A0A087YA58_POEFO Loading...

b(0,+)-type amino acid transporter 1

AlphaFold DB , UniProt , Accession A0A087YA58, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 496 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
1M30.7Very low27Very low240 Ų240146.3 Ų146.3100%1.18281%0.807SS**  076.40-77.4175.1162.700105.6
2E27.3Very low26.9Very low175 Ų175148.1 Ų148.182%0.81882%0.815SS**  74.3132.168.8-157.1178.5-133.100111.4
3T28.1Very low26.7Very low136 Ų136142.4 Ų142.483%0.83481%0.811SS**  trans120.695.4175.462.90000109.8
4D26.9Very low27.8Very low146 Ų146141 Ų14178%0.78181%0.81SS**  cis76.410838-131.511.5000114.4
5S26.8Very low27.9Very low93 Ų93141.3 Ų141.365%0.6582%0.815SS**  trans95.3137.6130.281.70000122.5
6I28.4Very low28.1Very low151 Ų151141.3 Ų141.377%0.77481%0.812SS**  trans96.296.9145.4-45.3-170.9000120.7
7S25.4Very low28.3Very low103 Ų103145.2 Ų145.272%0.7282%0.817SS**  42.9126.5118.6-174.90000121.2
8K26.9Very low28.4Very low210 Ų210145.9 Ų145.991%0.91382%0.819SS**  trans-155.4143.5130-108.6169.1-172.3179.30112
9A25.2Very low28.4Very low91 Ų91141.2 Ų141.275%0.75281%0.806SS**  trans-96.3-180-168.100000113.4
10S25.6Very low28.7Very low96 Ų96140.6 Ų140.667%0.67181%0.808SS**  trans91135.9153.7-157.40000115.5
11Q25.1Very low29Very low168 Ų168142.1 Ų142.179%0.78581%0.812SS**  cis-173.3150.7-2.5-111.1166.41.200105.6
12N26.4Very low29Very low168 Ų168139.5 Ų139.590%0.89880%0.797SS**  trans176.1109137.4-87.5-12.7000109.1
13G23.9Very low29.2Very low74 Ų74140.5 Ų140.576%0.76380%0.799SS**  trans-96.4-154.9165.500000110.9
14P42.6Very low29.3Very low123 Ų123143.7 Ų143.780%0.79980%0.801SS**  cis-129.7163.8-25.838.2-23.3000112.1
15T29Very low29.3Very low145 Ų145147.4 Ų147.489%0.8980%0.804SS**  trans-155.8119.9146.839.70000110.3
16D30.5Very low29.6Very low142 Ų142148.4 Ų148.476%0.75981%0.809SS**  trans-48.8135.3169.1-73.1-44.5000113.3
17K31.4Very low30Very low207 Ų207150.1 Ų150.190%0.981%0.813SS**  -148.8101.3127.4-73.7-157.4178.6175.60109.2G19K17-G19 PolarHBondContact O-N 3.5Å
18D31.3Very low30.3Very low159 Ų159152.8 Ų152.885%0.8581%0.812SS**  trans-55.7112.8162.2-78-45.4000110.6
19G28.9Very low30.6Very low55 Ų55146.4 Ų146.457%0.56780%0.798SS**  trans-109.8135.3154.200000107.3K17 L21K17-G19 PolarHBondContact O-N 3.5Å; G19-L21 PolarHBondContact O-N 3.3Å
20P32.8Very low31.2Very low130 Ų130147.6 Ų147.684%0.84480%0.797SS**  trans-62.4117.4-176.123.8-29.7000108.9E22P20-E22 VanDerWaalsContact C-N 3.29Å; P20-E22 PolarHBondContact O-N 3Å
21L34.8Very low31.8Very low173 Ų173148.5 Ų148.591%0.90680%0.798SS**  trans-51.698.9165.6-81.3157.2000107.5G19 K23G19-L21 PolarHBondContact O-N 3.3Å; L21-K23 VanDerWaalsContact C-N 3.29Å; L21-K23 PolarHBondContact O-N 3.24Å
22E31.3Very low32.9Very low185 Ų185143.8 Ų143.886%0.86478%0.777SS**  trans-58.399.8169.6-147.8176.9-164.600105.5P20 K24P20-E22 VanDerWaalsContact C-N 3.29Å; P20-E22 PolarHBondContact O-N 3Å; E22-K24 PolarHBondContact O-N 2.73Å
23K31.1Very low34Very low196 Ų196140.6 Ų140.685%0.85276%0.757SS**  trans-5299.5166.1-93.5178.1174.4173.20105.2L21 R25L21-K23 VanDerWaalsContact C-N 3.29Å; L21-K23 PolarHBondContact O-N 3.24Å; K23-R25 PolarHBondContact O-N 2.72Å
24K31.2Very low35.7Very low202 Ų202142.3 Ų142.388%0.87875%0.745SS**  trans-51.4100.6160.3-89.1-175.1174.4-177.80104.9E22E22-K24 PolarHBondContact O-N 2.73Å
25R27.3Very low36.8Very low224 Ų224141.5 Ų141.585%0.84573%0.734SS**  trans-50.1131.6166.1-70.3177.3-179.2-179.70.4104.2K23 E27K23-R25 PolarHBondContact O-N 2.72Å; R25-E27 PolarHBondContact O-N 3.2Å
26P32.1Very low38.8Very low115 Ų115135.6 Ų135.675%0.74770%0.697SS**  trans-55.4114.4169.224.4-29.7000104.9K28P26-K28 VanDerWaalsContact C-N 3.34Å; P26-K28 PolarHBondContact O-N 2.83Å
27E36.8Very low41.1Very low186 Ų186130 Ų13087%0.86967%0.673SS**  trans-49.5112.4164-82.1175.9152.600103.9R25 A29R25-E27 PolarHBondContact O-N 3.2Å; E27-A29 PolarHBondContact O-N 3.41Å
28K31.8Very low43.4Very low159 Ų159122.7 Ų122.769%0.69164%0.644SS**  trans-61.191.7175.6-81.4-177171.4-170.40105P26 T30P26-K28 VanDerWaalsContact C-N 3.34Å; P26-K28 PolarHBondContact O-N 2.83Å; K28-T30 PolarHBondContact O-N 3.14Å
29A34.1Very low45.6Very low77 Ų77122.1 Ų122.164%0.63664%0.64SS**  trans-47.7132.317000000106.6E27 V31E27-A29 PolarHBondContact O-N 3.41Å; A29-V31 PolarHBondContact O-N 2.94Å
30T37.9Very low47.7Very low116 Ų116122.5 Ų122.571%0.71263%0.633SS**SBendtrans-64.348.9-172.438.90000112.9K28K28-T30 PolarHBondContact O-N 3.14Å
31V37.1Very low49.7Very low115 Ų115116.3 Ų116.370%0.69759%0.593SS**PPolyproline II helixtrans-80.4121.5160.7-176.30000105.9A29 Q33A29-V31 PolarHBondContact O-N 2.94Å; V31-Q33 PolarHBondContact O-N 3.47Å
32L48Very low51.9Low68 Ų68109.2 Ų109.236%0.35656%0.556SS.*PPolyproline II helixtrans-51.7116.6172-78.4147000108.4Q34 E254 R336L32-Q34 PolarHBondContact O-N 2.88Å; L32-E254 HydrophobicContact CB-CG 4.02Å; L32-E254 HydrophobicContact CD2-CG 4.19Å; L32-R336 VanDerWaalsContact CD1-NH1 3.32Å
33Q50.7Low54.1Low102 Ų102103.1 Ų103.148%0.47753%0.534SS..PPolyproline II helixtrans-68.1129.3-175.1-58.3-155.5-75.900108.5V31 D35V31-Q33 PolarHBondContact O-N 3.47Å; Q33-D35 WeakPolarHBondContact CB-OD2 3.5Å; Q33-D35 PolarHBondContact O-N 3.19Å
34Q59.7Low56.2Low109 Ų10996.4 Ų96.451%0.50951%0.507SS..  trans-71.576.7174-72.5-179.9-12.300109.8L32 E253 E254 K256L32-Q34 PolarHBondContact O-N 2.88Å; Q34-E253 WeakPolarHBondContact CG-O 3.33Å; Q34-E254 CarbonylContact C-O 2.88Å; Q34-E254 VanDerWaalsContact CA-O 3.31Å; Q34-E254 WeakPolarHBondContact CA-O 3.22Å; Q34-K256 HydrophobicContact CB-CG 4.32Å; Q34-K256 WeakPolarHBondContact O-CE 3.32Å; Q34-K256 WeakPolarHBondContact O-CG 3.32Å
35D65.8Low58.4Low106 Ų10686.8 Ų86.857%0.56747%0.465SS*.  trans-97.5-17.9-173.9-73.1-25.3000112.7Q33 G37 E254Q33-D35 WeakPolarHBondContact CB-OD2 3.5Å; Q33-D35 PolarHBondContact O-N 3.19Å; D35-G37 PolarHBondContact O-N 3.08Å; D35-E254 PolarHBondContact N-O 3Å
36I69.8Low61Low22 Ų2276.5 Ų76.511%0.11343%0.427CS..BIsolated β-bridgetrans-86.4109.9-170.8-53.5178000110.7I251 E254 L255 K256I36-I251 HydrophobicContact CD1-CD1 3.8Å; I36-E254 HydrophobicContact CD1-CB 3.96Å; I36-E254 HydrophobicContact CG1-CB 4.4Å; I36-E254 PolarHBondContact N-O 2.99Å; I36-E254 VanDerWaalsContact N-O 3.14Å; I36-L255 HydrophobicContact CB-CD2 4.09Å; I36-L255 HydrophobicContact CG2-CD2 3.7Å; I36-K256 PolarHBondContact O-N 3.5Å
37G79.7Confident63Low25 Ų2571.1 Ų71.126%0.25839%0.393SS..  trans-83.4175.7172.700000113.8D35 L39 S40 G41D35-G37 PolarHBondContact O-N 3.08Å; G37-L39 PolarHBondContact O-N 3.11Å; G37-S40 PolarHBondContact O-N 2.94Å; G37-G41 PolarHBondContact O-N 2.93Å
