O-N 3.01Å; A346-S350 PolarHBondContact O-OG 2.87Å
347R64.8Low60.6Low166 Ų16699.7 Ų99.763%0.62653%0.529SS*.Hα-helixtrans-71.4-38.1175.5-171177.5179.5178.70.1113H343 I344 Q345 S350 M351H343-R347 VanDerWaalsContact O-CB 3.29Å; H343-R347 WeakPolarHBondContact O-CB 3.37Å; H343-R347 PolarHBondContact O-N 3.48Å; I344-R347 PolarHBondContact O-N 3.15Å; Q345-R347 VanDerWaalsContact C-N 3.31Å; Q345-R347 PolarHBondContact O-N 3.06Å; R347-S350 PolarHBondContact O-OG 3.25Å; R347-M351 HydrophobicContact CG-CE 4.36Å; R347-M351 WeakPolarHBondContact O-CG 3.49Å; R347-M351 PolarHBondContact O-N 3.1Å; R347-M351 VanDerWaalsContact O-N 3.15Å
348R65.4Low61.6Low132 Ų132102.4 Ų102.450%0.49853%0.53SS..Hα-helixtrans-63.8-42.1172.1-72.1175-176.31675.3110.4D273 I344 Q345 A352D273-R348 IonicContact OD1-NH2 3.33Å; D273-R348 IonicContact OD2-CZ 2.96Å; D273-R348 IonicContact OD2-NH1 2.93Å; D273-R348 PolarHBondContact OD2-NH1 3.42Å; D273-R348 IonicContact OD2-NH2 2.62Å; D273-R348 PolarHBondContact OD2-NH2 3.21Å; I344-R348 WeakPolarHBondContact O-CB 3.36Å; I344-R348 WeakPolarHBondContact O-CG 3.49Å; I344-R348 PolarHBondContact O-N 3.32Å; Q345-R348 PolarHBondContact O-N 2.97Å; R348-A352 WeakPolarHBondContact O-CB 3.45Å; R348-A352 PolarHBondContact O-N 3.4Å
349L73.1Confident62.2Low91 Ų91100.8 Ų100.848%0.47652%0.517SS..Hα-helixtrans-69.8-39.9178.1-176.2147000113Q345 A346 A352 L353Q345-L349 VanDerWaalsContact O-CB 3.29Å; Q345-L349 WeakPolarHBondContact O-CB 3.16Å; Q345-L349 PolarHBondContact O-N 3.3Å; A346-L349 PolarHBondContact O-N 2.89Å; L349-A352 PolarHBondContact O-N 3.45Å; L349-L353 HydrophobicContact CD2-CD1 3.66Å; L349-L353 HydrophobicContact CD2-CG 4.32Å; L349-L353 PolarHBondContact O-N 3.05Å
350S69.6Low62.3Low62 Ų6299.4 Ų99.443%0.43452%0.518SS..Hα-helixtrans-66.8-41.4177.168.80000111.9A346 R347 L353 Q354A346-S350 WeakPolarHBondContact O-CB 3.39Å; A346-S350 PolarHBondContact O-N 3.01Å; A346-S350 PolarHBondContact O-OG 2.87Å; R347-S350 PolarHBondContact O-OG 3.25Å; S350-L353 PolarHBondContact O-N 2.85Å; S350-Q354 WeakPolarHBondContact O-CB 3.45Å; S350-Q354 PolarHBondContact O-N 3.22Å
351M69Low62.6Low85 Ų85104.5 Ų104.542%0.41952%0.522SS..Hα-helixtrans-62.1-43.7171.1-71.7-170.7-64.500111.8R347 L353 Q354 H355R347-M351 HydrophobicContact CG-CE 4.36Å; R347-M351 WeakPolarHBondContact O-CG 3.49Å; R347-M351 PolarHBondContact O-N 3.1Å; R347-M351 VanDerWaalsContact O-N 3.15Å; M351-L353 VanDerWaalsContact C-N 3.35Å; M351-L353 PolarHBondContact O-N 3.28Å; M351-Q354 PolarHBondContact O-N 3.37Å; M351-Q354 VanDerWaalsContact O-N 3.11Å; M351-H355 PolarHBondContact O-CD2 3.03Å; M351-H355 PolarHBondContact O-N 2.62Å
352A68.6Low61.9Low52 Ų52106.2 Ų106.243%0.4353%0.528SS..Hα-helixtrans-59.2-43.6176.400000112.4R348 L349 H355 L356R348-A352 WeakPolarHBondContact O-CB 3.45Å; R348-A352 PolarHBondContact O-N 3.4Å; L349-A352 PolarHBondContact O-N 3.45Å; A352-H355 PolarHBondContact O-N 3.01Å; A352-L356 WeakPolarHBondContact O-CB 3.45Å; A352-L356 PolarHBondContact O-N 2.89Å
