A0A5K4F6J3_SCHMA Loading...

RGS domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6J3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 520 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
1M40.7Very low51.5Low248 Ų248104.1 Ų104.1100%1.22255%0.545SS*.  0127.70-69.2161166.700108.3
2K45.9Very low52Low153 Ų153100.3 Ų100.367%0.66553%0.525SS*.  trans-73.1149.3159.1-74.1-172.8174-171.50107.6
3S47.5Very low52.4Low59 Ų59100.2 Ų100.241%0.41353%0.525SS..  trans-72.8143.617365.40000110.1V5 N6S3-V5 PolarHBondContact O-N 3.03Å; S3-V5 VanDerWaalsContact O-N 3.13Å; S3-N6 PolarHBondContact O-N 2.76Å; S3-N6 VanDerWaalsContact O-N 3.08Å; S3-N6 PolarHBondContact OG-OD1 2.84Å
4N51.7Low52.6Low132 Ų13299.1 Ų99.171%0.70653%0.53SS*.Hα-helixtrans-62.9-21.5178.9-62.43.9000112.2I7 L8N4-I7 PolarHBondContact O-N 3.37Å; N4-L8 PolarHBondContact O-N 3.08Å
5V53.1Low52.5Low88 Ų8895.4 Ų95.453%0.53351%0.51SS..Hα-helixtrans-62.6-44.9173.6-178.10000111.2S3 I7 L8 F9S3-V5 PolarHBondContact O-N 3.03Å; S3-V5 VanDerWaalsContact O-N 3.13Å; V5-I7 VanDerWaalsContact C-N 3.3Å; V5-I7 PolarHBondContact O-N 3.1Å; V5-L8 PolarHBondContact O-N 3.48Å; V5-F9 HydrophobicContact CG1-CD2 3.86Å; V5-F9 HydrophobicContact CG1-CE2 3.75Å; V5-F9 WeakPolarHBondContact O-CD2 3.25Å; V5-F9 PolarHBondContact O-N 3.1Å
6N51.1Low52.4Low84 Ų8497.8 Ų97.845%0.44952%0.522SS..Hα-helixtrans-64.8-35.2179.3-7332.8000111.7S3 L8 F9 D10S3-N6 PolarHBondContact O-N 2.76Å; S3-N6 VanDerWaalsContact O-N 3.08Å; S3-N6 PolarHBondContact OG-OD1 2.84Å; N6-L8 VanDerWaalsContact C-N 3.27Å; N6-L8 PolarHBondContact O-N 3.5Å; N6-F9 PolarHBondContact O-N 2.9Å; N6-D10 VanDerWaalsContact O-CB 3.26Å; N6-D10 WeakPolarHBondContact O-CB 3.26Å; N6-D10 VanDerWaalsContact O-CG 3.23Å; N6-D10 PolarHBondContact O-N 3.02Å
7I54.2Low52.2Low88 Ų8897.9 Ų97.945%0.45153%0.527SS..Hα-helixtrans-61.2-38177.2-57.8176000111N4 V5 G11N4-I7 PolarHBondContact O-N 3.37Å; V5-I7 VanDerWaalsContact C-N 3.3Å; V5-I7 PolarHBondContact O-N 3.1Å; I7-G11 PolarHBondContact O-N 3.36Å
8L51.5Low51.6Low61 Ų6196.9 Ų96.932%0.31953%0.528SS..Hα-helixtrans-71-41.5179.2-155.7160.6000111.5N4 V5 N6 L12 L71N4-L8 PolarHBondContact O-N 3.08Å; V5-L8 PolarHBondContact O-N 3.48Å; N6-L8 VanDerWaalsContact C-N 3.27Å; N6-L8 PolarHBondContact O-N 3.5Å; L8-L12 HydrophobicContact CD2-CD1 3.72Å; L8-L12 HydrophobicContact CD2-CG 4.32Å; L8-L12 WeakPolarHBondContact O-CG 3.48Å; L8-L12 PolarHBondContact O-N 3.08Å; L8-L71 HydrophobicContact CD1-CD1 4.21Å
9F57.1Low50.9Low126 Ų12697.3 Ų97.355%0.55354%0.539SS*.Hα-helixtrans-72-40.1175.3-77-71.7000113.6V5 N6 G11 L12 N13V5-F9 HydrophobicContact CG1-CD2 3.86Å; V5-F9 HydrophobicContact CG1-CE2 3.75Å; V5-F9 WeakPolarHBondContact O-CD2 3.25Å; V5-F9 PolarHBondContact O-N 3.1Å; N6-F9 PolarHBondContact O-N 2.9Å; F9-G11 VanDerWaalsContact C-N 3.31Å; F9-G11 PolarHBondContact O-N 2.9Å; F9-L12 PolarHBondContact O-N 3.42Å; F9-N13 WeakPolarHBondContact O-CB 3.35Å; F9-N13 PolarHBondContact O-N 3.32Å
10D56.1Low50.3Low83 Ų83100.5 Ų100.544%0.44455%0.551SS.*Hα-helixtrans-62.4-40.5173.2-72.1-18000110.2N6 N13 S14N6-D10 VanDerWaalsContact O-CB 3.26Å; N6-D10 WeakPolarHBondContact O-CB 3.26Å; N6-D10 VanDerWaalsContact O-CG 3.23Å; N6-D10 PolarHBondContact O-N 3.02Å; D10-N13 PolarHBondContact O-N 3.48Å; D10-S14 WeakPolarHBondContact O-CB 3.31Å; D10-S14 PolarHBondContact O-N 3.47Å
11G57.4Low49.7Very low23 Ų23103.7 Ų103.724%0.23756%0.563CS.*Hα-helixtrans-63.6-44.5174.400000113.4I7 F9 S14 L15I7-G11 PolarHBondContact O-N 3.36Å; F9-G11 VanDerWaalsContact C-N 3.31Å; F9-G11 PolarHBondContact O-N 2.9Å; G11-S14 PolarHBondContact O-N 3.35Å; G11-L15 WeakPolarHBondContact O-CB 3.29Å; G11-L15 PolarHBondContact O-N 2.84Å
12L57.3Low49.4Very low59 Ų59101.7 Ų101.731%0.30954%0.541SS..Hα-helixtrans-63.3-44.4173.7-79.6169.6000112.1L8 F9 S14 L15 L16 L72L8-L12 HydrophobicContact CD2-CD1 3.72Å; L8-L12 HydrophobicContact CD2-CG 4.32Å; L8-L12 WeakPolarHBondContact O-CG 3.48Å; L8-L12 PolarHBondContact O-N 3.08Å; F9-L12 PolarHBondContact O-N 3.42Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 2.89Å; L12-L15 PolarHBondContact O-N 3.36Å; L12-L16 WeakPolarHBondContact O-CB 3.31Å; L12-L16 VanDerWaalsContact O-CG 3.3Å; L12-L16 WeakPolarHBondContact O-CG 3.22Å; L12-L16 PolarHBondContact O-N 3.45Å; L12-L72 HydrophobicContact CD2-CD1 3.7Å
13N58.3Low49.1Very low98 Ų98100.3 Ų100.352%0.52455%0.546SS..Hα-helixtrans-63.1-37.7175.3-85.9-20.6000111.9F9 D10 T17F9-N13 WeakPolarHBondContact O-CB 3.35Å; F9-N13 PolarHBondContact O-N 3.32Å; D10-N13 PolarHBondContact O-N 3.48Å; N13-T17 WeakPolarHBondContact O-CA 3.34Å; N13-T17 WeakPolarHBondContact O-CB 3.36Å; N13-T17 PolarHBondContact O-N 3.31Å; N13-T17 PolarHBondContact O-OG1 3.27Å
14S54.6Low48.7Very low86 Ų86103.3 Ų103.360%0.60156%0.562SS**Hα-helixtrans-68.4-37.7174.9-173.30000112.6D10 G11 L12D10-S14 WeakPolarHBondContact O-CB 3.31Å; D10-S14 PolarHBondContact O-N 3.47Å; G11-S14 PolarHBondContact O-N 3.35Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 2.89Å
15L50.7Low48Very low43 Ų43103.3 Ų103.323%0.22557%0.567CS.*Hα-helixtrans-66.4-36.9175.4-94.6162.9000113.4G11 L12 L72 L151 R155G11-L15 WeakPolarHBondContact O-CB 3.29Å; G11-L15 PolarHBondContact O-N 2.84Å; L12-L15 PolarHBondContact O-N 3.36Å; L15-L72 HydrophobicContact CD1-CD1 4.01Å; L15-L72 HydrophobicContact CD1-CD2 3.83Å; L15-L151 HydrophobicContact CD2-CD2 3.6Å; L15-R155 PolarHBondContact O-NH2 3.49Å
16L51.5Low47.2Very low134 Ų134108.4 Ų108.470%0.70258%0.582SS**Hα-helixtrans-82.7-53.2179.1-69.1166.9000111.5L12 C18L12-L16 WeakPolarHBondContact O-CB 3.31Å; L12-L16 VanDerWaalsContact O-CG 3.3Å; L12-L16 WeakPolarHBondContact O-CG 3.22Å; L12-L16 PolarHBondContact O-N 3.45Å; L16-C18 VanDerWaalsContact C-N 3.33Å; L16-C18 PolarHBondContact O-N 3.28Å; L16-C18 VanDerWaalsContact O-N 3.07Å
17T48.3Very low46.6Very low99 Ų99109.7 Ų109.761%0.60760%0.595SS**SBendtrans-85.675.6178.7-48.10000109.7N13 S19N13-T17 WeakPolarHBondContact O-CA 3.34Å; N13-T17 WeakPolarHBondContact O-CB 3.36Å; N13-T17 PolarHBondContact O-N 3.31Å; N13-T17 PolarHBondContact O-OG1 3.27Å; T17-S19 PolarHBondContact O-N 3.39Å
18C42.7Very low46Very low80 Ų80111.3 Ų111.354%0.54161%0.611SS.*  trans-71.266.3-175.5-159.10000112.7L16 M20 R155L16-C18 VanDerWaalsContact C-N 3.33Å; L16-C18 PolarHBondContact O-N 3.28Å; L16-C18 VanDerWaalsContact O-N 3.07Å; C18-M20 PolarHBondContact O-N 3.41Å; C18-R155 PolarHBondContact SG-NH2 3.4Å
19S37.5Very low45.4Very low105 Ų105114.5 Ų114.573%0.73464%0.638SS**  trans-66.399.8172.3-171.20000109.3T17 E21T17-S19 PolarHBondContact O-N 3.39Å; S19-E21 PolarHBondContact O-N 3.23Å
20M38.3Very low44.5Very low161 Ų161113 Ų11379%0.79364%0.643SS**  trans-77.672.8178.8-173.2179.7172.900109.9C18 R22C18-M20 PolarHBondContact O-N 3.41Å; M20-R22 PolarHBondContact O-N 3.45Å
21E38.1Very low43.8Very low168 Ų168116.6 Ų116.679%0.78566%0.661SS**  trans-63108.3172.6-172.5163-141.800109.2S19 T23S19-E21 PolarHBondContact O-N 3.23Å; E21-T23 PolarHBondContact O-N 3.36Å
22R34.6Very low43.1Very low205 Ų205121.2 Ų121.277%0.77469%0.69SS**  trans-70.396.1177.2-80.9-179170.8167-3.6109.1M20 T24M20-R22 PolarHBondContact O-N 3.45Å; R22-T24 HydrophobicContact CB-CG2 4.46Å; R22-T24 PolarHBondContact O-N 2.85Å
23T40.7Very low42.2Very low124 Ų124123.4 Ų123.476%0.76171%0.71SS**  trans-64.283.6158.646.60000109.1E21 T25E21-T23 PolarHBondContact O-N 3.36Å; T23-T25 PolarHBondContact O-N 3.13Å
24T37.2Very low41.4Very low122 Ų122125.7 Ų125.775%0.74873%0.728SS**  trans-66.496.5175.134.90000109.4R22 K26R22-T24 HydrophobicContact CB-CG2 4.46Å; R22-T24 PolarHBondContact O-N 2.85Å; T24-K26 PolarHBondContact O-N 2.96Å
25T38.3Very low40.7Very low133 Ų133128.9 Ų128.982%0.81674%0.737SS**  trans-58.597.8177.549.70000110.5T23T23-T25 PolarHBondContact O-N 3.13Å
26K35.7Very low40.4Very low195 Ų195133.5 Ų133.585%0.84877%0.767SS**PPolyproline II helixtrans-66.7120173.4-158.2175.1-173.3-179.50107.6T24T24-K26 PolarHBondContact O-N 2.96Å
27P38.2Very low39.9Very low110 Ų110132.8 Ų132.871%0.71477%0.771SS**PPolyproline II helixtrans-68.5147.5-174.327.7-34.7000111S29P27-S29 PolarHBondContact O-N 3.2Å
28P41.2Very low40Very low122 Ų122133.8 Ų133.879%0.79278%0.779SS**PPolyproline II helixtrans-68.6124.2175.428.7-33.4000110.1S30P28-S30 PolarHBondContact O-N 3.11Å
29S39.6Very low39.9Very low128 Ų128135.3 Ų135.390%0.89579%0.79SS**  trans-74.4103.4176.252.80000110.6P27P27-S29 PolarHBondContact O-N 3.2Å
30S39.3Very low40.1Very low94 Ų94135.1 Ų135.166%0.65779%0.789SS**  trans-107.5133.7-179.9590000112.7P28P28-S30 PolarHBondContact O-N 3.11Å
31I41.5Very low40.3Very low159 Ų159132.5 Ų132.582%0.81579%0.787SS**  trans68.5104.7157.4-51.8152.7000116.2
32S40.9Very low40.5Very low121 Ų121129.2 Ų129.285%0.84678%0.782SS**  -158.7130.6126.4-84.40000111.2
33S39.3Very low40.7Very low104 Ų104124.8 Ų124.873%0.72778%0.783SS**  trans-63.3143.7-173.450.50000116.8
34T41.1Very low40.7Very low147 Ų147124.7 Ų124.790%0.90279%0.787SS**  trans-152.2150.8131.53.40000110.9
35L40.7Very low40.7Very low152 Ų152124.9 Ų124.980%0.79679%0.793SS**  trans-101.8141.3-176.5-56.787.7000110.9
36T43.7Very low40.9Very low140 Ų140123.2 Ų123.286%0.85979%0.793SS**  165.6126.6125.534.10000112.5
37P41.7Very low40.8Very low120 Ų120119.4 Ų119.478%0.77980%0.798SS**  trans-114.5-172.2163.641-31.4000110.9
38P50.1Low41Very low120 Ų120118.6 Ų118.678%0.77980%0.801SS**  cis-129.8160.4-37.832.1-16.3000113.3
39S41.3Very low40.8Very low111 Ų111117.7 Ų117.778%0.77680%0.804SS**  trans-157.4126.7156.249.50000115.9
40S40.6Very low40.9Very low102 Ų102116.2 Ų116.271%0.71380%0.799SS**  trans47.1118144.559.50000123.1
41S43.2Very low40.9Very low105 Ų105116.9 Ų116.973%0.73480%0.804SS**  92.5137.5120.765.90000123.4
42S41.8Very low40.6Very low99 Ų99116.4 Ų116.469%0.69280%0.802SS**  trans67.199.1149.148.40000121.2
43S38Very low40.7Very low112 Ų112116.5 Ų116.578%0.78380%0.8SS**  50.4111.1126.463.20000120.4
44S40.9Very low40.7Very low122 Ų122117.1 Ų117.185%0.85380%0.799SS**  -158.8153.1112.341.80000111.8
45S37.5Very low40.7Very low126 Ų126115.8 Ų115.888%0.88180%0.796SS**  trans-72.6123.3-177.449.20000112.8
46A42.8Very low40.8Very low99 Ų99113.9 Ų113.982%0.81879%0.791SS**  trans-130.8106.4162.800000109.1A48A46-A48 PolarHBondContact O-N 3.42Å
47A34.4Very low40.9Very low114 Ų114109.1 Ų109.194%0.94276%0.763SS**  trans-80107.3-179.700000110.6
48A40.9Very low41.4Very low94 Ų94108.1 Ų108.178%0.77776%0.755SS**  trans-112.8110.8164.800000108.2A46 A50A46-A48 PolarHBondContact O-N 3.42Å; A48-A50 PolarHBondContact O-N 3.45Å
49A37.9Very low41.5Very low103 Ų103107.6 Ų107.685%0.85175%0.746SS**  trans-7193.7-177.700000110.6S51A49-S51 VanDerWaalsContact C-N 3.28Å; A49-S51 PolarHBondContact O-N 3.17Å
50A40.9Very low42.3Very low96 Ų96107.2 Ų107.279%0.79374%0.735SS**  trans-6691.3166.200000108.6A48 L52A48-A50 PolarHBondContact O-N 3.45Å; A50-L52 PolarHBondContact O-N 3.11Å; A50-L52 VanDerWaalsContact O-N 3.12Å
51S39.1Very low43.1Very low108 Ų108106.7 Ų106.776%0.75573%0.727SS**  trans-55.6115.9176.455.30000109.6A49A49-S51 VanDerWaalsContact C-N 3.28Å; A49-S51 PolarHBondContact O-N 3.17Å
52L35.8Very low44Very low150 Ų150106.6 Ų106.679%0.78572%0.718SS**  trans-51.5127.8171.4-122.170.6000109.1A50 T54A50-L52 PolarHBondContact O-N 3.11Å; A50-L52 VanDerWaalsContact O-N 3.12Å; L52-T54 VanDerWaalsContact C-N 3.29Å; L52-T54 PolarHBondContact O-N 3.11Å
53P42.8Very low45Very low122 Ų122107.7 Ų107.779%0.79272%0.715SS**  trans-68.196163.728.7-31000106.9S55P53-S55 PolarHBondContact O-N 2.92Å; P53-S55 VanDerWaalsContact O-N 3.09Å
54T39.7Very low46.4Very low117 Ų117105.4 Ų105.472%0.71870%0.699SS**  trans-53.6118.2171.417.50000108.6L52 T56L52-T54 VanDerWaalsContact C-N 3.29Å; L52-T54 PolarHBondContact O-N 3.11Å; T54-T56 PolarHBondContact O-N 3.25Å
55S40.8Very low47.5Very low119 Ų119103 Ų10383%0.83268%0.682SS**  trans-73.664.9178.346.20000111.3P53 S57P53-S55 PolarHBondContact O-N 2.92Å; P53-S55 VanDerWaalsContact O-N 3.09Å; S55-S57 PolarHBondContact O-N 2.84Å
56T43.9Very low49.1Very low113 Ų113103.1 Ų103.169%0.69366%0.664SS**  trans-53.8126.4154.349.80000107T54 T58T54-T56 PolarHBondContact O-N 3.25Å; T56-T58 PolarHBondContact O-N 3.32Å
57S44.3Very low50.4Low40 Ų40103.7 Ų103.728%0.2865%0.652SS.*  trans-60.6142.7-166.679.90000111S55 D59 D60S55-S57 PolarHBondContact O-N 2.84Å; S57-D59 PolarHBondContact O-N 3.27Å; S57-D59 PolarHBondContact OG-N 3.15Å; S57-D60 PolarHBondContact O-N 3.39Å; S57-D60 WeakPolarHBondContact OG-CB 3.49Å; S57-D60 PolarHBondContact OG-N 3.39Å; S57-D60 PolarHBondContact OG-OD2 2.91Å
58T51.7Low52Low99 Ų99100 Ų10061%0.60762%0.619SS**Hα-helixtrans-55.1-31.2167.737.70000111T56 V61 I62T56-T58 PolarHBondContact O-N 3.32Å; T58-V61 PolarHBondContact O-N 3.49Å; T58-I62 VanDerWaalsContact O-CG1 3.3Å; T58-I62 WeakPolarHBondContact O-CG1 3.34Å; T58-I62 PolarHBondContact O-N 3.24Å
59D53.2Low53.4Low108 Ų10897 Ų9758%0.57859%0.592SS**Hα-helixtrans-73.8-38.6-170-47.1-13.1000110.4S57 V61 I62 L63S57-D59 PolarHBondContact O-N 3.27Å; S57-D59 PolarHBondContact OG-N 3.15Å; D59-V61 VanDerWaalsContact C-N 3.31Å; D59-V61 PolarHBondContact O-N 3.25Å; D59-I62 PolarHBondContact O-N 3.45Å; D59-L63 WeakPolarHBondContact O-CB 3.46Å; D59-L63 PolarHBondContact O-N 2.74Å
60D57.1Low55Low103 Ų10394.7 Ų94.755%0.55156%0.564SS**Hα-helixtrans-59.4-40.2171.1-70.6-56.8000111.9S57 S64S57-D60 PolarHBondContact O-N 3.39Å; S57-D60 WeakPolarHBondContact OG-CB 3.49Å; S57-D60 PolarHBondContact OG-N 3.39Å; S57-D60 PolarHBondContact OG-OD2 2.91Å; D60-S64 VanDerWaalsContact O-CB 3.31Å; D60-S64 WeakPolarHBondContact O-CB 3.33Å; D60-S64 PolarHBondContact O-N 3.02Å; D60-S64 PolarHBondContact O-OG 3.25Å
61V59.4Low56.6Low92 Ų9293.1 Ų93.156%0.55854%0.542SS*.Hα-helixtrans-71.5-44.6-179.5-177.30000110.6T58 D59 S64 S65T58-V61 PolarHBondContact O-N 3.49Å; D59-V61 VanDerWaalsContact C-N 3.31Å; D59-V61 PolarHBondContact O-N 3.25Å; V61-S64 PolarHBondContact O-OG 2.84Å; V61-S65 WeakPolarHBondContact O-CB 3.25Å; V61-S65 PolarHBondContact O-N 2.98Å; V61-S65 VanDerWaalsContact O-N 3.13Å
62I60.8Low58.1Low103 Ų10389.4 Ų89.453%0.52851%0.513SS..Hα-helixtrans-63.4-46.4176.1-67.4164000110.6T58 D59 S65 W66T58-I62 VanDerWaalsContact O-CG1 3.3Å; T58-I62 WeakPolarHBondContact O-CG1 3.34Å; T58-I62 PolarHBondContact O-N 3.24Å; D59-I62 PolarHBondContact O-N 3.45Å; I62-S65 PolarHBondContact O-N 3.01Å; I62-W66 PolarHBondContact O-N 2.97Å
63L63.7Low59.9Low122 Ų12283.1 Ų83.164%0.63948%0.48SS*.Hα-helixtrans-64.7-41-178.5-170.371.9000112.2D59 W66 L67D59-L63 WeakPolarHBondContact O-CB 3.46Å; D59-L63 PolarHBondContact O-N 2.74Å; L63-W66 PolarHBondContact O-N 3.03Å; L63-L67 WeakPolarHBondContact O-CB 3.43Å; L63-L67 PolarHBondContact O-N 3.21Å
64S66.3Low61.5Low63 Ų6380.9 Ų80.944%0.44146%0.461SS..Hα-helixtrans-68.5-36.917757.60000112.9D60 V61 S68D60-S64 VanDerWaalsContact O-CB 3.31Å; D60-S64 WeakPolarHBondContact O-CB 3.33Å; D60-S64 PolarHBondContact O-N 3.02Å; D60-S64 PolarHBondContact O-OG 3.25Å; V61-S64 PolarHBondContact O-OG 2.84Å; S64-S68 WeakPolarHBondContact O-CB 3.43Å; S64-S68 PolarHBondContact O-N 3.35Å
65S65.5Low63.3Low73 Ų7379.7 Ų79.751%0.5145%0.449SS..Hα-helixtrans-62.4-49171.7-1720000111.4V61 I62 L67 S68 S69V61-S65 WeakPolarHBondContact O-CB 3.25Å; V61-S65 PolarHBondContact O-N 2.98Å; V61-S65 VanDerWaalsContact O-N 3.13Å; I62-S65 PolarHBondContact O-N 3.01Å; S65-L67 PolarHBondContact O-N 3.08Å; S65-S68 PolarHBondContact O-N 3.05Å; S65-S69 PolarHBondContact O-N 3.45Å; S65-S69 PolarHBondContact O-OG 3.39Å
66W69.7Low64.8Low128 Ų12875.4 Ų75.449%0.48542%0.418SS..Hα-helixtrans-58.8-48.6175.2-107.657.7000112.4I62 L63 S68 S69 F70I62-W66 PolarHBondContact O-N 2.97Å; L63-W66 PolarHBondContact O-N 3.03Å; W66-S68 VanDerWaalsContact C-N 3.29Å; W66-S68 PolarHBondContact O-N 3.02Å; W66-S69 PolarHBondContact O-N 2.87Å; W66-F70 HydrophobicContact CD2-CD2 4.32Å; W66-F70 AromaticContact CD2-CE2 3.8Å; W66-F70 HydrophobicContact CD2-CE2 3.8Å; W66-F70 AromaticContact CE3-CD2 3.92Å; W66-F70 HydrophobicContact CE3-CD2 3.92Å; W66-F70 AromaticContact CE3-CE2 3.29Å; W66-F70 HydrophobicContact CE3-CE2 3.29Å; W66-F70 AromaticContact CE3-CZ 3.87Å; W66-F70 HydrophobicContact CE3-CZ 3.87Å; W66-F70 AromaticContact CH2-CE2 3.87Å; W66-F70 HydrophobicContact CH2-CE2 3.87Å; W66-F70 AromaticContact CH2-CZ 3.96Å; W66-F70 HydrophobicContact CH2-CZ 3.96Å; W66-F70 HydrophobicContact CZ2-CE2 4.31Å; W66-F70 HydrophobicContact CZ3-CD2 4.36Å; W66-F70 AromaticContact CZ3-CE2 3.34Å; W66-F70 HydrophobicContact CZ3-CE2 3.34Å; W66-F70 AromaticContact CZ3-CZ 3.44Å; W66-F70 HydrophobicContact CZ3-CZ 3.44Å; W66-F70 VanDerWaalsContact CZ3-CZ 3.44Å; W66-F70 WeakPolarHBondContact O-CD2 3.41Å; W66-F70 PolarHBondContact O-N 3.36Å
67L71Confident66.2Low110 Ų11072.5 Ų72.558%0.57640%0.398SS*.Hα-helixtrans-59.6-40.6-179.7-175.364.9000111.8L63 S65 F70 L71L63-L67 WeakPolarHBondContact O-CB 3.43Å; L63-L67 PolarHBondContact O-N 3.21Å; S65-L67 PolarHBondContact O-N 3.08Å; L67-F70 PolarHBondContact O-N 2.82Å; L67-L71 HydrophobicContact CD1-CD1 4.46Å; L67-L71 HydrophobicContact CG-CD1 4.14Å; L67-L71 WeakPolarHBondContact O-CB 3.46Å; L67-L71 VanDerWaalsContact O-CG 3.27Å; L67-L71 WeakPolarHBondContact O-CG 3.49Å; L67-L71 PolarHBondContact O-N 3.19Å
68S68Low67.9Low37 Ų3775 Ų7526%0.25941%0.408SS..Hα-helixtrans-62.4-48.6174.8-169.40000111.6S64 S65 W66 F70 L71 L72S64-S68 WeakPolarHBondContact O-CB 3.43Å; S64-S68 PolarHBondContact O-N 3.35Å; S65-S68 PolarHBondContact O-N 3.05Å; W66-S68 VanDerWaalsContact C-N 3.29Å; W66-S68 PolarHBondContact O-N 3.02Å; S68-F70 PolarHBondContact O-N 3.4Å; S68-L71 PolarHBondContact O-N 3.14Å; S68-L72 WeakPolarHBondContact O-CB 3.47Å; S68-L72 PolarHBondContact O-N 2.88Å
69S69.4Low69Low30 Ų3075.1 Ų75.121%0.2140%0.404CS..Hα-helixtrans-61.9-39.6177.2-60.60000113.2S65 W66 L72 I73S65-S69 PolarHBondContact O-N 3.45Å; S65-S69 PolarHBondContact O-OG 3.39Å; W66-S69 PolarHBondContact O-N 2.87Å; S69-L72 WeakPolarHBondContact O-CB 3.43Å; S69-L72 PolarHBondContact O-N 3.24Å; S69-I73 WeakPolarHBondContact O-CG1 3.4Å; S69-I73 PolarHBondContact O-N 2.9Å