38L78.6Confident64.9Low53 Ų5363.4 Ų63.428%0.27736%0.358SS..Hα-helixtrans-56.3-48.8-177.3178.663.8000113.7S40 G41 I42 N261 L264 A265L38-S40 VanDerWaalsContact C-N 3.31Å; L38-S40 PolarHBondContact O-N 2.98Å; L38-G41 PolarHBondContact O-N 3.24Å; L38-I42 HydrophobicContact CD1-CD1 4.25Å; L38-I42 HydrophobicContact CD1-CG1 4.45Å; L38-I42 HydrophobicContact CG-CD1 4.09Å; L38-I42 WeakPolarHBondContact O-CG1 3.18Å; L38-I42 PolarHBondContact O-N 2.76Å; L38-N261 HydrophobicContact CB-CB 4.5Å; L38-N261 HydrophobicContact CD1-CB 4.18Å; L38-L264 HydrophobicContact CD1-CB 3.78Å; L38-L264 HydrophobicContact CD2-CD1 4.46Å; L38-A265 HydrophobicContact CD1-CB 4.22Å
39L77.3Confident67.3Low147 Ų14756 Ų5677%0.7733%0.326SS*.Hα-helixtrans-63.1-39179.7-74.9169.5000112G37 I42 S43G37-L39 PolarHBondContact O-N 3.11Å; L39-I42 PolarHBondContact O-N 3.42Å; L39-S43 WeakPolarHBondContact O-CB 3.26Å; L39-S43 PolarHBondContact O-N 3.19Å
40S74.6Confident69.7Low62 Ų6252.4 Ų52.443%0.43430%0.296SS..Hα-helixtrans-67-38.6175.2-176.90000111.1G37 L38 S43 L44G37-S40 PolarHBondContact O-N 2.94Å; L38-S40 VanDerWaalsContact C-N 3.31Å; L38-S40 PolarHBondContact O-N 2.98Å; S40-S43 PolarHBondContact O-N 3.4Å; S40-L44 WeakPolarHBondContact O-CB 3.44Å; S40-L44 PolarHBondContact O-N 2.69Å
41G74.9Confident71.7Confident0 Ų047.1 Ų47.10%027%0.265CS..Hα-helixtrans-62.9-43.517300000113.4G37 L38 L44 I45G37-G41 PolarHBondContact O-N 2.93Å; L38-G41 PolarHBondContact O-N 3.24Å; G41-L44 PolarHBondContact O-N 3.41Å; G41-I45 PolarHBondContact O-N 2.84Å
42I80.8Confident73.7Confident24 Ų2441.8 Ų41.812%0.12323%0.233CC..Hα-helixtrans-62.1-48.7173.9-66164.1000110L38 L39 L44 I45 V46 A265 I268L38-I42 HydrophobicContact CD1-CD1 4.25Å; L38-I42 HydrophobicContact CD1-CG1 4.45Å; L38-I42 HydrophobicContact CG-CD1 4.09Å; L38-I42 WeakPolarHBondContact O-CG1 3.18Å; L38-I42 PolarHBondContact O-N 2.76Å; L39-I42 PolarHBondContact O-N 3.42Å; I42-L44 PolarHBondContact O-N 2.87Å; I42-I45 PolarHBondContact O-N 2.89Å; I42-V46 HydrophobicContact CG2-CG2 4.15Å; I42-V46 WeakPolarHBondContact O-CB 3.18Å; I42-V46 VanDerWaalsContact O-CG2 3.28Å; I42-V46 WeakPolarHBondContact O-CG2 3.48Å; I42-V46 PolarHBondContact O-N 3.18Å; I42-A265 HydrophobicContact CG1-CB 4.02Å; I42-I268 HydrophobicContact CD1-CB 4.26Å; I42-I268 HydrophobicContact CD1-CD1 4.09Å; I42-I268 HydrophobicContact CD1-CG2 4.08Å
43S76.4Confident75.5Confident57 Ų5738.7 Ų38.740%0.39922%0.218SC..Hα-helixtrans-60-34.4178.3-174.70000112.2L39 S40 G47L39-S43 WeakPolarHBondContact O-CB 3.26Å; L39-S43 PolarHBondContact O-N 3.19Å; S40-S43 PolarHBondContact O-N 3.4Å; S43-G47 WeakPolarHBondContact O-CA 3.49Å; S43-G47 PolarHBondContact O-N 3.21Å
44L74.7Confident77.4Confident55 Ų5533.9 Ų33.929%0.28820%0.195SC..Hα-helixtrans-70.4-47.5177.4-169.9138.2000110.9S40 G41 I42 V46 G47 T48 L248 I251S40-L44 WeakPolarHBondContact O-CB 3.44Å; S40-L44 PolarHBondContact O-N 2.69Å; G41-L44 PolarHBondContact O-N 3.41Å; I42-L44 PolarHBondContact O-N 2.87Å; L44-V46 PolarHBondContact O-N 2.8Å; L44-G47 PolarHBondContact O-N 3.21Å; L44-T48 HydrophobicContact CD2-CG2 4.3Å; L44-T48 HydrophobicContact CG-CG2 4.44Å; L44-T48 WeakPolarHBondContact O-CB 3.37Å; L44-T48 VanDerWaalsContact O-CG2 3.3Å; L44-T48 WeakPolarHBondContact O-CG2 3.35Å; L44-T48 PolarHBondContact O-N 3.43Å; L44-T48 PolarHBondContact O-OG1 3.24Å; L44-L248 HydrophobicContact CD2-CD1 3.86Å; L44-I251 HydrophobicContact CD1-CD1 3.76Å; L44-I251 HydrophobicContact CD2-CD1 3.9Å; L44-I251 HydrophobicContact CG-CD1 4.48Å
45I78.4Confident78.7Confident0 Ų028.8 Ų28.80%017%0.171CC..Hα-helixtrans-57.4-51.3174.7-71.2177.1000110.8G41 I42 G47 T48 M49 L248 A265 I266G41-I45 PolarHBondContact O-N 2.84Å; I42-I45 PolarHBondContact O-N 2.89Å; I45-G47 VanDerWaalsContact C-N 3.32Å; I45-G47 PolarHBondContact O-N 3.16Å; I45-T48 PolarHBondContact O-N 2.75Å; I45-T48 PolarHBondContact O-OG1 2.75Å; I45-T48 VanDerWaalsContact O-OG1 3.1Å; I45-M49 HydrophobicContact CG2-CG 4.32Å; I45-M49 HydrophobicContact CG2-SD 3.61Å; I45-M49 WeakPolarHBondContact O-CB 3.4Å; I45-M49 VanDerWaalsContact O-CG 3.3Å; I45-M49 WeakPolarHBondContact O-CG 3.33Å; I45-M49 PolarHBondContact O-N 2.82Å; I45-L248 HydrophobicContact CD1-CB 4.32Å; I45-L248 HydrophobicContact CD1-CD2 3.61Å; I45-L248 HydrophobicContact CD1-CG 4.45Å; I45-L248 HydrophobicContact CG1-CB 4.08Å; I45-L248 HydrophobicContact CG1-CD1 4.41Å; I45-L248 HydrophobicContact CG1-CD2 4.03Å; I45-L248 HydrophobicContact CG1-CG 4.39Å; I45-A265 HydrophobicContact CD1-CB 3.86Å; I45-I266 HydrophobicContact CD1-CG1 3.86Å
46V80.8Confident79.7Confident8 Ų824.4 Ų24.45%0.04815%0.148CC..Hα-helixtrans-63.3-43.1-178.6174.70000109.9I42 L44 T48 I50 L195 L272 V273I42-V46 HydrophobicContact CG2-CG2 4.15Å; I42-V46 WeakPolarHBondContact O-CB 3.18Å; I42-V46 VanDerWaalsContact O-CG2 3.28Å; I42-V46 WeakPolarHBondContact O-CG2 3.48Å; I42-V46 PolarHBondContact O-N 3.18Å; L44-V46 PolarHBondContact O-N 2.8Å; V46-T48 PolarHBondContact O-N 3.29Å; V46-I50 HydrophobicContact CG1-CD1 3.57Å; V46-I50 HydrophobicContact CG1-CG1 4.21Å; V46-I50 WeakPolarHBondContact O-CB 3.13Å; V46-I50 VanDerWaalsContact O-CG1 3.29Å; V46-I50 WeakPolarHBondContact O-CG1 3.34Å; V46-I50 PolarHBondContact O-N 3.09Å; V46-L195 HydrophobicContact CG1-CD2 3.9Å; V46-L272 HydrophobicContact CG2-CD2 4.17Å; V46-V273 HydrophobicContact CB-CG2 4.44Å; V46-V273 HydrophobicContact CG1-CG2 4.29Å; V46-V273 HydrophobicContact CG2-CG2 4.19Å
47G75.8Confident80.7Confident2 Ų223.4 Ų23.42%0.02114%0.142CC..Hα-helixtrans-70.3-26.6-179.500000114.7S43 L44 I45 K194S43-G47 WeakPolarHBondContact O-CA 3.49Å; S43-G47 PolarHBondContact O-N 3.21Å; L44-G47 PolarHBondContact O-N 3.21Å; I45-G47 VanDerWaalsContact C-N 3.32Å; I45-G47 PolarHBondContact O-N 3.16Å; G47-K194 PolarHBondContact O-NZ 3.31Å
48T75.9Confident81.3Confident24 Ų2422.2 Ų22.215%0.14713%0.13CC..Hα-helixtrans-86-38.9175.554.80000112.6L44 I45 V46 G244L44-T48 HydrophobicContact CD2-CG2 4.3Å; L44-T48 HydrophobicContact CG-CG2 4.44Å; L44-T48 WeakPolarHBondContact O-CB 3.37Å; L44-T48 VanDerWaalsContact O-CG2 3.3Å; L44-T48 WeakPolarHBondContact O-CG2 3.35Å; L44-T48 PolarHBondContact O-N 3.43Å; L44-T48 PolarHBondContact O-OG1 3.24Å; I45-T48 PolarHBondContact O-N 2.75Å; I45-T48 PolarHBondContact O-OG1 2.75Å; I45-T48 VanDerWaalsContact O-OG1 3.1Å; V46-T48 PolarHBondContact O-N 3.29Å; T48-G244 PolarHBondContact OG1-O 3.44Å