353L71.3Confident60.5Low103 Ų103107.5 Ų107.554%0.53954%0.541SS..Hα-helixtrans-64.3-37.3173-76.2175.1000112.7L349 S350 M351 L356 S357L349-L353 HydrophobicContact CD2-CD1 3.66Å; L349-L353 HydrophobicContact CD2-CG 4.32Å; L349-L353 PolarHBondContact O-N 3.05Å; S350-L353 PolarHBondContact O-N 2.85Å; M351-L353 VanDerWaalsContact C-N 3.35Å; M351-L353 PolarHBondContact O-N 3.28Å; L353-L356 PolarHBondContact O-N 2.88Å; L353-S357 PolarHBondContact O-N 3.03Å; L353-S357 PolarHBondContact O-OG 2.79Å
354Q68.7Low59.6Low114 Ų114108 Ų10853%0.53354%0.543SS..Hα-helixtrans-71.6-30.1179-159.9174.829.800112.6S350 M351 S357 R358S350-Q354 WeakPolarHBondContact O-CB 3.45Å; S350-Q354 PolarHBondContact O-N 3.22Å; M351-Q354 PolarHBondContact O-N 3.37Å; M351-Q354 VanDerWaalsContact O-N 3.11Å; Q354-S357 PolarHBondContact O-OG 3.41Å; Q354-S357 VanDerWaalsContact O-OG 3.09Å; Q354-R358 WeakPolarHBondContact O-CB 3.41Å; Q354-R358 PolarHBondContact O-N 2.89Å
355H62Low58.2Low119 Ų119109.5 Ų109.555%0.55156%0.557SS**Hα-helixtrans-74.5-37.8167.8-75.7-70.9000112.2M351 A352 N359M351-H355 PolarHBondContact O-CD2 3.03Å; M351-H355 PolarHBondContact O-N 2.62Å; A352-H355 PolarHBondContact O-N 3.01Å; H355-N359 WeakPolarHBondContact O-CB 3.42Å; H355-N359 PolarHBondContact O-N 2.77Å; H355-N359 PolarHBondContact O-ND2 3.05Å
356L55.2Low56.7Low122 Ų122113.9 Ų113.964%0.63958%0.582SS**Hα-helixtrans-62.9-43.4173.8-102.3159.1000112A352 L353 S360A352-L356 WeakPolarHBondContact O-CB 3.45Å; A352-L356 PolarHBondContact O-N 2.89Å; L353-L356 PolarHBondContact O-N 2.88Å; L356-S360 PolarHBondContact O-N 2.91Å; L356-S360 VanDerWaalsContact O-N 3.17Å
357S58.9Low55.1Low51 Ų51116.8 Ų116.836%0.35760%0.6SS.*Hα-helixtrans-65.5-51176.966.90000111.1L353 Q354 N359 S360 F361L353-S357 PolarHBondContact O-N 3.03Å; L353-S357 PolarHBondContact O-OG 2.79Å; Q354-S357 PolarHBondContact O-OG 3.41Å; Q354-S357 VanDerWaalsContact O-OG 3.09Å; S357-N359 VanDerWaalsContact C-N 3.3Å; S357-N359 PolarHBondContact O-N 2.97Å; S357-S360 PolarHBondContact O-N 3.07Å; S357-S360 PolarHBondContact O-OG 3.33Å; S357-F361 VanDerWaalsContact O-CD2 3.28Å; S357-F361 WeakPolarHBondContact O-CD2 3.29Å; S357-F361 PolarHBondContact O-N 2.88Å
358R52.6Low53.7Low191 Ų191112.9 Ų112.972%0.72160%0.598SS**Hα-helixtrans-55.3-40.2176.6-86.8-177.3150.1148.7-5.1113.4Q354 S360Q354-R358 WeakPolarHBondContact O-CB 3.41Å; Q354-R358 PolarHBondContact O-N 2.89Å; R358-S360 VanDerWaalsContact C-N 3.32Å; R358-S360 PolarHBondContact O-N 2.94Å
359N53.4Low52.6Low96 Ų96112.9 Ų112.951%0.51360%0.604SS.*Hα-helixtrans-74.1-17.9177.1-74.9-56.1000114.1H355 S357H355-N359 WeakPolarHBondContact O-CB 3.42Å; H355-N359 PolarHBondContact O-N 2.77Å; H355-N359 PolarHBondContact O-ND2 3.05Å; S357-N359 VanDerWaalsContact C-N 3.3Å; S357-N359 PolarHBondContact O-N 2.97Å
360S50.8Low51.2Low89 Ų89117.4 Ų117.462%0.62262%0.62SS**Hα-helixtrans-86.4-16.5177.969.80000114.5L356 S357 R358L356-S360 PolarHBondContact O-N 2.91Å; L356-S360 VanDerWaalsContact O-N 3.17Å; S357-S360 PolarHBondContact O-N 3.07Å; S357-S360 PolarHBondContact O-OG 3.33Å; R358-S360 VanDerWaalsContact C-N 3.32Å; R358-S360 PolarHBondContact O-N 2.94Å