70F72.6Confident70.1Confident56 Ų5670.2 Ų70.225%0.24638%0.378CS..Hα-helixtrans-68.4-42.7176.6-89.4-107.6000111.9W66 L67 S68 L72 I73 I74 F137W66-F70 HydrophobicContact CD2-CD2 4.32Å; W66-F70 AromaticContact CD2-CE2 3.8Å; W66-F70 HydrophobicContact CD2-CE2 3.8Å; W66-F70 AromaticContact CE3-CD2 3.92Å; W66-F70 HydrophobicContact CE3-CD2 3.92Å; W66-F70 AromaticContact CE3-CE2 3.29Å; W66-F70 HydrophobicContact CE3-CE2 3.29Å; W66-F70 AromaticContact CE3-CZ 3.87Å; W66-F70 HydrophobicContact CE3-CZ 3.87Å; W66-F70 AromaticContact CH2-CE2 3.87Å; W66-F70 HydrophobicContact CH2-CE2 3.87Å; W66-F70 AromaticContact CH2-CZ 3.96Å; W66-F70 HydrophobicContact CH2-CZ 3.96Å; W66-F70 HydrophobicContact CZ2-CE2 4.31Å; W66-F70 HydrophobicContact CZ3-CD2 4.36Å; W66-F70 AromaticContact CZ3-CE2 3.34Å; W66-F70 HydrophobicContact CZ3-CE2 3.34Å; W66-F70 AromaticContact CZ3-CZ 3.44Å; W66-F70 HydrophobicContact CZ3-CZ 3.44Å; W66-F70 VanDerWaalsContact CZ3-CZ 3.44Å; W66-F70 WeakPolarHBondContact O-CD2 3.41Å; W66-F70 PolarHBondContact O-N 3.36Å; L67-F70 PolarHBondContact O-N 2.82Å; S68-F70 PolarHBondContact O-N 3.4Å; F70-L72 VanDerWaalsContact C-N 3.31Å; F70-L72 PolarHBondContact O-N 3.33Å; F70-I73 PolarHBondContact O-N 3.02Å; F70-I74 HydrophobicContact CB-CD1 4.29Å; F70-I74 HydrophobicContact CD1-CD1 4.39Å; F70-I74 WeakPolarHBondContact O-CB 3.22Å; F70-I74 WeakPolarHBondContact O-CD1 3.46Å; F70-I74 VanDerWaalsContact O-CG1 3.23Å; F70-I74 WeakPolarHBondContact O-CG1 3.08Å; F70-I74 PolarHBondContact O-N 3.09Å; F70-F137 HydrophobicContact CE1-CE1 4.07Å; F70-F137 HydrophobicContact CE1-CZ 4.01Å; F70-F137 AromaticContact CZ-CE1 3.9Å; F70-F137 HydrophobicContact CZ-CE1 3.9Å; F70-F137 HydrophobicContact CZ-CZ 4.25Å
71L74.3Confident71.1Confident63 Ų6369 Ų6933%0.3337%0.371SS..Hα-helixtrans-61.4-39.3173.9-73.3168.9000112L8 L67 S68 I73 I74 I75L8-L71 HydrophobicContact CD1-CD1 4.21Å; L67-L71 HydrophobicContact CD1-CD1 4.46Å; L67-L71 HydrophobicContact CG-CD1 4.14Å; L67-L71 WeakPolarHBondContact O-CB 3.46Å; L67-L71 VanDerWaalsContact O-CG 3.27Å; L67-L71 WeakPolarHBondContact O-CG 3.49Å; L67-L71 PolarHBondContact O-N 3.19Å; S68-L71 PolarHBondContact O-N 3.14Å; L71-I73 PolarHBondContact O-N 3.38Å; L71-I74 PolarHBondContact O-N 2.9Å; L71-I75 HydrophobicContact CB-CD1 4.28Å; L71-I75 WeakPolarHBondContact O-CB 3.47Å; L71-I75 VanDerWaalsContact O-CG1 3.29Å; L71-I75 WeakPolarHBondContact O-CG1 3.39Å; L71-I75 PolarHBondContact O-N 3.48Å
72L70.2Confident72.1Confident30 Ų3069.8 Ų69.816%0.15737%0.371CS..Hα-helixtrans-60-27.5176.3-164.283.3000113.1L12 L15 S68 S69 F70 P76 I158L12-L72 HydrophobicContact CD2-CD1 3.7Å; L15-L72 HydrophobicContact CD1-CD1 4.01Å; L15-L72 HydrophobicContact CD1-CD2 3.83Å; S68-L72 WeakPolarHBondContact O-CB 3.47Å; S68-L72 PolarHBondContact O-N 2.88Å; S69-L72 WeakPolarHBondContact O-CB 3.43Å; S69-L72 PolarHBondContact O-N 3.24Å; F70-L72 VanDerWaalsContact C-N 3.31Å; F70-L72 PolarHBondContact O-N 3.33Å; L72-P76 WeakPolarHBondContact O-CD 3.18Å; L72-P76 VanDerWaalsContact O-CG 3.27Å; L72-P76 WeakPolarHBondContact O-CG 3.34Å; L72-I158 HydrophobicContact CD1-CD1 4.38Å; L72-I158 HydrophobicContact CD2-CD1 3.97Å; L72-I158 HydrophobicContact CG-CD1 4.12Å
73I73.6Confident72.8Confident18 Ų1867.3 Ų67.39%0.09236%0.358CS..Hα-helixtrans-93.5-42.1177.8-63.8166000111.2S69 F70 L71 L77 H136S69-I73 WeakPolarHBondContact O-CG1 3.4Å; S69-I73 PolarHBondContact O-N 2.9Å; F70-I73 PolarHBondContact O-N 3.02Å; L71-I73 PolarHBondContact O-N 3.38Å; I73-L77 WeakPolarHBondContact O-CB 3.46Å; I73-L77 PolarHBondContact O-N 3.4Å; I73-H136 WeakPolarHBondContact CD1-NE2 3.5Å
74I77.1Confident73.4Confident75 Ų7562.1 Ų62.139%0.38533%0.331SS..Hα-helixtrans-69.1-38.4-176.4-69.9166.4000111.8F70 L71 L77 L78F70-I74 HydrophobicContact CB-CD1 4.29Å; F70-I74 HydrophobicContact CD1-CD1 4.39Å; F70-I74 WeakPolarHBondContact O-CB 3.22Å; F70-I74 WeakPolarHBondContact O-CD1 3.46Å; F70-I74 VanDerWaalsContact O-CG1 3.23Å; F70-I74 WeakPolarHBondContact O-CG1 3.08Å; F70-I74 PolarHBondContact O-N 3.09Å; L71-I74 PolarHBondContact O-N 2.9Å; I74-L77 PolarHBondContact O-N 2.99Å; I74-L78 HydrophobicContact CG2-CD1 3.71Å; I74-L78 HydrophobicContact CG2-CG 4.15Å; I74-L78 WeakPolarHBondContact O-CB 3.4Å; I74-L78 WeakPolarHBondContact O-CG 3.46Å; I74-L78 PolarHBondContact O-N 3.49Å
75I76.8Confident74Confident92 Ų9263.2 Ų63.247%0.47233%0.331SS..Hα-helixtrans-65.4-49.4-177.6-68.5167.3000111.7L71 L77 L78 L79L71-I75 HydrophobicContact CB-CD1 4.28Å; L71-I75 WeakPolarHBondContact O-CB 3.47Å; L71-I75 VanDerWaalsContact O-CG1 3.29Å; L71-I75 WeakPolarHBondContact O-CG1 3.39Å; L71-I75 PolarHBondContact O-N 3.48Å; I75-L77 VanDerWaalsContact C-N 3.34Å; I75-L77 PolarHBondContact O-N 3.44Å; I75-L78 PolarHBondContact O-N 3.39Å; I75-L79 WeakPolarHBondContact O-CB 3.04Å; I75-L79 PolarHBondContact O-N 3.28Å
76P72.5Confident74.7Confident29 Ų2964.5 Ų64.519%0.18833%0.331CS..Hα-helixtrans-61.5-37.8171.9-25.736.4000113.5L72 L79 Q80 Y161L72-P76 WeakPolarHBondContact O-CD 3.18Å; L72-P76 VanDerWaalsContact O-CG 3.27Å; L72-P76 WeakPolarHBondContact O-CG 3.34Å; P76-L79 PolarHBondContact O-N 3.44Å; P76-Q80 WeakPolarHBondContact O-CB 3.17Å; P76-Q80 PolarHBondContact O-N 2.65Å; P76-Y161 VanDerWaalsContact C-CE1 3.46Å; P76-Y161 HydrophobicContact CB-CD1 3.71Å; P76-Y161 HydrophobicContact CB-CD2 3.44Å; P76-Y161 VanDerWaalsContact CB-CD2 3.44Å; P76-Y161 HydrophobicContact CB-CE1 3.9Å; P76-Y161 HydrophobicContact CB-CE2 3.65Å; P76-Y161 HydrophobicContact CB-CG 3.51Å; P76-Y161 HydrophobicContact CG-CD2 4.32Å; P76-Y161 WeakPolarHBondContact O-CE1 3.29Å
77L73.5Confident75Confident51 Ų5159.7 Ų59.727%0.26732%0.317SS..Hα-helixtrans-60.5-47.8176.5-177.7133.1000112.3I73 I74 I75 L79 Q80 I81 I133 Y161I73-L77 WeakPolarHBondContact O-CB 3.46Å; I73-L77 PolarHBondContact O-N 3.4Å; I74-L77 PolarHBondContact O-N 2.99Å; I75-L77 VanDerWaalsContact C-N 3.34Å; I75-L77 PolarHBondContact O-N 3.44Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-Q80 PolarHBondContact O-N 3.48Å; L77-I81 HydrophobicContact CD2-CD1 3.6Å; L77-I81 HydrophobicContact CG-CD1 4.09Å; L77-I81 WeakPolarHBondContact O-CG1 3.48Å; L77-I81 PolarHBondContact O-N 2.9Å; L77-I133 HydrophobicContact CD1-CD1 3.6Å; L77-Y161 WeakPolarHBondContact CA-OH 3.39Å; L77-Y161 WeakPolarHBondContact CB-OH 3.48Å
78L79.2Confident75.3Confident92 Ų9258.1 Ų58.148%0.48231%0.308SS..Hα-helixtrans-62.8-41.6176.3-71.9171.4000111.5I74 I75 I81 I82I74-L78 HydrophobicContact CG2-CD1 3.71Å; I74-L78 HydrophobicContact CG2-CG 4.15Å; I74-L78 WeakPolarHBondContact O-CB 3.4Å; I74-L78 WeakPolarHBondContact O-CG 3.46Å; I74-L78 PolarHBondContact O-N 3.49Å; I75-L78 PolarHBondContact O-N 3.39Å; L78-I81 PolarHBondContact O-N 2.85Å; L78-I82 WeakPolarHBondContact O-CD1 3.38Å; L78-I82 VanDerWaalsContact O-CG1 3.26Å; L78-I82 WeakPolarHBondContact O-CG1 3.45Å; L78-I82 PolarHBondContact O-N 3.09Å
79L76.3Confident75.9Confident103 Ų10360.4 Ų60.454%0.53932%0.317SS..Hα-helixtrans-62.4-43.7176.5-17464.4000111.7I75 P76 L77 I82 I83I75-L79 WeakPolarHBondContact O-CB 3.04Å; I75-L79 PolarHBondContact O-N 3.28Å; P76-L79 PolarHBondContact O-N 3.44Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L79-I82 PolarHBondContact O-N 3.48Å; L79-I83 HydrophobicContact CG-CD1 4.09Å; L79-I83 WeakPolarHBondContact O-CG1 3.45Å; L79-I83 PolarHBondContact O-N 2.85Å
80Q75.3Confident76.2Confident4 Ų463.5 Ų63.52%0.01933%0.33CS..Hα-helixtrans-63.8-43.2177.3-163.767.212.100111.7P76 L77 I82 I83 I84 E125 L129 Y161P76-Q80 WeakPolarHBondContact O-CB 3.17Å; P76-Q80 PolarHBondContact O-N 2.65Å; L77-Q80 PolarHBondContact O-N 3.48Å; Q80-I82 VanDerWaalsContact C-N 3.32Å; Q80-I82 PolarHBondContact O-N 3.49Å; Q80-I83 PolarHBondContact O-N 3.39Å; Q80-I84 HydrophobicContact CG-CD1 3.95Å; Q80-I84 HydrophobicContact CG-CG1 4.48Å; Q80-I84 WeakPolarHBondContact O-CB 3.43Å; Q80-I84 VanDerWaalsContact O-CG1 3.31Å; Q80-I84 WeakPolarHBondContact O-CG1 3.38Å; Q80-I84 PolarHBondContact O-N 3.37Å; Q80-E125 PolarHBondContact NE2-OE1 3.36Å; Q80-L129 HydrophobicContact CB-CD2 4.18Å; Q80-L129 HydrophobicContact CG-CD1 4.36Å; Q80-L129 HydrophobicContact CG-CD2 3.89Å; Q80-Y161 HydrophobicContact CB-CD1 4.1Å; Q80-Y161 HydrophobicContact CB-CE1 3.89Å; Q80-Y161 HydrophobicContact CG-CE1 4.45Å
81I77.3Confident76.4Confident78 Ų7863 Ų6340%0.433%0.33SS..Hα-helixtrans-60.4-42.5175.8-71.1168.6000110.7L77 L78 I84 I85L77-I81 HydrophobicContact CD2-CD1 3.6Å; L77-I81 HydrophobicContact CG-CD1 4.09Å; L77-I81 WeakPolarHBondContact O-CG1 3.48Å; L77-I81 PolarHBondContact O-N 2.9Å; L78-I81 PolarHBondContact O-N 2.85Å; I81-I84 PolarHBondContact O-N 3.1Å; I81-I85 HydrophobicContact CG2-CD1 3.69Å; I81-I85 HydrophobicContact CG2-CG1 4.42Å; I81-I85 WeakPolarHBondContact O-CB 3.27Å; I81-I85 VanDerWaalsContact O-CG1 3.24Å; I81-I85 WeakPolarHBondContact O-CG1 3.15Å; I81-I85 PolarHBondContact O-N 2.26Å
82I81Confident76.6Confident109 Ų10966.6 Ų66.656%0.55934%0.343SS*.Hα-helixtrans-62.9-42.6175.8-69.1163.4000111.3L78 L79 Q80 I85 L86L78-I82 WeakPolarHBondContact O-CD1 3.38Å; L78-I82 VanDerWaalsContact O-CG1 3.26Å; L78-I82 WeakPolarHBondContact O-CG1 3.45Å; L78-I82 PolarHBondContact O-N 3.09Å; L79-I82 PolarHBondContact O-N 3.48Å; Q80-I82 VanDerWaalsContact C-N 3.32Å; Q80-I82 PolarHBondContact O-N 3.49Å; I82-I85 PolarHBondContact O-N 3.12Å; I82-L86 WeakPolarHBondContact O-CB 3.46Å; I82-L86 PolarHBondContact O-N 2.81Å
83I76.5Confident76.9Confident50 Ų5069.4 Ų69.426%0.25636%0.358SS..Hα-helixtrans-63.6-45.8176.5-69.3165.1000111L79 Q80 L86 C87 P165L79-I83 HydrophobicContact CG-CD1 4.09Å; L79-I83 WeakPolarHBondContact O-CG1 3.45Å; L79-I83 PolarHBondContact O-N 2.85Å; Q80-I83 PolarHBondContact O-N 3.39Å; I83-L86 PolarHBondContact O-N 2.92Å; I83-C87 WeakPolarHBondContact O-CB 3.16Å; I83-C87 PolarHBondContact O-N 3.49Å; I83-C87 PolarHBondContact O-SG 3.06Å; I83-P165 HydrophobicContact CD1-CG 4.31Å
84I76.1Confident76.8Confident14 Ų1472.4 Ų72.47%0.07237%0.372CS..Hα-helixtrans-61.7-46.1177.9-71.9169.8000110.6Q80 I81 L86 C87 I88 L122 I126Q80-I84 HydrophobicContact CG-CD1 3.95Å; Q80-I84 HydrophobicContact CG-CG1 4.48Å; Q80-I84 WeakPolarHBondContact O-CB 3.43Å; Q80-I84 VanDerWaalsContact O-CG1 3.31Å; Q80-I84 WeakPolarHBondContact O-CG1 3.38Å; Q80-I84 PolarHBondContact O-N 3.37Å; I81-I84 PolarHBondContact O-N 3.1Å; I84-L86 PolarHBondContact O-N 3.16Å; I84-C87 PolarHBondContact O-N 3.23Å; I84-I88 HydrophobicContact CG2-CD1 3.88Å; I84-I88 VanDerWaalsContact O-CG1 3.32Å; I84-I88 WeakPolarHBondContact O-CG1 3.29Å; I84-I88 PolarHBondContact O-N 3.5Å; I84-L122 HydrophobicContact CG2-CD1 4.13Å; I84-L122 HydrophobicContact CG2-CD2 4.49Å; I84-L122 HydrophobicContact CG2-CG 4.37Å; I84-I126 HydrophobicContact CD1-CG1 4.01Å
85I79.1Confident76.5Confident86 Ų8671.5 Ų71.544%0.44137%0.367SS..Hα-helixtrans-61.2-43.8175.8-71.1168.4000110.8I81 I82 C87 I88 I89I81-I85 HydrophobicContact CG2-CD1 3.69Å; I81-I85 HydrophobicContact CG2-CG1 4.42Å; I81-I85 WeakPolarHBondContact O-CB 3.27Å; I81-I85 VanDerWaalsContact O-CG1 3.24Å; I81-I85 WeakPolarHBondContact O-CG1 3.15Å; I81-I85 PolarHBondContact O-N 2.26Å; I82-I85 PolarHBondContact O-N 3.12Å; I85-C87 PolarHBondContact O-N 2.94Å; I85-I88 PolarHBondContact O-N 3.24Å; I85-I89 HydrophobicContact CG2-CD1 3.74Å; I85-I89 HydrophobicContact CG2-CG1 4.42Å; I85-I89 VanDerWaalsContact O-CG1 3.31Å; I85-I89 WeakPolarHBondContact O-CG1 3.42Å; I85-I89 PolarHBondContact O-N 2.83Å
86L79Confident76.5Confident99 Ų9973 Ų7352%0.51837%0.368SS..Hα-helixtrans-61.8-42.6176.7-172.669.7000111.5I82 I83 I84 I89 L90I82-L86 WeakPolarHBondContact O-CB 3.46Å; I82-L86 PolarHBondContact O-N 2.81Å; I83-L86 PolarHBondContact O-N 2.92Å; I84-L86 PolarHBondContact O-N 3.16Å; L86-I89 PolarHBondContact O-N 3.41Å; L86-L90 HydrophobicContact CG-CD1 4.18Å; L86-L90 WeakPolarHBondContact O-CB 3.31Å; L86-L90 VanDerWaalsContact O-CG 3.26Å; L86-L90 WeakPolarHBondContact O-CG 3.07Å; L86-L90 PolarHBondContact O-N 2.94Å
87C75.9Confident76.3Confident28 Ų2876.1 Ų76.119%0.18938%0.377CS..Hα-helixtrans-62.2-41.9174.3-77.80000112.3I83 I84 I85 L90 L91I83-C87 WeakPolarHBondContact O-CB 3.16Å; I83-C87 PolarHBondContact O-N 3.49Å; I83-C87 PolarHBondContact O-SG 3.06Å; I84-C87 PolarHBondContact O-N 3.23Å; I85-C87 PolarHBondContact O-N 2.94Å; C87-L90 PolarHBondContact O-N 2.88Å; C87-L91 WeakPolarHBondContact O-CB 3.26Å; C87-L91 VanDerWaalsContact O-CG 3.27Å; C87-L91 WeakPolarHBondContact O-CG 3.44Å; C87-L91 PolarHBondContact O-N 2.95Å
88I77.6Confident76Confident76 Ų7675 Ų7539%0.3937%0.37SS..Hα-helixtrans-63.9-43.9175.4-68.9165.5000110.9I84 I85 L91 F92 L122I84-I88 HydrophobicContact CG2-CD1 3.88Å; I84-I88 VanDerWaalsContact O-CG1 3.32Å; I84-I88 WeakPolarHBondContact O-CG1 3.29Å; I84-I88 PolarHBondContact O-N 3.5Å; I85-I88 PolarHBondContact O-N 3.24Å; I88-L91 PolarHBondContact O-N 3.49Å; I88-F92 WeakPolarHBondContact O-CB 3.35Å; I88-F92 PolarHBondContact O-N 3.49Å; I88-L122 HydrophobicContact CD1-CD1 4.21Å; I88-L122 HydrophobicContact CG1-CD1 4Å
89I80.3Confident75.5Confident86 Ų8675.2 Ų75.244%0.44137%0.373SS..Hα-helixtrans-62.6-44.2176.3-70.2167.7000110.8I85 L86 F92 I93I85-I89 HydrophobicContact CG2-CD1 3.74Å; I85-I89 HydrophobicContact CG2-CG1 4.42Å; I85-I89 VanDerWaalsContact O-CG1 3.31Å; I85-I89 WeakPolarHBondContact O-CG1 3.42Å; I85-I89 PolarHBondContact O-N 2.83Å; L86-I89 PolarHBondContact O-N 3.41Å; I89-F92 PolarHBondContact O-N 3.36Å; I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.41Å; I89-I93 WeakPolarHBondContact O-CB 3.47Å; I89-I93 VanDerWaalsContact O-CG1 3.27Å; I89-I93 WeakPolarHBondContact O-CG1 3.45Å; I89-I93 PolarHBondContact O-N 2.85Å
90L76.5Confident74.9Confident95 Ų9576.3 Ų76.350%0.49738%0.375SS..Hα-helixtrans-64.3-41176.6-72.9169.9000112.1L86 C87 I93 M94L86-L90 HydrophobicContact CG-CD1 4.18Å; L86-L90 WeakPolarHBondContact O-CB 3.31Å; L86-L90 VanDerWaalsContact O-CG 3.26Å; L86-L90 WeakPolarHBondContact O-CG 3.07Å; L86-L90 PolarHBondContact O-N 2.94Å; C87-L90 PolarHBondContact O-N 2.88Å; L90-I93 PolarHBondContact O-N 3.49Å; L90-M94 WeakPolarHBondContact O-CB 3.46Å; L90-M94 VanDerWaalsContact O-CG 3.23Å; L90-M94 WeakPolarHBondContact O-CG 3.44Å; L90-M94 PolarHBondContact O-N 3.5Å
91L76Confident74.3Confident46 Ų4680.4 Ų80.424%0.24139%0.392CS..Hα-helixtrans-61.6-44.5172.9-76166.4000111.4C87 I88 M94 I95 I118 L172C87-L91 WeakPolarHBondContact O-CB 3.26Å; C87-L91 VanDerWaalsContact O-CG 3.27Å; C87-L91 WeakPolarHBondContact O-CG 3.44Å; C87-L91 PolarHBondContact O-N 2.95Å; I88-L91 PolarHBondContact O-N 3.49Å; L91-M94 PolarHBondContact O-N 3.33Å; L91-I95 VanDerWaalsContact O-CG1 3.29Å; L91-I95 WeakPolarHBondContact O-CG1 3.42Å; L91-I95 PolarHBondContact O-N 2.88Å; L91-I118 HydrophobicContact CD1-CG2 3.82Å; L91-I118 HydrophobicContact CD2-CD1 4.47Å; L91-L172 HydrophobicContact CD2-CD1 4.23Å
92F78Confident73.1Confident137 Ų13785.4 Ų85.460%0.60141%0.414SS*.Hα-helixtrans-63.9-44.5177-172.6-92.2000111.9I88 I89 M94 I95 Y96I88-F92 WeakPolarHBondContact O-CB 3.35Å; I88-F92 PolarHBondContact O-N 3.49Å; I89-F92 PolarHBondContact O-N 3.36Å; F92-M94 VanDerWaalsContact C-N 3.31Å; F92-M94 PolarHBondContact O-N 2.84Å; F92-I95 PolarHBondContact O-N 3.43Å; F92-Y96 VanDerWaalsContact O-CB 3.22Å; F92-Y96 WeakPolarHBondContact O-CB 3.46Å; F92-Y96 PolarHBondContact O-N 3.29Å
93I77.9Confident71.7Confident90 Ų9084 Ų8446%0.46241%0.406SS..Hα-helixtrans-59.9-41.6174.7-71.2167.4000110.7I89 L90 Y96 Y97I89-I93 HydrophobicContact CG2-CD1 3.74Å; I89-I93 HydrophobicContact CG2-CG1 4.41Å; I89-I93 WeakPolarHBondContact O-CB 3.47Å; I89-I93 VanDerWaalsContact O-CG1 3.27Å; I89-I93 WeakPolarHBondContact O-CG1 3.45Å; I89-I93 PolarHBondContact O-N 2.85Å; L90-I93 PolarHBondContact O-N 3.49Å; I93-Y96 PolarHBondContact O-N 3.25Å; I93-Y97 WeakPolarHBondContact O-CB 3.49Å; I93-Y97 PolarHBondContact O-N 2.77Å
94M70.9Confident70.3Confident80 Ų8088.4 Ų88.439%0.39443%0.431SS..Hα-helixtrans-64.5-44.4176.5-74.1-67.8-70.800112L90 L91 F92 Y97 I98 F181L90-M94 WeakPolarHBondContact O-CB 3.46Å; L90-M94 VanDerWaalsContact O-CG 3.23Å; L90-M94 WeakPolarHBondContact O-CG 3.44Å; L90-M94 PolarHBondContact O-N 3.5Å; L91-M94 PolarHBondContact O-N 3.33Å; F92-M94 VanDerWaalsContact C-N 3.31Å; F92-M94 PolarHBondContact O-N 2.84Å; M94-Y97 PolarHBondContact O-N 3.23Å; M94-I98 VanDerWaalsContact O-CB 3.29Å; M94-I98 WeakPolarHBondContact O-CB 3.27Å; M94-I98 WeakPolarHBondContact O-CD1 3.34Å; M94-I98 WeakPolarHBondContact O-CG1 3.38Å; M94-I98 PolarHBondContact O-N 3.35Å; M94-F181 HydrophobicContact CE-CE1 3.97Å; M94-F181 HydrophobicContact CE-CZ 3.71Å
95I70.9Confident69Low56 Ų5690.6 Ų90.629%0.28744%0.442SS..Hα-helixtrans-64-46.1176-67.6162.8000110.9L91 F92 Y97 I98 N99 L115L91-I95 VanDerWaalsContact O-CG1 3.29Å; L91-I95 WeakPolarHBondContact O-CG1 3.42Å; L91-I95 PolarHBondContact O-N 2.88Å; F92-I95 PolarHBondContact O-N 3.43Å; I95-Y97 PolarHBondContact O-N 3.07Å; I95-I98 WeakPolarHBondContact O-CB 3.46Å; I95-I98 PolarHBondContact O-N 2.8Å; I95-N99 VanDerWaalsContact O-CG 3.29Å; I95-N99 PolarHBondContact O-N 2.91Å; I95-L115 HydrophobicContact CD1-CD1 3.91Å
96Y76.4Confident67.3Low124 Ų12491.6 Ų91.649%0.48646%0.457SS..Hα-helixtrans-61-44.4177.3178.6-92.3000112F92 I93 N99 H100F92-Y96 VanDerWaalsContact O-CB 3.22Å; F92-Y96 WeakPolarHBondContact O-CB 3.46Å; F92-Y96 PolarHBondContact O-N 3.29Å; I93-Y96 PolarHBondContact O-N 3.25Å; Y96-N99 PolarHBondContact O-N 2.97Å; Y96-H100 AromaticContact CD2-CD2 3.71Å; Y96-H100 AromaticContact CE1-CD2 3.8Å; Y96-H100 AromaticContact CE2-CD2 3.25Å; Y96-H100 WeakPolarHBondContact CE2-CD2 3.39Å; Y96-H100 AromaticContact CE2-NE2 3.34Å; Y96-H100 VanDerWaalsContact CE2-NE2 3.34Å; Y96-H100 WeakPolarHBondContact CE2-NE2 3.31Å; Y96-H100 AromaticContact CZ-CD2 3.31Å; Y96-H100 AromaticContact CZ-NE2 3.5Å; Y96-H100 WeakPolarHBondContact O-CB 3.14Å; Y96-H100 PolarHBondContact O-N 3.07Å; Y96-H100 PolarHBondContact OH-NE2 3.37Å
97Y68.8Low65.8Low95 Ų9594.6 Ų94.637%0.37347%0.466SS..Hα-helixtrans-64.5-39.2176.6-179.9-90.2000112.5I93 M94 I95 K101 F188I93-Y97 WeakPolarHBondContact O-CB 3.49Å; I93-Y97 PolarHBondContact O-N 2.77Å; M94-Y97 PolarHBondContact O-N 3.23Å; I95-Y97 PolarHBondContact O-N 3.07Å; Y97-K101 HydrophobicContact CE1-CD 4.14Å; Y97-K101 HydrophobicContact CE2-CD 3.95Å; Y97-K101 VanDerWaalsContact CE2-CE 3.42Å; Y97-K101 VanDerWaalsContact CE2-NZ 3.27Å; Y97-K101 VanDerWaalsContact CZ-NZ 3.31Å; Y97-K101 PolarHBondContact O-N 2.94Å; Y97-K101 PolarHBondContact OH-NZ 3.39Å; Y97-F188 HydrophobicContact CE1-CE2 4.42Å; Y97-F188 HydrophobicContact CE1-CZ 4.21Å; Y97-F188 AromaticContact CZ-CZ 3.98Å; Y97-F188 WeakPolarHBondContact OH-CE1 3.4Å; Y97-F188 WeakPolarHBondContact OH-CZ 3.18Å
98I67.6Low64.6Low26 Ų2695.3 Ų95.313%0.13347%0.468CS..Hα-helixtrans-62.5-42.4173.2-78.1168.4000110.7M94 I95 L105 L108M94-I98 VanDerWaalsContact O-CB 3.29Å; M94-I98 WeakPolarHBondContact O-CB 3.27Å; M94-I98 WeakPolarHBondContact O-CD1 3.34Å; M94-I98 WeakPolarHBondContact O-CG1 3.38Å; M94-I98 PolarHBondContact O-N 3.35Å; I95-I98 WeakPolarHBondContact O-CB 3.46Å; I95-I98 PolarHBondContact O-N 2.8Å; I98-L105 HydrophobicContact CG2-CD1 3.95Å; I98-L105 HydrophobicContact CG2-CD2 3.54Å; I98-L105 HydrophobicContact CG2-CG 4.27Å; I98-L105 WeakPolarHBondContact O-CD1 3.4Å; I98-L108 HydrophobicContact CD1-CD2 4.29Å; I98-L108 HydrophobicContact CG1-CD2 4.37Å; I98-L108 HydrophobicContact CG2-CD2 4.24Å
99N67.7Low63.3Low98 Ų9899.1 Ų99.152%0.52448%0.478SS..Hα-helixtrans-73.6-47.2-180-70-10.7000112.9I95 Y96 K101I95-N99 VanDerWaalsContact O-CG 3.29Å; I95-N99 PolarHBondContact O-N 2.91Å; Y96-N99 PolarHBondContact O-N 2.97Å; N99-K101 VanDerWaalsContact C-N 3.32Å; N99-K101 PolarHBondContact O-N 3.08Å