49M81.6Confident81.8Confident4 Ų422.8 Ų22.82%0.0213%0.131CC..Hα-helixtrans-72.1-47.4178.2-72.1-179.974.500111.9I45 G51 Y242 W245 I270 V273 Y277I45-M49 HydrophobicContact CG2-CG 4.32Å; I45-M49 HydrophobicContact CG2-SD 3.61Å; I45-M49 WeakPolarHBondContact O-CB 3.4Å; I45-M49 VanDerWaalsContact O-CG 3.3Å; I45-M49 WeakPolarHBondContact O-CG 3.33Å; I45-M49 PolarHBondContact O-N 2.82Å; M49-G51 PolarHBondContact O-N 3.1Å; M49-Y242 HydrophobicContact CE-CD1 3.69Å; M49-Y242 HydrophobicContact CE-CG 4.37Å; M49-Y242 VanDerWaalsContact CE-O 3.23Å; M49-Y242 WeakPolarHBondContact CE-O 3.16Å; M49-W245 HydrophobicContact CE-CB 4.28Å; M49-W245 HydrophobicContact CG-CB 4.47Å; M49-W245 HydrophobicContact SD-CB 3.91Å; M49-I270 HydrophobicContact CE-CG1 4.37Å; M49-I270 HydrophobicContact CE-CG2 4.05Å; M49-I270 HydrophobicContact SD-CG1 4.03Å; M49-V273 HydrophobicContact CB-CG1 4.39Å; M49-V273 HydrophobicContact CB-CG2 4.33Å; M49-V273 HydrophobicContact CE-CB 4.48Å; M49-V273 HydrophobicContact CE-CG1 4.26Å; M49-V273 HydrophobicContact SD-CG2 4.42Å; M49-Y277 PolarHBondContact O-OH 2.87Å
50I84.3Confident82.4Confident1 Ų116 Ų161%0.00510%0.095CC..SBendtrans-70.7101.6174.9-61-176.2000107.8V46 K194 L195 I198 V273 Y277V46-I50 HydrophobicContact CG1-CD1 3.57Å; V46-I50 HydrophobicContact CG1-CG1 4.21Å; V46-I50 WeakPolarHBondContact O-CB 3.13Å; V46-I50 VanDerWaalsContact O-CG1 3.29Å; V46-I50 WeakPolarHBondContact O-CG1 3.34Å; V46-I50 PolarHBondContact O-N 3.09Å; I50-K194 HydrophobicContact CB-CD 4.22Å; I50-K194 HydrophobicContact CG2-CD 3.99Å; I50-K194 HydrophobicContact CG2-CG 4.39Å; I50-K194 WeakPolarHBondContact O-CD 3.01Å; I50-K194 WeakPolarHBondContact O-CE 3.48Å; I50-K194 PolarHBondContact O-NZ 2.92Å; I50-L195 HydrophobicContact CD1-CD2 3.9Å; I50-I198 HydrophobicContact CB-CD1 4.44Å; I50-I198 HydrophobicContact CD1-CD1 4.02Å; I50-I198 HydrophobicContact CG1-CD1 4.49Å; I50-I198 HydrophobicContact CG2-CD1 3.18Å; I50-V273 HydrophobicContact CD1-CG2 4.18Å; I50-V273 HydrophobicContact CG1-CG1 4.09Å; I50-V273 HydrophobicContact CG1-CG2 3.92Å; I50-Y277 WeakPolarHBondContact CA-OH 3.45Å; I50-Y277 HydrophobicContact CG1-CE1 4.12Å
51G80.9Confident83.1Confident5 Ų513 Ų135%0.0528%0.075CC..SBendtrans-140.8-141.1-178.300000113.1M49 G53 F55 S326M49-G51 PolarHBondContact O-N 3.1Å; G51-G53 PolarHBondContact O-N 2.86Å; G51-F55 WeakPolarHBondContact O-CD2 3.43Å; G51-F55 WeakPolarHBondContact O-CE2 3.46Å; G51-S326 WeakPolarHBondContact CA-OG 3.43Å
52S79.7Confident83.8Confident3 Ų313.1 Ų13.12%0.0218%0.075CC..SBendtrans-70.9-20.6176.159.30000113.4I54 F55 I56 S140 T323S52-I54 PolarHBondContact O-N 2.8Å; S52-F55 PolarHBondContact O-N 3.17Å; S52-F55 VanDerWaalsContact O-N 3.11Å; S52-I56 PolarHBondContact O-N 3.17Å; S52-S140 VanDerWaalsContact CB-CB 3.48Å; S52-S140 WeakPolarHBondContact CB-OG 3.4Å; S52-S140 PolarHBondContact OG-OG 3.4Å; S52-T323 VanDerWaalsContact CB-CG2 3.5Å
53G85.8Confident84.2Confident4 Ų416.8 Ų16.84%0.0419%0.094CC..Hα-helixtrans-59.4-46.1-172.500000114G51 F55 I56 S57G51-G53 PolarHBondContact O-N 2.86Å; G53-F55 PolarHBondContact O-N 3.39Å; G53-F55 VanDerWaalsContact O-N 3.11Å; G53-I56 PolarHBondContact O-N 2.87Å; G53-I56 VanDerWaalsContact O-N 3.16Å; G53-S57 WeakPolarHBondContact O-CB 3.24Å; G53-S57 PolarHBondContact O-N 3.14Å; G53-S57 PolarHBondContact O-OG 2.84Å; G53-S57 VanDerWaalsContact O-OG 3.06Å
54I89.1Confident84.7Confident0 Ų015.7 Ų15.70%08%0.082CC..Hα-helixtrans-63.9-19.7179.6-167.754.3000113.4S52 P58 W75 Y277 V280S52-I54 PolarHBondContact O-N 2.8Å; I54-P58 WeakPolarHBondContact O-CD 3.29Å; I54-P58 WeakPolarHBondContact O-CG 3.23Å; I54-W75 HydrophobicContact CD1-CH2 3.64Å; I54-W75 HydrophobicContact CD1-CZ2 4.08Å; I54-W75 HydrophobicContact CD1-CZ3 3.96Å; I54-Y277 HydrophobicContact CB-CD1 3.98Å; I54-Y277 HydrophobicContact CB-CE1 3.63Å; I54-Y277 HydrophobicContact CD1-CD1 3.65Å; I54-Y277 HydrophobicContact CD1-CD2 4.3Å; I54-Y277 HydrophobicContact CD1-CE1 4.2Å; I54-Y277 HydrophobicContact CD1-CG 3.69Å; I54-Y277 HydrophobicContact CG1-CD1 3.65Å; I54-Y277 HydrophobicContact CG1-CE1 3.85Å; I54-Y277 HydrophobicContact CG1-CG 4.22Å; I54-Y277 HydrophobicContact CG2-CE1 4.12Å; I54-V280 HydrophobicContact CD1-CG1 4.29Å; I54-V280 HydrophobicContact CG1-CB 4.4Å; I54-V280 HydrophobicContact CG1-CG1 3.95Å
55F87.3Confident85.2Confident2 Ų213.1 Ų13.11%0.0097%0.069CC..Hα-helixtrans-91.6-18-179.4-58.4-58.9000112.9G51 S52 G53 Y144 I197 I201 A300 V319G51-F55 WeakPolarHBondContact O-CD2 3.43Å; G51-F55 WeakPolarHBondContact O-CE2 3.46Å; S52-F55 PolarHBondContact O-N 3.17Å; S52-F55 VanDerWaalsContact O-N 3.11Å; G53-F55 PolarHBondContact O-N 3.39Å; G53-F55 VanDerWaalsContact O-N 3.11Å; F55-Y144 HydrophobicContact CB-CE1 4.45Å; F55-Y144 HydrophobicContact CB-CE2 3.69Å; F55-Y144 WeakPolarHBondContact CB-OH 3.23Å; F55-Y144 PolarHBondContact O-OH 3.37Å; F55-I197 HydrophobicContact CZ-CG2 4.4Å; F55-I201 HydrophobicContact CE1-CD1 4.4Å; F55-A300 HydrophobicContact CD1-CB 3.8Å; F55-A300 HydrophobicContact CE1-CB 4.25Å; F55-V319 HydrophobicContact CB-CG1 4.22Å; F55-V319 HydrophobicContact CD1-CG1 4.39Å; F55-V319 HydrophobicContact CD1-CG2 3.92Å; F55-V319 HydrophobicContact CD2-CG1 3.66Å; F55-V319 HydrophobicContact CD2-CG2 4.29Å; F55-V319 HydrophobicContact CE1-CG2 3.73Å; F55-V319 HydrophobicContact CE2-CB 4.48Å; F55-V319 HydrophobicContact CE2-CG1 4.07Å; F55-V319 HydrophobicContact CE2-CG2 4.13Å; F55-V319 HydrophobicContact CG-CG1 3.83Å; F55-V319 HydrophobicContact CG-CG2 4.19Å; F55-V319 HydrophobicContact CZ-CG2 3.84Å
56I87.5Confident85.4Confident15 Ų1515.2 Ų15.28%0.0779%0.09CC..Hα-helixtrans-110.6-46.3-178.9-70.9175.7000111.7S52 G53 P58 K59 S140 Y144 I381 I385S52-I56 PolarHBondContact O-N 3.17Å; G53-I56 PolarHBondContact O-N 2.87Å; G53-I56 VanDerWaalsContact O-N 3.16Å; I56-P58 VanDerWaalsContact C-N 3.34Å; I56-K59 PolarHBondContact O-N 2.86Å; I56-S140 WeakPolarHBondContact CD1-OG 3.49Å; I56-Y144 HydrophobicContact CG1-CE2 4.23Å; I56-I381 HydrophobicContact CD1-CD1 4.42Å; I56-I381 HydrophobicContact CD1-CG2 4.41Å; I56-I381 HydrophobicContact CG2-CG2 4.01Å; I56-I385 HydrophobicContact CG2-CD1 4.48Å
57S90.9Very high85.6Confident0 Ų015.7 Ų15.70%09%0.092CC..Hα-helixtrans-56.9-33.8-174.2-63.40000114.8G53 K59 S60 V61 N237G53-S57 WeakPolarHBondContact O-CB 3.24Å; G53-S57 PolarHBondContact O-N 3.14Å; G53-S57 PolarHBondContact O-OG 2.84Å; G53-S57 VanDerWaalsContact O-OG 3.06Å; S57-K59 VanDerWaalsContact C-N 3.26Å; S57-K59 PolarHBondContact O-N 2.68Å; S57-S60 PolarHBondContact O-N 3.47Å; S57-V61 WeakPolarHBondContact O-CB 3.25Å; S57-V61 VanDerWaalsContact O-CG2 3.23Å; S57-V61 WeakPolarHBondContact O-CG2 3.38Å; S57-V61 PolarHBondContact O-N 3.48Å; S57-N237 WeakPolarHBondContact CB-O 3.31Å; S57-N237 PolarHBondContact OG-O 2.93Å