361F45.8Very low50Low172 Ų172119.5 Ų119.575%0.75462%0.622SS**SBendtrans-91.1-4.7178.2-78.2-68.5000114.6S357 P363S357-F361 VanDerWaalsContact O-CD2 3.28Å; S357-F361 WeakPolarHBondContact O-CD2 3.29Å; S357-F361 PolarHBondContact O-N 2.88Å; F361-P363 WeakPolarHBondContact O-CD 3.4Å
362Q40.8Very low49Very low133 Ų133123.8 Ų123.862%0.62164%0.641SS**SBendtrans-84.9109.2175.2-167.1171.436.200109.6Q364Q362-Q364 PolarHBondContact O-N 3.09Å
363P38.1Very low48.2Very low112 Ų112126.4 Ų126.473%0.72765%0.652SS**  trans-70.3103.6179.629.2-34000109.4F361 T365F361-P363 WeakPolarHBondContact O-CD 3.4Å; P363-T365 PolarHBondContact O-N 2.87Å; P363-T365 VanDerWaalsContact O-N 3.14Å
364Q41.7Very low47.3Very low161 Ų161124.8 Ų124.875%0.75265%0.647SS**  trans-63.8115.9168.7-68.2-172.31.100108.2Q362 L366Q362-Q364 PolarHBondContact O-N 3.09Å; Q364-L366 PolarHBondContact O-N 3.27Å
365T38.8Very low46.7Very low119 Ų119122.5 Ų122.573%0.7364%0.643SS**  trans-62.4128.1-175.138.20000110.8P363 S367P363-T365 PolarHBondContact O-N 2.87Å; P363-T365 VanDerWaalsContact O-N 3.14Å; T365-S367 VanDerWaalsContact C-N 3.27Å; T365-S367 PolarHBondContact O-N 3.25Å
366L35.8Very low46.1Very low181 Ų181123.5 Ų123.595%0.94865%0.65SS**SBendtrans-73.975.9-178.6-8377.8000111.1Q364Q364-L366 PolarHBondContact O-N 3.27Å
367S33.8Very low46.4Very low102 Ų102122.3 Ų122.371%0.71364%0.644SS**  trans-148.527.5179.360.20000115.9T365T365-S367 VanDerWaalsContact C-N 3.27Å; T365-S367 PolarHBondContact O-N 3.25Å
368S34.9Very low46.4Very low84 Ų84124.2 Ų124.259%0.58765%0.65SS**  trans-148.161.8172.1-152.20000115.9K370S368-K370 PolarHBondContact O-N 3.32Å
369H42.5Very low46.3Very low131 Ų131120.6 Ų120.661%0.60664%0.642SS**THydrogen-bonded Turntrans-74.143.8173-168.585.4000113G82G82-H369 PolarHBondContact O-CE1 3.01Å; G82-H369 PolarHBondContact O-NE2 3.45Å
370K44Very low46.5Very low187 Ų187118.4 Ų118.481%0.81364%0.637SS**THydrogen-bonded Turntrans-146.7-0.9-180-85-165.9175.6178.70115.6S368S368-K370 PolarHBondContact O-N 3.32Å
371H42.5Very low46.9Very low106 Ų106120.8 Ų120.849%0.49163%0.633SS.*  trans-135.337.3-166-106.9-53.4000115.2T373 T374 S375H371-T373 PolarHBondContact O-N 3.49Å; H371-T373 VanDerWaalsContact O-N 3.16Å; H371-T374 WeakPolarHBondContact CB-OG1 3.29Å; H371-T374 WeakPolarHBondContact ND1-CG2 3.3Å; H371-T374 PolarHBondContact O-N 3.32Å; H371-T374 PolarHBondContact O-OG1 3.01Å; H371-S375 PolarHBondContact O-N 2.91Å
372E49Very low47.4Very low174 Ų174119.7 Ų119.781%0.81362%0.624SS**Hα-helixtrans-54.7-34.9-178.2-160.3160.8-140.900113.3T374 S375E372-T374 PolarHBondContact O-N 2.96Å; E372-S375 WeakPolarHBondContact O-CB 3.41Å; E372-S375 PolarHBondContact O-N 2.87Å
373T51.8Low48.3Very low108 Ų108119 Ų11966%0.66362%0.624SS**Hα-helixtrans-63.3-34.9173.952.80000113.9H371 L377H371-T373 PolarHBondContact O-N 3.49Å; H371-T373 VanDerWaalsContact O-N 3.16Å; T373-L377 WeakPolarHBondContact O-CB 3.39Å; T373-L377 PolarHBondContact O-N 3.41Å; T373-L377 VanDerWaalsContact O-N 3.14Å