100H63.8Low62.2Low126 Ų12698.7 Ų98.758%0.58348%0.476SS*.Hα-helixtrans-70.9-24.1-175.5-97.3-86.1000114.2Y96 H102Y96-H100 AromaticContact CD2-CD2 3.71Å; Y96-H100 AromaticContact CE1-CD2 3.8Å; Y96-H100 AromaticContact CE2-CD2 3.25Å; Y96-H100 WeakPolarHBondContact CE2-CD2 3.39Å; Y96-H100 AromaticContact CE2-NE2 3.34Å; Y96-H100 VanDerWaalsContact CE2-NE2 3.34Å; Y96-H100 WeakPolarHBondContact CE2-NE2 3.31Å; Y96-H100 AromaticContact CZ-CD2 3.31Å; Y96-H100 AromaticContact CZ-NE2 3.5Å; Y96-H100 WeakPolarHBondContact O-CB 3.14Å; Y96-H100 PolarHBondContact O-N 3.07Å; Y96-H100 PolarHBondContact OH-NE2 3.37Å; H100-H102 PolarHBondContact O-N 3.46Å
101K63Low61.4Low89 Ų8996.5 Ų96.539%0.38747%0.469SS..SBendtrans-91.299.6169.1-65.9-168179.6-176.70108.2Y97 N99 L103 F188Y97-K101 HydrophobicContact CE1-CD 4.14Å; Y97-K101 HydrophobicContact CE2-CD 3.95Å; Y97-K101 VanDerWaalsContact CE2-CE 3.42Å; Y97-K101 VanDerWaalsContact CE2-NZ 3.27Å; Y97-K101 VanDerWaalsContact CZ-NZ 3.31Å; Y97-K101 PolarHBondContact O-N 2.94Å; Y97-K101 PolarHBondContact OH-NZ 3.39Å; N99-K101 VanDerWaalsContact C-N 3.32Å; N99-K101 PolarHBondContact O-N 3.08Å; K101-L103 WeakPolarHBondContact O-CB 3.32Å; K101-L103 PolarHBondContact O-N 3.09Å; K101-F188 HydrophobicContact CD-CE2 4.24Å; K101-F188 HydrophobicContact CD-CZ 3.77Å
102H51.7Low60.6Low184 Ų184101.4 Ų101.485%0.85249%0.49SS*.  trans-54.747.3-179.5-112.8-90.1000115.6H100 N104H100-H102 PolarHBondContact O-N 3.46Å; H102-N104 VanDerWaalsContact C-N 3.29Å; H102-N104 PolarHBondContact O-N 3.48Å
103L52Low59.9Low78 Ų78102.5 Ų102.541%0.40850%0.495SS..  trans-90.650.3-161.7-154.791.6000112.3K101 L105 F188K101-L103 WeakPolarHBondContact O-CB 3.32Å; K101-L103 PolarHBondContact O-N 3.09Å; L103-L105 PolarHBondContact O-N 2.8Å; L103-F188 HydrophobicContact CD1-CE2 4.49Å; L103-F188 HydrophobicContact CD2-CD2 4.25Å; L103-F188 HydrophobicContact CD2-CE2 4.42Å
104N48Very low59.4Low144 Ų144100 Ų10077%0.7749%0.485SS*.  trans44.260.6-179.4-75.2-12.4000113.2H102 S106H102-N104 VanDerWaalsContact C-N 3.29Å; H102-N104 PolarHBondContact O-N 3.48Å; N104-S106 PolarHBondContact O-N 3.34Å
105L47.1Very low59.3Low60 Ų6099 Ų9931%0.31448%0.481SS..G310 helixtrans-71.4-2.8-160.9-134.787000116.2I98 L103 K107 L108I98-L105 HydrophobicContact CG2-CD1 3.95Å; I98-L105 HydrophobicContact CG2-CD2 3.54Å; I98-L105 HydrophobicContact CG2-CG 4.27Å; I98-L105 WeakPolarHBondContact O-CD1 3.4Å; L103-L105 PolarHBondContact O-N 2.8Å; L105-K107 PolarHBondContact O-N 3.29Å; L105-K107 VanDerWaalsContact O-N 3.1Å; L105-L108 HydrophobicContact CD1-CB 4.33Å; L105-L108 HydrophobicContact CG-CB 3.99Å; L105-L108 CarbonylContact O-C 3.54Å; L105-L108 WeakPolarHBondContact O-CA 3.27Å; L105-L108 PolarHBondContact O-N 2.7Å
106S43.3Very low59.2Low107 Ų107100.8 Ų100.875%0.74849%0.491SS*.G310 helixtrans-58-23.7176.456.50000113.6N104N104-S106 PolarHBondContact O-N 3.34Å
107K47.7Very low59Low162 Ų16298.8 Ų98.870%0.70449%0.488SS*.G310 helixtrans-96.4-4171.9-71-171.5175.8-177.10114.7L105L105-K107 PolarHBondContact O-N 3.29Å; L105-K107 VanDerWaalsContact O-N 3.1Å
108L50.9Low59.1Low43 Ų4395.4 Ų95.423%0.22548%0.476CS..  trans-109.347.6169.5-145.479.7000111.7I98 L105 L110 L184I98-L108 HydrophobicContact CD1-CD2 4.29Å; I98-L108 HydrophobicContact CG1-CD2 4.37Å; I98-L108 HydrophobicContact CG2-CD2 4.24Å; L105-L108 HydrophobicContact CD1-CB 4.33Å; L105-L108 HydrophobicContact CG-CB 3.99Å; L105-L108 CarbonylContact O-C 3.54Å; L105-L108 WeakPolarHBondContact O-CA 3.27Å; L105-L108 PolarHBondContact O-N 2.7Å; L108-L110 PolarHBondContact O-N 2.93Å; L108-L184 HydrophobicContact CD1-CD1 3.77Å; L108-L184 HydrophobicContact CD1-CD2 3.6Å; L108-L184 HydrophobicContact CD1-CG 4.3Å; L108-L184 HydrophobicContact CD2-CD2 3.72Å; L108-L184 HydrophobicContact CG-CD2 4.32Å
109Y50.7Low59.3Low155 Ų15599.3 Ų99.361%0.60849%0.492SS*.  trans-61.784.5155.8-133.7-98.4000108.1S111 H112Y109-S111 PolarHBondContact O-N 2.8Å; Y109-H112 AromaticContact CE1-CD2 3.67Å; Y109-H112 AromaticContact CE1-NE2 3.61Å; Y109-H112 AromaticContact CZ-CD2 3.99Å; Y109-H112 AromaticContact CZ-NE2 3.12Å; Y109-H112 PolarHBondContact OH-NE2 3.26Å
110L56.6Low59.7Low77 Ų7798.9 Ų98.940%0.40349%0.489SS..  trans-61.588.7159.5179.874.2000104.7L108 H112L108-L110 PolarHBondContact O-N 2.93Å; L110-H112 PolarHBondContact O-N 3.5Å
111S60Low60.1Low49 Ų4995.6 Ų95.634%0.34348%0.475SS..  trans-50.6136.7-161.7-176.30000110Y109 K113 S114 L115Y109-S111 PolarHBondContact O-N 2.8Å; S111-K113 CarbonylContact O-C 3.39Å; S111-K113 PolarHBondContact O-N 3.13Å; S111-S114 WeakPolarHBondContact O-CA 3.23Å; S111-S114 WeakPolarHBondContact O-CB 3.41Å; S111-S114 PolarHBondContact O-N 2.91Å; S111-L115 PolarHBondContact O-N 3.41Å
112H60.4Low60.5Low150 Ų15092.1 Ų92.169%0.69446%0.461SS*.Hα-helixtrans-48.3-32175.9-62.1-57.7000111.4Y109 L110 S114 L115 L116Y109-H112 AromaticContact CE1-CD2 3.67Å; Y109-H112 AromaticContact CE1-NE2 3.61Å; Y109-H112 AromaticContact CZ-CD2 3.99Å; Y109-H112 AromaticContact CZ-NE2 3.12Å; Y109-H112 PolarHBondContact OH-NE2 3.26Å; L110-H112 PolarHBondContact O-N 3.5Å; H112-S114 PolarHBondContact O-N 2.85Å; H112-L115 PolarHBondContact O-N 3.45Å; H112-L116 WeakPolarHBondContact O-CB 3.31Å; H112-L116 PolarHBondContact O-N 3.02Å
113K63.3Low61.7Low160 Ų16088 Ų8870%0.69644%0.444SS*.Hα-helixtrans-56.2-44.2170.4-59.3-172177.8-171.20114S111 I117S111-K113 CarbonylContact O-C 3.39Å; S111-K113 PolarHBondContact O-N 3.13Å; K113-I117 WeakPolarHBondContact O-CB 3.42Å; K113-I117 WeakPolarHBondContact O-CD1 3.47Å; K113-I117 WeakPolarHBondContact O-CG1 3.47Å; K113-I117 PolarHBondContact O-N 3.41Å
114S67.4Low62.8Low37 Ų3788 Ų8826%0.25945%0.448SS..Hα-helixtrans-71.7-36.2179.2-167.70000112.8S111 H112 I118S111-S114 WeakPolarHBondContact O-CA 3.23Å; S111-S114 WeakPolarHBondContact O-CB 3.41Å; S111-S114 PolarHBondContact O-N 2.91Å; H112-S114 PolarHBondContact O-N 2.85Å; S114-I118 WeakPolarHBondContact O-CG1 3.49Å; S114-I118 PolarHBondContact O-N 3.44Å
115L67.4Low63.9Low58 Ų5882 Ų8230%0.30442%0.415SS..Hα-helixtrans-71-44.8174.3179.7143.8000110.2I95 S111 H112 I117 I118 F119I95-L115 HydrophobicContact CD1-CD1 3.91Å; S111-L115 PolarHBondContact O-N 3.41Å; H112-L115 PolarHBondContact O-N 3.45Å; L115-I117 VanDerWaalsContact C-N 3.31Å; L115-I117 PolarHBondContact O-N 2.9Å; L115-I118 WeakPolarHBondContact O-CB 3.25Å; L115-I118 PolarHBondContact O-N 3.27Å; L115-F119 HydrophobicContact CD2-CD2 3.6Å; L115-F119 HydrophobicContact CD2-CE2 3.66Å; L115-F119 HydrophobicContact CG-CD2 4.02Å; L115-F119 HydrophobicContact CG-CE2 4.01Å; L115-F119 WeakPolarHBondContact O-CD2 3.31Å; L115-F119 PolarHBondContact O-N 2.92Å
116L69.9Low65.1Low95 Ų9582.9 Ų82.950%0.49742%0.419SS..Hα-helixtrans-60-36.2173.6176.8139.3000112.6H112 F119 I120H112-L116 WeakPolarHBondContact O-CB 3.31Å; H112-L116 PolarHBondContact O-N 3.02Å; L116-F119 PolarHBondContact O-N 2.86Å; L116-I120 HydrophobicContact CD2-CD1 3.51Å; L116-I120 HydrophobicContact CD2-CG1 4.48Å; L116-I120 HydrophobicContact CG-CD1 3.97Å; L116-I120 WeakPolarHBondContact O-CB 3.45Å; L116-I120 VanDerWaalsContact O-CG1 3.27Å; L116-I120 WeakPolarHBondContact O-CG1 3.33Å; L116-I120 PolarHBondContact O-N 2.76Å
117I72Confident66.7Low82 Ų8280.7 Ų80.742%0.42140%0.404SS..Hα-helixtrans-62-43.7170.8-76.4161.2000111.1K113 L115 I120 L121K113-I117 WeakPolarHBondContact O-CB 3.42Å; K113-I117 WeakPolarHBondContact O-CD1 3.47Å; K113-I117 WeakPolarHBondContact O-CG1 3.47Å; K113-I117 PolarHBondContact O-N 3.41Å; L115-I117 VanDerWaalsContact C-N 3.31Å; L115-I117 PolarHBondContact O-N 2.9Å; I117-I120 PolarHBondContact O-N 3.46Å; I117-L121 HydrophobicContact CG2-CD1 3.95Å; I117-L121 HydrophobicContact CG2-CG 4.45Å; I117-L121 WeakPolarHBondContact O-CB 3.42Å; I117-L121 VanDerWaalsContact O-CG 3.27Å; I117-L121 WeakPolarHBondContact O-CG 3.27Å; I117-L121 PolarHBondContact O-N 3.26Å
118I71.1Confident67.9Low24 Ų2475.3 Ų75.312%0.12339%0.386CS..Hα-helixtrans-64.6-41.9177.1-66.6164.3000110.8L91 S114 L115 L121 L122 L172L91-I118 HydrophobicContact CD1-CG2 3.82Å; L91-I118 HydrophobicContact CD2-CD1 4.47Å; S114-I118 WeakPolarHBondContact O-CG1 3.49Å; S114-I118 PolarHBondContact O-N 3.44Å; L115-I118 WeakPolarHBondContact O-CB 3.25Å; L115-I118 PolarHBondContact O-N 3.27Å; I118-L121 PolarHBondContact O-N 3.29Å; I118-L122 WeakPolarHBondContact O-CB 3.34Å; I118-L122 PolarHBondContact O-N 2.93Å; I118-L172 HydrophobicContact CD1-CD1 4.39Å
119F72.1Confident68.8Low108 Ų10874 Ų7447%0.47438%0.38SS..Hα-helixtrans-65.1-41.9174.7-88.4-85.8000112.9L115 L116 L122 I123L115-F119 HydrophobicContact CD2-CD2 3.6Å; L115-F119 HydrophobicContact CD2-CE2 3.66Å; L115-F119 HydrophobicContact CG-CD2 4.02Å; L115-F119 HydrophobicContact CG-CE2 4.01Å; L115-F119 WeakPolarHBondContact O-CD2 3.31Å; L115-F119 PolarHBondContact O-N 2.92Å; L116-F119 PolarHBondContact O-N 2.86Å; F119-L122 PolarHBondContact O-N 3.19Å; F119-I123 WeakPolarHBondContact O-CB 3.45Å; F119-I123 WeakPolarHBondContact O-CD1 3.24Å; F119-I123 VanDerWaalsContact O-CG1 3.25Å; F119-I123 WeakPolarHBondContact O-CG1 3.26Å; F119-I123 PolarHBondContact O-N 3.08Å
120I74.8Confident69.8Low89 Ų8970 Ų7046%0.45637%0.374SS..Hα-helixtrans-64.7-42.4176-73.3171.7000110.8L116 I117 I123 T124L116-I120 HydrophobicContact CD2-CD1 3.51Å; L116-I120 HydrophobicContact CD2-CG1 4.48Å; L116-I120 HydrophobicContact CG-CD1 3.97Å; L116-I120 WeakPolarHBondContact O-CB 3.45Å; L116-I120 VanDerWaalsContact O-CG1 3.27Å; L116-I120 WeakPolarHBondContact O-CG1 3.33Å; L116-I120 PolarHBondContact O-N 2.76Å; I117-I120 PolarHBondContact O-N 3.46Å; I120-I123 PolarHBondContact O-N 3.09Å; I120-T124 VanDerWaalsContact O-CB 3.31Å; I120-T124 WeakPolarHBondContact O-CB 3.27Å; I120-T124 PolarHBondContact O-N 3.28Å; I120-T124 PolarHBondContact O-OG1 2.85Å
121L72.4Confident70.6Confident56 Ų5670.8 Ų70.829%0.29338%0.382SS..Hα-helixtrans-59.3-47.5174.2-74.8169.7000111.1I117 I118 I123 T124 E125 L171I117-L121 HydrophobicContact CG2-CD1 3.95Å; I117-L121 HydrophobicContact CG2-CG 4.45Å; I117-L121 WeakPolarHBondContact O-CB 3.42Å; I117-L121 VanDerWaalsContact O-CG 3.27Å; I117-L121 WeakPolarHBondContact O-CG 3.27Å; I117-L121 PolarHBondContact O-N 3.26Å; I118-L121 PolarHBondContact O-N 3.29Å; L121-I123 PolarHBondContact O-N 3.4Å; L121-T124 CarbonylContact O-C 3.6Å; L121-T124 WeakPolarHBondContact O-CB 3.43Å; L121-T124 PolarHBondContact O-N 3.47Å; L121-T124 VanDerWaalsContact O-N 3.12Å; L121-E125 WeakPolarHBondContact O-CB 3.46Å; L121-E125 PolarHBondContact O-N 3.02Å; L121-L171 HydrophobicContact CD1-CB 4.46Å; L121-L171 HydrophobicContact CD1-CD1 4.17Å; L121-L171 HydrophobicContact CD2-CD1 3.99Å
122L72.3Confident71.1Confident17 Ų1769.9 Ų69.99%0.08938%0.375CS..Hα-helixtrans-64.6-37.9179.6-175.2147.2000112.7I84 I88 I118 F119 I126I84-L122 HydrophobicContact CG2-CD1 4.13Å; I84-L122 HydrophobicContact CG2-CD2 4.49Å; I84-L122 HydrophobicContact CG2-CG 4.37Å; I88-L122 HydrophobicContact CD1-CD1 4.21Å; I88-L122 HydrophobicContact CG1-CD1 4Å; I118-L122 WeakPolarHBondContact O-CB 3.34Å; I118-L122 PolarHBondContact O-N 2.93Å; F119-L122 PolarHBondContact O-N 3.19Å; L122-I126 HydrophobicContact CD2-CD1 3.66Å; L122-I126 HydrophobicContact CG-CD1 4.44Å; L122-I126 VanDerWaalsContact O-CG1 3.26Å; L122-I126 WeakPolarHBondContact O-CG1 3.45Å; L122-I126 PolarHBondContact O-N 3.27Å
123I76.7Confident71.6Confident96 Ų9663.8 Ų63.849%0.49235%0.347SS..Hα-helixtrans-67.4-38.4171.8-69.1164000111F119 I120 L121 S127F119-I123 WeakPolarHBondContact O-CB 3.45Å; F119-I123 WeakPolarHBondContact O-CD1 3.24Å; F119-I123 VanDerWaalsContact O-CG1 3.25Å; F119-I123 WeakPolarHBondContact O-CG1 3.26Å; F119-I123 PolarHBondContact O-N 3.08Å; I120-I123 PolarHBondContact O-N 3.09Å; L121-I123 PolarHBondContact O-N 3.4Å; I123-S127 WeakPolarHBondContact O-CB 3.33Å; I123-S127 PolarHBondContact O-N 3.05Å; I123-S127 PolarHBondContact O-OG 3.16Å
124T73.9Confident72.3Confident80 Ų8061 Ų6149%0.49134%0.339SS..Hα-helixtrans-66.4-42177.8-55.80000110.7I120 L121 S127 S128I120-T124 VanDerWaalsContact O-CB 3.31Å; I120-T124 WeakPolarHBondContact O-CB 3.27Å; I120-T124 PolarHBondContact O-N 3.28Å; I120-T124 PolarHBondContact O-OG1 2.85Å; L121-T124 CarbonylContact O-C 3.6Å; L121-T124 WeakPolarHBondContact O-CB 3.43Å; L121-T124 PolarHBondContact O-N 3.47Å; L121-T124 VanDerWaalsContact O-N 3.12Å; T124-S127 PolarHBondContact O-N 3.08Å; T124-S128 VanDerWaalsContact O-CB 3.26Å; T124-S128 WeakPolarHBondContact O-CB 3.39Å; T124-S128 PolarHBondContact O-N 2.99Å
125E72.8Confident72.7Confident17 Ų1765.6 Ų65.68%0.07935%0.352CS..Hα-helixtrans-61.5-50174.8-169.2-176.5148.500111.1Q80 L121 S127 S128 L129 D164 L168Q80-E125 PolarHBondContact NE2-OE1 3.36Å; L121-E125 WeakPolarHBondContact O-CB 3.46Å; L121-E125 PolarHBondContact O-N 3.02Å; E125-S127 VanDerWaalsContact C-N 3.29Å; E125-S127 PolarHBondContact O-N 3.23Å; E125-S128 PolarHBondContact O-N 3.21Å; E125-L129 WeakPolarHBondContact O-CB 3.26Å; E125-L129 PolarHBondContact O-N 3.39Å; E125-D164 HydrophobicContact CG-CB 4.23Å; E125-L168 WeakPolarHBondContact OE2-CD2 3.4Å
126I72.2Confident72.9Confident78 Ų7863 Ų6340%0.434%0.338SS..Hα-helixtrans-59.6-38.5174.8-69167.9000112I84 L122 L129 C130I84-I126 HydrophobicContact CD1-CG1 4.01Å; L122-I126 HydrophobicContact CD2-CD1 3.66Å; L122-I126 HydrophobicContact CG-CD1 4.44Å; L122-I126 VanDerWaalsContact O-CG1 3.26Å; L122-I126 WeakPolarHBondContact O-CG1 3.45Å; L122-I126 PolarHBondContact O-N 3.27Å; I126-L129 PolarHBondContact O-N 3.05Å; I126-C130 WeakPolarHBondContact O-CB 3.34Å; I126-C130 PolarHBondContact O-N 3.27Å
127S75.9Confident73.1Confident61 Ų6163.6 Ų63.643%0.42734%0.337SS..Hα-helixtrans-69.4-41177.5-56.90000111.6I123 T124 E125 L129 C130 T131I123-S127 WeakPolarHBondContact O-CB 3.33Å; I123-S127 PolarHBondContact O-N 3.05Å; I123-S127 PolarHBondContact O-OG 3.16Å; T124-S127 PolarHBondContact O-N 3.08Å; E125-S127 VanDerWaalsContact C-N 3.29Å; E125-S127 PolarHBondContact O-N 3.23Å; S127-L129 VanDerWaalsContact C-N 3.32Å; S127-C130 PolarHBondContact O-N 3.41Å; S127-T131 PolarHBondContact O-N 2.87Å; S127-T131 PolarHBondContact O-OG1 2.88Å
128S73.4Confident73.4Confident49 Ų4963.7 Ų63.734%0.34334%0.338SS..Hα-helixtrans-64.4-37.5175.3-163.90000111.1T124 E125 P132 H160T124-S128 VanDerWaalsContact O-CB 3.26Å; T124-S128 WeakPolarHBondContact O-CB 3.39Å; T124-S128 PolarHBondContact O-N 2.99Å; E125-S128 PolarHBondContact O-N 3.21Å; S128-P132 WeakPolarHBondContact O-CD 3.19Å; S128-H160 VanDerWaalsContact C-NE2 3.33Å; S128-H160 WeakPolarHBondContact CB-NE2 3.23Å; S128-H160 PolarHBondContact O-NE2 3.5Å; S128-H160 PolarHBondContact OG-CE1 3.07Å; S128-H160 PolarHBondContact OG-NE2 2.92Å
129L68.6Low73.4Confident16 Ų1663.6 Ų63.68%0.08434%0.337CS..Hα-helixtrans-66.1-42.8174.3-157.170.7000112.8Q80 E125 I126 S127 P132 I133 Y161Q80-L129 HydrophobicContact CB-CD2 4.18Å; Q80-L129 HydrophobicContact CG-CD1 4.36Å; Q80-L129 HydrophobicContact CG-CD2 3.89Å; E125-L129 WeakPolarHBondContact O-CB 3.26Å; E125-L129 PolarHBondContact O-N 3.39Å; I126-L129 PolarHBondContact O-N 3.05Å; S127-L129 VanDerWaalsContact C-N 3.32Å; L129-P132 WeakPolarHBondContact O-CD 3.42Å; L129-I133 VanDerWaalsContact O-CD1 3.31Å; L129-I133 WeakPolarHBondContact O-CD1 3.21Å; L129-I133 WeakPolarHBondContact O-CG1 3.33Å; L129-Y161 HydrophobicContact CD1-CD1 3.7Å; L129-Y161 HydrophobicContact CD1-CE1 3.24Å; L129-Y161 HydrophobicContact CD1-CE2 4.45Å; L129-Y161 HydrophobicContact CD1-CG 4.44Å; L129-Y161 HydrophobicContact CD2-CE1 4.06Å; L129-Y161 HydrophobicContact CG-CE1 3.98Å
130C71.7Confident73.3Confident72 Ų7260.1 Ų60.149%0.48633%0.326SS..Hα-helixtrans-69.3-36.4-179.2-170.30000112.2I126 S127 I133 L134I126-C130 WeakPolarHBondContact O-CB 3.34Å; I126-C130 PolarHBondContact O-N 3.27Å; S127-C130 PolarHBondContact O-N 3.41Å; C130-I133 PolarHBondContact O-N 2.89Å; C130-L134 WeakPolarHBondContact O-CB 3.41Å; C130-L134 PolarHBondContact O-N 2.75Å
131T74.2Confident73.2Confident92 Ų9264.8 Ų64.856%0.56434%0.34SS*.Hα-helixtrans-55.7-53-173.9-62.20000114.4S127 I133 L134 Y135S127-T131 PolarHBondContact O-N 2.87Å; S127-T131 PolarHBondContact O-OG1 2.88Å; T131-I133 VanDerWaalsContact C-N 3.34Å; T131-I133 PolarHBondContact O-N 3.36Å; T131-L134 PolarHBondContact O-N 2.91Å; T131-Y135 WeakPolarHBondContact O-CB 3.02Å; T131-Y135 PolarHBondContact O-N 3.4Å
132P70.8Confident73.1Confident30 Ų3070.8 Ų70.820%0.19536%0.359CS..Hα-helixtrans-75.6-22.5-178.432.8-37.7000112.8S128 L129 H136 I157S128-P132 WeakPolarHBondContact O-CD 3.19Å; L129-P132 WeakPolarHBondContact O-CD 3.42Å; P132-H136 VanDerWaalsContact O-CB 3.27Å; P132-H136 WeakPolarHBondContact O-CB 3.26Å; P132-H136 PolarHBondContact O-N 3.29Å; P132-I157 HydrophobicContact CB-CD1 4.33Å; P132-I157 HydrophobicContact CB-CG1 3.75Å; P132-I157 HydrophobicContact CG-CG1 4.09Å
133I70.9Confident72.8Confident23 Ų2371.4 Ų71.412%0.11836%0.363CS..Hα-helixtrans-69.8-47.5171.9-59.7171.5000109.6L77 L129 C130 T131 Y135 H136 F137L77-I133 HydrophobicContact CD1-CD1 3.6Å; L129-I133 VanDerWaalsContact O-CD1 3.31Å; L129-I133 WeakPolarHBondContact O-CD1 3.21Å; L129-I133 WeakPolarHBondContact O-CG1 3.33Å; C130-I133 PolarHBondContact O-N 2.89Å; T131-I133 VanDerWaalsContact C-N 3.34Å; T131-I133 PolarHBondContact O-N 3.36Å; I133-Y135 VanDerWaalsContact C-N 3.31Å; I133-Y135 PolarHBondContact O-N 2.89Å; I133-H136 WeakPolarHBondContact O-CB 3.41Å; I133-H136 PolarHBondContact O-N 3.35Å; I133-F137 HydrophobicContact CG2-CD2 3.93Å; I133-F137 HydrophobicContact CG2-CE2 3.78Å; I133-F137 VanDerWaalsContact O-CD2 3.29Å; I133-F137 WeakPolarHBondContact O-CD2 3.48Å; I133-F137 PolarHBondContact O-N 3.25Å
134L77.9Confident72Confident101 Ų10176.4 Ų76.453%0.52938%0.384SS..Hα-helixtrans-60.1-43174.1-172.268.5000110.8C130 T131 H136 F137 I138C130-L134 WeakPolarHBondContact O-CB 3.41Å; C130-L134 PolarHBondContact O-N 2.75Å; T131-L134 PolarHBondContact O-N 2.91Å; L134-H136 PolarHBondContact O-N 2.88Å; L134-F137 PolarHBondContact O-N 3.08Å; L134-I138 HydrophobicContact CG-CD1 3.95Å; L134-I138 WeakPolarHBondContact O-CB 3.4Å; L134-I138 VanDerWaalsContact O-CG1 3.25Å; L134-I138 WeakPolarHBondContact O-CG1 3.26Å; L134-I138 PolarHBondContact O-N 3.19Å
135Y75.8Confident71.5Confident133 Ų13380.2 Ų80.252%0.52240%0.396SS..Hα-helixtrans-62.2-39.6174.7-170.7-98.4000112.9T131 I133 I138 L139 I153T131-Y135 WeakPolarHBondContact O-CB 3.02Å; T131-Y135 PolarHBondContact O-N 3.4Å; I133-Y135 VanDerWaalsContact C-N 3.31Å; I133-Y135 PolarHBondContact O-N 2.89Å; Y135-I138 PolarHBondContact O-N 2.89Å; Y135-L139 WeakPolarHBondContact O-CB 3.32Å; Y135-L139 PolarHBondContact O-N 3.42Å; Y135-I153 HydrophobicContact CD1-CD1 4.06Å; Y135-I153 HydrophobicContact CD1-CG1 4.46Å; Y135-I153 HydrophobicContact CE1-CD1 3.73Å; Y135-I153 HydrophobicContact CE1-CG1 4.28Å