58P91.1Very high86Confident1 Ų115.7 Ų15.71%0.0069%0.092CC..Hα-helixtrans-54.3-39.8-178.7-29.836.8000114.1I54 I56 L62 W75 N281 Y284I54-P58 WeakPolarHBondContact O-CD 3.29Å; I54-P58 WeakPolarHBondContact O-CG 3.23Å; I56-P58 VanDerWaalsContact C-N 3.34Å; P58-L62 VanDerWaalsContact O-CB 3.25Å; P58-L62 WeakPolarHBondContact O-CB 3.43Å; P58-L62 PolarHBondContact O-N 3.45Å; P58-W75 HydrophobicContact CG-CZ2 4.04Å; P58-N281 WeakPolarHBondContact CB-OD1 3.35Å; P58-Y284 HydrophobicContact CB-CD2 4.47Å; P58-Y284 HydrophobicContact CG-CD2 4.4Å; P58-Y284 HydrophobicContact CG-CE2 4.15Å
59K90.5Very high86.5Confident65 Ų6514.8 Ų14.828%0.2839%0.088SC..Hα-helixtrans-62.5-51.2177.8176.3175.9-178.91590111.7I56 S57 L62 L63 L293 L294 S296 V299I56-K59 PolarHBondContact O-N 2.86Å; S57-K59 VanDerWaalsContact C-N 3.26Å; S57-K59 PolarHBondContact O-N 2.68Å; K59-L62 PolarHBondContact O-N 2.81Å; K59-L63 WeakPolarHBondContact O-CB 3.4Å; K59-L63 PolarHBondContact O-N 3.39Å; K59-L293 HydrophobicContact CB-CD2 4.22Å; K59-L294 WeakPolarHBondContact CE-O 3.27Å; K59-L294 HydrophobicContact CG-CD2 4.44Å; K59-L294 PolarHBondContact NZ-O 3.45Å; K59-L294 WeakPolarHBondContact O-CD2 3.36Å; K59-S296 WeakPolarHBondContact CD-O 3.44Å; K59-S296 PolarHBondContact NZ-O 3.27Å; K59-V299 HydrophobicContact CB-CG2 4.35Å
60S88.6Confident86.7Confident4 Ų415.5 Ų15.53%0.0289%0.093CC..Hα-helixtrans-71.2-37.5-176.8-54.70000112S57 L63 Y64 N237 N382S57-S60 PolarHBondContact O-N 3.47Å; S60-L63 PolarHBondContact O-N 3.26Å; S60-Y64 WeakPolarHBondContact O-CD2 3.4Å; S60-Y64 PolarHBondContact O-N 3.32Å; S60-Y64 VanDerWaalsContact O-N 3.11Å; S60-N237 WeakPolarHBondContact CB-OD1 3.42Å; S60-N382 PolarHBondContact OG-OD1 3.15Å
61V90.7Very high87Confident0 Ų015.5 Ų15.50%09%0.092CC..Hα-helixtrans-63.9-43.9174.7177.70000110.3S57 Y64 S65 C71 I74 W75 N237S57-V61 WeakPolarHBondContact O-CB 3.25Å; S57-V61 VanDerWaalsContact O-CG2 3.23Å; S57-V61 WeakPolarHBondContact O-CG2 3.38Å; S57-V61 PolarHBondContact O-N 3.48Å; V61-Y64 PolarHBondContact O-N 2.74Å; V61-S65 WeakPolarHBondContact O-CB 3.08Å; V61-S65 PolarHBondContact O-N 3.44Å; V61-S65 PolarHBondContact O-OG 2.92Å; V61-C71 HydrophobicContact CG1-CB 4.47Å; V61-I74 HydrophobicContact CG1-CB 4.3Å; V61-I74 HydrophobicContact CG1-CG2 3.99Å; V61-W75 HydrophobicContact CG2-CZ2 4.47Å; V61-N237 HydrophobicContact CG2-CB 3.86Å
62L90.1Very high87.4Confident2 Ų216.6 Ų16.61%0.0110%0.097CC..Hα-helixtrans-62.9-43.9175.8-175.863.3000111.7P58 K59 Y64 S65 G66 C71 F285 P290 L293 L294P58-L62 VanDerWaalsContact O-CB 3.25Å; P58-L62 WeakPolarHBondContact O-CB 3.43Å; P58-L62 PolarHBondContact O-N 3.45Å; K59-L62 PolarHBondContact O-N 2.81Å; L62-Y64 VanDerWaalsContact C-N 3.3Å; L62-Y64 PolarHBondContact O-N 3.41Å; L62-S65 WeakPolarHBondContact CA-OG 3.11Å; L62-S65 PolarHBondContact O-N 3.06Å; L62-S65 PolarHBondContact O-OG 2.98Å; L62-G66 PolarHBondContact O-N 3.28Å; L62-C71 HydrophobicContact CD1-CB 4.23Å; L62-F285 HydrophobicContact CD1-CE1 4.16Å; L62-F285 HydrophobicContact CD1-CZ 4.17Å; L62-F285 HydrophobicContact CD2-CE1 4.01Å; L62-P290 HydrophobicContact CD2-CB 4.07Å; L62-L293 HydrophobicContact CB-CD2 4.48Å; L62-L293 HydrophobicContact CD2-CB 4.11Å; L62-L293 HydrophobicContact CD2-CD1 4.41Å; L62-L293 HydrophobicContact CD2-CD2 3.82Å; L62-L293 HydrophobicContact CD2-CG 4.32Å; L62-L294 HydrophobicContact CB-CD2 4.22Å; L62-L294 HydrophobicContact CD2-CD2 4.18Å; L62-L294 HydrophobicContact CD2-CG 4.07Å; L62-L294 HydrophobicContact CG-CD2 4.2Å; L62-L294 HydrophobicContact CG-CG 4.44Å
63L88.7Confident87.9Confident101 Ų10121.5 Ų21.553%0.52912%0.122SC..Hα-helixtrans-56.9-42.8178.9-178.366.5000112.5K59 S60 L294K59-L63 WeakPolarHBondContact O-CB 3.4Å; K59-L63 PolarHBondContact O-N 3.39Å; S60-L63 PolarHBondContact O-N 3.26Å; L63-L294 HydrophobicContact CB-CD2 3.82Å; L63-L294 HydrophobicContact CD1-CD2 4.27Å
64Y86.8Confident88.2Confident33 Ų3321.9 Ų21.913%0.12912%0.124CC..Hα-helixtrans-86.1-28.8-177.1-68.1-54.5000114S60 V61 L62 S225 A230 L233S60-Y64 WeakPolarHBondContact O-CD2 3.4Å; S60-Y64 PolarHBondContact O-N 3.32Å; S60-Y64 VanDerWaalsContact O-N 3.11Å; V61-Y64 PolarHBondContact O-N 2.74Å; L62-Y64 VanDerWaalsContact C-N 3.3Å; L62-Y64 PolarHBondContact O-N 3.41Å; Y64-S225 WeakPolarHBondContact O-CB 2.91Å; Y64-A230 WeakPolarHBondContact CB-O 3.45Å; Y64-L233 HydrophobicContact CD1-CB 4.08Å; Y64-L233 HydrophobicContact CD1-CD1 4.12Å; Y64-L233 HydrophobicContact CD2-CB 3.81Å; Y64-L233 HydrophobicContact CE1-CB 4.17Å; Y64-L233 HydrophobicContact CE1-CD1 3.66Å; Y64-L233 HydrophobicContact CE2-CB 3.92Å; Y64-L233 HydrophobicContact CG-CB 3.92Å
65S84.6Confident88.3Confident2 Ų221.9 Ų21.91%0.01412%0.124CC..Hα-helixtrans-79.1-24.5177.363.10000113.1V61 L62 D67 C71 S225V61-S65 WeakPolarHBondContact O-CB 3.08Å; V61-S65 PolarHBondContact O-N 3.44Å; V61-S65 PolarHBondContact O-OG 2.92Å; L62-S65 WeakPolarHBondContact CA-OG 3.11Å; L62-S65 PolarHBondContact O-N 3.06Å; L62-S65 PolarHBondContact O-OG 2.98Å; S65-D67 PolarHBondContact O-N 3.12Å; S65-D67 PolarHBondContact OG-O 3.32Å; S65-C71 WeakPolarHBondContact OG-CB 3.49Å; S65-S225 PolarHBondContact O-N 2.89Å; S65-S225 VanDerWaalsContact O-N 3.08Å
66G83.1Confident88.4Confident44 Ų4424.7 Ų24.745%0.45414%0.141SC..  trans87.9-37.1176.300000113.6L62L62-G66 PolarHBondContact O-N 3.28Å
67D84.5Confident88.5Confident18 Ų1825.5 Ų25.510%0.09615%0.15CC..SBendtrans-145.6166.7-173.5-157.1-2.3000112.8S65 P70 C71 F221 E222 G223S65-D67 PolarHBondContact O-N 3.12Å; S65-D67 PolarHBondContact OG-O 3.32Å; D67-P70 HydrophobicContact CB-CG 4.45Å; D67-C71 WeakPolarHBondContact O-CB 3.2Å; D67-C71 PolarHBondContact O-N 2.76Å; D67-C71 VanDerWaalsContact O-N 3.11Å; D67-F221 VanDerWaalsContact OD2-CA 3.29Å; D67-F221 WeakPolarHBondContact OD2-CA 3.46Å; D67-F221 PolarHBondContact OD2-N 3.3Å; D67-E222 PolarHBondContact OD2-N 3.35Å; D67-G223 PolarHBondContact OD2-N 3Å
68V85.4Confident88.4Confident1 Ų125.5 Ų25.51%0.00615%0.15CC..Hα-helixtrans-64.1-45.4-171-1800000112.6C71 L72 L217 A220 F285 P290V68-C71 WeakPolarHBondContact O-CB 3.14Å; V68-C71 PolarHBondContact O-N 2.72Å; V68-L72 HydrophobicContact CG1-CD1 4.35Å; V68-L72 WeakPolarHBondContact O-CG 3.07Å; V68-L72 PolarHBondContact O-N 3.36Å; V68-L217 HydrophobicContact CG1-CD2 4.19Å; V68-A220 HydrophobicContact CB-CB 4.33Å; V68-F285 HydrophobicContact CG1-CB 4.31Å; V68-F285 HydrophobicContact CG1-CD1 4.02Å; V68-F285 HydrophobicContact CG1-CD2 3.6Å; V68-F285 HydrophobicContact CG1-CE1 4.22Å; V68-F285 HydrophobicContact CG1-CE2 3.83Å; V68-F285 HydrophobicContact CG1-CG 3.71Å; V68-F285 HydrophobicContact CG1-CZ 4.14Å; V68-F285 HydrophobicContact CG2-CD1 3.91Å; V68-F285 HydrophobicContact CG2-CE1 3.92Å; V68-F285 HydrophobicContact CG2-CG 4.43Å; V68-F285 HydrophobicContact CG2-CZ 4.43Å; V68-P290 HydrophobicContact CG2-CG 3.66Å