374T52.3Low49.4Very low69 Ų69118.3 Ų118.342%0.42362%0.618SS.*Hα-helixtrans-78.2-24178.562.20000112.8H371 E372 L377 N378H371-T374 WeakPolarHBondContact CB-OG1 3.29Å; H371-T374 WeakPolarHBondContact ND1-CG2 3.3Å; H371-T374 PolarHBondContact O-N 3.32Å; H371-T374 PolarHBondContact O-OG1 3.01Å; E372-T374 PolarHBondContact O-N 2.96Å; T374-L377 PolarHBondContact O-N 2.99Å; T374-N378 WeakPolarHBondContact O-CB 3.25Å; T374-N378 PolarHBondContact O-N 3.33Å
375S55.4Low49.8Very low66 Ų66116 Ų11646%0.46261%0.608SS.*Hα-helixtrans-60.8-53.7172.7-178.40000110.5H371 E372 N378 M379H371-S375 PolarHBondContact O-N 2.91Å; E372-S375 WeakPolarHBondContact O-CB 3.41Å; E372-S375 PolarHBondContact O-N 2.87Å; S375-N378 PolarHBondContact O-N 2.99Å; S375-M379 WeakPolarHBondContact O-CB 3.34Å; S375-M379 PolarHBondContact O-N 3.09Å
376M50.4Low50.2Low140 Ų140112.8 Ų112.869%0.6959%0.593SS**Hα-helixtrans-62-43.6175.4-82.6170.751.400112.8N378 M379 A380M376-N378 PolarHBondContact O-N 2.92Å; M376-M379 PolarHBondContact O-N 3.27Å; M376-A380 WeakPolarHBondContact O-CB 3.49Å; M376-A380 PolarHBondContact O-N 3.29Å
377L62.2Low50.6Low97 Ų97108.7 Ų108.751%0.50858%0.58SS.*Hα-helixtrans-67.4-36.6-178.6-165.4151.2000112.1T373 T374 R381T373-L377 WeakPolarHBondContact O-CB 3.39Å; T373-L377 PolarHBondContact O-N 3.41Å; T373-L377 VanDerWaalsContact O-N 3.14Å; T374-L377 PolarHBondContact O-N 2.99Å; L377-R381 WeakPolarHBondContact O-CB 3.47Å; L377-R381 PolarHBondContact O-N 3.01Å
378N56.8Low51.1Low90 Ų90107.3 Ų107.348%0.48157%0.57SS.*Hα-helixtrans-73-35.3175-159.715.1000111.7T374 S375 M376 R381 R382T374-N378 WeakPolarHBondContact O-CB 3.25Å; T374-N378 PolarHBondContact O-N 3.33Å; S375-N378 PolarHBondContact O-N 2.99Å; M376-N378 PolarHBondContact O-N 2.92Å; N378-R381 PolarHBondContact O-N 3.49Å; N378-R382 WeakPolarHBondContact O-CB 3.4Å; N378-R382 WeakPolarHBondContact O-CG 3.27Å; N378-R382 PolarHBondContact O-N 3.05Å
379M52.2Low51.5Low115 Ų115106.7 Ų106.757%0.56757%0.57SS**Hα-helixtrans-63.9-46.2171.2-170.2-178.1-6300111.6S375 M376 R382 L383S375-M379 WeakPolarHBondContact O-CB 3.34Å; S375-M379 PolarHBondContact O-N 3.09Å; M376-M379 PolarHBondContact O-N 3.27Å; M379-R382 PolarHBondContact O-N 3.15Å; M379-L383 HydrophobicContact CG-CD1 4.35Å; M379-L383 WeakPolarHBondContact O-CG 3.48Å; M379-L383 PolarHBondContact O-N 3.01Å
380A56Low51.6Low50 Ų50107.5 Ų107.541%0.41358%0.577SS.*Hα-helixtrans-59.7-47.8174.700000111.5M376 R382 L383 T384M376-A380 WeakPolarHBondContact O-CB 3.49Å; M376-A380 PolarHBondContact O-N 3.29Å; A380-R382 VanDerWaalsContact C-N 3.33Å; A380-R382 PolarHBondContact O-N 2.82Å; A380-L383 PolarHBondContact O-N 3.19Å; A380-L383 VanDerWaalsContact O-N 3.12Å; A380-T384 PolarHBondContact O-N 2.89Å; A380-T384 PolarHBondContact O-OG1 3.01Å; A380-T384 VanDerWaalsContact O-OG1 3.11Å