136H72.4Confident71.1Confident5 Ų581.3 Ų81.32%0.02340%0.399CS..Hα-helixtrans-61.2-47.5173.8172-71.8000111.6I73 P132 I133 L134 L139 S140 Y146 L150 I153 I157I73-H136 WeakPolarHBondContact CD1-NE2 3.5Å; P132-H136 VanDerWaalsContact O-CB 3.27Å; P132-H136 WeakPolarHBondContact O-CB 3.26Å; P132-H136 PolarHBondContact O-N 3.29Å; I133-H136 WeakPolarHBondContact O-CB 3.41Å; I133-H136 PolarHBondContact O-N 3.35Å; L134-H136 PolarHBondContact O-N 2.88Å; H136-L139 PolarHBondContact O-N 3.47Å; H136-S140 VanDerWaalsContact O-CB 3.3Å; H136-S140 WeakPolarHBondContact O-CB 3.31Å; H136-S140 PolarHBondContact O-N 3.35Å; H136-Y146 PolarHBondContact CE1-OH 2.87Å; H136-Y146 PolarHBondContact NE2-OH 3.4Å; H136-L150 WeakPolarHBondContact NE2-CD1 3.43Å; H136-I153 HydrophobicContact CB-CG2 4.24Å; H136-I157 HydrophobicContact CB-CD1 4.29Å
137F73.4Confident70.9Confident106 Ų10684.9 Ų84.947%0.46541%0.414SS..Hα-helixtrans-63.8-42.7175.9-81.6-69.2000112.7F70 I133 L134 S140 Y141F70-F137 HydrophobicContact CE1-CE1 4.07Å; F70-F137 HydrophobicContact CE1-CZ 4.01Å; F70-F137 AromaticContact CZ-CE1 3.9Å; F70-F137 HydrophobicContact CZ-CE1 3.9Å; F70-F137 HydrophobicContact CZ-CZ 4.25Å; I133-F137 HydrophobicContact CG2-CD2 3.93Å; I133-F137 HydrophobicContact CG2-CE2 3.78Å; I133-F137 VanDerWaalsContact O-CD2 3.29Å; I133-F137 WeakPolarHBondContact O-CD2 3.48Å; I133-F137 PolarHBondContact O-N 3.25Å; L134-F137 PolarHBondContact O-N 3.08Å; F137-S140 PolarHBondContact O-N 3.39Å; F137-Y141 PolarHBondContact O-N 2.97Å
138I78Confident70.5Confident85 Ų8590.6 Ų90.644%0.43643%0.432SS..Hα-helixtrans-61.1-48.6176-70.2166.4000110.4L134 Y135 S140 Y141 Y142L134-I138 HydrophobicContact CG-CD1 3.95Å; L134-I138 WeakPolarHBondContact O-CB 3.4Å; L134-I138 VanDerWaalsContact O-CG1 3.25Å; L134-I138 WeakPolarHBondContact O-CG1 3.26Å; L134-I138 PolarHBondContact O-N 3.19Å; Y135-I138 PolarHBondContact O-N 2.89Å; I138-S140 VanDerWaalsContact C-N 3.32Å; I138-S140 PolarHBondContact O-N 2.83Å; I138-Y141 WeakPolarHBondContact O-CB 3.33Å; I138-Y141 PolarHBondContact O-N 3.45Å; I138-Y141 VanDerWaalsContact O-N 3.11Å; I138-Y142 HydrophobicContact CG2-CD2 4.02Å; I138-Y142 HydrophobicContact CG2-CE2 4.4Å; I138-Y142 WeakPolarHBondContact O-CD2 3.46Å; I138-Y142 PolarHBondContact O-N 3.43Å
139L71.1Confident70.3Confident21 Ų2195 Ų9511%0.1144%0.441CS..Hα-helixtrans-67.6-33.7-179.2-164.671.3000112.3Y135 H136 Y141 Y142 D143 R149 I153Y135-L139 WeakPolarHBondContact O-CB 3.32Å; Y135-L139 PolarHBondContact O-N 3.42Å; H136-L139 PolarHBondContact O-N 3.47Å; L139-Y141 PolarHBondContact O-N 2.91Å; L139-Y142 PolarHBondContact O-N 3.19Å; L139-D143 HydrophobicContact CD1-CB 3.76Å; L139-D143 HydrophobicContact CG-CB 4.05Å; L139-D143 PolarHBondContact O-N 3.29Å; L139-D143 VanDerWaalsContact O-N 3.13Å; L139-R149 HydrophobicContact CD2-CB 3.84Å; L139-I153 HydrophobicContact CD2-CD1 3.33Å
140S70.7Confident70.3Confident36 Ų3695.5 Ų95.525%0.25244%0.443SS..Hα-helixtrans-62.5-21.4172.8-169.50000113.9H136 F137 I138 Y146H136-S140 VanDerWaalsContact O-CB 3.3Å; H136-S140 WeakPolarHBondContact O-CB 3.31Å; H136-S140 PolarHBondContact O-N 3.35Å; F137-S140 PolarHBondContact O-N 3.39Å; I138-S140 VanDerWaalsContact C-N 3.32Å; I138-S140 PolarHBondContact O-N 2.83Å; S140-Y146 WeakPolarHBondContact CB-OH 3.45Å; S140-Y146 PolarHBondContact OG-OH 3.4Å
141Y72.6Confident70.1Confident187 Ų18796.1 Ų96.173%0.73344%0.441SS*.Hα-helixtrans-91.7-29.1179.1-171.5-91.8000112.7F137 I138 L139F137-Y141 PolarHBondContact O-N 2.97Å; I138-Y141 WeakPolarHBondContact O-CB 3.33Å; I138-Y141 PolarHBondContact O-N 3.45Å; I138-Y141 VanDerWaalsContact O-N 3.11Å; L139-Y141 PolarHBondContact O-N 2.91Å
142Y70.6Confident70Confident181 Ų18198.3 Ų98.371%0.7144%0.443SS*.Hα-helixtrans-110.1-17.4-168.6-77.4-70.1000116.5I138 L139I138-Y142 HydrophobicContact CG2-CD2 4.02Å; I138-Y142 HydrophobicContact CG2-CE2 4.4Å; I138-Y142 WeakPolarHBondContact O-CD2 3.46Å; I138-Y142 PolarHBondContact O-N 3.43Å; L139-Y142 PolarHBondContact O-N 3.19Å
143D65.6Low70Confident30 Ų3097.7 Ų97.716%0.1644%0.438CS..  trans-119.4110.8-168.7-167.8-5.8000113.9L139 H145 Y146 R149L139-D143 HydrophobicContact CD1-CB 3.76Å; L139-D143 HydrophobicContact CG-CB 4.05Å; L139-D143 PolarHBondContact O-N 3.29Å; L139-D143 VanDerWaalsContact O-N 3.13Å; D143-H145 PolarHBondContact O-N 2.85Å; D143-H145 WeakPolarHBondContact OD1-CB 3.41Å; D143-H145 PolarHBondContact OD1-N 2.74Å; D143-Y146 WeakPolarHBondContact O-CB 3.15Å; D143-Y146 PolarHBondContact O-N 3.26Å; D143-R149 WeakPolarHBondContact OD2-CD 3.41Å; D143-R149 IonicContact OD2-CZ 3.46Å; D143-R149 IonicContact OD2-NE 3.75Å; D143-R149 IonicContact OD2-NH1 2.91Å; D143-R149 PolarHBondContact OD2-NH1 3.41Å
144H59.6Low70Confident202 Ų20297 Ų9794%0.93544%0.435SS*.THydrogen-bonded Turntrans-68.1-15.1174.4-109.2-20000113.8Y146H144-Y146 VanDerWaalsContact C-N 3.25Å; H144-Y146 PolarHBondContact O-N 3.1Å
145H63Low69.9Low159 Ų15997.3 Ų97.374%0.73643%0.429SS*.THydrogen-bonded Turntrans-91.726.6173.1-77.6-51.8000113.3D143 E147D143-H145 PolarHBondContact O-N 2.85Å; D143-H145 WeakPolarHBondContact OD1-CB 3.41Å; D143-H145 PolarHBondContact OD1-N 2.74Å; H145-E147 PolarHBondContact O-N 2.88Å
146Y65.6Low69.7Low40 Ų4095 Ų9516%0.15743%0.426CS..Hα-helixtrans-45.1-52.2-172.7-167.7-134.1000115.3H136 S140 D143 H144 K148 R149 L150H136-Y146 PolarHBondContact CE1-OH 2.87Å; H136-Y146 PolarHBondContact NE2-OH 3.4Å; S140-Y146 WeakPolarHBondContact CB-OH 3.45Å; S140-Y146 PolarHBondContact OG-OH 3.4Å; D143-Y146 WeakPolarHBondContact O-CB 3.15Å; D143-Y146 PolarHBondContact O-N 3.26Å; H144-Y146 VanDerWaalsContact C-N 3.25Å; H144-Y146 PolarHBondContact O-N 3.1Å; Y146-K148 PolarHBondContact O-N 2.67Å; Y146-K148 VanDerWaalsContact O-N 3.14Å; Y146-R149 PolarHBondContact O-N 2.84Å; Y146-L150 HydrophobicContact CD1-CB 4.46Å; Y146-L150 HydrophobicContact CD1-CD2 4.09Å; Y146-L150 HydrophobicContact CD2-CB 4.38Å; Y146-L150 HydrophobicContact CE1-CB 4.41Å; Y146-L150 HydrophobicContact CE1-CD1 4.26Å; Y146-L150 HydrophobicContact CE1-CD2 3.67Å; Y146-L150 HydrophobicContact CE1-CG 4.32Å; Y146-L150 HydrophobicContact CE2-CB 4.28Å; Y146-L150 HydrophobicContact CE2-CD1 4.25Å; Y146-L150 HydrophobicContact CG-CB 4.45Å; Y146-L150 WeakPolarHBondContact O-CB 3.37Å; Y146-L150 PolarHBondContact O-N 3.11Å
147E66.6Low69.7Low153 Ų15395 Ų9572%0.71543%0.426SS*.Hα-helixtrans-50.7-47-164.1-58.7-176.6146.800114.9H145 L151H145-E147 PolarHBondContact O-N 2.88Å; E147-L151 PolarHBondContact O-N 3.36Å
148K67.2Low69.7Low182 Ų18292.2 Ų92.279%0.79142%0.415SS*.Hα-helixtrans-75.4-29-176.6-67.7-178.8-178.2173.70112.6Y146Y146-K148 PolarHBondContact O-N 2.67Å; Y146-K148 VanDerWaalsContact O-N 3.14Å
149R69.1Low69.6Low142 Ų14292.7 Ų92.754%0.53642%0.418SS..Hα-helixtrans-79.8-39.3175.8-72.2174.9165.5-177.5-5.2110.9L139 D143 Y146 L151 F152 I153L139-R149 HydrophobicContact CD2-CB 3.84Å; D143-R149 WeakPolarHBondContact OD2-CD 3.41Å; D143-R149 IonicContact OD2-CZ 3.46Å; D143-R149 IonicContact OD2-NE 3.75Å; D143-R149 IonicContact OD2-NH1 2.91Å; D143-R149 PolarHBondContact OD2-NH1 3.41Å; Y146-R149 PolarHBondContact O-N 2.84Å; R149-L151 PolarHBondContact O-N 3.31Å; R149-F152 PolarHBondContact O-N 3.06Å; R149-F152 VanDerWaalsContact O-N 3.17Å; R149-I153 HydrophobicContact CB-CD1 4.41Å; R149-I153 WeakPolarHBondContact O-CD1 3.45Å; R149-I153 WeakPolarHBondContact O-CG1 2.87Å; R149-I153 PolarHBondContact O-N 2.83Å
150L68.6Low69.8Low25 Ų2593.5 Ų93.513%0.13142%0.421CS..Hα-helixtrans-53.4-49.9175.2174.261.5000112.2H136 Y146 F152 I153 S154H136-L150 WeakPolarHBondContact NE2-CD1 3.43Å; Y146-L150 HydrophobicContact CD1-CB 4.46Å; Y146-L150 HydrophobicContact CD1-CD2 4.09Å; Y146-L150 HydrophobicContact CD2-CB 4.38Å; Y146-L150 HydrophobicContact CE1-CB 4.41Å; Y146-L150 HydrophobicContact CE1-CD1 4.26Å; Y146-L150 HydrophobicContact CE1-CD2 3.67Å; Y146-L150 HydrophobicContact CE1-CG 4.32Å; Y146-L150 HydrophobicContact CE2-CB 4.28Å; Y146-L150 HydrophobicContact CE2-CD1 4.25Å; Y146-L150 HydrophobicContact CG-CB 4.45Å; Y146-L150 WeakPolarHBondContact O-CB 3.37Å; Y146-L150 PolarHBondContact O-N 3.11Å; L150-F152 VanDerWaalsContact C-N 3.28Å; L150-F152 PolarHBondContact O-N 3.46Å; L150-I153 PolarHBondContact O-N 2.93Å; L150-S154 VanDerWaalsContact O-CB 3.32Å; L150-S154 WeakPolarHBondContact O-CB 3.38Å; L150-S154 PolarHBondContact O-N 3.29Å; L150-S154 PolarHBondContact O-OG 3.12Å
151L68.2Low69.9Low86 Ų8692.6 Ų92.645%0.4541%0.413SS..Hα-helixtrans-61.7-34.6179.8-76.3169000112.9L15 E147 R149 R155L15-L151 HydrophobicContact CD2-CD2 3.6Å; E147-L151 PolarHBondContact O-N 3.36Å; R149-L151 PolarHBondContact O-N 3.31Å; L151-R155 WeakPolarHBondContact O-CB 3.24Å; L151-R155 WeakPolarHBondContact O-CD 3.19Å; L151-R155 VanDerWaalsContact O-CG 3.24Å; L151-R155 WeakPolarHBondContact O-CG 3.48Å; L151-R155 PolarHBondContact O-N 3.02Å
152F71.7Confident69.9Low137 Ų13790.8 Ų90.860%0.60141%0.409SS*.Hα-helixtrans-73-45.1175.9-176.8-105.1000111.8R149 L150 R155 L156R149-F152 PolarHBondContact O-N 3.06Å; R149-F152 VanDerWaalsContact O-N 3.17Å; L150-F152 VanDerWaalsContact C-N 3.28Å; L150-F152 PolarHBondContact O-N 3.46Å; F152-R155 PolarHBondContact O-N 3.49Å; F152-L156 HydrophobicContact CD1-CD1 3.99Å; F152-L156 HydrophobicContact CE1-CD1 3.49Å; F152-L156 VanDerWaalsContact CE1-CD1 3.49Å; F152-L156 HydrophobicContact CE1-CG 4.27Å; F152-L156 HydrophobicContact CZ-CD1 3.93Å; F152-L156 HydrophobicContact CZ-CG 4.36Å; F152-L156 PolarHBondContact O-N 3.48Å
153I72.1Confident70.2Confident17 Ų1786.2 Ų86.29%0.08740%0.396CS..Hα-helixtrans-64.2-44.5178.8-68160.9000110.8Y135 H136 L139 R149 L150 R155 L156 I157Y135-I153 HydrophobicContact CD1-CD1 4.06Å; Y135-I153 HydrophobicContact CD1-CG1 4.46Å; Y135-I153 HydrophobicContact CE1-CD1 3.73Å; Y135-I153 HydrophobicContact CE1-CG1 4.28Å; H136-I153 HydrophobicContact CB-CG2 4.24Å; L139-I153 HydrophobicContact CD2-CD1 3.33Å; R149-I153 HydrophobicContact CB-CD1 4.41Å; R149-I153 WeakPolarHBondContact O-CD1 3.45Å; R149-I153 WeakPolarHBondContact O-CG1 2.87Å; R149-I153 PolarHBondContact O-N 2.83Å; L150-I153 PolarHBondContact O-N 2.93Å; I153-R155 VanDerWaalsContact C-N 3.32Å; I153-R155 PolarHBondContact O-N 2.9Å; I153-L156 PolarHBondContact O-N 3.3Å; I153-L156 VanDerWaalsContact O-N 3.16Å; I153-I157 HydrophobicContact CG2-CD1 3.8Å; I153-I157 HydrophobicContact CG2-CG1 4.41Å; I153-I157 WeakPolarHBondContact O-CB 3.45Å; I153-I157 VanDerWaalsContact O-CG1 3.3Å; I153-I157 WeakPolarHBondContact O-CG1 3.44Å; I153-I157 PolarHBondContact O-N 3.47Å
154S69.8Low70.4Confident8 Ų885.5 Ų85.56%0.05639%0.392CS..Hα-helixtrans-63.8-36.5177.1-55.70000112.1L150 I157 I158L150-S154 VanDerWaalsContact O-CB 3.32Å; L150-S154 WeakPolarHBondContact O-CB 3.38Å; L150-S154 PolarHBondContact O-N 3.29Å; L150-S154 PolarHBondContact O-OG 3.12Å; S154-I157 PolarHBondContact O-N 3.27Å; S154-I158 WeakPolarHBondContact O-CB 3.48Å; S154-I158 WeakPolarHBondContact O-CD1 3.23Å; S154-I158 VanDerWaalsContact O-CG1 3.27Å; S154-I158 WeakPolarHBondContact O-CG1 3.43Å; S154-I158 PolarHBondContact O-N 2.88Å
155R75.2Confident71Confident108 Ų10877.2 Ų77.241%0.40836%0.356SS..Hα-helixtrans-66.8-38.5172.5-78.6173.8172.9169.60.5112.5L15 C18 L151 F152 I153 L159L15-R155 PolarHBondContact O-NH2 3.49Å; C18-R155 PolarHBondContact SG-NH2 3.4Å; L151-R155 WeakPolarHBondContact O-CB 3.24Å; L151-R155 WeakPolarHBondContact O-CD 3.19Å; L151-R155 VanDerWaalsContact O-CG 3.24Å; L151-R155 WeakPolarHBondContact O-CG 3.48Å; L151-R155 PolarHBondContact O-N 3.02Å; F152-R155 PolarHBondContact O-N 3.49Å; I153-R155 VanDerWaalsContact C-N 3.32Å; I153-R155 PolarHBondContact O-N 2.9Å; R155-L159 WeakPolarHBondContact O-CB 3.34Å; R155-L159 PolarHBondContact O-N 3.48Å
156L72.7Confident71.6Confident86 Ų8675.4 Ų75.445%0.4535%0.35SS..Hα-helixtrans-66.6-41.8172.7-73177.2000112.2F152 I153 L159 H160F152-L156 HydrophobicContact CD1-CD1 3.99Å; F152-L156 HydrophobicContact CE1-CD1 3.49Å; F152-L156 VanDerWaalsContact CE1-CD1 3.49Å; F152-L156 HydrophobicContact CE1-CG 4.27Å; F152-L156 HydrophobicContact CZ-CD1 3.93Å; F152-L156 HydrophobicContact CZ-CG 4.36Å; F152-L156 PolarHBondContact O-N 3.48Å; I153-L156 PolarHBondContact O-N 3.3Å; I153-L156 VanDerWaalsContact O-N 3.16Å; L156-L159 PolarHBondContact O-N 3.27Å; L156-H160 WeakPolarHBondContact O-CB 3.33Å; L156-H160 PolarHBondContact O-N 2.85Å
157I72.5Confident71.9Confident4 Ų477.6 Ų77.62%0.02137%0.365CS..Hα-helixtrans-56.9-51.5174.1-73.7167.7000110.2P132 H136 I153 S154 L159 H160 Y161P132-I157 HydrophobicContact CB-CD1 4.33Å; P132-I157 HydrophobicContact CB-CG1 3.75Å; P132-I157 HydrophobicContact CG-CG1 4.09Å; H136-I157 HydrophobicContact CB-CD1 4.29Å; I153-I157 HydrophobicContact CG2-CD1 3.8Å; I153-I157 HydrophobicContact CG2-CG1 4.41Å; I153-I157 WeakPolarHBondContact O-CB 3.45Å; I153-I157 VanDerWaalsContact O-CG1 3.3Å; I153-I157 WeakPolarHBondContact O-CG1 3.44Å; I153-I157 PolarHBondContact O-N 3.47Å; S154-I157 PolarHBondContact O-N 3.27Å; I157-L159 PolarHBondContact O-N 2.91Å; I157-H160 WeakPolarHBondContact O-CB 3.48Å; I157-H160 PolarHBondContact O-N 3.45Å; I157-Y161 HydrophobicContact CG2-CD2 3.68Å; I157-Y161 HydrophobicContact CG2-CE2 3.44Å; I157-Y161 VanDerWaalsContact CG2-CE2 3.44Å; I157-Y161 WeakPolarHBondContact O-CD2 3.48Å; I157-Y161 PolarHBondContact O-N 3.33Å
158I73.3Confident72.1Confident48 Ų4871.2 Ų71.225%0.24634%0.335CS..Hα-helixtrans-61.1-44.2178.2-70.2164.4000111.5L72 S154 H160 Y161 F162L72-I158 HydrophobicContact CD1-CD1 4.38Å; L72-I158 HydrophobicContact CD2-CD1 3.97Å; L72-I158 HydrophobicContact CG-CD1 4.12Å; S154-I158 WeakPolarHBondContact O-CB 3.48Å; S154-I158 WeakPolarHBondContact O-CD1 3.23Å; S154-I158 VanDerWaalsContact O-CG1 3.27Å; S154-I158 WeakPolarHBondContact O-CG1 3.43Å; S154-I158 PolarHBondContact O-N 2.88Å; I158-H160 VanDerWaalsContact C-N 3.3Å; I158-H160 PolarHBondContact O-N 2.83Å; I158-Y161 PolarHBondContact O-N 3.32Å; I158-F162 HydrophobicContact CG2-CD2 3.83Å; I158-F162 HydrophobicContact CG2-CE2 3.66Å; I158-F162 VanDerWaalsContact O-CD2 3.26Å; I158-F162 WeakPolarHBondContact O-CD2 3.33Å; I158-F162 PolarHBondContact O-N 2.93Å; I158-F162 VanDerWaalsContact O-N 3.13Å
159L76.3Confident72.4Confident94 Ų9468.1 Ų68.149%0.49233%0.326SS..Hα-helixtrans-61.1-40.2177.7-177.763.2000111.7R155 L156 I157 F162 I163R155-L159 WeakPolarHBondContact O-CB 3.34Å; R155-L159 PolarHBondContact O-N 3.48Å; L156-L159 PolarHBondContact O-N 3.27Å; I157-L159 PolarHBondContact O-N 2.91Å; L159-F162 PolarHBondContact O-N 3.03Å; L159-I163 HydrophobicContact CD1-CD1 3.96Å; L159-I163 HydrophobicContact CD1-CG1 4.43Å; L159-I163 HydrophobicContact CG-CD1 3.85Å; L159-I163 WeakPolarHBondContact O-CG1 3.41Å; L159-I163 PolarHBondContact O-N 2.71Å
160H74.9Confident72.7Confident39 Ų3966.8 Ų66.818%0.18132%0.322CS..Hα-helixtrans-63.1-47.5176.2-168.633.1000111.5S128 L156 I157 I158 F162 I163 D164S128-H160 VanDerWaalsContact C-NE2 3.33Å; S128-H160 WeakPolarHBondContact CB-NE2 3.23Å; S128-H160 PolarHBondContact O-NE2 3.5Å; S128-H160 PolarHBondContact OG-CE1 3.07Å; S128-H160 PolarHBondContact OG-NE2 2.92Å; L156-H160 WeakPolarHBondContact O-CB 3.33Å; L156-H160 PolarHBondContact O-N 2.85Å; I157-H160 WeakPolarHBondContact O-CB 3.48Å; I157-H160 PolarHBondContact O-N 3.45Å; I158-H160 VanDerWaalsContact C-N 3.3Å; I158-H160 PolarHBondContact O-N 2.83Å; H160-F162 PolarHBondContact O-N 2.82Å; H160-I163 PolarHBondContact O-N 3.12Å; H160-I163 VanDerWaalsContact O-N 3.09Å; H160-D164 IonicContact CE1-OD1 3.57Å; H160-D164 PolarHBondContact CE1-OD1 3.21Å; H160-D164 IonicContact CE1-OD2 3.01Å; H160-D164 PolarHBondContact CE1-OD2 2.84Å; H160-D164 IonicContact ND1-OD1 2.67Å; H160-D164 PolarHBondContact ND1-OD1 3.38Å; H160-D164 IonicContact ND1-OD2 2.92Å; H160-D164 IonicContact NE2-OD2 3.52Å; H160-D164 PolarHBondContact NE2-OD2 3.47Å; H160-D164 PolarHBondContact O-N 3.46Å
161Y71.9Confident72.8Confident17 Ų1768 Ų687%0.06733%0.328CS..Hα-helixtrans-56.9-29173.5-82.8-66.3000114.2P76 L77 Q80 L129 I157 I158 P165P76-Y161 VanDerWaalsContact C-CE1 3.46Å; P76-Y161 HydrophobicContact CB-CD1 3.71Å; P76-Y161 HydrophobicContact CB-CD2 3.44Å; P76-Y161 VanDerWaalsContact CB-CD2 3.44Å; P76-Y161 HydrophobicContact CB-CE1 3.9Å; P76-Y161 HydrophobicContact CB-CE2 3.65Å; P76-Y161 HydrophobicContact CB-CG 3.51Å; P76-Y161 HydrophobicContact CG-CD2 4.32Å; P76-Y161 WeakPolarHBondContact O-CE1 3.29Å; L77-Y161 WeakPolarHBondContact CA-OH 3.39Å; L77-Y161 WeakPolarHBondContact CB-OH 3.48Å; Q80-Y161 HydrophobicContact CB-CD1 4.1Å; Q80-Y161 HydrophobicContact CB-CE1 3.89Å; Q80-Y161 HydrophobicContact CG-CE1 4.45Å; L129-Y161 HydrophobicContact CD1-CD1 3.7Å; L129-Y161 HydrophobicContact CD1-CE1 3.24Å; L129-Y161 HydrophobicContact CD1-CE2 4.45Å; L129-Y161 HydrophobicContact CD1-CG 4.44Å; L129-Y161 HydrophobicContact CD2-CE1 4.06Å; L129-Y161 HydrophobicContact CG-CE1 3.98Å; I157-Y161 HydrophobicContact CG2-CD2 3.68Å; I157-Y161 HydrophobicContact CG2-CE2 3.44Å; I157-Y161 VanDerWaalsContact CG2-CE2 3.44Å; I157-Y161 WeakPolarHBondContact O-CD2 3.48Å; I157-Y161 PolarHBondContact O-N 3.33Å; I158-Y161 PolarHBondContact O-N 3.32Å; Y161-P165 WeakPolarHBondContact O-CD 3.09Å; Y161-P165 WeakPolarHBondContact O-CG 3.17Å
162F74.2Confident72.8Confident148 Ų14865.6 Ų65.665%0.64932%0.316SS*.Hα-helixtrans-82.8-32.8174.7-81.1-65.2000113.6I158 L159 H160 I166I158-F162 HydrophobicContact CG2-CD2 3.83Å; I158-F162 HydrophobicContact CG2-CE2 3.66Å; I158-F162 VanDerWaalsContact O-CD2 3.26Å; I158-F162 WeakPolarHBondContact O-CD2 3.33Å; I158-F162 PolarHBondContact O-N 2.93Å; I158-F162 VanDerWaalsContact O-N 3.13Å; L159-F162 PolarHBondContact O-N 3.03Å; H160-F162 PolarHBondContact O-N 2.82Å; F162-I166 VanDerWaalsContact O-CD1 3.29Å; F162-I166 WeakPolarHBondContact O-CD1 3.29Å; F162-I166 WeakPolarHBondContact O-CG1 3.42Å
163I76.3Confident73Confident86 Ų8665.2 Ų65.244%0.44132%0.316SS..Hα-helixtrans-78.7-41.5-177.5-69.5171.5000111.3L159 H160 I166 L167L159-I163 HydrophobicContact CD1-CD1 3.96Å; L159-I163 HydrophobicContact CD1-CG1 4.43Å; L159-I163 HydrophobicContact CG-CD1 3.85Å; L159-I163 WeakPolarHBondContact O-CG1 3.41Å; L159-I163 PolarHBondContact O-N 2.71Å; H160-I163 PolarHBondContact O-N 3.12Å; H160-I163 VanDerWaalsContact O-N 3.09Å; I163-I166 WeakPolarHBondContact O-CB 3.44Å; I163-I166 PolarHBondContact O-N 2.82Å; I163-I166 VanDerWaalsContact O-N 3.14Å; I163-L167 WeakPolarHBondContact O-CB 3.4Å; I163-L167 PolarHBondContact O-N 3.37Å
164D70.5Confident73Confident14 Ų1470.2 Ų70.28%0.07534%0.337CS..Hα-helixtrans-63-47.8-169.7-83.125.3000114.2E125 H160 I166 L167 L168E125-D164 HydrophobicContact CG-CB 4.23Å; H160-D164 IonicContact CE1-OD1 3.57Å; H160-D164 PolarHBondContact CE1-OD1 3.21Å; H160-D164 IonicContact CE1-OD2 3.01Å; H160-D164 PolarHBondContact CE1-OD2 2.84Å; H160-D164 IonicContact ND1-OD1 2.67Å; H160-D164 PolarHBondContact ND1-OD1 3.38Å; H160-D164 IonicContact ND1-OD2 2.92Å; H160-D164 IonicContact NE2-OD2 3.52Å; H160-D164 PolarHBondContact NE2-OD2 3.47Å; H160-D164 PolarHBondContact O-N 3.46Å; D164-I166 PolarHBondContact O-N 2.81Å; D164-L167 PolarHBondContact O-N 2.8Å; D164-L167 VanDerWaalsContact O-N 3.14Å; D164-L168 WeakPolarHBondContact O-CB 3.36Å; D164-L168 PolarHBondContact O-N 3.3Å