69G85.8Confident88Confident6 Ų625.5 Ų25.56%0.06215%0.15CC..Hα-helixtrans-62.3-55.4-178.600000112.2C71 L72 L73 A220G69-C71 VanDerWaalsContact C-N 3.27Å; G69-C71 PolarHBondContact O-N 2.88Å; G69-L72 PolarHBondContact O-N 3.39Å; G69-L73 WeakPolarHBondContact O-CG 3.19Å; G69-L73 PolarHBondContact O-N 3.36Å; G69-A220 WeakPolarHBondContact CA-O 3.37Å; G69-A220 PolarHBondContact N-O 2.84Å
70P86.3Confident87.7Confident19 Ų1924.6 Ų24.612%0.12315%0.15CC..Hα-helixtrans-55.6-38.3172.3-27.436.2000113.5D67 L73 I74 A220 F221D67-P70 HydrophobicContact CB-CG 4.45Å; P70-L73 PolarHBondContact O-N 3.02Å; P70-I74 WeakPolarHBondContact O-CD1 3.41Å; P70-I74 VanDerWaalsContact O-CG1 3.25Å; P70-I74 WeakPolarHBondContact O-CG1 2.84Å; P70-I74 PolarHBondContact O-N 3.32Å; P70-A220 WeakPolarHBondContact CD-O 3.34Å; P70-F221 HydrophobicContact CG-CD1 4.26Å
71C88.9Confident87.3Confident0 Ų026.7 Ų26.70%016%0.16CC..Hα-helixtrans-58.9-49.4175.4-177.50000112.1V61 L62 S65 D67 V68 G69 L73 I74 W75 F285V61-C71 HydrophobicContact CG1-CB 4.47Å; L62-C71 HydrophobicContact CD1-CB 4.23Å; S65-C71 WeakPolarHBondContact OG-CB 3.49Å; D67-C71 WeakPolarHBondContact O-CB 3.2Å; D67-C71 PolarHBondContact O-N 2.76Å; D67-C71 VanDerWaalsContact O-N 3.11Å; V68-C71 WeakPolarHBondContact O-CB 3.14Å; V68-C71 PolarHBondContact O-N 2.72Å; G69-C71 VanDerWaalsContact C-N 3.27Å; G69-C71 PolarHBondContact O-N 2.88Å; C71-L73 PolarHBondContact O-N 2.71Å; C71-I74 PolarHBondContact O-N 3.26Å; C71-W75 VanDerWaalsContact O-CD1 3.24Å; C71-W75 PolarHBondContact O-N 3.02Å; C71-F285 HydrophobicContact CB-CZ 4.46Å
72L90Very high86.5Confident29 Ų2927 Ų2715%0.15216%0.163CC..Hα-helixtrans-65.7-36.7178-67.7176.1000112.6V68 G69 I74 W75 T76 N281 I282 F285V68-L72 HydrophobicContact CG1-CD1 4.35Å; V68-L72 WeakPolarHBondContact O-CG 3.07Å; V68-L72 PolarHBondContact O-N 3.36Å; G69-L72 PolarHBondContact O-N 3.39Å; L72-I74 VanDerWaalsContact C-N 3.34Å; L72-W75 PolarHBondContact O-N 3.18Å; L72-T76 WeakPolarHBondContact O-CB 3.41Å; L72-T76 PolarHBondContact O-N 2.83Å; L72-T76 PolarHBondContact O-OG1 3.44Å; L72-N281 HydrophobicContact CD2-CB 3.8Å; L72-I282 HydrophobicContact CD1-CG1 4.12Å; L72-I282 HydrophobicContact CD2-CG1 3.94Å; L72-F285 HydrophobicContact CD2-CD2 4.34Å; L72-F285 HydrophobicContact CD2-CE2 4.14Å; L72-F285 HydrophobicContact CG-CE2 4.33Å
73L90.6Very high85.3Confident105 Ų10528.6 Ų28.655%0.5517%0.173SC..Hα-helixtrans-63.1-40.7172.9-71.9176.5000111.3G69 P70 C71 T76 A77 F221G69-L73 WeakPolarHBondContact O-CG 3.19Å; G69-L73 PolarHBondContact O-N 3.36Å; P70-L73 PolarHBondContact O-N 3.02Å; C71-L73 PolarHBondContact O-N 2.71Å; L73-T76 PolarHBondContact O-N 3.28Å; L73-A77 WeakPolarHBondContact O-CB 3.4Å; L73-A77 PolarHBondContact O-N 2.95Å; L73-F221 HydrophobicContact CD1-CE1 4.01Å; L73-F221 HydrophobicContact CD1-CZ 4.37Å
74I91.2Very high83.5Confident13 Ų1330.3 Ų30.37%0.06718%0.18CC..Hα-helixtrans-67-40.9176.9-70.3160.7000110.8V61 P70 C71 L72 T76 A77 C78 A234V61-I74 HydrophobicContact CG1-CB 4.3Å; V61-I74 HydrophobicContact CG1-CG2 3.99Å; P70-I74 WeakPolarHBondContact O-CD1 3.41Å; P70-I74 VanDerWaalsContact O-CG1 3.25Å; P70-I74 WeakPolarHBondContact O-CG1 2.84Å; P70-I74 PolarHBondContact O-N 3.32Å; C71-I74 PolarHBondContact O-N 3.26Å; L72-I74 VanDerWaalsContact C-N 3.34Å; I74-T76 VanDerWaalsContact C-N 3.33Å; I74-T76 PolarHBondContact O-N 2.89Å; I74-A77 PolarHBondContact O-N 3.2Å; I74-C78 VanDerWaalsContact O-CB 3.31Å; I74-C78 WeakPolarHBondContact O-CB 3.12Å; I74-C78 PolarHBondContact O-N 3.39Å; I74-C78 PolarHBondContact O-SG 3.42Å; I74-A234 HydrophobicContact CD1-CB 3.74Å; I74-A234 HydrophobicContact CG2-CB 4.33Å
75W91.9Very high81.6Confident0 Ų028.9 Ų28.90%018%0.175CC..Hα-helixtrans-61.2-42.8174.3-84.2106.3000112.6I54 P58 V61 C71 L72 G79 A241 Y242 Y277 V278 N281I54-W75 HydrophobicContact CD1-CH2 3.64Å; I54-W75 HydrophobicContact CD1-CZ2 4.08Å; I54-W75 HydrophobicContact CD1-CZ3 3.96Å; P58-W75 HydrophobicContact CG-CZ2 4.04Å; V61-W75 HydrophobicContact CG2-CZ2 4.47Å; C71-W75 VanDerWaalsContact O-CD1 3.24Å; C71-W75 PolarHBondContact O-N 3.02Å; L72-W75 PolarHBondContact O-N 3.18Å; W75-G79 PolarHBondContact O-N 2.99Å; W75-A241 HydrophobicContact CH2-CB 3.46Å; W75-A241 VanDerWaalsContact CH2-CB 3.46Å; W75-A241 HydrophobicContact CZ3-CB 3.59Å; W75-Y242 AromaticContact CE3-CE2 3.71Å; W75-Y242 HydrophobicContact CE3-CE2 3.71Å; W75-Y242 HydrophobicContact CZ3-CD2 4.5Å; W75-Y242 AromaticContact CZ3-CE2 3.97Å; W75-Y242 HydrophobicContact CZ3-CE2 3.97Å; W75-Y242 PolarHBondContact O-OH 3.36Å; W75-Y277 AromaticContact CE3-CD2 3.98Å; W75-Y277 HydrophobicContact CE3-CD2 3.98Å; W75-Y277 HydrophobicContact CE3-CG 4.41Å; W75-Y277 HydrophobicContact CH2-CD2 4.49Å; W75-Y277 AromaticContact CZ3-CD2 3.48Å; W75-Y277 HydrophobicContact CZ3-CD2 3.48Å; W75-Y277 VanDerWaalsContact CZ3-CD2 3.48Å; W75-Y277 HydrophobicContact CZ3-CE2 4.09Å; W75-Y277 HydrophobicContact CZ3-CG 4.08Å; W75-V278 HydrophobicContact CB-CG2 4.34Å; W75-N281 VanDerWaalsContact CE2-ND2 3.27Å; W75-N281 PolarHBondContact NE1-ND2 3.02Å; W75-N281 PolarHBondContact NE1-OD1 3.02Å; W75-N281 VanDerWaalsContact NE1-OD1 3.14Å
76T90.2Very high79.3Confident60 Ų6037.5 Ų37.537%0.36821%0.207SC..Hα-helixtrans-66.8-43.7176.1-53.50000110.5L72 L73 I74 G79 V80L72-T76 WeakPolarHBondContact O-CB 3.41Å; L72-T76 PolarHBondContact O-N 2.83Å; L72-T76 PolarHBondContact O-OG1 3.44Å; L73-T76 PolarHBondContact O-N 3.28Å; I74-T76 VanDerWaalsContact C-N 3.33Å; I74-T76 PolarHBondContact O-N 2.89Å; T76-G79 CarbonylContact O-C 3.05Å; T76-G79 PolarHBondContact O-N 3.35Å; T76-V80 WeakPolarHBondContact O-CB 3.34Å; T76-V80 WeakPolarHBondContact O-CG2 3.31Å; T76-V80 PolarHBondContact O-N 3.28Å
77A89.4Confident77.6Confident32 Ų3235.4 Ų35.426%0.26419%0.186SC..Hα-helixtrans-65.6-39.617800000112L73 I74 V80 L81 F235L73-A77 WeakPolarHBondContact O-CB 3.4Å; L73-A77 PolarHBondContact O-N 2.95Å; I74-A77 PolarHBondContact O-N 3.2Å; A77-V80 CarbonylContact O-C 3.49Å; A77-V80 WeakPolarHBondContact O-CB 3.29Å; A77-V80 PolarHBondContact O-N 2.93Å; A77-L81 WeakPolarHBondContact O-CB 3.33Å; A77-L81 VanDerWaalsContact O-CG 3.26Å; A77-L81 WeakPolarHBondContact O-CG 3.35Å; A77-L81 PolarHBondContact O-N 3.47Å; A77-F235 HydrophobicContact CB-CE1 3.8Å; A77-F235 HydrophobicContact CB-CZ 3.85Å