381R60.2Low51.5Low140 Ų140102.7 Ų102.753%0.52857%0.573SS.*Hα-helixtrans-59.5-40.5175.5-175-179.9-75.8139.7-6.9112.3L377 N378 M385L377-R381 WeakPolarHBondContact O-CB 3.47Å; L377-R381 PolarHBondContact O-N 3.01Å; N378-R381 PolarHBondContact O-N 3.49Å; R381-M385 HydrophobicContact CG-CE 4.11Å; R381-M385 HydrophobicContact CG-SD 4.27Å; R381-M385 WeakPolarHBondContact O-CB 3.4Å; R381-M385 WeakPolarHBondContact O-CG 3.44Å; R381-M385 PolarHBondContact O-N 3.34Å
382R56.9Low51.3Low149 Ų149105.3 Ų105.356%0.56259%0.589SS**Hα-helixtrans-64.4-39.4173.8-76-179.974.9-174.82.6112.3N378 M379 A380 A386N378-R382 WeakPolarHBondContact O-CB 3.4Å; N378-R382 WeakPolarHBondContact O-CG 3.27Å; N378-R382 PolarHBondContact O-N 3.05Å; M379-R382 PolarHBondContact O-N 3.15Å; A380-R382 VanDerWaalsContact C-N 3.33Å; A380-R382 PolarHBondContact O-N 2.82Å; R382-A386 WeakPolarHBondContact O-CB 3.42Å; R382-A386 PolarHBondContact O-N 2.9Å
383L58.8Low50.7Low119 Ų119100.3 Ų100.362%0.62359%0.585SS**Hα-helixtrans-67.3-43.9176.2-71.2167.4000112M379 A380 A386 S387M379-L383 HydrophobicContact CG-CD1 4.35Å; M379-L383 WeakPolarHBondContact O-CG 3.48Å; M379-L383 PolarHBondContact O-N 3.01Å; A380-L383 PolarHBondContact O-N 3.19Å; A380-L383 VanDerWaalsContact O-N 3.12Å; L383-A386 PolarHBondContact O-N 3.35Å; L383-S387 PolarHBondContact O-N 3.14Å; L383-S387 VanDerWaalsContact O-N 3.12Å
384T61Low50Low97 Ų97100 Ų10060%0.59559%0.587SS**Hα-helixtrans-59.6-51174.6-54.90000111.3A380 A386 S387 S388A380-T384 PolarHBondContact O-N 2.89Å; A380-T384 PolarHBondContact O-OG1 3.01Å; A380-T384 VanDerWaalsContact O-OG1 3.11Å; T384-A386 PolarHBondContact O-N 3.04Å; T384-S387 WeakPolarHBondContact O-CB 3.42Å; T384-S387 PolarHBondContact O-N 2.87Å; T384-S388 PolarHBondContact O-N 3.34Å; T384-S388 PolarHBondContact O-OG 2.74Å
385M49.6Very low49.3Very low112 Ų112103 Ų10355%0.55261%0.605SS**Hα-helixtrans-70.4-31.3-178.9-64.7-170.7-46.600113.1R381 S387 S388 A389R381-M385 HydrophobicContact CG-CE 4.11Å; R381-M385 HydrophobicContact CG-SD 4.27Å; R381-M385 WeakPolarHBondContact O-CB 3.4Å; R381-M385 WeakPolarHBondContact O-CG 3.44Å; R381-M385 PolarHBondContact O-N 3.34Å; M385-S387 VanDerWaalsContact C-N 3.29Å; M385-S387 PolarHBondContact O-N 3.32Å; M385-S388 WeakPolarHBondContact O-CB 3.44Å; M385-S388 PolarHBondContact O-N 3.3Å; M385-S388 VanDerWaalsContact O-N 3.08Å; M385-A389 WeakPolarHBondContact O-CB 3.36Å; M385-A389 PolarHBondContact O-N 3.46Å
386A48.3Very low48.3Very low51 Ų51106 Ų10642%0.42162%0.616SS.*Hα-helixtrans-62.4-38.117200000111.7R382 L383 T384 S388 A389 I390R382-A386 WeakPolarHBondContact O-CB 3.42Å; R382-A386 PolarHBondContact O-N 2.9Å; L383-A386 PolarHBondContact O-N 3.35Å; T384-A386 PolarHBondContact O-N 3.04Å; A386-S388 PolarHBondContact O-N 3.34Å; A386-A389 PolarHBondContact O-N 3.2Å; A386-I390 WeakPolarHBondContact O-CD1 3.38Å; A386-I390 WeakPolarHBondContact O-CG1 3.08Å