165P70.2Confident72.8Confident29 Ų2972 Ų7219%0.18835%0.35CS..Hα-helixtrans-56.5-36.8173-27.535.7000113.6I83 Y161 L169I83-P165 HydrophobicContact CD1-CG 4.31Å; Y161-P165 WeakPolarHBondContact O-CD 3.09Å; Y161-P165 WeakPolarHBondContact O-CG 3.17Å; P165-L169 WeakPolarHBondContact O-CB 3.42Å; P165-L169 PolarHBondContact O-N 3.41Å
166I75.7Confident72.4Confident120 Ų12070.3 Ų70.362%0.61535%0.348SS*.Hα-helixtrans-72.5-40.5-179.9-58.5176.9000109.7F162 I163 D164 Y170F162-I166 VanDerWaalsContact O-CD1 3.29Å; F162-I166 WeakPolarHBondContact O-CD1 3.29Å; F162-I166 WeakPolarHBondContact O-CG1 3.42Å; I163-I166 WeakPolarHBondContact O-CB 3.44Å; I163-I166 PolarHBondContact O-N 2.82Å; I163-I166 VanDerWaalsContact O-N 3.14Å; D164-I166 PolarHBondContact O-N 2.81Å; I166-Y170 WeakPolarHBondContact O-CB 3.29Å; I166-Y170 PolarHBondContact O-N 3.1Å
167L73.6Confident71.9Confident87 Ų8769.3 Ų69.346%0.45535%0.348SS..Hα-helixtrans-67.8-45.7176.5-175.961.8000111.6I163 D164 Y170 L171I163-L167 WeakPolarHBondContact O-CB 3.4Å; I163-L167 PolarHBondContact O-N 3.37Å; D164-L167 PolarHBondContact O-N 2.8Å; D164-L167 VanDerWaalsContact O-N 3.14Å; L167-Y170 PolarHBondContact O-N 2.99Å; L167-L171 HydrophobicContact CD1-CD1 4.15Å; L167-L171 HydrophobicContact CD1-CG 4.26Å; L167-L171 HydrophobicContact CG-CD1 3.99Å; L167-L171 HydrophobicContact CG-CG 4.48Å; L167-L171 WeakPolarHBondContact O-CB 3.44Å; L167-L171 VanDerWaalsContact O-CG 3.24Å; L167-L171 WeakPolarHBondContact O-CG 3.31Å; L167-L171 PolarHBondContact O-N 3.49Å
168L71.2Confident71.4Confident19 Ų1974.2 Ų74.210%0.09937%0.374CS..Hα-helixtrans-58.7-49.4173.8177.464.8000110.7E125 D164 Y170 L171 L172E125-L168 WeakPolarHBondContact OE2-CD2 3.4Å; D164-L168 WeakPolarHBondContact O-CB 3.36Å; D164-L168 PolarHBondContact O-N 3.3Å; L168-Y170 PolarHBondContact O-N 3.5Å; L168-L171 PolarHBondContact O-N 3.49Å; L168-L172 VanDerWaalsContact O-CB 3.23Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 PolarHBondContact O-N 3.09Å
169L72.2Confident70.7Confident116 Ų11680.4 Ų80.461%0.60740%0.399SS*.Hα-helixtrans-62.7-41.8178.6-177.562.2000111.8P165 Q173P165-L169 WeakPolarHBondContact O-CB 3.42Å; P165-L169 PolarHBondContact O-N 3.41Å; L169-Q173 WeakPolarHBondContact O-CB 3.49Å; L169-Q173 PolarHBondContact O-N 3.02Å
170Y75.6Confident69.7Low115 Ų11584 Ų8445%0.45141%0.411SS..Hα-helixtrans-64.4-43175.5174.1-97.2000112I166 L167 L168 Q173 K174I166-Y170 WeakPolarHBondContact O-CB 3.29Å; I166-Y170 PolarHBondContact O-N 3.1Å; L167-Y170 PolarHBondContact O-N 2.99Å; L168-Y170 PolarHBondContact O-N 3.5Å; Y170-Q173 PolarHBondContact O-N 3.3Å; Y170-K174 HydrophobicContact CE1-CD 3.83Å; Y170-K174 WeakPolarHBondContact O-CB 3.25Å; Y170-K174 PolarHBondContact O-N 3.08Å; Y170-K174 PolarHBondContact OH-NZ 3.02Å; Y170-K174 VanDerWaalsContact OH-NZ 3.1Å
171L70.6Confident68.8Low49 Ų4984.9 Ų84.926%0.25742%0.415SS..Hα-helixtrans-68.2-41.7177.5-72.3173.1000111.8L121 L167 L168 K174 C175L121-L171 HydrophobicContact CD1-CB 4.46Å; L121-L171 HydrophobicContact CD1-CD1 4.17Å; L121-L171 HydrophobicContact CD2-CD1 3.99Å; L167-L171 HydrophobicContact CD1-CD1 4.15Å; L167-L171 HydrophobicContact CD1-CG 4.26Å; L167-L171 HydrophobicContact CG-CD1 3.99Å; L167-L171 HydrophobicContact CG-CG 4.48Å; L167-L171 WeakPolarHBondContact O-CB 3.44Å; L167-L171 VanDerWaalsContact O-CG 3.24Å; L167-L171 WeakPolarHBondContact O-CG 3.31Å; L167-L171 PolarHBondContact O-N 3.49Å; L168-L171 PolarHBondContact O-N 3.49Å; L171-K174 PolarHBondContact O-N 2.98Å; L171-C175 WeakPolarHBondContact O-CB 3.47Å; L171-C175 PolarHBondContact O-N 3.3Å; L171-C175 PolarHBondContact O-SG 3.35Å
172L69.3Low68Low37 Ų3788.2 Ų88.219%0.19443%0.433CS..Hα-helixtrans-61.6-47.4173.5-170.574.6000110.5L91 I118 L168 K174 C175 L176L91-L172 HydrophobicContact CD2-CD1 4.23Å; I118-L172 HydrophobicContact CD1-CD1 4.39Å; L168-L172 VanDerWaalsContact O-CB 3.23Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 PolarHBondContact O-N 3.09Å; L172-K174 VanDerWaalsContact C-N 3.29Å; L172-K174 PolarHBondContact O-N 3.31Å; L172-C175 PolarHBondContact O-N 2.98Å; L172-L176 HydrophobicContact CG-CD1 4.09Å; L172-L176 WeakPolarHBondContact O-CB 3.29Å; L172-L176 VanDerWaalsContact O-CG 3.31Å; L172-L176 WeakPolarHBondContact O-CG 3.5Å; L172-L176 PolarHBondContact O-N 3Å
173Q74.5Confident67.1Low129 Ų12986.4 Ų86.460%0.60343%0.429SS*.Hα-helixtrans-59-39.9173.8-172-173.225.300111.3L169 Y170 L176 S177L169-Q173 WeakPolarHBondContact O-CB 3.49Å; L169-Q173 PolarHBondContact O-N 3.02Å; Y170-Q173 PolarHBondContact O-N 3.3Å; Q173-L176 PolarHBondContact O-N 3.43Å; Q173-S177 WeakPolarHBondContact O-CA 3.09Å; Q173-S177 WeakPolarHBondContact O-CB 3.36Å; Q173-S177 PolarHBondContact O-N 3.28Å
174K73Confident66.2Low122 Ų12284.9 Ų84.953%0.5342%0.422SS..Hα-helixtrans-70.5-37179.2-165.1168.6-172.4168.20112.4Y170 L171 L172Y170-K174 HydrophobicContact CE1-CD 3.83Å; Y170-K174 WeakPolarHBondContact O-CB 3.25Å; Y170-K174 PolarHBondContact O-N 3.08Å; Y170-K174 PolarHBondContact OH-NZ 3.02Å; Y170-K174 VanDerWaalsContact OH-NZ 3.1Å; L171-K174 PolarHBondContact O-N 2.98Å; L172-K174 VanDerWaalsContact C-N 3.29Å; L172-K174 PolarHBondContact O-N 3.31Å
175C66.3Low65.6Low46 Ų4687.1 Ų87.131%0.31144%0.439SS..Hα-helixtrans-65.1-43.5172-68.40000111.6L171 L172 N178L171-C175 WeakPolarHBondContact O-CB 3.47Å; L171-C175 PolarHBondContact O-N 3.3Å; L171-C175 PolarHBondContact O-SG 3.35Å; L172-C175 PolarHBondContact O-N 2.98Å; C175-N178 VanDerWaalsContact O-CB 3.27Å; C175-N178 WeakPolarHBondContact O-CB 3.37Å
176L65.1Low65.1Low71 Ų7190.7 Ų90.737%0.37246%0.456SS..Hα-helixtrans-74.9-31.2178-67.3171000113.2L172 Q173 N178 F181L172-L176 HydrophobicContact CG-CD1 4.09Å; L172-L176 WeakPolarHBondContact O-CB 3.29Å; L172-L176 VanDerWaalsContact O-CG 3.31Å; L172-L176 WeakPolarHBondContact O-CG 3.5Å; L172-L176 PolarHBondContact O-N 3Å; Q173-L176 PolarHBondContact O-N 3.43Å; L176-N178 PolarHBondContact O-N 2.99Å; L176-F181 HydrophobicContact CD2-CD2 4.36Å; L176-F181 HydrophobicContact CD2-CE1 4.34Å; L176-F181 HydrophobicContact CD2-CE2 4.13Å; L176-F181 HydrophobicContact CD2-CZ 4.12Å; L176-F181 WeakPolarHBondContact O-CB 3.42Å
177S63.3Low64.5Low65 Ų6590.4 Ų90.446%0.45545%0.45SS..THydrogen-bonded Turntrans-73.6-6.9178.1-171.70000113Q173 K179Q173-S177 WeakPolarHBondContact O-CA 3.09Å; Q173-S177 WeakPolarHBondContact O-CB 3.36Å; Q173-S177 PolarHBondContact O-N 3.28Å; S177-K179 PolarHBondContact O-N 3.39Å; S177-K179 VanDerWaalsContact O-N 3.1Å
178N62.2Low63.8Low107 Ų10788.8 Ų88.857%0.57244%0.439SS*.SBendtrans-53.2119169.9-168.8-17.3000109.7C175 L176 K180 F181C175-N178 VanDerWaalsContact O-CB 3.27Å; C175-N178 WeakPolarHBondContact O-CB 3.37Å; L176-N178 PolarHBondContact O-N 2.99Å; N178-K180 PolarHBondContact O-N 3.21Å; N178-F181 PolarHBondContact O-N 2.95Å
179K57.2Low63.6Low178 Ų17892.1 Ų92.177%0.77446%0.457SS*.Hα-helixtrans-48.8-26.4-157.5-66.1-178.1179178.80115.7S177 F181 I182 L183S177-K179 PolarHBondContact O-N 3.39Å; S177-K179 VanDerWaalsContact O-N 3.1Å; K179-F181 VanDerWaalsContact C-N 3.31Å; K179-F181 PolarHBondContact O-N 2.78Å; K179-I182 PolarHBondContact O-N 2.94Å; K179-L183 WeakPolarHBondContact O-CB 3.44Å; K179-L183 PolarHBondContact O-N 2.89Å
180K56.6Low63.2Low169 Ų16993.2 Ų93.274%0.73546%0.46SS*.Hα-helixtrans-55.2-40.2174-64-177.4178.3-1780112.8N178 L184N178-K180 PolarHBondContact O-N 3.21Å; K180-L184 WeakPolarHBondContact O-CB 3.27Å; K180-L184 PolarHBondContact O-N 3.27Å
181F55.6Low62.7Low59 Ų5994.4 Ų94.426%0.25946%0.464SS..Hα-helixtrans-74.5-37.3-178.7-138.3-87.2000112.4M94 L176 N178 K179 L184 S185M94-F181 HydrophobicContact CE-CE1 3.97Å; M94-F181 HydrophobicContact CE-CZ 3.71Å; L176-F181 HydrophobicContact CD2-CD2 4.36Å; L176-F181 HydrophobicContact CD2-CE1 4.34Å; L176-F181 HydrophobicContact CD2-CE2 4.13Å; L176-F181 HydrophobicContact CD2-CZ 4.12Å; L176-F181 WeakPolarHBondContact O-CB 3.42Å; N178-F181 PolarHBondContact O-N 2.95Å; K179-F181 VanDerWaalsContact C-N 3.31Å; K179-F181 PolarHBondContact O-N 2.78Å; F181-L184 CarbonylContact O-C 3.59Å; F181-L184 WeakPolarHBondContact O-CB 3.26Å; F181-L184 PolarHBondContact O-N 3Å; F181-L184 VanDerWaalsContact O-N 3.16Å; F181-S185 PolarHBondContact O-N 3.46Å
182I56Low62.5Low87 Ų8796.3 Ų96.345%0.44647%0.472SS..Hα-helixtrans-64.9-43.1174.5-61.1173.5000110.2K179 L184 S185 N186K179-I182 PolarHBondContact O-N 2.94Å; I182-L184 VanDerWaalsContact C-N 3.26Å; I182-L184 PolarHBondContact O-N 3.36Å; I182-S185 PolarHBondContact O-N 2.91Å; I182-N186 PolarHBondContact O-N 3.19Å; I182-N186 VanDerWaalsContact O-N 3.09Å
183L55Low62.5Low110 Ų110100.3 Ų100.358%0.57649%0.491SS*.Hα-helixtrans-60.3-38.2172.2-168.475.7000111.6K179 K187K179-L183 WeakPolarHBondContact O-CB 3.44Å; K179-L183 PolarHBondContact O-N 2.89Å; L183-K187 PolarHBondContact O-N 2.79Å; L183-K187 VanDerWaalsContact O-N 3.08Å
184L56.3Low62.3Low54 Ų5499.4 Ų99.428%0.28349%0.488SS..Hα-helixtrans-66.1-44176.1-145.781.7000111.9L108 K180 F181 I182 N186 K187 F188L108-L184 HydrophobicContact CD1-CD1 3.77Å; L108-L184 HydrophobicContact CD1-CD2 3.6Å; L108-L184 HydrophobicContact CD1-CG 4.3Å; L108-L184 HydrophobicContact CD2-CD2 3.72Å; L108-L184 HydrophobicContact CG-CD2 4.32Å; K180-L184 WeakPolarHBondContact O-CB 3.27Å; K180-L184 PolarHBondContact O-N 3.27Å; F181-L184 CarbonylContact O-C 3.59Å; F181-L184 WeakPolarHBondContact O-CB 3.26Å; F181-L184 PolarHBondContact O-N 3Å; F181-L184 VanDerWaalsContact O-N 3.16Å; I182-L184 VanDerWaalsContact C-N 3.26Å; I182-L184 PolarHBondContact O-N 3.36Å; L184-N186 PolarHBondContact O-N 3.46Å; L184-K187 CarbonylContact O-C 3.6Å; L184-K187 PolarHBondContact O-N 2.81Å; L184-F188 VanDerWaalsContact O-CB 3.31Å; L184-F188 WeakPolarHBondContact O-CB 3.35Å; L184-F188 PolarHBondContact O-N 3.14Å
185S58.9Low62.1Low61 Ų6199.2 Ų99.243%0.42749%0.49SS..Hα-helixtrans-58.4-45.9176.8-175.70000111.8F181 I182 F188 N189F181-S185 PolarHBondContact O-N 3.46Å; I182-S185 PolarHBondContact O-N 2.91Å; S185-F188 PolarHBondContact O-N 3.35Å; S185-N189 PolarHBondContact O-N 2.88Å
186N59.1Low62.6Low104 Ų104102.9 Ų102.956%0.55650%0.501SS*.Hα-helixtrans-63.1-44.4176.2-75.8-4.5000112.1I182 L184 F188 N189 Q190I182-N186 PolarHBondContact O-N 3.19Å; I182-N186 VanDerWaalsContact O-N 3.09Å; L184-N186 PolarHBondContact O-N 3.46Å; N186-F188 VanDerWaalsContact C-N 3.32Å; N186-F188 PolarHBondContact O-N 2.86Å; N186-N189 PolarHBondContact O-N 2.76Å; N186-Q190 PolarHBondContact O-N 3.06Å
187K63.5Low62.8Low114 Ų114104.6 Ų104.650%0.49651%0.51SS..Hα-helixtrans-63.6-36.7173.4-75.8-169.3173-168.90112.4L183 L184 Q190 Y191L183-K187 PolarHBondContact O-N 2.79Å; L183-K187 VanDerWaalsContact O-N 3.08Å; L184-K187 CarbonylContact O-C 3.6Å; L184-K187 PolarHBondContact O-N 2.81Å; K187-Q190 WeakPolarHBondContact O-CB 3.27Å; K187-Q190 PolarHBondContact O-N 3.29Å; K187-Y191 WeakPolarHBondContact O-CD2 3.5Å; K187-Y191 PolarHBondContact O-N 2.83Å
188F59.4Low63.1Low52 Ų52106.1 Ų106.123%0.22851%0.512CS..Hα-helixtrans-68.6-40.2179.4-158.3-81.6000111.7Y97 K101 L103 L184 S185 N186 Q190 Y191 H192Y97-F188 HydrophobicContact CE1-CE2 4.42Å; Y97-F188 HydrophobicContact CE1-CZ 4.21Å; Y97-F188 AromaticContact CZ-CZ 3.98Å; Y97-F188 WeakPolarHBondContact OH-CE1 3.4Å; Y97-F188 WeakPolarHBondContact OH-CZ 3.18Å; K101-F188 HydrophobicContact CD-CE2 4.24Å; K101-F188 HydrophobicContact CD-CZ 3.77Å; L103-F188 HydrophobicContact CD1-CE2 4.49Å; L103-F188 HydrophobicContact CD2-CD2 4.25Å; L103-F188 HydrophobicContact CD2-CE2 4.42Å; L184-F188 VanDerWaalsContact O-CB 3.31Å; L184-F188 WeakPolarHBondContact O-CB 3.35Å; L184-F188 PolarHBondContact O-N 3.14Å; S185-F188 PolarHBondContact O-N 3.35Å; N186-F188 VanDerWaalsContact C-N 3.32Å; N186-F188 PolarHBondContact O-N 2.86Å; F188-Q190 VanDerWaalsContact C-N 3.34Å; F188-Y191 PolarHBondContact O-N 3.07Å; F188-H192 VanDerWaalsContact O-CB 3.26Å; F188-H192 WeakPolarHBondContact O-CB 3.3Å; F188-H192 PolarHBondContact O-N 3.31Å
189N65.4Low63.5Low89 Ų89108.1 Ų108.148%0.47652%0.516SS..Hα-helixtrans-62-40.9170.1-83.6-33.4000111.9S185 N186 H192 M193S185-N189 PolarHBondContact O-N 2.88Å; N186-N189 PolarHBondContact O-N 2.76Å; N189-H192 PolarHBondContact O-N 3.12Å; N189-M193 WeakPolarHBondContact O-CG 3.35Å; N189-M193 PolarHBondContact O-N 2.95Å
190Q64.8Low64.1Low140 Ų140106.6 Ų106.665%0.65451%0.509SS*.Hα-helixtrans-62.7-46.7175.7-164.3175.414.200111.9N186 K187 F188 H192 M193 M194N186-Q190 PolarHBondContact O-N 3.06Å; K187-Q190 WeakPolarHBondContact O-CB 3.27Å; K187-Q190 PolarHBondContact O-N 3.29Å; F188-Q190 VanDerWaalsContact C-N 3.34Å; Q190-H192 PolarHBondContact O-N 3.42Å; Q190-M193 PolarHBondContact O-N 3.42Å; Q190-M194 WeakPolarHBondContact O-CB 3.3Å; Q190-M194 PolarHBondContact O-N 3.14Å
191Y64.3Low64.2Low140 Ų140103 Ų10355%0.54950%0.498SS..Hα-helixtrans-63.3-38.7173.5-79.3-60.7000112.8K187 F188 M194 M195K187-Y191 WeakPolarHBondContact O-CD2 3.5Å; K187-Y191 PolarHBondContact O-N 2.83Å; F188-Y191 PolarHBondContact O-N 3.07Å; Y191-M194 PolarHBondContact O-N 3.41Å; Y191-M195 WeakPolarHBondContact O-CB 3.33Å; Y191-M195 PolarHBondContact O-N 3.04Å
192H68Low64.3Low88 Ų88107 Ų10741%0.40752%0.515SS..Hα-helixtrans-66.8-39.8177.8179.2-143.4000112F188 N189 Q190 M195 K196F188-H192 VanDerWaalsContact O-CB 3.26Å; F188-H192 WeakPolarHBondContact O-CB 3.3Å; F188-H192 PolarHBondContact O-N 3.31Å; N189-H192 PolarHBondContact O-N 3.12Å; Q190-H192 PolarHBondContact O-N 3.42Å; H192-M195 PolarHBondContact O-N 3.26Å; H192-K196 WeakPolarHBondContact NE2-CE 3.38Å; H192-K196 WeakPolarHBondContact O-CB 3.22Å; H192-K196 WeakPolarHBondContact O-CG 3.49Å; H192-K196 PolarHBondContact O-N 3.4Å
193M68.9Low64.3Low122 Ų122110.9 Ų110.960%0.60153%0.529SS*.Hα-helixtrans-63.9-46.6171.4-72.1-61.5-160.400111.5N189 Q190 M195 K196 L197N189-M193 WeakPolarHBondContact O-CG 3.35Å; N189-M193 PolarHBondContact O-N 2.95Å; Q190-M193 PolarHBondContact O-N 3.42Å; M193-M195 VanDerWaalsContact C-N 3.34Å; M193-M195 PolarHBondContact O-N 3.05Å; M193-K196 PolarHBondContact O-N 3.03Å; M193-L197 WeakPolarHBondContact O-CG 3.27Å; M193-L197 PolarHBondContact O-N 3.27Å
194M69.6Low64.4Low109 Ų109109.7 Ų109.754%0.53752%0.522SS..Hα-helixtrans-57.9-44.9175.6-171.8-174.3-173.900111.8Q190 Y191 K196 L197 I198Q190-M194 WeakPolarHBondContact O-CB 3.3Å; Q190-M194 PolarHBondContact O-N 3.14Å; Y191-M194 PolarHBondContact O-N 3.41Å; M194-K196 PolarHBondContact O-N 3.44Å; M194-L197 WeakPolarHBondContact O-CB 3.36Å; M194-L197 PolarHBondContact O-N 3.26Å; M194-I198 HydrophobicContact CE-CD1 4.33Å; M194-I198 HydrophobicContact CG-CD1 4.03Å; M194-I198 WeakPolarHBondContact O-CG1 3.33Å; M194-I198 PolarHBondContact O-N 3.44Å
195M69.9Low64.1Low119 Ų119112.5 Ų112.559%0.58654%0.537SS*.Hα-helixtrans-70.5-31.6179.7-157.4-178.4-157.100112.6Y191 H192 M193 K199Y191-M195 WeakPolarHBondContact O-CB 3.33Å; Y191-M195 PolarHBondContact O-N 3.04Å; H192-M195 PolarHBondContact O-N 3.26Å; M193-M195 VanDerWaalsContact C-N 3.34Å; M193-M195 PolarHBondContact O-N 3.05Å; M195-K199 WeakPolarHBondContact O-CB 3.34Å; M195-K199 WeakPolarHBondContact O-CG 3.42Å; M195-K199 PolarHBondContact O-N 3.22Å
196K75.3Confident63.9Low123 Ų123115.3 Ų115.354%0.53555%0.547SS..Hα-helixtrans-64.1-43.6168.6-84.1-176.2170.7-178.70111.7H192 M193 M194 K199 K200H192-K196 WeakPolarHBondContact NE2-CE 3.38Å; H192-K196 WeakPolarHBondContact O-CB 3.22Å; H192-K196 WeakPolarHBondContact O-CG 3.49Å; H192-K196 PolarHBondContact O-N 3.4Å; M193-K196 PolarHBondContact O-N 3.03Å; M194-K196 PolarHBondContact O-N 3.44Å; K196-K199 PolarHBondContact O-N 3.47Å; K196-K200 WeakPolarHBondContact O-CB 3.37Å; K196-K200 PolarHBondContact O-N 3.26Å
197L70.5Confident63.5Low107 Ų107115.1 Ų115.156%0.5655%0.55SS*.Hα-helixtrans-62.9-46175.8-70.2167.9000111.6M193 M194 K199 K200 N201M193-L197 WeakPolarHBondContact O-CG 3.27Å; M193-L197 PolarHBondContact O-N 3.27Å; M194-L197 WeakPolarHBondContact O-CB 3.36Å; M194-L197 PolarHBondContact O-N 3.26Å; L197-K199 PolarHBondContact O-N 2.86Å; L197-K200 PolarHBondContact O-N 3.04Å; L197-K200 VanDerWaalsContact O-N 3.16Å; L197-N201 PolarHBondContact O-N 3.14Å; L197-N201 PolarHBondContact O-OD1 2.91Å
198I68.6Low63Low96 Ų96115.7 Ų115.749%0.49256%0.558SS.*Hα-helixtrans-59.4-45.1175.7-67.9164.5000111.1M194 K200 N201 K202M194-I198 HydrophobicContact CE-CD1 4.33Å; M194-I198 HydrophobicContact CG-CD1 4.03Å; M194-I198 WeakPolarHBondContact O-CG1 3.33Å; M194-I198 PolarHBondContact O-N 3.44Å; I198-K200 PolarHBondContact O-N 3.33Å; I198-N201 PolarHBondContact O-N 3.23Å; I198-K202 WeakPolarHBondContact O-CB 3.49Å; I198-K202 PolarHBondContact O-N 3.44Å
199K70.2Confident62.4Low150 Ų150119.7 Ų119.765%0.65258%0.582SS**Hα-helixtrans-63.9-37.7175.4-78.4-169.8175.5-171.30112.7M195 K196 L197 K203M195-K199 WeakPolarHBondContact O-CB 3.34Å; M195-K199 WeakPolarHBondContact O-CG 3.42Å; M195-K199 PolarHBondContact O-N 3.22Å; K196-K199 PolarHBondContact O-N 3.47Å; L197-K199 PolarHBondContact O-N 2.86Å; K199-K203 PolarHBondContact O-N 3.31Å; K199-K203 VanDerWaalsContact O-N 3.09Å
200K69.5Low61.5Low145 Ų145122.4 Ų122.463%0.6360%0.597SS**Hα-helixtrans-65.8-47.6177.1-164.7176.3-178.1-175.50111.1K196 L197 I198 K203 I204K196-K200 WeakPolarHBondContact O-CB 3.37Å; K196-K200 PolarHBondContact O-N 3.26Å; L197-K200 PolarHBondContact O-N 3.04Å; L197-K200 VanDerWaalsContact O-N 3.16Å; I198-K200 PolarHBondContact O-N 3.33Å; K200-K203 PolarHBondContact O-N 3.2Å; K200-I204 HydrophobicContact CG-CD1 4.41Å; K200-I204 WeakPolarHBondContact O-CG1 3.42Å; K200-I204 PolarHBondContact O-N 2.98Å; K200-I204 VanDerWaalsContact O-N 3.14Å
201N58.5Low60.7Low94 Ų94123 Ų12350%0.50360%0.604SS.*Hα-helixtrans-66.5-40178.7-68.17.2000112L197 I198 K203 I204 N205L197-N201 PolarHBondContact O-N 3.14Å; L197-N201 PolarHBondContact O-OD1 2.91Å; I198-N201 PolarHBondContact O-N 3.23Å; N201-K203 VanDerWaalsContact C-N 3.29Å; N201-K203 PolarHBondContact O-N 3.45Å; N201-I204 PolarHBondContact O-N 3.49Å; N201-N205 PolarHBondContact O-N 3.31Å
202K57.7Low59.8Low144 Ų144123.7 Ų123.763%0.62662%0.617SS**Hα-helixtrans-63.8-33.5175-168166.8-175.3174.70112.2I198 L206I198-K202 WeakPolarHBondContact O-CB 3.49Å; I198-K202 PolarHBondContact O-N 3.44Å; K202-L206 HydrophobicContact CG-CD1 3.88Å; K202-L206 WeakPolarHBondContact O-CD1 3.27Å; K202-L206 PolarHBondContact O-N 3.01Å
203K56.6Low58.7Low167 Ų167131 Ų13173%0.72664%0.641SS**Hα-helixtrans-69.6-34.5174.1-166.7172.9-177.8-179.10112.8K199 K200 N201 T207K199-K203 PolarHBondContact O-N 3.31Å; K199-K203 VanDerWaalsContact O-N 3.09Å; K200-K203 PolarHBondContact O-N 3.2Å; N201-K203 VanDerWaalsContact C-N 3.29Å; N201-K203 PolarHBondContact O-N 3.45Å; K203-T207 PolarHBondContact O-OG1 3.09Å