78C88Confident76.2Confident0 Ų034.8 Ų34.80%018%0.184CC..Hα-helixtrans-63.1-45.9172.6-69.20000110.9I74 V80 L81 A82 F235 L239 Y242I74-C78 VanDerWaalsContact O-CB 3.31Å; I74-C78 WeakPolarHBondContact O-CB 3.12Å; I74-C78 PolarHBondContact O-N 3.39Å; I74-C78 PolarHBondContact O-SG 3.42Å; C78-V80 VanDerWaalsContact C-N 3.29Å; C78-V80 PolarHBondContact O-N 2.9Å; C78-L81 PolarHBondContact O-N 2.78Å; C78-A82 WeakPolarHBondContact O-CB 3.07Å; C78-A82 PolarHBondContact O-N 3.07Å; C78-F235 WeakPolarHBondContact SG-CD1 3.42Å; C78-L239 HydrophobicContact CB-CD2 3.97Å; C78-L239 HydrophobicContact CB-CG 4.37Å; C78-Y242 HydrophobicContact CB-CD2 3.61Å; C78-Y242 HydrophobicContact CB-CE2 3.46Å; C78-Y242 VanDerWaalsContact CB-CE2 3.46Å
79G83.4Confident74.9Confident1 Ų134.8 Ų34.81%0.0118%0.184CC..Hα-helixtrans-61.7-39.4174.800000111.6W75 T76 A82 T83 Y242 T274W75-G79 PolarHBondContact O-N 2.99Å; T76-G79 CarbonylContact O-C 3.05Å; T76-G79 PolarHBondContact O-N 3.35Å; G79-A82 CarbonylContact O-C 3.46Å; G79-A82 PolarHBondContact O-N 3.18Å; G79-T83 WeakPolarHBondContact O-CA 2.84Å; G79-T83 WeakPolarHBondContact O-CB 3.34Å; G79-T83 PolarHBondContact O-N 2.87Å; G79-T83 PolarHBondContact O-OG1 2.84Å; G79-Y242 WeakPolarHBondContact CA-OH 2.91Å; G79-T274 WeakPolarHBondContact CA-OG1 3.49Å
80V83.4Confident74.2Confident47 Ų4735.4 Ų35.429%0.28519%0.186SC..Hα-helixtrans-65.8-41.4171.71460000111.7T76 A77 C78 A82 T83 M84 G85T76-V80 WeakPolarHBondContact O-CB 3.34Å; T76-V80 WeakPolarHBondContact O-CG2 3.31Å; T76-V80 PolarHBondContact O-N 3.28Å; A77-V80 CarbonylContact O-C 3.49Å; A77-V80 WeakPolarHBondContact O-CB 3.29Å; A77-V80 PolarHBondContact O-N 2.93Å; C78-V80 VanDerWaalsContact C-N 3.29Å; C78-V80 PolarHBondContact O-N 2.9Å; V80-A82 VanDerWaalsContact C-N 3.27Å; V80-A82 PolarHBondContact O-N 2.78Å; V80-T83 CarbonylContact O-C 3.54Å; V80-T83 PolarHBondContact O-N 2.74Å; V80-T83 VanDerWaalsContact O-N 3.08Å; V80-M84 HydrophobicContact CB-CB 4.41Å; V80-M84 HydrophobicContact CB-CG 4.07Å; V80-M84 HydrophobicContact CB-SD 4.08Å; V80-M84 HydrophobicContact CG1-CB 3.78Å; V80-M84 HydrophobicContact CG1-CE 4.26Å; V80-M84 HydrophobicContact CG1-CG 3.6Å; V80-M84 HydrophobicContact CG1-SD 3.25Å; V80-M84 WeakPolarHBondContact CG1-SD 3.35Å; V80-M84 HydrophobicContact CG2-CG 3.93Å; V80-M84 HydrophobicContact CG2-SD 3.83Å; V80-M84 CarbonylContact O-C 3.49Å; V80-M84 WeakPolarHBondContact O-CA 3.35Å; V80-M84 WeakPolarHBondContact O-CB 3.35Å; V80-M84 PolarHBondContact O-N 3.23Å; V80-G85 PolarHBondContact O-N 2.95Å
81L80.1Confident73.7Confident47 Ų4734.5 Ų34.525%0.24618%0.18CC..Hα-helixtrans-65.6-36.3175.1-73.1172.2000110.8A77 C78 G85 F235 L239 V430A77-L81 WeakPolarHBondContact O-CB 3.33Å; A77-L81 VanDerWaalsContact O-CG 3.26Å; A77-L81 WeakPolarHBondContact O-CG 3.35Å; A77-L81 PolarHBondContact O-N 3.47Å; C78-L81 PolarHBondContact O-N 2.78Å; L81-G85 PolarHBondContact O-N 2.86Å; L81-F235 HydrophobicContact CD1-CD1 3.93Å; L81-F235 HydrophobicContact CD1-CE1 3.65Å; L81-L239 HydrophobicContact CB-CD2 4.41Å; L81-V430 HydrophobicContact CD1-CG1 4.07Å; L81-V430 HydrophobicContact CD2-CG1 4Å; L81-V430 HydrophobicContact CD2-CG2 4.04Å
82A74.8Confident73.2Confident6 Ų634.6 Ų34.65%0.0518%0.18CC..Hα-helixtrans-69.4-35.4169.900000112.6C78 G79 V80 Y242 I270C78-A82 WeakPolarHBondContact O-CB 3.07Å; C78-A82 PolarHBondContact O-N 3.07Å; G79-A82 CarbonylContact O-C 3.46Å; G79-A82 PolarHBondContact O-N 3.18Å; V80-A82 VanDerWaalsContact C-N 3.27Å; V80-A82 PolarHBondContact O-N 2.78Å; A82-Y242 HydrophobicContact CB-CD1 4.34Å; A82-Y242 HydrophobicContact CB-CG 4.49Å; A82-I270 HydrophobicContact CB-CG2 3.57Å; A82-I270 WeakPolarHBondContact O-CD1 3.02Å
83T64Low72.5Confident37 Ų3733.2 Ų33.223%0.22717%0.173CC..Hα-helixtrans-109.3-51.5-169.1-440000116.2G79 V80 G85 R86 I270 P271G79-T83 WeakPolarHBondContact O-CA 2.84Å; G79-T83 WeakPolarHBondContact O-CB 3.34Å; G79-T83 PolarHBondContact O-N 2.87Å; G79-T83 PolarHBondContact O-OG1 2.84Å; V80-T83 CarbonylContact O-C 3.54Å; V80-T83 PolarHBondContact O-N 2.74Å; V80-T83 VanDerWaalsContact O-N 3.08Å; T83-G85 VanDerWaalsContact C-C 3.47Å; T83-G85 CarbonylContact O-C 3.57Å; T83-G85 PolarHBondContact O-N 3.02Å; T83-R86 PolarHBondContact O-N 3.28Å; T83-I270 WeakPolarHBondContact OG1-CG2 3.25Å; T83-P271 HydrophobicContact CG2-CB 3.93Å; T83-P271 HydrophobicContact CG2-CG 3.67Å
84M51.5Low72.2Confident137 Ų13728.2 Ų28.268%0.67515%0.147SC*.THydrogen-bonded Turntrans-62.5-7.1158-64.1-178.342.600112.1V80 R86V80-M84 HydrophobicContact CB-CB 4.41Å; V80-M84 HydrophobicContact CB-CG 4.07Å; V80-M84 HydrophobicContact CB-SD 4.08Å; V80-M84 HydrophobicContact CG1-CB 3.78Å; V80-M84 HydrophobicContact CG1-CE 4.26Å; V80-M84 HydrophobicContact CG1-CG 3.6Å; V80-M84 HydrophobicContact CG1-SD 3.25Å; V80-M84 WeakPolarHBondContact CG1-SD 3.35Å; V80-M84 HydrophobicContact CG2-CG 3.93Å; V80-M84 HydrophobicContact CG2-SD 3.83Å; V80-M84 CarbonylContact O-C 3.49Å; V80-M84 WeakPolarHBondContact O-CA 3.35Å; V80-M84 WeakPolarHBondContact O-CB 3.35Å; V80-M84 PolarHBondContact O-N 3.23Å; M84-R86 PolarHBondContact O-N 3.5Å
85G46Very low71.8Confident3 Ų327.6 Ų27.63%0.03114%0.144CC..  -48.741.2126.800000115.4V80 L81 T83 S87 G88V80-G85 PolarHBondContact O-N 2.95Å; L81-G85 PolarHBondContact O-N 2.86Å; T83-G85 VanDerWaalsContact C-C 3.47Å; T83-G85 CarbonylContact O-C 3.57Å; T83-G85 PolarHBondContact O-N 3.02Å; G85-S87 PolarHBondContact O-N 3.01Å; G85-G88 PolarHBondContact O-N 3.47Å
86R36.2Very low71Confident183 Ų18327.6 Ų27.669%0.69114%0.144SC*.THydrogen-bonded Turntrans-621.3155-144.2179.7-174131.6-0.4108.9T83 M84 L90T83-R86 PolarHBondContact O-N 3.28Å; M84-R86 PolarHBondContact O-N 3.5Å; R86-L90 VanDerWaalsContact C-CB 3.42Å; R86-L90 VanDerWaalsContact C-CD1 3.49Å; R86-L90 HydrophobicContact CB-CD1 4.29Å; R86-L90 HydrophobicContact CG-CD1 3.73Å; R86-L90 WeakPolarHBondContact O-CB 3.5Å; R86-L90 WeakPolarHBondContact O-CD1 3.32Å
87S47.2Very low70.5Confident0 Ų025 Ų250%013%0.127CC..THydrogen-bonded Turntrans-143.317.9158.9-33.30000114G85 C91 V419 I423G85-S87 PolarHBondContact O-N 3.01Å; S87-C91 WeakPolarHBondContact O-CA 3.3Å; S87-C91 WeakPolarHBondContact O-CB 3.44Å; S87-C91 PolarHBondContact O-N 3.38Å; S87-C91 PolarHBondContact O-SG 3.05Å; S87-V419 WeakPolarHBondContact OG-CB 3.4Å; S87-I423 VanDerWaalsContact CB-CB 3.47Å; S87-I423 WeakPolarHBondContact OG-CB 3.26Å; S87-I423 WeakPolarHBondContact OG-CD1 3.5Å; S87-I423 WeakPolarHBondContact OG-CG2 3.26Å
88G55.6Low70.2Confident5 Ų524.6 Ų24.65%0.05212%0.12CC..THydrogen-bonded Turntrans-82.6-77.7171.200000108.3G85 L90 C91 Y92G85-G88 PolarHBondContact O-N 3.47Å; G88-L90 PolarHBondContact O-N 3.33Å; G88-C91 WeakPolarHBondContact O-CB 3.23Å; G88-C91 PolarHBondContact O-N 3.04Å; G88-Y92 WeakPolarHBondContact O-CD2 3.21Å; G88-Y92 PolarHBondContact O-N 2.9Å