387S43.4Very low47.6Very low96 Ų96108.3 Ų108.367%0.67162%0.617SS**Hα-helixtrans-68.1-18.3173.6-1660000113.6L383 T384 M385L383-S387 PolarHBondContact O-N 3.14Å; L383-S387 VanDerWaalsContact O-N 3.12Å; T384-S387 WeakPolarHBondContact O-CB 3.42Å; T384-S387 PolarHBondContact O-N 2.87Å; M385-S387 VanDerWaalsContact C-N 3.29Å; M385-S387 PolarHBondContact O-N 3.32Å
388S44Very low46.4Very low73 Ų73109.2 Ų109.251%0.5162%0.623SS.*Hα-helixtrans-89.6-38.3173.6-48.40000112.4T384 M385 A386 I390 A391T384-S388 PolarHBondContact O-N 3.34Å; T384-S388 PolarHBondContact O-OG 2.74Å; M385-S388 WeakPolarHBondContact O-CB 3.44Å; M385-S388 PolarHBondContact O-N 3.3Å; M385-S388 VanDerWaalsContact O-N 3.08Å; A386-S388 PolarHBondContact O-N 3.34Å; S388-I390 VanDerWaalsContact C-N 3.29Å; S388-I390 PolarHBondContact O-N 3.06Å; S388-A391 PolarHBondContact O-N 3.34Å
389A44.2Very low45.6Very low71 Ų71115 Ų11559%0.58764%0.639SS**Hα-helixtrans-69.9-21.9-174.100000114.1M385 A386 A391M385-A389 WeakPolarHBondContact O-CB 3.36Å; M385-A389 PolarHBondContact O-N 3.46Å; A386-A389 PolarHBondContact O-N 3.2Å; A389-A391 PolarHBondContact O-N 3.27Å
390I45Very low44.7Very low147 Ų147120.7 Ų120.775%0.75466%0.656SS**G310 helixtrans-67.3-17.7176.7-67.9164.6000111.9A386 S388A386-I390 WeakPolarHBondContact O-CD1 3.38Å; A386-I390 WeakPolarHBondContact O-CG1 3.08Å; S388-I390 VanDerWaalsContact C-N 3.29Å; S388-I390 PolarHBondContact O-N 3.06Å
391A42.1Very low43.5Very low86 Ų86121.4 Ų121.471%0.71167%0.668SS**G310 helixtrans-882.2-17600000115.7S388 A389S388-A391 PolarHBondContact O-N 3.34Å; A389-A391 PolarHBondContact O-N 3.27Å
392L37.6Very low42.3Very low161 Ų161123.1 Ų123.184%0.84368%0.682SS**G310 helixtrans-11516-174-98.276.9000114.3
393G35.8Very low41.2Very low69 Ų69119.4 Ų119.471%0.71168%0.678SS**SBendtrans-102.2-6.9-161.400000119.3
394S37.5Very low39.9Very low101 Ų101117.9 Ų117.971%0.70668%0.677SS**  trans-170.6103.6173.153.20000109
395T37.1Very low38.7Very low132 Ų132123.6 Ų123.681%0.8169%0.688SS**  62103.573.869.10000115.3
396D34.7Very low38Very low130 Ų130124.8 Ų124.870%0.69570%0.696SS**  trans76.5140144.4-142.824.5000120.2
397R36.7Very low37.2Very low189 Ų189127.5 Ų127.571%0.71371%0.708SS**  trans76.490.8159-47.2-142.7171.5-124.3-8.8122.2
398D36.2Very low36.5Very low116 Ų116126 Ų12662%0.6271%0.708SS**  81.3153.1114.9-52.1-28.2000121.6
399Y39.6Very low35.9Very low212 Ų212128.2 Ų128.283%0.83172%0.723SS**  trans60.871.5171.3-68.5-77.3000119.7
400Y33.3Very low35.7Very low234 Ų234136.7 Ų136.792%0.91874%0.74SS**  27.6114.8122.5-77.6-93.7000118.5
401G31.5Very low35Very low64 Ų64135.6 Ų135.666%0.6674%0.74SS**  trans177.4-32160.500000116.4
402H34.5Very low34.7Very low177 Ų177141.2 Ų141.282%0.81974%0.743SS**SBendtrans-122.9136.2-162.5-83.1-89.1000116.6
403S33.8Very low34.4Very low71 Ų71141.3 Ų141.350%0.49774%0.739SS.*  trans48.779.7146.3-52.70000117.5W405S403-W405 VanDerWaalsContact C-N 3.28Å; S403-W405 PolarHBondContact O-N 2.91Å
404S31.5Very low34.2Very low86 Ų86140.8 Ų140.860%0.60173%0.734SS**  trans-75.169.4172.163.60000113.4L406 T407S404-L406 PolarHBondContact O-N 2.86Å; S404-T407 PolarHBondContact O-N 3.13Å; S404-T407 PolarHBondContact OG-O 3.2Å