204I57Low57.6Low85 Ų85130.6 Ų130.644%0.43664%0.641SS.*Hα-helixtrans-69.6-42.1176.4-66.9163.5000111.2K200 N201 L206 T207K200-I204 HydrophobicContact CG-CD1 4.41Å; K200-I204 WeakPolarHBondContact O-CG1 3.42Å; K200-I204 PolarHBondContact O-N 2.98Å; K200-I204 VanDerWaalsContact O-N 3.14Å; N201-I204 PolarHBondContact O-N 3.49Å; I204-L206 PolarHBondContact O-N 2.92Å; I204-T207 PolarHBondContact O-N 2.98Å; I204-T207 PolarHBondContact O-OG1 3.07Å
205N51Low56.7Low114 Ų114132.4 Ų132.461%0.6165%0.652SS**Hα-helixtrans-72.1-29.1-179.1-72.516.1000113.1N201 T207N201-N205 PolarHBondContact O-N 3.31Å; N205-T207 VanDerWaalsContact C-N 3.29Å; N205-T207 PolarHBondContact O-N 3Å
206L53.1Low55.7Low119 Ų119133.6 Ų133.662%0.62366%0.66SS**Hα-helixtrans-71-19.9174.5-97.488.2000113.8K202 I204K202-L206 HydrophobicContact CG-CD1 3.88Å; K202-L206 WeakPolarHBondContact O-CD1 3.27Å; K202-L206 PolarHBondContact O-N 3.01Å; I204-L206 PolarHBondContact O-N 2.92Å
207T52.2Low54.5Low100 Ų100132.7 Ų132.761%0.61366%0.661SS**THydrogen-bonded Turntrans-83.8-11.1178.139.10000114.6K203 I204 N205K203-T207 PolarHBondContact O-OG1 3.09Å; I204-T207 PolarHBondContact O-N 2.98Å; I204-T207 PolarHBondContact O-OG1 3.07Å; N205-T207 VanDerWaalsContact C-N 3.29Å; N205-T207 PolarHBondContact O-N 3Å
208N52.4Low53.4Low127 Ų127132.5 Ų132.568%0.67966%0.657SS**THydrogen-bonded Turntrans-107-14.7-176.3-74.721.3000114.6
209N45.9Very low52.3Low135 Ų135135.1 Ų135.172%0.72267%0.668SS**  trans-10450.5-175.8-79.321.5000113.2N211N209-N211 PolarHBondContact O-N 3.03Å
210N48.3Very low51.3Low147 Ų147134.5 Ų134.579%0.78667%0.67SS**  trans-85.868.6159.2-80.11.7000109.4
211N46.9Very low50.1Low151 Ų151133.5 Ų133.581%0.80767%0.666SS**  trans-155.8134.6165.6-91.8-50.6000108.2N209N209-N211 PolarHBondContact O-N 3.03Å
212D45.5Very low49.5Very low156 Ų156133 Ų13383%0.83466%0.662SS**  trans-74.2175.6-164.1-66.4-76.7000116.2
213R44.4Very low48.7Very low240 Ų240131.2 Ų131.291%0.90666%0.659SS**SBendtrans87.920.6141.3-141.2177.3-168.3174.43.6119.6
214L45.4Very low48Very low115 Ų115130.8 Ų130.860%0.60266%0.657SS**  trans-131.731.2179-114.4170.3000115.9D217L214-D217 HydrophobicContact CD2-CB 4.22Å
215I52Low47.4Very low147 Ų147130.8 Ų130.875%0.75466%0.657SS**  trans-73.3-34.7-169.1-69.2174.8000114
216N49Very low47.2Very low144 Ų144130 Ų13077%0.7765%0.652SS**THydrogen-bonded Turntrans-82.5-22.4-168.1-6714.7000115.3
217D49.4Very low46.6Very low103 Ų103130.1 Ų130.155%0.55165%0.653SS**THydrogen-bonded Turntrans-87.1-13.4-176.9-98.88.2000114L214L214-D217 HydrophobicContact CD2-CB 4.22Å
218H47.8Very low46.1Very low104 Ų104130.5 Ų130.548%0.48165%0.652SS.*Hα-helixtrans-84-27.3-170-109.5-56.9000114.1K221 I222H218-K221 PolarHBondContact O-N 2.9Å; H218-I222 HydrophobicContact CB-CD1 4.49Å; H218-I222 VanDerWaalsContact O-CG1 3.26Å; H218-I222 WeakPolarHBondContact O-CG1 3.32Å; H218-I222 PolarHBondContact O-N 3.48Å
219E46.4Very low45.4Very low151 Ų151130.1 Ų130.171%0.70665%0.649SS**Hα-helixtrans-67.5-41.2-175.3-164.1158.3-132.300112.2K221 I222 N223E219-K221 VanDerWaalsContact C-N 3.35Å; E219-K221 PolarHBondContact O-N 3.45Å; E219-I222 PolarHBondContact O-N 2.92Å; E219-N223 PolarHBondContact O-N 2.95Å
220I48.8Very low45Very low137 Ų137130.2 Ų130.270%0.70365%0.646SS**Hα-helixtrans-63.8-39.2174.7-60.1176.3000111.2K224I220-K224 PolarHBondContact O-N 2.99Å
221K44.5Very low44.3Very low124 Ų124128.8 Ų128.854%0.53965%0.647SS.*Hα-helixtrans-71-34.2176.3-79.6172.5179.3161.40112.6H218 E219 K224 I225H218-K221 PolarHBondContact O-N 2.9Å; E219-K221 VanDerWaalsContact C-N 3.35Å; E219-K221 PolarHBondContact O-N 3.45Å; K221-K224 PolarHBondContact O-N 3.43Å; K221-I225 VanDerWaalsContact O-CG1 3.29Å; K221-I225 WeakPolarHBondContact O-CG1 3.37Å; K221-I225 PolarHBondContact O-N 2.86Å
222I46.2Very low43.7Very low83 Ų83125.3 Ų125.343%0.42664%0.635SS.*Hα-helixtrans-63.4-43.8178.9-76.2164000111.2H218 E219 K224 I225 I226H218-I222 HydrophobicContact CB-CD1 4.49Å; H218-I222 VanDerWaalsContact O-CG1 3.26Å; H218-I222 WeakPolarHBondContact O-CG1 3.32Å; H218-I222 PolarHBondContact O-N 3.48Å; E219-I222 PolarHBondContact O-N 2.92Å; I222-K224 VanDerWaalsContact C-N 3.32Å; I222-K224 PolarHBondContact O-N 3.18Å; I222-I225 PolarHBondContact O-N 2.86Å; I222-I225 VanDerWaalsContact O-N 3.13Å; I222-I226 HydrophobicContact CG2-CD1 3.66Å; I222-I226 HydrophobicContact CG2-CG1 4.32Å; I222-I226 VanDerWaalsContact O-CG1 3.31Å; I222-I226 WeakPolarHBondContact O-CG1 3.49Å; I222-I226 PolarHBondContact O-N 3.03Å
223N40.6Very low43.1Very low106 Ų106123.4 Ų123.457%0.56763%0.631SS**Hα-helixtrans-63.2-36.2174.9-76.7-20.8000112.7E219 I225 I226 N227E219-N223 PolarHBondContact O-N 2.95Å; N223-I225 VanDerWaalsContact C-N 3.3Å; N223-I225 PolarHBondContact O-N 3.25Å; N223-I226 PolarHBondContact O-N 3.34Å; N223-N227 PolarHBondContact O-N 2.97Å
224K41.1Very low42.7Very low159 Ų159117 Ų11769%0.69161%0.614SS**Hα-helixtrans-69.9-26.5175.3-154.8168.7-171.1173.40113I220 K221 I222I220-K224 PolarHBondContact O-N 2.99Å; K221-K224 PolarHBondContact O-N 3.43Å; I222-K224 VanDerWaalsContact C-N 3.32Å; I222-K224 PolarHBondContact O-N 3.18Å
225I44.7Very low42.2Very low85 Ų85116.9 Ų116.944%0.43661%0.61SS.*Hα-helixtrans-82.2-34.9174.3-68.6165.4000111.5K221 I222 N223 N227 N228 N229K221-I225 VanDerWaalsContact O-CG1 3.29Å; K221-I225 WeakPolarHBondContact O-CG1 3.37Å; K221-I225 PolarHBondContact O-N 2.86Å; I222-I225 PolarHBondContact O-N 2.86Å; I222-I225 VanDerWaalsContact O-N 3.13Å; N223-I225 VanDerWaalsContact C-N 3.3Å; N223-I225 PolarHBondContact O-N 3.25Å; I225-N227 VanDerWaalsContact C-N 3.3Å; I225-N227 PolarHBondContact O-N 2.98Å; I225-N228 PolarHBondContact O-N 3.41Å; I225-N228 VanDerWaalsContact O-N 3.15Å; I225-N229 HydrophobicContact CG2-CB 4.43Å; I225-N229 VanDerWaalsContact CG2-ND2 3.35Å; I225-N229 WeakPolarHBondContact CG2-ND2 3.24Å; I225-N229 VanDerWaalsContact O-CB 3.31Å; I225-N229 WeakPolarHBondContact O-CB 3.49Å; I225-N229 PolarHBondContact O-N 3.25Å
226I45.7Very low41.4Very low96 Ų96115.3 Ų115.349%0.49260%0.602SS.*Hα-helixtrans-62.2-36.8177.4-74.4166.4000111.7I222 N223I222-I226 HydrophobicContact CG2-CD1 3.66Å; I222-I226 HydrophobicContact CG2-CG1 4.32Å; I222-I226 VanDerWaalsContact O-CG1 3.31Å; I222-I226 WeakPolarHBondContact O-CG1 3.49Å; I222-I226 PolarHBondContact O-N 3.03Å; N223-I226 PolarHBondContact O-N 3.34Å
227N42Very low40.8Very low123 Ų123115.7 Ų115.766%0.65860%0.597SS**Hα-helixtrans-74.9-27.8174.5-75.7-4.7000113.7N223 I225N223-N227 PolarHBondContact O-N 2.97Å; I225-N227 VanDerWaalsContact C-N 3.3Å; I225-N227 PolarHBondContact O-N 2.98Å
228N41.4Very low40.2Very low107 Ų107116 Ų11657%0.57261%0.608SS**Hα-helixtrans-96.2-13.9-177.6-76.310.2000114.6I225I225-N228 PolarHBondContact O-N 3.41Å; I225-N228 VanDerWaalsContact O-N 3.15Å
229N36.7Very low39.5Very low119 Ų119115.7 Ų115.764%0.63662%0.616SS**  trans-97.317.6177.8-76.29.7000113.5I225 S231I225-N229 HydrophobicContact CG2-CB 4.43Å; I225-N229 VanDerWaalsContact CG2-ND2 3.35Å; I225-N229 WeakPolarHBondContact CG2-ND2 3.24Å; I225-N229 VanDerWaalsContact O-CB 3.31Å; I225-N229 WeakPolarHBondContact O-CB 3.49Å; I225-N229 PolarHBondContact O-N 3.25Å; N229-S231 PolarHBondContact O-N 3.31Å
230Q38Very low39Very low137 Ų137115 Ų11564%0.6462%0.616SS**  trans-7287.3159.2-68.9-163.332.100108.6S232Q230-S232 PolarHBondContact O-N 3.27Å
231S34Very low38.3Very low117 Ų117113.4 Ų113.482%0.81862%0.618SS**  trans-70.865.3-178.2650000112.5N229N229-S231 PolarHBondContact O-N 3.31Å
232S34.2Very low37.8Very low78 Ų78113.5 Ų113.555%0.54562%0.624SS.*  trans-64.1140.3156.2-570000108.4Q230Q230-S232 PolarHBondContact O-N 3.27Å
233P32.7Very low37.1Very low117 Ų117115.2 Ų115.276%0.7663%0.634SS**SBendtrans-62.9144.5168.728.9-33.6000109.5
234I35.7Very low36.7Very low106 Ų106115.9 Ų115.954%0.54464%0.638SS.*  trans7283.1176.6-50.5164.9000114.2L236I234-L236 HydrophobicContact CG2-CB 4.4Å; I234-L236 HydrophobicContact CG2-CD1 3.68Å; I234-L236 HydrophobicContact CG2-CG 3.61Å; I234-L236 PolarHBondContact O-N 3.19Å
235H34.7Very low36.4Very low112 Ų112114.6 Ų114.652%0.51964%0.639SS.*  trans-82.692.1161.1-105.9-93.7000110.3F237H235-F237 PolarHBondContact O-N 3.13Å
236L35.4Very low35.7Very low114 Ų114117.7 Ų117.760%0.59766%0.656SS**THydrogen-bonded Turntrans-75.537.6-179.3-98.1162.7000114.5I234I234-L236 HydrophobicContact CG2-CB 4.4Å; I234-L236 HydrophobicContact CG2-CD1 3.68Å; I234-L236 HydrophobicContact CG2-CG 3.61Å; I234-L236 PolarHBondContact O-N 3.19Å
237F37.4Very low35.2Very low151 Ų151120.8 Ų120.866%0.66267%0.674SS**THydrogen-bonded Turntrans-122.2-11-178.8-76.3-80.8000114.8H235 C239 L240H235-F237 PolarHBondContact O-N 3.13Å; F237-C239 PolarHBondContact O-N 3.37Å; F237-L240 HydrophobicContact CD1-CD1 4.14Å
238S35.8Very low34.6Very low110 Ų110122.8 Ų122.877%0.76968%0.684SS**THydrogen-bonded Turntrans-72.3-4.4177.4-47.50000114.6
239C33.2Very low34.1Very low98 Ų98129.3 Ų129.366%0.66270%0.701SS**THydrogen-bonded Turntrans-101.91.6-177-580000113.8F237 S241F237-C239 PolarHBondContact O-N 3.37Å; C239-S241 PolarHBondContact O-N 3.32Å
240L36.4Very low33.7Very low135 Ų135131.4 Ų131.471%0.70771%0.711SS**SBendtrans-70.2124168.7-84162.7000108.8F237 N242F237-L240 HydrophobicContact CD1-CD1 4.14Å; L240-N242 PolarHBondContact O-N 3.35Å; L240-N242 VanDerWaalsContact O-N 3.08Å
241S33Very low33.4Very low105 Ų105132.2 Ų132.273%0.73472%0.719SS**  trans-59.6114.2-174.8-1750000111C239 N243C239-S241 PolarHBondContact O-N 3.32Å; S241-N243 PolarHBondContact O-N 3.24Å
242N34Very low33.1Very low126 Ų126133.9 Ų133.967%0.67472%0.719SS**  trans-73.877.9172-174.962.8000109.3L240 N244L240-N242 PolarHBondContact O-N 3.35Å; L240-N242 VanDerWaalsContact O-N 3.08Å; N242-N244 VanDerWaalsContact C-N 3.26Å; N242-N244 VanDerWaalsContact ND2-CG 3.27Å; N242-N244 PolarHBondContact ND2-ND2 3.18Å; N242-N244 PolarHBondContact ND2-OD1 3.41Å; N242-N244 PolarHBondContact O-N 3.46Å
243N32.9Very low33Very low118 Ų118140 Ų14063%0.63173%0.73SS**  trans-75.576.1-171-160.111.9000110.6S241 N245S241-N243 PolarHBondContact O-N 3.24Å; N243-N245 PolarHBondContact O-N 3.33Å; N243-N245 PolarHBondContact OD1-ND2 2.9Å
244N31.5Very low32.8Very low121 Ų121141.2 Ų141.265%0.64773%0.73SS**  trans-67.449.9178.3-84.7-2.7000112.8N242 N246N242-N244 VanDerWaalsContact C-N 3.26Å; N242-N244 VanDerWaalsContact ND2-CG 3.27Å; N242-N244 PolarHBondContact ND2-ND2 3.18Å; N242-N244 PolarHBondContact ND2-OD1 3.41Å; N242-N244 PolarHBondContact O-N 3.46Å; N244-N246 PolarHBondContact O-N 2.97Å; N244-N246 VanDerWaalsContact O-N 3.1Å
245N34.1Very low32.9Very low132 Ų132143 Ų14371%0.70674%0.739SS**  trans-79.390.6169-82.3-21.3000109.3N243 N247N243-N245 PolarHBondContact O-N 3.33Å; N243-N245 PolarHBondContact OD1-ND2 2.9Å; N245-N247 PolarHBondContact O-N 2.94Å
246N31.3Very low32.9Very low149 Ų149144.5 Ų144.580%0.79775%0.751SS**  trans-51.8108.9159.8-66.8-36.9000109.1N244N244-N246 PolarHBondContact O-N 2.97Å; N244-N246 VanDerWaalsContact O-N 3.1Å
247N34.7Very low32.8Very low162 Ų162148.1 Ų148.187%0.86677%0.765SS**  trans-170.8134.9146.7-98.6-40.7000112N245 R249N245-N247 PolarHBondContact O-N 2.94Å; N247-R249 PolarHBondContact O-N 3.43Å
248N29.2Very low32.5Very low165 Ų165147.9 Ų147.988%0.88277%0.769SS**  trans-72118.3178.5-63.7-47.8000111.1
249R31.1Very low32.4Very low243 Ų243150 Ų15092%0.91777%0.767SS**  trans-161148.2147.8-116.2161.6-176.6168.80.9113.1N247N247-R249 PolarHBondContact O-N 3.43Å
250L28.8Very low32.2Very low164 Ų164150.3 Ų150.386%0.85977%0.77SS**  trans-59.5136.9179.7-6571.4000110.8
251L31.7Very low31.9Very low153 Ų153150.3 Ų150.380%0.80178%0.775SS**  trans-146.8113.1136.9-137.2120.7000111.2
252N26.6Very low31.8Very low152 Ų152151.2 Ų151.281%0.81378%0.777SS**  trans-80.1115.4175177.218.8000109.3
253R32.8Very low31.6Very low208 Ų208152.7 Ų152.779%0.78578%0.781SS**  trans-161.4144.4166.6-111164.8-170.6-179.71.7111.3
254N29.2Very low31.7Very low142 Ų142151.8 Ų151.876%0.75978%0.782SS**  trans-58147.5-167-50.94.6000113.5
255I37.3Very low31.5Very low143 Ų143156.4 Ų156.473%0.73379%0.792SS**  trans-122.149.5176.4-47.3170.4000109I258I255-I258 HydrophobicContact CG2-CD1 4.11Å
256D33.9Very low31.3Very low143 Ų143159.7 Ų159.777%0.76580%0.8SS**  trans-108.4-5-178.8-63.8-66.3000113.2
257E33.5Very low31.2Very low190 Ų190156.8 Ų156.889%0.88879%0.792SS**  trans-117.777.6179.7-68.1-169.3127.800112.1
258I32Very low30.8Very low146 Ų146157.9 Ų157.975%0.74980%0.797SS**  trans-127.684.5164.8-54.5-178.6000108.8I255 S260I255-I258 HydrophobicContact CG2-CD1 4.11Å; I258-S260 PolarHBondContact O-N 2.83Å
259Q32.3Very low30.9Very low156 Ų156154.1 Ų154.173%0.72978%0.784SS**  trans-71.5125174.1-75.2-172-1300111.3V261Q259-V261 PolarHBondContact O-N 3.33Å
260S30.1Very low30.7Very low104 Ų104152.4 Ų152.473%0.72779%0.786SS**  trans-80106.3173.457.80000111.3I258 T262I258-S260 PolarHBondContact O-N 2.83Å; S260-T262 PolarHBondContact O-N 3.25Å; S260-T262 VanDerWaalsContact O-N 3.11Å
261V29.5Very low30.6Very low135 Ų135148.8 Ų148.882%0.81877%0.774SS**  trans-7597.9176.2-178.20000110.6Q259 M263Q259-V261 PolarHBondContact O-N 3.33Å; V261-M263 PolarHBondContact O-N 3.27Å
262T31.5Very low30.4Very low124 Ų124149.3 Ų149.376%0.76178%0.777SS**  trans-82.3106.817445.80000111.8S260S260-T262 PolarHBondContact O-N 3.25Å; S260-T262 VanDerWaalsContact O-N 3.11Å
263M30.5Very low30.5Very low156 Ų156147.2 Ų147.277%0.76877%0.769SS**  trans-64125.8171.5-85-87.3-79.100112V261 Y265V261-M263 PolarHBondContact O-N 3.27Å; M263-Y265 PolarHBondContact O-N 3.11Å
264P33.8Very low30.3Very low100 Ų100143 Ų14365%0.64977%0.766SS**  trans-77.1108.4175.330-32.8000111.1F266P264-F266 PolarHBondContact O-N 3.42Å
265Y28.4Very low30.2Very low218 Ų218142.7 Ų142.786%0.85577%0.77SS**  trans-68.8102.2172.8-107.1-89.4000111.1M263 S267M263-Y265 PolarHBondContact O-N 3.11Å; Y265-S267 VanDerWaalsContact C-N 3.29Å; Y265-S267 PolarHBondContact O-N 3.25Å
266F28.3Very low29.9Very low200 Ų200140.5 Ų140.588%0.87777%0.767SS**  trans-6981.1170.7-88.5-89.8000111.6P264P264-F266 PolarHBondContact O-N 3.42Å
267S30.7Very low29.6Very low89 Ų89139 Ų13962%0.62277%0.768SS**  trans-86.1129.7163.160.80000110.3Y265 S269Y265-S267 VanDerWaalsContact C-N 3.29Å; Y265-S267 PolarHBondContact O-N 3.25Å; S267-S269 VanDerWaalsContact C-N 3.31Å; S267-S269 PolarHBondContact O-N 3.39Å
268N26.5Very low29.5Very low185 Ų185137 Ų13799%0.98977%0.769SS**SBendtrans-72.974.7-171.5-120.8-21.1000113.2
269S30.6Very low29.3Very low85 Ų85138.9 Ų138.959%0.59477%0.774SS**SBendtrans-155.3123.3170.558.80000110.9S267 C271S267-S269 VanDerWaalsContact C-N 3.31Å; S267-S269 PolarHBondContact O-N 3.39Å; S269-C271 PolarHBondContact O-N 2.93Å; S269-C271 VanDerWaalsContact O-N 3.12Å
270Q26.6Very low29.2Very low208 Ų208137.7 Ų137.797%0.97277%0.772SS**  trans-62.1112.1179.5-67.9168.5-42.100111.1
271C27.2Very low29.2Very low87 Ų87141.3 Ų141.359%0.58878%0.775SS**  trans-147.794.3170.5-160.30000109.8S269 V273S269-C271 PolarHBondContact O-N 2.93Å; S269-C271 VanDerWaalsContact O-N 3.12Å; C271-V273 PolarHBondContact O-N 3.46Å
272L27.8Very low29.3Very low165 Ų165143 Ų14386%0.86478%0.777SS**  trans-59.9128.4165-86.9111.9000109.1
273V28.5Very low29.1Very low108 Ų108144.2 Ų144.266%0.65578%0.779SS**  trans-108.298167.5178.60000107.1C271 T275C271-V273 PolarHBondContact O-N 3.46Å; V273-T275 PolarHBondContact O-N 2.89Å
274T27.7Very low29.1Very low118 Ų118141.3 Ų141.372%0.72478%0.775SS**  trans-78.8108.6171.337.20000109.8S276T274-S276 PolarHBondContact O-N 3.16Å
275T28.1Very low28.7Very low137 Ų137143.7 Ų143.784%0.8478%0.782SS**  trans-78.2111.4165.647.80000109V273V273-T275 PolarHBondContact O-N 2.89Å
276S30Very low28.6Very low96 Ų96138 Ų13867%0.67177%0.773SS**  trans-138.3160.4173.954.50000110.1T274T274-S276 PolarHBondContact O-N 3.16Å
277S28.1Very low28.7Very low111 Ų111136.9 Ų136.978%0.77677%0.769SS**  trans56.273.9-177.162.40000116.6
278V30.6Very low28.7Very low150 Ų150140.6 Ų140.691%0.90978%0.781SS**  trans-127.779.6133.5-175.20000107.3
279H28.2Very low29Very low185 Ų185139.4 Ų139.486%0.85677%0.773SS**  trans-93.7103.7165-110.7-65000107.2
280D30.7Very low29.1Very low130 Ų130140.5 Ų140.570%0.69578%0.779SS**  179.8146.6128-102.7-6.1000112.2
281K29.4Very low29.2Very low180 Ų180138.1 Ų138.178%0.78377%0.771SS**  trans46.698.5159.3-64.5173.3-179.9169.80117.6
282I32.1Very low29.5Very low170 Ų170140.3 Ų140.387%0.87278%0.782SS**  -173.9160.3100.8-93.1155.3000110.6
283N28Very low29.6Very low150 Ų150137.1 Ų137.180%0.80277%0.773SS**  trans-68.8171.4-173.4-86-26000115.7
284S29.4Very low29.6Very low96 Ų96138.8 Ų138.867%0.67178%0.778SS**  trans79.8108.3152.558.50000119.7
285N26.5Very low29.7Very low150 Ų150141.1 Ų141.180%0.80279%0.787SS**  trans73.7133.2137.6-57.8-6.9000119.8
286S26.9Very low29.8Very low97 Ų97141.6 Ų141.668%0.67878%0.782SS**  trans47.7103.916051.80000117.7
287F29.3Very low30Very low177 Ų177143.1 Ų143.178%0.77678%0.782SS**  -162.1122.9101.9-100.4-70000110L289F287-L289 PolarHBondContact O-N 2.86Å
288L30.6Very low30Very low168 Ų168144.9 Ų144.988%0.8878%0.783SS**PPolyproline II helixtrans-76.3123.6169.9-82.183.9000109.1
289L33.8Very low29.9Very low159 Ų159146.4 Ų146.483%0.83278%0.779SS**PPolyproline II helixtrans-74.8130.8165.8-78.5155.3000109.3F287 I291F287-L289 PolarHBondContact O-N 2.86Å; L289-I291 PolarHBondContact O-N 3.49Å
290P32.7Very low29.9Very low108 Ų108142 Ų14270%0.70177%0.769SS**PPolyproline II helixtrans-69.6122177.227.7-33.2000110.5T292P290-T292 PolarHBondContact O-N 2.86Å; P290-T292 VanDerWaalsContact O-N 3.11Å
291I28.9Very low30.1Very low159 Ų159143.5 Ų143.582%0.81578%0.776SS**  trans-72.7100.9175.1-59169.6000108.5L289 S293L289-I291 PolarHBondContact O-N 3.49Å; I291-S293 VanDerWaalsContact C-N 3.35Å; I291-S293 PolarHBondContact O-N 3.33Å; I291-S293 VanDerWaalsContact O-N 3.11Å
292T33.4Very low30.2Very low132 Ų132142.8 Ų142.881%0.8178%0.775SS**  trans-83.379.8171.843.40000110.7P290 N294P290-T292 PolarHBondContact O-N 2.86Å; P290-T292 VanDerWaalsContact O-N 3.11Å; T292-N294 PolarHBondContact O-N 3.17Å
293S28.5Very low30.1Very low98 Ų98140.9 Ų140.969%0.68577%0.766SS**  trans-66.388.6173.655.70000111.6I291I291-S293 VanDerWaalsContact C-N 3.35Å; I291-S293 PolarHBondContact O-N 3.33Å; I291-S293 VanDerWaalsContact O-N 3.11Å
294N29.8Very low30.4Very low143 Ų143140.8 Ų140.877%0.76576%0.764SS**  trans-161.376.4161.1-103.2-26000111.9T292T292-N294 PolarHBondContact O-N 3.17Å
295N29.8Very low30.5Very low168 Ų168146.4 Ų146.490%0.89877%0.772SS**  trans-162.975.1152.9-95.4-31.9000106.9I297N295-I297 PolarHBondContact O-N 3.45Å
296I30.1Very low30.7Very low146 Ų146143.2 Ų143.275%0.74976%0.762SS**  trans-77.2109-179.2-66.7176.7000108.9
297I32.6Very low30.9Very low128 Ų128144.8 Ų144.866%0.65676%0.763SS**  trans42.998.3141.2-49.9174.6000115.6N295 H299N295-I297 PolarHBondContact O-N 3.45Å; I297-H299 PolarHBondContact O-N 3.44Å