89A59.5Low69.8Low1 Ų125.2 Ų25.21%0.00812%0.123CC..Hα-helixtrans-57.8-28.316400000112.6Y92 A93 W245 I266 I270A89-Y92 CarbonylContact O-C 3.44Å; A89-Y92 WeakPolarHBondContact O-CB 3.43Å; A89-Y92 PolarHBondContact O-N 2.99Å; A89-A93 WeakPolarHBondContact O-CB 3.34Å; A89-A93 PolarHBondContact O-N 3.43Å; A89-W245 HydrophobicContact CB-CD2 4.41Å; A89-W245 HydrophobicContact CB-CE3 3.64Å; A89-W245 HydrophobicContact CB-CZ3 4.1Å; A89-I266 HydrophobicContact CB-CB 4.43Å; A89-I266 HydrophobicContact CB-CD1 4.08Å; A89-I266 HydrophobicContact CB-CG1 4.31Å; A89-I266 HydrophobicContact CB-CG2 3.31Å; A89-I270 HydrophobicContact CB-CD1 3.8Å
90L69.9Low69.2Low19 Ų1928.7 Ų28.710%0.09915%0.145CC..Hα-helixtrans-79.8-27.7172.8-86.4-177.5000114.4R86 G88 A93 E94 P263 V267 V417 V419R86-L90 VanDerWaalsContact C-CB 3.42Å; R86-L90 VanDerWaalsContact C-CD1 3.49Å; R86-L90 HydrophobicContact CB-CD1 4.29Å; R86-L90 HydrophobicContact CG-CD1 3.73Å; R86-L90 WeakPolarHBondContact O-CB 3.5Å; R86-L90 WeakPolarHBondContact O-CD1 3.32Å; G88-L90 PolarHBondContact O-N 3.33Å; L90-A93 HydrophobicContact CD2-CB 3.88Å; L90-A93 PolarHBondContact O-N 3.34Å; L90-E94 PolarHBondContact O-N 3.38Å; L90-P263 HydrophobicContact CD2-CB 3.53Å; L90-V267 HydrophobicContact CD1-CG2 4.18Å; L90-V417 HydrophobicContact CD2-CG1 4.44Å; L90-V419 HydrophobicContact CB-CG1 3.82Å; L90-V419 WeakPolarHBondContact O-CG1 3.18Å
91C76.4Confident68.7Low0 Ų031.8 Ų31.80%015%0.154CC..Hα-helixtrans-62.7-42.7164.8-86.70000108.2S87 G88 A93 E94 L95 L403S87-C91 WeakPolarHBondContact O-CA 3.3Å; S87-C91 WeakPolarHBondContact O-CB 3.44Å; S87-C91 PolarHBondContact O-N 3.38Å; S87-C91 PolarHBondContact O-SG 3.05Å; G88-C91 WeakPolarHBondContact O-CB 3.23Å; G88-C91 PolarHBondContact O-N 3.04Å; C91-A93 VanDerWaalsContact C-N 3.31Å; C91-A93 PolarHBondContact O-N 2.75Å; C91-E94 PolarHBondContact O-N 3.44Å; C91-L95 VanDerWaalsContact O-CG 3.31Å; C91-L95 WeakPolarHBondContact O-CG 3.42Å; C91-L95 PolarHBondContact O-N 3.17Å; C91-L403 HydrophobicContact CB-CD1 3.58Å; C91-L403 WeakPolarHBondContact O-CD1 3.42Å
92Y77.1Confident68.1Low1 Ų129.6 Ų29.60%0.00414%0.143CC..Hα-helixtrans-64.3-34.6174-88-109.8000113G88 A89 L95 G96 E105 Y108 W245 N246 Y396 T399G88-Y92 WeakPolarHBondContact O-CD2 3.21Å; G88-Y92 PolarHBondContact O-N 2.9Å; A89-Y92 CarbonylContact O-C 3.44Å; A89-Y92 WeakPolarHBondContact O-CB 3.43Å; A89-Y92 PolarHBondContact O-N 2.99Å; Y92-L95 PolarHBondContact O-N 3.41Å; Y92-G96 PolarHBondContact O-N 3.37Å; Y92-E105 HydrophobicContact CE1-CG 3.41Å; Y92-E105 VanDerWaalsContact CE1-CG 3.41Å; Y92-E105 WeakPolarHBondContact CE1-OE1 3.11Å; Y92-E105 VanDerWaalsContact CZ-OE1 3.24Å; Y92-E105 WeakPolarHBondContact OH-CG 3.44Å; Y92-E105 PolarHBondContact OH-OE1 3.3Å; Y92-Y108 HydrophobicContact CD1-CE2 4.23Å; Y92-W245 HydrophobicContact CD1-CZ3 4.1Å; Y92-W245 AromaticContact CD2-CH2 3.82Å; Y92-W245 HydrophobicContact CD2-CH2 3.82Å; Y92-W245 AromaticContact CD2-CZ3 3.78Å; Y92-W245 HydrophobicContact CD2-CZ3 3.78Å; Y92-W245 HydrophobicContact CE1-CH2 4.39Å; Y92-W245 HydrophobicContact CE1-CZ3 4.39Å; Y92-W245 AromaticContact CE2-CH2 3.73Å; Y92-W245 HydrophobicContact CE2-CH2 3.73Å; Y92-W245 HydrophobicContact CE2-CZ3 4.14Å; Y92-W245 HydrophobicContact CG-CH2 4.21Å; Y92-W245 AromaticContact CG-CZ3 3.75Å; Y92-W245 HydrophobicContact CG-CZ3 3.75Å; Y92-N246 HydrophobicContact CD1-CB 4.33Å; Y92-N246 HydrophobicContact CE1-CB 4.23Å; Y92-Y396 WeakPolarHBondContact OH-CD1 3.41Å; Y92-T399 HydrophobicContact CE1-CG2 4.15Å; Y92-T399 HydrophobicContact CE2-CG2 3.9Å
93A77.1Confident67.8Low0 Ų029.3 Ų29.30%014%0.141CC..Hα-helixtrans-69.9-38.4173.300000111.8A89 L90 C91 G96 T97 L262 I266A89-A93 WeakPolarHBondContact O-CB 3.34Å; A89-A93 PolarHBondContact O-N 3.43Å; L90-A93 HydrophobicContact CD2-CB 3.88Å; L90-A93 PolarHBondContact O-N 3.34Å; C91-A93 VanDerWaalsContact C-N 3.31Å; C91-A93 PolarHBondContact O-N 2.75Å; A93-G96 PolarHBondContact O-N 3.02Å; A93-T97 VanDerWaalsContact O-CB 3.29Å; A93-T97 WeakPolarHBondContact O-CB 3.34Å; A93-T97 VanDerWaalsContact O-CG2 3.23Å; A93-T97 WeakPolarHBondContact O-CG2 3.42Å; A93-T97 PolarHBondContact O-N 3.28Å; A93-T97 PolarHBondContact O-OG1 3.36Å; A93-L262 HydrophobicContact CB-CD2 4.06Å; A93-L262 HydrophobicContact CB-CG 4.24Å; A93-I266 HydrophobicContact CB-CD1 4.22Å
94E84Confident68.5Low1 Ų127.6 Ų27.61%0.00513%0.13CC..Hα-helixtrans-60.2-47.7169.8171.6168.616600110.1L90 C91 G96 T97 M98 L403 R407 R415 V417 V419L90-E94 PolarHBondContact O-N 3.38Å; C91-E94 PolarHBondContact O-N 3.44Å; E94-G96 PolarHBondContact O-N 2.9Å; E94-T97 PolarHBondContact O-N 2.96Å; E94-T97 PolarHBondContact O-OG1 3.48Å; E94-M98 WeakPolarHBondContact O-CB 3.33Å; E94-M98 PolarHBondContact O-N 3.27Å; E94-L403 HydrophobicContact CB-CD1 4.13Å; E94-L403 HydrophobicContact CG-CD1 4.09Å; E94-R407 IonicContact OE1-CZ 3.48Å; E94-R407 IonicContact OE1-NE 3.41Å; E94-R407 PolarHBondContact OE1-NE 2.92Å; E94-R407 IonicContact OE1-NH2 2.83Å; E94-R407 PolarHBondContact OE1-NH2 3.39Å; E94-R407 IonicContact OE2-CZ 3.89Å; E94-R407 IonicContact OE2-NH2 2.72Å; E94-R407 PolarHBondContact OE2-NH2 3.39Å; E94-R415 IonicContact OE1-NH1 3.24Å; E94-R415 PolarHBondContact OE1-NH1 3.07Å; E94-V417 WeakPolarHBondContact CB-O 3.18Å; E94-V417 VanDerWaalsContact CG-O 3.23Å; E94-V417 WeakPolarHBondContact CG-O 3.43Å; E94-V419 WeakPolarHBondContact OE2-CG2 3.37Å; E94-V419 PolarHBondContact OE2-N 3.26Å
95L81.8Confident70Confident0 Ų021 Ų210%010%0.098CC..Hα-helixtrans-62.7-42.9177-69.5174.2000112.7C91 Y92 M98 I99 Y108 T399 L403 M406C91-L95 VanDerWaalsContact O-CG 3.31Å; C91-L95 WeakPolarHBondContact O-CG 3.42Å; C91-L95 PolarHBondContact O-N 3.17Å; Y92-L95 PolarHBondContact O-N 3.41Å; L95-M98 HydrophobicContact CD2-CE 3.81Å; L95-M98 PolarHBondContact O-N 3.37Å; L95-I99 PolarHBondContact O-N 3.22Å; L95-Y108 HydrophobicContact CB-CD1 3.99Å; L95-Y108 HydrophobicContact CB-CD2 3.81Å; L95-Y108 HydrophobicContact CB-CE1 3.99Å; L95-Y108 HydrophobicContact CB-CE2 3.79Å; L95-Y108 HydrophobicContact CB-CG 3.93Å; L95-Y108 HydrophobicContact CD1-CD2 3.81Å; L95-Y108 HydrophobicContact CD1-CE2 4.41Å; L95-Y108 HydrophobicContact CD1-CG 4.14Å; L95-Y108 HydrophobicContact CG-CD2 4.39Å; L95-Y108 HydrophobicContact CG-CG 4.46Å; L95-Y108 WeakPolarHBondContact O-CE1 3.32Å; L95-T399 HydrophobicContact CD1-CG2 3.61Å; L95-L403 HydrophobicContact CD1-CB 4.32Å; L95-L403 HydrophobicContact CD1-CD1 4.5Å; L95-L403 HydrophobicContact CD2-CB 4.08Å; L95-L403 HydrophobicContact CD2-CD1 4.29Å; L95-L403 HydrophobicContact CD2-CG 4.27Å; L95-L403 HydrophobicContact CG-CB 4.32Å; L95-L403 HydrophobicContact CG-CD1 3.99Å; L95-L403 HydrophobicContact CG-CG 4.47Å; L95-M406 HydrophobicContact CD2-CE 3.21Å