405W37.3Very low34.1Very low217 Ų217142.7 Ų142.782%0.82274%0.74SS**THydrogen-bonded Turntrans-68.81.7174.153.1-86.7000114.4S403S403-W405 VanDerWaalsContact C-N 3.28Å; S403-W405 PolarHBondContact O-N 2.91Å
406L33.6Very low34.1Very low138 Ų138148.2 Ų148.272%0.72375%0.747SS**THydrogen-bonded Turntrans-118.9-7.7-176.2-74.9162.1000114.6S404S404-L406 PolarHBondContact O-N 2.86Å
407T32.5Very low34.1Very low107 Ų107150.8 Ų150.866%0.65675%0.746SS**  trans-143.2144.5179520000111.9S404S404-T407 PolarHBondContact O-N 3.13Å; S404-T407 PolarHBondContact OG-O 3.2Å
408G28.3Very low34.1Very low66 Ų66147.3 Ų147.368%0.6875%0.751SS**  trans112.382.9162.400000117.7R410G408-R410 PolarHBondContact O-N 3.49Å; G408-R410 VanDerWaalsContact O-N 3.13Å
409S31.3Very low34.3Very low119 Ų119150 Ų15083%0.83277%0.765SS**  32.970.1120.163.10000119.9
410R39.1Very low34.3Very low248 Ų248142.1 Ų142.194%0.93674%0.744SS**  trans-167136.8138.1-104.9151.7-162.1-133.11.3112.2G408G408-R410 PolarHBondContact O-N 3.49Å; G408-R410 VanDerWaalsContact O-N 3.13Å
411V31.4Very low34.3Very low125 Ų125142.9 Ų142.976%0.75875%0.745SS**  trans-81.9118.9-178.8177.80000110.6H413V411-H413 WeakPolarHBondContact CG1-ND1 3.5Å
412R36.1Very low34.6Very low203 Ų203143.7 Ų143.777%0.76673%0.734SS**  trans-129.8131.3153.8-79.9-169.9162.6-169.5-7.6109.8E322 G414E322-R412 IonicContact OE2-CZ 2.89Å; E322-R412 IonicContact OE2-NH1 3.74Å; E322-R412 PolarHBondContact OE2-NH1 3.18Å; R412-G414 PolarHBondContact O-N 2.97Å
413H30.8Very low35Very low163 Ų163145.4 Ų145.476%0.75574%0.742SS**  trans-83100.1-175.7-85.940.4000110.8V411V411-H413 WeakPolarHBondContact CG1-ND1 3.5Å
414G32Very low35.5Very low59 Ų59146.6 Ų146.661%0.60875%0.751SS**  trans-130.670-179.300000113.7R412 R416R412-G414 PolarHBondContact O-N 2.97Å; G414-R416 PolarHBondContact O-N 2.79Å
415V35.4Very low35.8Very low140 Ų140144.7 Ų144.785%0.84875%0.745SS**  trans49.122.5162.5-152.80000118R417V415-R417 VanDerWaalsContact C-N 3.26Å; V415-R417 PolarHBondContact O-N 3.21Å
416R36.2Very low35.6Very low249 Ų249137 Ų13794%0.9473%0.728SS**  trans-73.477.2161.8-72.2-170.6176-166.40.3110.4G414G414-R416 PolarHBondContact O-N 2.79Å
417R34.9Very low35.8Very low183 Ų183134.7 Ų134.769%0.69172%0.72SS**  trans-135.710-175.8-78.3-164.8177.2-170.51116.9V415 L419 A420V415-R417 VanDerWaalsContact C-N 3.26Å; V415-R417 PolarHBondContact O-N 3.21Å; R417-L419 VanDerWaalsContact C-N 3.27Å; R417-L419 PolarHBondContact O-N 3.26Å; R417-A420 HydrophobicContact CG-CB 4.44Å
418S36.5Very low36Very low117 Ų117139.5 Ų139.582%0.81873%0.726SS**THydrogen-bonded Turntrans-69.8-16.9177.948.20000115.1
419L40Very low36.5Very low172 Ų172144.7 Ų144.790%0.90173%0.73SS**THydrogen-bonded Turntrans-135.941.5173.7-87.1119.4000112.2R417 W421R417-L419 VanDerWaalsContact C-N 3.27Å; R417-L419 PolarHBondContact O-N 3.26Å; L419-W421 PolarHBondContact O-N 3.25Å