298D28.9Very low31.2Very low149 Ų149143.7 Ų143.780%0.79776%0.76SS**SBendtrans-62.1127.8152.2-95.9-46.9000109.8
299H29.3Very low31.2Very low182 Ų182143.3 Ų143.384%0.84375%0.754SS**SBendtrans42.481.3156.5-67.5-75000119I297I297-H299 PolarHBondContact O-N 3.44Å
300S28.2Very low31.2Very low91 Ų91142.9 Ų142.964%0.63675%0.747SS**  trans-162167.5140.353.20000112.5
301I33.5Very low31.2Very low163 Ų163145.3 Ų145.384%0.83675%0.749SS**  trans74.496.4174.1-50.1174.7000114.7
302H31.9Very low31.2Very low164 Ų164144.2 Ų144.276%0.75974%0.744SS**  trans-72.2157.2167.7-125.2-89.4000111.4
303N31.1Very low31.1Very low131 Ų131146.9 Ų146.970%0.70174%0.744SS**  trans65123.2161.3-51.6-21.2000117.7
304I33Very low31Very low148 Ų148147.7 Ų147.776%0.75975%0.747SS**  179.5117.6104.5-94.1166.6000109.4
305Y31.5Very low31.1Very low213 Ų213149.8 Ų149.884%0.83576%0.755SS**  trans63.6154.3163.2-76.4-126000118.6
306S31.1Very low30.9Very low84 Ų84150.3 Ų150.359%0.58775%0.749SS**  cis-171.6146.3-30.152.40000110.9
307N32.1Very low30.7Very low130 Ų130150.1 Ų150.170%0.69575%0.75SS**  trans73.7133.2157.6-6835.7000121.5
308E35Very low30.4Very low153 Ų153149.3 Ų149.372%0.71576%0.755SS**  trans62.596.6143.9-68152.2-124.600117.5
309E30.6Very low30.4Very low161 Ų161151 Ų15175%0.75276%0.758SS**  63.7105.870.7-60.3-164.2146.300114
310H33.2Very low30.2Very low150 Ų150148.9 Ų148.969%0.69475%0.753SS**  -179.4146.3101.5-94.1-71.7000113.2
311H33.7Very low30.1Very low158 Ų158151.6 Ų151.673%0.73177%0.765SS**  trans39.8110.8155.1-58.1-56.3000122.8
312L28.7Very low29.7Very low136 Ų136148.4 Ų148.471%0.71275%0.753SS**  51.3110.8108.1-149.384.3000119
313F30.2Very low29.4Very low188 Ų188147.3 Ų147.383%0.82575%0.751SS**  178.3132.9118.4-99.6-67000111.8
314P28Very low29.3Very low115 Ų115146 Ų14675%0.74776%0.759SS**  trans-102.7121.4176.934.8-28.5000113
315M29.9Very low29Very low187 Ų187144.4 Ų144.492%0.92176%0.756SS**  trans-141.3139.9168.2-90.4-109.2174.500114
316K27.2Very low28.7Very low179 Ų179141.8 Ų141.878%0.77876%0.757SS**  trans-33.2142.1177.4-74.6167.5169.1176.10119.5
317D26.1Very low28.6Very low143 Ų143144 Ų14477%0.76577%0.766SS**  32.9137.5121.4-50.9-25000121.1
318S26.2Very low28.4Very low110 Ų110142.3 Ų142.377%0.76977%0.765SS**  trans70.871.6159.7-61.80000117.6
319Q27.2Very low28Very low184 Ų184142.4 Ų142.486%0.8677%0.77SS**  trans-157.5167147.5-118146.8103.300113.3
320L26.6Very low28Very low139 Ų139140.3 Ų140.373%0.72877%0.773SS**  trans61.576.3175.7-84.870.3000117.4
321V25.4Very low27.8Very low147 Ų147141 Ų14189%0.89178%0.782SS**  -69.5111.4114.8171.90000106.9
322T26Very low27.7Very low96 Ų96140.8 Ų140.859%0.58979%0.786SS**  trans176.9119.4150.7-80.30000111.5
323I25.7Very low27.7Very low141 Ų141140.1 Ų140.172%0.72379%0.793SS**  trans30.6116.6144.1-48.9173.3000118.5T325I323-T325 HydrophobicContact CG2-CG2 4.48Å; I323-T325 WeakPolarHBondContact CG2-OG1 3.39Å
324A27.9Very low27.7Very low105 Ų105136.4 Ų136.487%0.86879%0.788SS**  trans-133.663.6156.100000110.8N326A324-N326 PolarHBondContact O-N 3.5Å
325T26.3Very low27.9Very low114 Ų114138.5 Ų138.570%0.69979%0.792SS**  trans-87.4101.3172.747.20000111.1I323I323-T325 HydrophobicContact CG2-CG2 4.48Å; I323-T325 WeakPolarHBondContact CG2-OG1 3.39Å
326N26.2Very low27.9Very low157 Ų157136.8 Ų136.884%0.8479%0.785SS**  trans176.7132.4158.4-85.3-28.8000103.8A324A324-N326 PolarHBondContact O-N 3.5Å
327V29.4Very low28Very low130 Ų130137.4 Ų137.479%0.78878%0.784SS**  -153.9106.954.6164.20000106.1
328S26.6Very low28.2Very low96 Ų96140.7 Ų140.767%0.67179%0.786SS**  92.7146.592.692.80000115
329N27.1Very low28.5Very low154 Ų154142 Ų14282%0.82478%0.784SS**  trans47.581.9164.5-63.4-0.8000120
330S31.2Very low29Very low117 Ų117139.6 Ų139.682%0.81878%0.776SS**  -167.2154.1120.643.40000112N332S330-N332 PolarHBondContact O-N 3.02Å; S330-N332 VanDerWaalsContact O-N 3.08Å
331N28Very low29.5Very low165 Ų165137.7 Ų137.788%0.88277%0.771SS**SBendtrans-77.991.2-173.4-65.3-23.9000111.9
332N31.8Very low30Very low153 Ų153137.4 Ų137.482%0.81877%0.765SS**  trans-162.6100.4160.2-94.1-40000109.8S330 P334S330-N332 PolarHBondContact O-N 3.02Å; S330-N332 VanDerWaalsContact O-N 3.08Å; N332-P334 VanDerWaalsContact O-CD 3.25Å; N332-P334 WeakPolarHBondContact O-CD 3.42Å
333S28Very low30.4Very low122 Ų122136.4 Ų136.485%0.85377%0.766SS**  trans-79.9115.4-173.6-56.30000112.8
334P30.3Very low30.6Very low111 Ų111136.6 Ų136.672%0.72177%0.768SS**  trans-76.2127.9167.531.6-32.5000110N332 I336N332-P334 VanDerWaalsContact O-CD 3.25Å; N332-P334 WeakPolarHBondContact O-CD 3.42Å; P334-I336 PolarHBondContact O-N 2.93Å; P334-I336 VanDerWaalsContact O-N 3.1Å
335L32Very low31.3Very low159 Ų159137.2 Ų137.283%0.83276%0.763SS**  trans-65.8107.6176.6-92.6151.3000110.9Y337L335-Y337 PolarHBondContact O-N 3.32Å
336I29.9Very low32.1Very low150 Ų150140.8 Ų140.877%0.76977%0.772SS**  trans-73.395.1176.5-57.5175000109.1P334 R338P334-I336 PolarHBondContact O-N 2.93Å; P334-I336 VanDerWaalsContact O-N 3.1Å; I336-R338 VanDerWaalsContact C-N 3.3Å; I336-R338 PolarHBondContact O-N 3.07Å
337Y31.2Very low33.1Very low193 Ų193137.7 Ų137.776%0.75776%0.755SS**  trans-6986.1168.5-95.1-92000110.8L335L335-Y337 PolarHBondContact O-N 3.32Å
338R29.3Very low35.3Very low211 Ų211134.5 Ų134.580%0.79674%0.738SS**  trans-65.3159152.1-80.1179.5166.4165.6-4.6109.2I336I336-R338 VanDerWaalsContact C-N 3.3Å; I336-R338 PolarHBondContact O-N 3.07Å
339N31.7Very low37.3Very low138 Ų138137.8 Ų137.874%0.73874%0.743SS**  trans74.778.1179.9-49.7-6000114.1P341N339-P341 VanDerWaalsContact C-CD 3.43Å
340I39.5Very low39.3Very low134 Ų134136.6 Ų136.669%0.68773%0.732SS**  trans-118.955.4163.2-41.8175.3000112.1A343I340-A343 HydrophobicContact CG2-CB 4Å
341P36.6Very low41.2Very low98 Ų98133 Ų13364%0.63670%0.702SS**SBendtrans-92.2-37.8151.9-11.328.9000112.2N339 A343N339-P341 VanDerWaalsContact C-CD 3.43Å; P341-A343 PolarHBondContact O-N 3.42Å
342D35.5Very low43.3Very low142 Ų142131 Ų13176%0.75969%0.687SS**THydrogen-bonded Turntrans-84.79.1-162.9-49.8-65.4000114.4
343A34.1Very low45.2Very low74 Ų74129.2 Ų129.261%0.61267%0.674SS**THydrogen-bonded Turntrans-96.8-1.2-173.100000114.7I340 P341I340-A343 HydrophobicContact CG2-CB 4Å; P341-A343 PolarHBondContact O-N 3.42Å
344L30.8Very low47.4Very low146 Ų146127 Ų12776%0.76465%0.652SS**SBendtrans-79.3129.2165.6-95.575.7000109.3Q346L344-Q346 PolarHBondContact O-N 3.34Å
345P42.5Very low49.4Very low117 Ų117125 Ų12576%0.7664%0.635SS**  trans-66.1109.3173.827.5-33.1000109.4L347P345-L347 PolarHBondContact O-N 2.87Å
346Q41.8Very low51.4Low189 Ų189119.7 Ų119.788%0.88361%0.614SS**PPolyproline II helixtrans-58123.1170.8-66.8-175.41.900108.8L344 C348L344-Q346 PolarHBondContact O-N 3.34Å; Q346-C348 PolarHBondContact O-N 3.29Å
347L47.1Very low53.6Low92 Ų92116.9 Ų116.948%0.48260%0.597SS.*PPolyproline II helixtrans-58.9126.7169.7-100.869.1000108.2P345 H351 L355P345-L347 PolarHBondContact O-N 2.87Å; L347-H351 HydrophobicContact CD2-CB 4.33Å; L347-H351 HydrophobicContact CG-CB 4.26Å; L347-L355 HydrophobicContact CD2-CD1 3.48Å; L347-L355 VanDerWaalsContact CD2-CD1 3.48Å
348C76.6Confident55.2Low64 Ų64113.3 Ų113.343%0.43259%0.587SS.*PPolyproline II helixtrans-62.2148.5172.570.10000109.6Q346 H350 H351 Q352Q346-C348 PolarHBondContact O-N 3.29Å; C348-H350 PolarHBondContact O-N 3.31Å; C348-H351 PolarHBondContact O-N 3.27Å; C348-Q352 PolarHBondContact O-N 2.81Å; C348-Q352 VanDerWaalsContact O-N 3.08Å
349Q69.3Low57Low165 Ų165110.5 Ų110.577%0.77158%0.578SS**Hα-helixtrans-51.4-35.3-176.1-71178.1-26.800112.7Q352 H353Q349-Q352 PolarHBondContact O-N 2.82Å; Q349-H353 WeakPolarHBondContact O-CB 3.47Å; Q349-H353 PolarHBondContact O-N 3.21Å
350H67.6Low58.7Low128 Ų128109.2 Ų109.259%0.59357%0.567SS**Hα-helixtrans-62.2-42.1175.1-177.964.4000113.3C348 H353 L354C348-H350 PolarHBondContact O-N 3.31Å; H350-H353 PolarHBondContact O-N 3.41Å; H350-L354 WeakPolarHBondContact O-CG 3.34Å; H350-L354 PolarHBondContact O-N 3.29Å
351H70.8Confident59.7Low42 Ų42109.3 Ų109.319%0.19457%0.565CS.*Hα-helixtrans-71.1-35.2177.3-142.891.5000111.8L347 C348 L354 L355L347-H351 HydrophobicContact CD2-CB 4.33Å; L347-H351 HydrophobicContact CG-CB 4.26Å; C348-H351 PolarHBondContact O-N 3.27Å; H351-L354 PolarHBondContact O-N 3.13Å; H351-L355 PolarHBondContact O-N 2.67Å; H351-L355 VanDerWaalsContact O-N 3.09Å
352Q72Confident60.5Low123 Ų123111 Ų11158%0.57557%0.565SS**Hα-helixtrans-65.3-39.6173.8-154.9172.220.100111.3C348 Q349 L355 A356C348-Q352 PolarHBondContact O-N 2.81Å; C348-Q352 VanDerWaalsContact O-N 3.08Å; Q349-Q352 PolarHBondContact O-N 2.82Å; Q352-L355 PolarHBondContact O-N 2.86Å; Q352-A356 PolarHBondContact O-N 3.08Å; Q352-A356 VanDerWaalsContact O-N 3.09Å
353H73.8Confident61.6Low115 Ų115110.9 Ų110.953%0.53256%0.56SS.*Hα-helixtrans-70.6-37176.5-161.6-18.6000112.9Q349 H350 A356 Q357Q349-H353 WeakPolarHBondContact O-CB 3.47Å; Q349-H353 PolarHBondContact O-N 3.21Å; H350-H353 PolarHBondContact O-N 3.41Å; H353-A356 PolarHBondContact O-N 3.17Å; H353-Q357 PolarHBondContact O-N 2.94Å
354L72.2Confident62.6Low75 Ų75115.2 Ų115.239%0.39357%0.567SS.*Hα-helixtrans-64-41.2173-79.5168.5000112.2H350 H351 Q357 Q358H350-L354 WeakPolarHBondContact O-CG 3.34Å; H350-L354 PolarHBondContact O-N 3.29Å; H351-L354 PolarHBondContact O-N 3.13Å; L354-Q357 PolarHBondContact O-N 2.98Å; L354-Q358 PolarHBondContact O-N 3.31Å; L354-Q358 VanDerWaalsContact O-N 3.07Å
355L73.2Confident63.4Low71 Ų71116.4 Ų116.437%0.37257%0.569SS.*Hα-helixtrans-63.8-41.7174.2-77.8168.3000111.7L347 H351 Q352 Q357 Q358 Y359L347-L355 HydrophobicContact CD2-CD1 3.48Å; L347-L355 VanDerWaalsContact CD2-CD1 3.48Å; H351-L355 PolarHBondContact O-N 2.67Å; H351-L355 VanDerWaalsContact O-N 3.09Å; Q352-L355 PolarHBondContact O-N 2.86Å; L355-Q357 PolarHBondContact O-N 3.41Å; L355-Q358 PolarHBondContact O-N 3.2Å; L355-Y359 WeakPolarHBondContact O-CD2 3.2Å; L355-Y359 PolarHBondContact O-N 3.4Å
356A74.9Confident63.2Low46 Ų46118.3 Ų118.338%0.3857%0.567SS.*Hα-helixtrans-57.1-47.8174.300000111.6Q352 H353 Q358 Y359 E360Q352-A356 PolarHBondContact O-N 3.08Å; Q352-A356 VanDerWaalsContact O-N 3.09Å; H353-A356 PolarHBondContact O-N 3.17Å; A356-Q358 VanDerWaalsContact C-N 3.33Å; A356-Q358 PolarHBondContact O-N 3.36Å; A356-Y359 PolarHBondContact O-N 3.13Å; A356-Y359 VanDerWaalsContact O-N 3.08Å; A356-E360 WeakPolarHBondContact O-CG 3.49Å; A356-E360 PolarHBondContact O-N 3.2Å
357Q74.5Confident62.9Low92 Ų92115.4 Ų115.443%0.4357%0.565SS.*Hα-helixtrans-61.5-36177.2-74.1-179.2-16.400113.3H353 L354 L355 E360 Q361H353-Q357 PolarHBondContact O-N 2.94Å; L354-Q357 PolarHBondContact O-N 2.98Å; L355-Q357 PolarHBondContact O-N 3.41Å; Q357-E360 PolarHBondContact O-N 3.39Å; Q357-Q361 WeakPolarHBondContact O-CG 3.31Å; Q357-Q361 PolarHBondContact O-N 3.35Å
358Q65.8Low62.2Low117 Ų117120 Ų12055%0.54758%0.584SS.*Hα-helixtrans-66.8-36.9173.5-71.4-153.9-81.600112.7L354 L355 A356 Q362L354-Q358 PolarHBondContact O-N 3.31Å; L354-Q358 VanDerWaalsContact O-N 3.07Å; L355-Q358 PolarHBondContact O-N 3.2Å; A356-Q358 VanDerWaalsContact C-N 3.33Å; A356-Q358 PolarHBondContact O-N 3.36Å; Q358-Q362 WeakPolarHBondContact O-CG 3.44Å; Q358-Q362 PolarHBondContact O-N 3.42Å
359Y66.6Low60.3Low152 Ų152126.5 Ų126.560%0.59661%0.608SS**Hα-helixtrans-68.1-41.6174.9-89.7-76.4000112L355 A356 Q362 Q363L355-Y359 WeakPolarHBondContact O-CD2 3.2Å; L355-Y359 PolarHBondContact O-N 3.4Å; A356-Y359 PolarHBondContact O-N 3.13Å; A356-Y359 VanDerWaalsContact O-N 3.08Å; Y359-Q362 PolarHBondContact O-N 2.98Å; Y359-Q363 WeakPolarHBondContact O-CG 3.37Å; Y359-Q363 PolarHBondContact O-N 2.92Å
360E67.9Low58.7Low111 Ų111127.7 Ų127.752%0.51961%0.614SS.*Hα-helixtrans-60-45.8175.1-70176139.600111.8A356 Q357 Q362 Q363 Q364A356-E360 WeakPolarHBondContact O-CG 3.49Å; A356-E360 PolarHBondContact O-N 3.2Å; Q357-E360 PolarHBondContact O-N 3.39Å; E360-Q362 VanDerWaalsContact C-N 3.31Å; E360-Q362 PolarHBondContact O-N 2.84Å; E360-Q363 PolarHBondContact O-N 2.82Å; E360-Q364 WeakPolarHBondContact O-CG 3.11Å; E360-Q364 PolarHBondContact O-N 2.95Å; E360-Q364 VanDerWaalsContact O-N 3.08Å
361Q59.5Low57Low137 Ų137127.1 Ų127.164%0.6462%0.621SS**Hα-helixtrans-63.8-31.8177.3-75-173.71.100113.5Q357Q357-Q361 WeakPolarHBondContact O-CG 3.31Å; Q357-Q361 PolarHBondContact O-N 3.35Å
362Q54.4Low55.4Low134 Ų134134.5 Ų134.563%0.62666%0.656SS**Hα-helixtrans-74.4-34.5175-73-175.72400112.5Q358 Y359 E360Q358-Q362 WeakPolarHBondContact O-CG 3.44Å; Q358-Q362 PolarHBondContact O-N 3.42Å; Y359-Q362 PolarHBondContact O-N 2.98Å; E360-Q362 VanDerWaalsContact C-N 3.31Å; E360-Q362 PolarHBondContact O-N 2.84Å
363Q58.4Low53.6Low139 Ų139134.1 Ų134.165%0.6566%0.664SS**Hα-helixtrans-71.2-34.6177.1-70-178.123.200112.4Y359 E360 Q365 Q366Y359-Q363 WeakPolarHBondContact O-CG 3.37Å; Y359-Q363 PolarHBondContact O-N 2.92Å; E360-Q363 PolarHBondContact O-N 2.82Å; Q363-Q365 PolarHBondContact O-N 3.46Å; Q363-Q365 VanDerWaalsContact O-N 3.08Å; Q363-Q366 PolarHBondContact O-N 3.01Å
364Q55.1Low52Low165 Ų165134.4 Ų134.477%0.77168%0.676SS**THydrogen-bonded Turntrans-67.6-4.8177.7-71.1-177.810.500114.9E360E360-Q364 WeakPolarHBondContact O-CG 3.11Å; E360-Q364 PolarHBondContact O-N 2.95Å; E360-Q364 VanDerWaalsContact O-N 3.08Å
365Q46.8Very low49.9Very low171 Ų171138.5 Ų138.580%0.79970%0.697SS**THydrogen-bonded Turntrans-1027.4174.2-64.1-167.85.800114.3Q363Q363-Q365 PolarHBondContact O-N 3.46Å; Q363-Q365 VanDerWaalsContact O-N 3.08Å
366Q38.2Very low47.8Very low156 Ų156141.8 Ų141.873%0.72971%0.714SS**SBendtrans-104.2131.5172.4-69-167.9-10.600112Q363Q363-Q366 PolarHBondContact O-N 3.01Å
367P36.8Very low45.6Very low128 Ų128145.5 Ų145.583%0.83173%0.732SS**  trans-59.6144.5168.1-23.634.9000112.1
368Q31.4Very low43.2Very low189 Ų189148.8 Ų148.888%0.88375%0.751SS**  trans-61.9139.1-170.2-60.9172.4-9.300114.2
369Q36.2Very low41.3Very low200 Ų200149 Ų14994%0.93576%0.76SS**  trans-149.3158.1141-111.9166.625.500110.8
370Q35.8Very low39.4Very low191 Ų191149 Ų14989%0.89377%0.771SS**  trans-83.3167.4-150-89.1178.1-38.800116.7
371P33.2Very low37.5Very low115 Ų115149.5 Ų149.575%0.74778%0.781SS**  trans-105.3163-156.840-36.3000116
372Q35.9Very low35.9Very low197 Ų197152.3 Ų152.392%0.92180%0.797SS**  trans-154.4125.4154.1-110.9175.52400111.7
373P35.2Very low34.7Very low115 Ų115155.7 Ų155.775%0.74781%0.809SS**  trans-115.7177.9172.140.8-32.1000112.4
374P39.9Very low33.2Very low122 Ų122159 Ų15979%0.79282%0.816SS**  cis-129.6-164.7-36.737.8-21.3000111.5
375L27.5Very low32Very low160 Ų160156.6 Ų156.684%0.83881%0.809SS**  trans135160.3140.7-159.964.9000114.3
376I30.7Very low31.2Very low140 Ų140157.8 Ų157.872%0.71881%0.806SS**  trans84.980.1169.1-45.6-175.9000116.6
377T27Very low30.8Very low125 Ų125156.7 Ų156.777%0.76781%0.805SS**  57.7124.3120.3-45.40000120.9
378I25Very low30.5Very low161 Ų161158.7 Ų158.783%0.82680%0.801SS**  trans-79.8113.7170.5-57.5157.5000110
379T24.9Very low30.4Very low121 Ų121155 Ų15574%0.74279%0.791SS**  trans170.1109.6136.837.30000108.4
380D27.7Very low30.1Very low152 Ų152152.9 Ų152.981%0.81379%0.786SS**  -169.1159127.4-126-41.3000115.5
381T27Very low29.9Very low121 Ų121149.5 Ų149.574%0.74278%0.779SS**  trans-27.5157.4174.146.50000121.9K383T381-K383 PolarHBondContact O-N 3.41Å; T381-K383 VanDerWaalsContact O-N 3.13Å
382M26.5Very low29.8Very low196 Ų196149.6 Ų149.697%0.96678%0.779SS**  trans-50.4106.4175.5-57.3177.4-172.700114.1
383K28.9Very low29.6Very low205 Ų205151.3 Ų151.389%0.89178%0.777SS**  trans-104.1106.9166.5-126.5165.4-170.8165.90112.3T381 N385T381-K383 PolarHBondContact O-N 3.41Å; T381-K383 VanDerWaalsContact O-N 3.13Å; K383-N385 VanDerWaalsContact C-N 3.34Å; K383-N385 PolarHBondContact O-N 3.21Å
384R28Very low29.5Very low209 Ų209155.8 Ų155.879%0.78979%0.785SS**  trans-69.674.2-172-168.8-171.9-158.31697.7112.6R386R384-R386 VanDerWaalsContact C-N 3.33Å; R384-R386 PolarHBondContact O-N 3.13Å
385N28.6Very low28.9Very low115 Ų115159.1 Ų159.162%0.61579%0.787SS**  trans-72.281.7-176.1-164.8-1.5000113.3K383 N387K383-N385 VanDerWaalsContact C-N 3.34Å; K383-N385 PolarHBondContact O-N 3.21Å; N385-N387 VanDerWaalsContact C-N 3.27Å; N385-N387 PolarHBondContact O-N 3.04Å
386R31.8Very low29Very low195 Ų195160 Ų16074%0.73679%0.787SS**  trans-74.676.3164.6-75.7179.1166.4173.2-5.4109.9R384R384-R386 VanDerWaalsContact C-N 3.33Å; R384-R386 PolarHBondContact O-N 3.13Å
387N29.8Very low28.8Very low133 Ų133158.7 Ų158.771%0.71179%0.786SS**  trans-178.494.6150.6-93.6-20.3000111N385N385-N387 VanDerWaalsContact C-N 3.27Å; N385-N387 PolarHBondContact O-N 3.04Å
388F30.4Very low28.9Very low171 Ų171159.6 Ų159.675%0.7579%0.785SS**  trans-133.370.7161.3-90.4-74000110.3
389T27.7Very low29Very low110 Ų110157 Ų15768%0.67578%0.777SS**  trans-58.7163.4142.741.40000109.5
390N30.1Very low29.1Very low156 Ų156156.9 Ų156.983%0.83478%0.778SS**  trans69.659.8-179.8-53.4-17.5000116.1
391V31.7Very low29.1Very low121 Ų121154.8 Ų154.873%0.73377%0.771SS**  trans-99.4127149.1179.70000107.8R393V391-R393 PolarHBondContact O-N 2.97Å; V391-R393 VanDerWaalsContact O-N 3.12Å
392P31.4Very low29.4Very low117 Ų117154.6 Ų154.676%0.7677%0.769SS**  trans-68.5112.1-17526.5-34000111.2F394P392-F394 PolarHBondContact O-N 3.37Å
393R30.9Very low29.5Very low232 Ų232151.9 Ų151.988%0.87576%0.759SS**  trans-63.3125165.5-75.8-173177.8-1761.7108.8V391 K395V391-R393 PolarHBondContact O-N 2.97Å; V391-R393 VanDerWaalsContact O-N 3.12Å; R393-K395 PolarHBondContact O-N 2.93Å
394F33.1Very low29.5Very low210 Ų210150.9 Ų150.992%0.92176%0.755SS**  trans-54.2113.2159.3-99.7-95.4000108.6P392 Q396P392-F394 PolarHBondContact O-N 3.37Å; F394-Q396 VanDerWaalsContact C-N 3.34Å; F394-Q396 PolarHBondContact O-N 3.35Å
395K28.6Very low29.7Very low192 Ų192147.7 Ų147.784%0.83575%0.753SS**  trans-7291.8170.4-71.1-174.9179.4-179.30108.3R393 T397R393-K395 PolarHBondContact O-N 2.93Å; K395-T397 VanDerWaalsContact C-N 3.3Å; K395-T397 PolarHBondContact O-N 3.28Å
396Q28.8Very low29.9Very low177 Ų177150.8 Ų150.883%0.82776%0.764SS**  trans-67.497.8155.8-81.9-173.1-47.400107.5F394 I398F394-Q396 VanDerWaalsContact C-N 3.34Å; F394-Q396 PolarHBondContact O-N 3.35Å; Q396-I398 VanDerWaalsContact C-N 3.34Å; Q396-I398 PolarHBondContact O-N 2.96Å
397T26.5Very low29.8Very low114 Ų114149.3 Ų149.370%0.69977%0.77SS**  trans-67.493173-55.90000109K395 T399K395-T397 VanDerWaalsContact C-N 3.3Å; K395-T397 PolarHBondContact O-N 3.28Å; T397-T399 HydrophobicContact CG2-CG2 4.36Å
398I29.5Very low29.8Very low144 Ų144151.6 Ų151.674%0.73877%0.774SS**  trans-85.1105.1161.3-56.9175.4000105.6Q396 P400Q396-I398 VanDerWaalsContact C-N 3.34Å; Q396-I398 PolarHBondContact O-N 2.96Å; I398-P400 WeakPolarHBondContact O-CD 3.46Å
399T26.8Very low29.8Very low107 Ų107150.3 Ų150.366%0.65677%0.772SS**  trans-74.7113.5176.511.60000110.3T397T397-T399 HydrophobicContact CG2-CG2 4.36Å
400P26.5Very low29.8Very low118 Ų118152.6 Ų152.677%0.76678%0.78SS**  trans-106.464.9-179.735.3-19.2000109.5I398I398-P400 WeakPolarHBondContact O-CD 3.46Å