420A39.7Very low36.9Very low47 Ų47148.8 Ų148.839%0.38873%0.728SS.*  trans-85.999.516900000110.1R417 N422R417-A420 HydrophobicContact CG-CB 4.44Å; A420-N422 PolarHBondContact O-N 3.41Å
421W34.7Very low36.9Very low250 Ų250145.1 Ų145.195%0.94772%0.722SS**  trans-60.2121.1158.9-95.719.3000108.3L419L419-W421 PolarHBondContact O-N 3.25Å
422N37.1Very low37.4Very low81 Ų81146.3 Ų146.343%0.43372%0.719SS.*  trans-114.8147.116663.2-10.6000109.6A420 S424 G425 A426A420-N422 PolarHBondContact O-N 3.41Å; N422-S424 PolarHBondContact ND2-OG 2.96Å; N422-S424 PolarHBondContact O-N 3.32Å; N422-G425 PolarHBondContact O-N 3.39Å; N422-A426 PolarHBondContact OD1-N 3.29Å
423E43.5Very low37.6Very low212 Ų212142 Ų14299%0.99172%0.719SS**THydrogen-bonded Turntrans-65.1-11.2-171.3-62169.6126.400113.4
424S44.1Very low37.9Very low96 Ų96143.4 Ų143.467%0.67172%0.719SS**THydrogen-bonded Turntrans-87.42.1173550000115N422 A426N422-S424 PolarHBondContact ND2-OG 2.96Å; N422-S424 PolarHBondContact O-N 3.32Å; S424-A426 PolarHBondContact O-N 3.49Å
425G36.7Very low38.1Very low47 Ų47149.4 Ų149.449%0.48574%0.737SS.*  trans6630.4168.900000115.2N422 T427N422-G425 PolarHBondContact O-N 3.39Å; G425-T427 VanDerWaalsContact C-N 3.33Å; G425-T427 PolarHBondContact O-N 3.3Å
426A33.6Very low38.3Very low56 Ų56149.9 Ų149.946%0.46373%0.731SS.*THydrogen-bonded Turntrans-75.9-9.1-16300000115.9N422 S424 R428N422-A426 PolarHBondContact OD1-N 3.29Å; S424-A426 PolarHBondContact O-N 3.49Å; A426-R428 PolarHBondContact O-N 2.93Å
427T38.4Very low38.4Very low89 Ų89144.7 Ų144.755%0.54672%0.72SS.*THydrogen-bonded Turntrans-75.815.7-174.847.40000115.4G425 F429G425-T427 VanDerWaalsContact C-N 3.33Å; G425-T427 PolarHBondContact O-N 3.3Å; T427-F429 PolarHBondContact O-N 3.35Å; T427-F429 VanDerWaalsContact O-N 3.09Å
428R37.1Very low38.6Very low207 Ų207142.6 Ų142.678%0.78172%0.722SS**THydrogen-bonded Turntrans-68-0.2177.6-87.2-171.3165.1-158.2-4.2116.4A426A426-R428 PolarHBondContact O-N 2.93Å
429F38.1Very low38.7Very low175 Ų175144.1 Ų144.177%0.76872%0.716SS**THydrogen-bonded Turntrans-86.2-10.7-175.3-83.6-84.7000115.6T427T427-F429 PolarHBondContact O-N 3.35Å; T427-F429 VanDerWaalsContact O-N 3.09Å
430Y40.4Very low38.6Very low205 Ų205142.3 Ų142.380%0.80471%0.705SS**SBendtrans-90.4-14.3179.3-76-77.6000115.1
431E39.2Very low38.5Very low171 Ų171148.7 Ų148.780%0.79973%0.726SS**SBendtrans-89.1-18.4178.7-89.1-176.214500114.6
432H40.1Very low38.8Very low151 Ų151141.4 Ų141.470%0.69971%0.71SS**THydrogen-bonded Turntrans-97.511-167.4-155.6-69.4000114.7
433C40.3Very low38.9Very low112 Ų112146.1 Ų146.176%0.75773%0.731SS**THydrogen-bonded Turntrans-116.75.9178.7-70.30000114.4
434Y37.3Very low38.6Very low193 Ų193140.6 Ų140.676%0.75771%0.71SS**  trans-120.578.9176.4-73.4-85.3000110.4
435D37.4Very low38Very low185 Ų185144.6 Ų144.699%0.98971%0.713SS**  trans-154.80178.2-16948.2000111.4K191K191-D435 WeakPolarHBondContact CE-OD2 3.45Å; K191-D435 IonicContact NZ-OD2 3.9Å; K191-D435 PolarHBondContact NZ-OD2 2.86Å

Retrieved 435 of 435 residues in 317.1 ms (Link to these results)