401T28.4Very low29.8Very low108 Ų108153.9 Ų153.966%0.66378%0.778SS**  trans-134.771.7-17054.50000112.5
402T33.5Very low29.7Very low116 Ų116153 Ų15371%0.71278%0.778SS**  trans-11163.9161.553.20000109.4F404T402-F404 VanDerWaalsContact C-N 3.33Å; T402-F404 HydrophobicContact CG2-CE2 4.29Å; T402-F404 PolarHBondContact O-N 3.32Å; T402-F404 VanDerWaalsContact O-N 3.11Å
403N29.2Very low29.6Very low139 Ų139154.5 Ų154.574%0.74378%0.778SS**  trans-79.983.5172.4-169.920.8000108.9N405N403-N405 PolarHBondContact O-N 3.43Å
404F28.7Very low29.7Very low184 Ų184149.7 Ų149.781%0.80777%0.774SS**THydrogen-bonded Turntrans-72.588.9-179.6-77.7-82.2000111T402T402-F404 VanDerWaalsContact C-N 3.33Å; T402-F404 HydrophobicContact CG2-CE2 4.29Å; T402-F404 PolarHBondContact O-N 3.32Å; T402-F404 VanDerWaalsContact O-N 3.11Å
405N30.7Very low29.6Very low142 Ų142146.8 Ų146.876%0.75977%0.768SS**THydrogen-bonded Turntrans-153.6-20.9165.5-99.3-33.2000115.2N403N403-N405 PolarHBondContact O-N 3.43Å
406E32.7Very low29.4Very low180 Ų180142.7 Ų142.784%0.84176%0.764SS**SBendtrans-125.476-174.4-67.4-175.1119.200113.4
407L30.4Very low29.6Very low164 Ų164143.4 Ų143.486%0.85976%0.764SS**  trans-161.459.1155.3-117.4161.8000112.7
408F29.4Very low29.8Very low182 Ų182143.9 Ų143.980%0.79876%0.763SS**  trans-65.8156.5157.6-103.3-94.9000110.4
409M30.5Very low30Very low144 Ų144144.9 Ų144.971%0.70976%0.764SS**  trans60.288.7175.2-44.4-49.1-179.100114.4
410N28.2Very low30.3Very low158 Ų158144.5 Ų144.585%0.84577%0.766SS**  -173.3164.476.6-92.9-58.8000113.4
411K29.7Very low30.8Very low183 Ų183144 Ų14480%0.79677%0.765SS**  trans82.865.6155.4-150.1175.4-170.3174.70119
412S30.9Very low31.1Very low103 Ų103145.3 Ų145.372%0.7277%0.768SS**  -62.2139.4121.147.30000107.9
413I29Very low31.2Very low148 Ų148147.1 Ų147.176%0.75977%0.768SS**  cis58.162.341.5-44.8-179.3000110.4
414T32.3Very low31.3Very low131 Ų131147.8 Ų147.880%0.80477%0.77SS**PPolyproline II helixtrans-82.2145.2149.8300000109.4
415D30.7Very low31.7Very low149 Ų149147.1 Ų147.180%0.79777%0.773SS**PPolyproline II helixtrans-69.7161.2-175.3-63.3-79.6000114.3F417D415-F417 PolarHBondContact O-N 2.79Å
416S25.9Very low31.8Very low106 Ų106146.5 Ų146.574%0.74177%0.77SS**PPolyproline II helixtrans-64.6120.4173.552.80000112.4
417F32Very low32Very low191 Ų191145.1 Ų145.184%0.83877%0.768SS**  trans-153.8119.8149.2-107.8-69.8000113.2D415D415-F417 PolarHBondContact O-N 2.79Å
418N30.9Very low32.2Very low124 Ų124143.1 Ų143.166%0.66376%0.758SS**  trans61.9134.8150.9-75.6-5.9000123.8
419Q33Very low32.7Very low166 Ų166140.8 Ų140.878%0.77675%0.754SS**  trans82103.4139.1-73.6175.610.600121.6
420S33.5Very low33.1Very low98 Ų98139.7 Ų139.769%0.68575%0.751SS**  89.3114.5119.5-56.20000121.3
421S37.8Very low33.6Very low107 Ų107137.9 Ų137.975%0.74874%0.741SS**  trans68.9149.7134.9570000120.4
422L33.8Very low34.1Very low137 Ų137135.4 Ų135.472%0.71774%0.737SS**  cis-162.5158.6-9.5-112.9166.4000109.7
423Q35.6Very low34.5Very low154 Ų154136.8 Ų136.872%0.7274%0.736SS**  trans58.5132.4158.7-75.6151.4-6.500118.7
424I31.2Very low34.8Very low152 Ų152136.5 Ų136.578%0.77974%0.736SS**  cis75.5114.438.1-54.2162.6000113.7
425I37.4Very low35.1Very low171 Ų171138.2 Ų138.288%0.87774%0.737SS**  trans-168.8157.6133-99.5155.9000109.4
426N33.1Very low35.2Very low129 Ų129136.9 Ų136.969%0.6974%0.735SS**  trans-138.6152.5-169.6179.635.3000109.8
427N35.9Very low35.7Very low151 Ų151137.5 Ų137.581%0.80774%0.736SS**  trans169.8171.4156.9-92.4-20.3000112.8
428N36.3Very low36.1Very low122 Ų122133.6 Ų133.665%0.65273%0.73SS**  -167167.8-71.2-14018.5000110.4
429N38.6Very low36.1Very low132 Ų132134.7 Ų134.771%0.70674%0.735SS**  trans69.2154.2167.8-50.8-4.5000115
430N39.4Very low36.1Very low122 Ų122133.9 Ų133.965%0.65273%0.733SS**  cis-162.2-175.3-7.9-112.829.5000106.9
431D39.3Very low36.1Very low120 Ų120135.6 Ų135.664%0.64273%0.734SS**  cis-152.9127.40.4-111.2-51.1000105.7
432N39.7Very low35.9Very low131 Ų131138.9 Ų138.970%0.70174%0.738SS**  83.7136.790.3-90.7-37.2000119.9
433N39.4Very low35.8Very low132 Ų132137.5 Ų137.571%0.70674%0.737SS**  trans90100.6156-57.9-34.5000123.7
434N34.5Very low35.7Very low141 Ų141138 Ų13875%0.75474%0.743SS**  40.4124125-52.5-22000120.5
435M38.9Very low35.6Very low167 Ų167137.8 Ų137.882%0.82374%0.744SS**  -174.7158.364.7-85.6-156.8178.200114.1
436T33Very low35.1Very low122 Ų122134 Ų13475%0.74873%0.732SS**  trans51.3124.8151.850.30000123.3
437P37.3Very low34.9Very low118 Ų118136.1 Ų136.177%0.76674%0.738SS**  trans-87.9-173.5157.942.3-37.2000110.8
438P39.1Very low34.5Very low110 Ų110136.2 Ų136.271%0.71473%0.733SS**  cis-144.8-169.614.243.7-22.9000118
439L31.7Very low34.3Very low147 Ų147139.8 Ų139.877%0.7774%0.739SS**  trans108.1130.4142.5-13483.5000120.8
440M33.2Very low33.8Very low148 Ų148144.7 Ų144.773%0.72975%0.748SS**  trans67.4124.1153.1-89.7179.9170.600123.1
441N33.1Very low33.4Very low135 Ų135145 Ų14572%0.72275%0.754SS**  trans70.3144.2142.3-59.4-0.3000118.4
442E32.8Very low33.2Very low176 Ų176146.9 Ų146.982%0.82276%0.763SS**  cis-144.1176.1-0.3-119.7-156.2109.700110.2
443P33.2Very low33Very low107 Ų107147.2 Ų147.270%0.69577%0.77SS**  trans-98140.3-158.436.7-36.6000117
444I32.9Very low33.2Very low164 Ų164143.6 Ų143.684%0.84176%0.763SS**  trans-135100.6165-59-176.2000112.2
445N28.2Very low33.6Very low149 Ų149145 Ų14580%0.79777%0.766SS**  trans58153137-118-23000124.7
446S27.7Very low34.1Very low92 Ų92142 Ų14264%0.64376%0.761SS**  trans67.697.7153.6460000122.6
447Q28.1Very low35Very low173 Ų173141.1 Ų141.181%0.80876%0.755SS**  84.7153.9128.9-60.3-166.813.500122.9
448Q29.2Very low35.4Very low152 Ų152138.3 Ų138.371%0.7174%0.742SS**  trans91.5144.3153.6-79.4-179.333.700122
449Y31.5Very low36.1Very low197 Ų197137.1 Ų137.177%0.77373%0.733SS**  trans52.796.7173.7-68.7-71.6000122.2
450R27.3Very low37.1Very low235 Ų235133 Ų13389%0.88772%0.721SS**  trans-60134.2146.3-77.3176.8166-178.6-4.1110.9
451T30.6Very low38.6Very low129 Ų129130.8 Ų130.879%0.79172%0.715SS**  trans-119.184.5165.132.90000111
452I36.7Very low40.3Very low160 Ų160129.3 Ų129.382%0.82171%0.711SS**  trans-136.890.5167.9-55.6174.2000108.3
453T35.6Very low42.1Very low137 Ų137127.3 Ų127.384%0.8470%0.703SS**  trans-142.8150-178.542.30000111
454G42.1Very low43.8Very low56 Ų56125.2 Ų125.258%0.57770%0.695SS**SBendtrans111-70.5166.600000117.2S456 T457G454-S456 PolarHBondContact O-N 3.34Å; G454-T457 PolarHBondContact O-OG1 3.11Å
455Q43.4Very low45.5Very low172 Ų172120.3 Ų120.380%0.80468%0.678SS**Hα-helixtrans-72.1-22.2-153.1-67.2-177.9-12.300117.6T459Q455-T459 PolarHBondContact O-OG1 3Å
456S49.7Very low47.5Very low103 Ų103115.5 Ų115.572%0.7266%0.659SS**Hα-helixtrans-76.1-36.6-172.7-162.70000113.4G454 A460G454-S456 PolarHBondContact O-N 3.34Å; S456-A460 PolarHBondContact O-N 3.14Å
457T51Low49.5Very low103 Ų103114 Ų11463%0.63265%0.652SS**Hα-helixtrans-71.7-41.5-177.6430000112.7G454 T459 A460 V461G454-T457 PolarHBondContact O-OG1 3.11Å; T457-T459 VanDerWaalsContact C-N 3.35Å; T457-T459 PolarHBondContact O-N 3.25Å; T457-A460 PolarHBondContact O-N 3.02Å; T457-V461 WeakPolarHBondContact O-CG2 3.41Å; T457-V461 PolarHBondContact O-N 3.45Å
458A46.7Very low51.4Low59 Ų59108.7 Ų108.749%0.48864%0.638SS.*Hα-helixtrans-58.7-46.2176.700000111.8A460 V461 V462A458-A460 VanDerWaalsContact C-N 3.33Å; A458-A460 PolarHBondContact O-N 3.42Å; A458-V461 PolarHBondContact O-N 2.94Å; A458-V462 WeakPolarHBondContact O-CG2 3.45Å; A458-V462 PolarHBondContact O-N 3.33Å
459T54.4Low53.4Low85 Ų85104 Ų10452%0.52163%0.626SS.*Hα-helixtrans-60.3-40.7178.1-52.60000112.1Q455 T457 M463Q455-T459 PolarHBondContact O-OG1 3Å; T457-T459 VanDerWaalsContact C-N 3.35Å; T457-T459 PolarHBondContact O-N 3.25Å; T459-M463 WeakPolarHBondContact O-CB 3.3Å; T459-M463 PolarHBondContact O-N 3.21Å; T459-M463 VanDerWaalsContact O-N 3.14Å
460A52.9Low55.3Low62 Ų62100.2 Ų100.251%0.51262%0.618SS.*Hα-helixtrans-66.4-4217700000112.7S456 T457 A458 M463 A464S456-A460 PolarHBondContact O-N 3.14Å; T457-A460 PolarHBondContact O-N 3.02Å; A458-A460 VanDerWaalsContact C-N 3.33Å; A458-A460 PolarHBondContact O-N 3.42Å; A460-M463 PolarHBondContact O-N 3.47Å; A460-A464 WeakPolarHBondContact O-CB 3.42Å; A460-A464 PolarHBondContact O-N 3.26Å
461V62.7Low57.1Low101 Ų10192.1 Ų92.161%0.61260%0.601SS**Hα-helixtrans-64.6-45.8178.6171.30000111.4T457 A458 M463 A464 A465T457-V461 WeakPolarHBondContact O-CG2 3.41Å; T457-V461 PolarHBondContact O-N 3.45Å; A458-V461 PolarHBondContact O-N 2.94Å; V461-M463 VanDerWaalsContact C-N 3.32Å; V461-M463 PolarHBondContact O-N 2.6Å; V461-A464 PolarHBondContact O-N 3.5Å; V461-A465 WeakPolarHBondContact O-CB 3.49Å; V461-A465 PolarHBondContact O-N 2.86Å
462V70.3Confident58.8Low104 Ų10489.1 Ų89.163%0.6359%0.589SS**Hα-helixtrans-61.8-41177.4173.70000111.3A458 A465 A466A458-V462 WeakPolarHBondContact O-CG2 3.45Å; A458-V462 PolarHBondContact O-N 3.33Å; V462-A465 PolarHBondContact O-N 2.79Å; V462-A466 WeakPolarHBondContact O-CB 3.26Å; V462-A466 PolarHBondContact O-N 3.46Å
463M70.6Confident60.1Low133 Ų13388.1 Ų88.166%0.65558%0.581SS**Hα-helixtrans-69.2-35.2179.1-161.4175.7-61.700112.7T459 A460 V461 A467T459-M463 WeakPolarHBondContact O-CB 3.3Å; T459-M463 PolarHBondContact O-N 3.21Å; T459-M463 VanDerWaalsContact O-N 3.14Å; A460-M463 PolarHBondContact O-N 3.47Å; V461-M463 VanDerWaalsContact C-N 3.32Å; V461-M463 PolarHBondContact O-N 2.6Å; M463-A467 WeakPolarHBondContact O-CB 3.3Å; M463-A467 PolarHBondContact O-N 2.89Å; M463-A467 VanDerWaalsContact O-N 3.08Å
464A67.6Low61.1Low63 Ų6384.9 Ų84.952%0.52157%0.569SS.*Hα-helixtrans-67.5-43.2173.200000112.2A460 V461 A467 A468A460-A464 WeakPolarHBondContact O-CB 3.42Å; A460-A464 PolarHBondContact O-N 3.26Å; V461-A464 PolarHBondContact O-N 3.5Å; A464-A467 PolarHBondContact O-N 2.75Å; A464-A468 PolarHBondContact O-N 3.07Å
465A69.7Low61.5Low61 Ų6186.9 Ų86.950%0.50457%0.573SS.*Hα-helixtrans-62.5-42.9176.100000112.1V461 V462 A467 A468 A469V461-A465 WeakPolarHBondContact O-CB 3.49Å; V461-A465 PolarHBondContact O-N 2.86Å; V462-A465 PolarHBondContact O-N 2.79Å; A465-A467 PolarHBondContact O-N 2.77Å; A465-A468 PolarHBondContact O-N 3.44Å; A465-A469 PolarHBondContact O-N 3.28Å
466A70.5Confident62Low48 Ų4884 Ų8440%0.39757%0.568SS.*Hα-helixtrans-62.1-41.417500000112.3V462 A469 I470V462-A466 WeakPolarHBondContact O-CB 3.26Å; V462-A466 PolarHBondContact O-N 3.46Å; A466-A469 PolarHBondContact O-N 3Å; A466-I470 WeakPolarHBondContact O-CG1 3.34Å; A466-I470 PolarHBondContact O-N 2.81Å; A466-I470 VanDerWaalsContact O-N 3.09Å
467A68.6Low61.8Low60 Ų6086.1 Ų86.150%0.49657%0.57SS.*Hα-helixtrans-63.5-40.5175.900000112.4M463 A464 A465 I470 A471M463-A467 WeakPolarHBondContact O-CB 3.3Å; M463-A467 PolarHBondContact O-N 2.89Å; M463-A467 VanDerWaalsContact O-N 3.08Å; A464-A467 PolarHBondContact O-N 2.75Å; A465-A467 PolarHBondContact O-N 2.77Å; A467-I470 PolarHBondContact O-N 2.9Å; A467-A471 WeakPolarHBondContact O-CB 3.42Å; A467-A471 PolarHBondContact O-N 2.91Å
468A68.5Low61.2Low62 Ų6287.2 Ų87.251%0.51258%0.577SS.*Hα-helixtrans-64.9-42.4176.100000112.4A464 A465 I470 A471 A472A464-A468 PolarHBondContact O-N 3.07Å; A465-A468 PolarHBondContact O-N 3.44Å; A468-I470 PolarHBondContact O-N 3.01Å; A468-A471 PolarHBondContact O-N 2.96Å; A468-A472 PolarHBondContact O-N 2.93Å
469A71.3Confident60.7Low55 Ų5593.6 Ų93.646%0.45559%0.594SS.*Hα-helixtrans-62.8-4217700000112.5A465 A466 A472 Q473A465-A469 PolarHBondContact O-N 3.28Å; A466-A469 PolarHBondContact O-N 3Å; A469-A472 PolarHBondContact O-N 2.82Å; A469-Q473 PolarHBondContact O-N 3.4Å; A469-Q473 VanDerWaalsContact O-N 3.12Å
470I71.6Confident59.8Low116 Ų11695.4 Ų95.460%0.59561%0.605SS**Hα-helixtrans-66.3-39.7176.2-66.8166.2000110.9A466 A467 A468 A472 Q473 A474A466-I470 WeakPolarHBondContact O-CG1 3.34Å; A466-I470 PolarHBondContact O-N 2.81Å; A466-I470 VanDerWaalsContact O-N 3.09Å; A467-I470 PolarHBondContact O-N 2.9Å; A468-I470 PolarHBondContact O-N 3.01Å; I470-A472 VanDerWaalsContact C-N 3.35Å; I470-A472 PolarHBondContact O-N 3.09Å; I470-Q473 PolarHBondContact O-N 3.12Å; I470-A474 WeakPolarHBondContact O-CB 3.38Å; I470-A474 PolarHBondContact O-N 2.89Å
471A64.4Low59.1Low66 Ų66100 Ų10055%0.54562%0.621SS.*Hα-helixtrans-63.5-38.8175.800000112.5A467 A468 A474 S475A467-A471 WeakPolarHBondContact O-CB 3.42Å; A467-A471 PolarHBondContact O-N 2.91Å; A468-A471 PolarHBondContact O-N 2.96Å; A471-A474 PolarHBondContact O-N 2.93Å; A471-S475 PolarHBondContact O-N 3.19Å
472A65.8Low57.8Low65 Ų65102.4 Ų102.454%0.53763%0.63SS.*Hα-helixtrans-63.8-43.917500000112.2A468 A469 I470 S475A468-A472 PolarHBondContact O-N 2.93Å; A469-A472 PolarHBondContact O-N 2.82Å; I470-A472 VanDerWaalsContact C-N 3.35Å; I470-A472 PolarHBondContact O-N 3.09Å; A472-S475 WeakPolarHBondContact O-CB 3.16Å; A472-S475 PolarHBondContact O-N 3.03Å
473Q65.4Low56.2Low139 Ų139103.2 Ų103.265%0.6564%0.638SS**Hα-helixtrans-71-29.8177.7-69.9-176.4-5.900113.5A469 I470 S475 T476A469-Q473 PolarHBondContact O-N 3.4Å; A469-Q473 VanDerWaalsContact O-N 3.12Å; I470-Q473 PolarHBondContact O-N 3.12Å; Q473-S475 PolarHBondContact O-N 2.86Å; Q473-T476 PolarHBondContact O-N 3.36Å; Q473-T476 PolarHBondContact O-OG1 3.31Å; Q473-T476 VanDerWaalsContact O-OG1 3.11Å
474A56.8Low54.5Low70 Ų70104.7 Ų104.758%0.57965%0.648SS**Hα-helixtrans-65.6-22.3174.400000113I470 A471I470-A474 WeakPolarHBondContact O-CB 3.38Å; I470-A474 PolarHBondContact O-N 2.89Å; A471-A474 PolarHBondContact O-N 2.93Å
475S50.4Low53.1Low97 Ų97108.3 Ų108.368%0.67866%0.658SS**THydrogen-bonded Turntrans-79.1-21.2-179.2-159.20000113.8A471 A472 Q473A471-S475 PolarHBondContact O-N 3.19Å; A472-S475 WeakPolarHBondContact O-CB 3.16Å; A472-S475 PolarHBondContact O-N 3.03Å; Q473-S475 PolarHBondContact O-N 2.86Å
476T52.9Low51.5Low112 Ų112112.3 Ų112.369%0.68768%0.676SS**SBendtrans-951-171.556.10000114.8Q473Q473-T476 PolarHBondContact O-N 3.36Å; Q473-T476 PolarHBondContact O-OG1 3.31Å; Q473-T476 VanDerWaalsContact O-OG1 3.11Å
477L44.7Very low49.9Very low147 Ų147114.7 Ų114.777%0.7769%0.69SS**SBendtrans-115.631.3-169.8-80.9167.9000115.3
478T39.3Very low48.4Very low126 Ų126120.9 Ų120.977%0.77371%0.711SS**  trans-136.876.2171.747.90000113.3
479K37.2Very low46.9Very low193 Ų193124 Ų12484%0.83972%0.718SS**  trans-147.4112.1155.7-124.3173.7-174.6178.50113.5
480T34.2Very low45.3Very low124 Ų124129.4 Ų129.476%0.76174%0.737SS**  trans47.4114.3147.2540000119.8
481N38.5Very low43.5Very low159 Ų159130.4 Ų130.485%0.8574%0.744SS**  trans-147.2139.2131.2-108.8-21.1000111.2
482N35.4Very low42.2Very low150 Ų150132.3 Ų132.380%0.80275%0.753SS**  trans54.6122173.4-66.50.1000120.4
483P35.9Very low40.9Very low121 Ų121134.5 Ų134.579%0.78676%0.76SS**  trans-91.3157.6158.537.3-31.9000111.6
484L36.8Very low39.5Very low165 Ų165134.8 Ų134.886%0.86477%0.766SS**  trans-155.7148.1150.9-144.577.3000112.7
485N37.4Very low38.6Very low139 Ų139137.4 Ų137.474%0.74378%0.78SS**  trans-27.1132.8172.9-54.8-23.4000117.3
486T36.2Very low38Very low144 Ų144139.4 Ų139.488%0.88378%0.783SS**  -150.6138104.4-18.30000111.1
487S36.4Very low37.2Very low98 Ų98142 Ų14269%0.68579%0.792SS**  trans-86.5148.517650.10000111.9
488M37.4Very low36.7Very low190 Ų190142.3 Ų142.394%0.93679%0.787SS**  trans-140.3127.4149.1-161165.6-72.200109.1
489I36.1Very low36.9Very low129 Ų129143.9 Ų143.966%0.66279%0.789SS**  trans-105.5131.3-170.3-61.8159.2000108.7
490I39.1Very low37Very low167 Ų167140.9 Ų140.986%0.85678%0.782SS**  trans-140.9118.2153.8-59.7-175.3000107.7
491D32.4Very low37.1Very low137 Ų137142.7 Ų142.773%0.73378%0.782SS**  trans-81.6148.7173.5-72.2-74.5000112.7
492S38.8Very low37.2Very low106 Ų106140.6 Ų140.674%0.74178%0.777SS**  trans-158.676.2150.453.20000113.6
493T38.6Very low37.3Very low112 Ų112141.6 Ų141.669%0.68777%0.774SS**  trans46.5121.7135.657.80000121.3
494N35.1Very low37.6Very low145 Ų145142.5 Ų142.578%0.77578%0.777SS**  trans74.991.6134.4-55.8-9.1000120.2
495S38.7Very low37.6Very low125 Ų125142.3 Ų142.387%0.87478%0.776SS**  trans-135.3100134.353.60000110.6
496L36.3Very low37.9Very low139 Ų139144.3 Ų144.373%0.72878%0.78SS**  trans-85.4134.2175.6-78.8157.8000110.4F498L496-F498 HydrophobicContact CD2-CE2 4.17Å
497L36.7Very low38Very low167 Ų167145 Ų14587%0.87477%0.773SS**  trans-154.5130.8149.2-127.6154.3000110.8
498F34Very low38Very low153 Ų153145.2 Ų145.267%0.67177%0.771SS**  trans-92.5156.6-176.2-72.7-106.6000112.2L496L496-F498 HydrophobicContact CD2-CE2 4.17Å
499I44.2Very low37.9Very low159 Ų159142.1 Ų142.182%0.81576%0.758SS**  trans-174.198.5138.3-90.4144.5000104.1
500N39.9Very low37.9Very low130 Ų130143.8 Ų143.870%0.69577%0.768SS**  74.7108.579.3-74.510.2000114.3
501E35.9Very low37.9Very low162 Ų162141.5 Ų141.576%0.75776%0.757SS**  trans-69163.8156.7-146.2-176.2-148.400109.5
502P40.5Very low38.4Very low115 Ų115141.7 Ų141.775%0.74776%0.758SS**  -150.5174.692.840.2-23.3000115.7
503K37.3Very low38.6Very low171 Ų171144.7 Ų144.774%0.74376%0.764SS**  trans-84.2156.7164.1-63.4171.8-180170.60111.8
504T40.9Very low38.9Very low139 Ų139146.2 Ų146.285%0.85377%0.768SS**  trans-139.8145.9158.228.80000111
505I38.5Very low39.1Very low161 Ų161144.4 Ų144.483%0.82677%0.766SS**  trans-142.2102.5175.9-61.2174.2000107.8
506E42.2Very low39.2Very low181 Ų181146.5 Ų146.585%0.84676%0.762SS**  trans-159.7158.7174.3-77.2-169.1174.600108.8
507Q38.3Very low39.5Very low158 Ų158146.9 Ų146.974%0.73876%0.764SS**  cis-158.7145.5-43-138.9-179.4-88.700110.2
508T37.2Very low39.5Very low104 Ų104145.3 Ų145.364%0.63876%0.756SS**  trans11.8139.5156.252.20000124.3
509N34.5Very low40.1Very low125 Ų125144 Ų14467%0.66876%0.76SS**  trans76.8119.1141.1-69.227.7000122.8
510L37.7Very low40Very low163 Ų163149.8 Ų149.885%0.85378%0.779SS**  -171.5110.5121.8-122.262.6000105.3
511D39.3Very low40Very low119 Ų119150.8 Ų150.864%0.63678%0.784SS**  76.4128.164.8-64.3-40.3000114.3
512D41.6Very low40.3Very low141 Ų141150.2 Ų150.275%0.75479%0.785SS**  trans48.1123.6169-69.7-34.2000122.2
513I44.1Very low40.2Very low169 Ų169152.1 Ų152.187%0.86779%0.787SS**  -161.2130.1104.4-97.4156.6000110.3
514N43Very low40.4Very low144 Ų144151 Ų15177%0.7779%0.79SS**  trans-86.3137168.1-79.7-70.8000110.7
515C40.1Very low40.4Very low108 Ų108151.8 Ų151.873%0.7379%0.786SS**  trans-169.6115.7136-104.40000107.3
516E42.1Very low40.5Very low168 Ų168151.1 Ų151.179%0.78578%0.783SS**  8891.284.5-166.1167.2-151.300109.8
517L41.2Very low40.4Very low148 Ų148149 Ų14978%0.77578%0.778SS**  77.8125.461-167.877.1000112.5
518L38Very low40.5Very low134 Ų134148.3 Ų148.370%0.70278%0.782SS**  trans68.1113.5163.6-76.1162.8000120.6
519T45.9Very low40.8Very low124 Ų124152 Ų15276%0.76179%0.794SS**  trans59.596.3138.354.90000120.3
520K42.5Very low41.4Very low281 Ų281154.5 Ų154.5100%1.22281%0.805SS**  -151.50108.8-122.4172.4-176173.10112.4

Retrieved 520 of 520 residues in 189.4 ms (Link to these results)