96G76.3Confident71.9Confident0 Ų021 Ų210%010%0.097CC..Hα-helixtrans-74.7-22.4-179.500000114.2Y92 A93 E94 Y108Y92-G96 PolarHBondContact O-N 3.37Å; A93-G96 PolarHBondContact O-N 3.02Å; E94-G96 PolarHBondContact O-N 2.9Å; G96-Y108 WeakPolarHBondContact CA-OH 3.31Å; G96-Y108 PolarHBondContact N-OH 2.82Å
97T79.6Confident74.2Confident5 Ų512.9 Ų12.93%0.0317%0.068CC..Hα-helixtrans-88.4-26.8171.353.70000112.7A93 E94 Y259 L262 V417A93-T97 VanDerWaalsContact O-CB 3.29Å; A93-T97 WeakPolarHBondContact O-CB 3.34Å; A93-T97 VanDerWaalsContact O-CG2 3.23Å; A93-T97 WeakPolarHBondContact O-CG2 3.42Å; A93-T97 PolarHBondContact O-N 3.28Å; A93-T97 PolarHBondContact O-OG1 3.36Å; E94-T97 PolarHBondContact O-N 2.96Å; E94-T97 PolarHBondContact O-OG1 3.48Å; T97-Y259 HydrophobicContact CG2-CD1 3.92Å; T97-L262 HydrophobicContact CG2-CD2 4.27Å; T97-V417 HydrophobicContact CG2-CG2 4.09Å
98M82.3Confident76.1Confident23 Ų2312.9 Ų12.911%0.1137%0.068CC..Hα-helixtrans-79.5-40.7174.6-177.1-178.669.900112.1E94 L95 M406 L413 R415E94-M98 WeakPolarHBondContact O-CB 3.33Å; E94-M98 PolarHBondContact O-N 3.27Å; L95-M98 HydrophobicContact CD2-CE 3.81Å; L95-M98 PolarHBondContact O-N 3.37Å; M98-M406 HydrophobicContact CE-CE 3.75Å; M98-M406 HydrophobicContact CE-SD 3.62Å; M98-L413 HydrophobicContact CG-CB 4.27Å; M98-L413 HydrophobicContact CG-CD1 4.25Å; M98-L413 HydrophobicContact SD-CB 4.27Å; M98-L413 HydrophobicContact SD-CD1 3.95Å; M98-R415 HydrophobicContact SD-CG 4.32Å
99I79.6Confident77.7Confident13 Ų1312.7 Ų12.77%0.0677%0.066CC..  trans-118.287.8-179.8-55.8171.1000107.6L95 K101 Y108 E111 M406L95-I99 PolarHBondContact O-N 3.22Å; I99-K101 HydrophobicContact CG2-CB 4.07Å; I99-K101 HydrophobicContact CG2-CD 4.19Å; I99-K101 HydrophobicContact CG2-CG 4.09Å; I99-K101 PolarHBondContact O-N 3.26Å; I99-Y108 HydrophobicContact CB-CD1 4.07Å; I99-Y108 HydrophobicContact CB-CE1 4.12Å; I99-Y108 HydrophobicContact CD1-CD1 4.07Å; I99-Y108 HydrophobicContact CG2-CD1 4.4Å; I99-E111 HydrophobicContact CD1-CB 3.73Å; I99-E111 HydrophobicContact CD1-CG 3.92Å; I99-M406 HydrophobicContact CD1-CE 4.49Å; I99-M406 HydrophobicContact CD1-SD 4.17Å
100T71.4Confident79Confident75 Ų7514.9 Ų14.946%0.468%0.077SC..  trans-79.945.8178.161.30000111.8
101K71.6Confident79.9Confident111 Ų11116.4 Ų16.448%0.4838%0.083SC..  trans-105.3132.8173.5-65.7179.1-178.8170.30109I99 E111I99-K101 HydrophobicContact CG2-CB 4.07Å; I99-K101 HydrophobicContact CG2-CD 4.19Å; I99-K101 HydrophobicContact CG2-CG 4.09Å; I99-K101 PolarHBondContact O-N 3.26Å; K101-E111 IonicContact NZ-OE2 3.31Å
102S67.3Low80.4Confident1 Ų117.4 Ų17.41%0.0079%0.091CC..THydrogen-bonded Turntrans-59.4135.4170.2165.60000110.7S107 E253 R336 V340S102-S107 PolarHBondContact O-OG 3.22Å; S102-E253 WeakPolarHBondContact CB-OE1 3.43Å; S102-E253 VanDerWaalsContact CB-OE2 3.32Å; S102-E253 WeakPolarHBondContact CB-OE2 3.19Å; S102-E253 PolarHBondContact N-OE1 2.94Å; S102-R336 PolarHBondContact OG-NE 3.27Å; S102-R336 PolarHBondContact OG-NH2 3.47Å; S102-V340 WeakPolarHBondContact O-CG1 3.4Å; S102-V340 WeakPolarHBondContact OG-CG2 3.34Å
103G69Low80.9Confident0 Ų020.8 Ų20.80%011%0.106CC..THydrogen-bonded Turntrans131.4-12.9-176.200000114.2E105 Y106G103-E105 PolarHBondContact O-N 3.31Å; G103-Y106 WeakPolarHBondContact O-CB 3.08Å; G103-Y106 PolarHBondContact O-N 3.18Å
104A78.1Confident81.4Confident1 Ų122 Ų221%0.00812%0.119CC..THydrogen-bonded Turntrans47.9-118.2-179.800000112Y106 S107 Y108 N249 F250A104-Y106 PolarHBondContact O-N 3.03Å; A104-S107 WeakPolarHBondContact O-CB 3.25Å; A104-S107 PolarHBondContact O-N 3.49Å; A104-Y108 VanDerWaalsContact C-CE2 3.45Å; A104-Y108 HydrophobicContact CB-CE2 4.37Å; A104-Y108 WeakPolarHBondContact O-CD1 3.41Å; A104-Y108 WeakPolarHBondContact O-CD2 3.22Å; A104-Y108 PolarHBondContact O-N 3.32Å; A104-N249 HydrophobicContact CB-CB 4.08Å; A104-F250 HydrophobicContact CB-CD1 3.62Å; A104-F250 HydrophobicContact CB-CD2 3.87Å; A104-F250 HydrophobicContact CB-CE1 3.61Å; A104-F250 HydrophobicContact CB-CE2 3.88Å; A104-F250 HydrophobicContact CB-CG 3.76Å; A104-F250 HydrophobicContact CB-CZ 3.76Å
105E84Confident81.5Confident0 Ų024.5 Ų24.50%014%0.136CC..Hα-helixtrans-54-37-177.2-66.1169.3-176.900113.1Y92 G103 S107 Y108 L109 Y121 N246 Y396 T399Y92-E105 HydrophobicContact CE1-CG 3.41Å; Y92-E105 VanDerWaalsContact CE1-CG 3.41Å; Y92-E105 WeakPolarHBondContact CE1-OE1 3.11Å; Y92-E105 VanDerWaalsContact CZ-OE1 3.24Å; Y92-E105 WeakPolarHBondContact OH-CG 3.44Å; Y92-E105 PolarHBondContact OH-OE1 3.3Å; G103-E105 PolarHBondContact O-N 3.31Å; E105-S107 VanDerWaalsContact C-N 3.34Å; E105-S107 PolarHBondContact O-N 3.43Å; E105-Y108 PolarHBondContact O-N 3.41Å; E105-L109 WeakPolarHBondContact O-CB 3.49Å; E105-L109 VanDerWaalsContact O-CG 3.22Å; E105-L109 WeakPolarHBondContact O-CG 3.25Å; E105-L109 PolarHBondContact O-N 3.36Å; E105-Y121 HydrophobicContact CB-CD1 4.43Å; E105-Y121 HydrophobicContact CB-CD2 4.45Å; E105-Y121 HydrophobicContact CB-CE1 3.79Å; E105-Y121 HydrophobicContact CB-CE2 3.8Å; E105-Y121 VanDerWaalsContact CB-CZ 3.42Å; E105-Y121 WeakPolarHBondContact CB-OH 3.39Å; E105-Y121 HydrophobicContact CG-CE2 4.5Å; E105-Y121 WeakPolarHBondContact OE2-CE2 3.14Å; E105-Y121 PolarHBondContact OE2-OH 3.2Å; E105-N246 PolarHBondContact OE1-ND2 3.04Å; E105-Y396 WeakPolarHBondContact OE1-CD1 3.18Å; E105-Y396 WeakPolarHBondContact OE1-CE1 3.44Å; E105-T399 HydrophobicContact CG-CG2 4.35Å
106Y86.1Confident81.8Confident3 Ų327.8 Ų27.81%0.01215%0.153CC..Hα-helixtrans-59.5-46.4176.7173.4-100.6000111.7G103 A104 M110 A118 Y121 V340 E344 H346G103-Y106 WeakPolarHBondContact O-CB 3.08Å; G103-Y106 PolarHBondContact O-N 3.18Å; A104-Y106 PolarHBondContact O-N 3.03Å; Y106-M110 HydrophobicContact CE1-CE 4.39Å; Y106-M110 HydrophobicContact CE2-CE 4.28Å; Y106-M110 WeakPolarHBondContact O-CB 3.42Å; Y106-M110 PolarHBondContact O-N 3.14Å; Y106-M110 WeakPolarHBondContact OH-CE 3.47Å; Y106-A118 HydrophobicContact CD2-CB 3.99Å; Y106-A118 VanDerWaalsContact CD2-O 3.24Å; Y106-A118 WeakPolarHBondContact CD2-O 3.19Å; Y106-A118 HydrophobicContact CE2-CB 3.74Å; Y106-A118 WeakPolarHBondContact CE2-O 3.41Å; Y106-Y121 HydrophobicContact CD2-CD1 4.39Å; Y106-V340 HydrophobicContact CD1-CG1 3.86Å; Y106-V340 HydrophobicContact CE1-CG1 4.04Å; Y106-E344 HydrophobicContact CE1-CB 4.41Å; Y106-E344 HydrophobicContact CE1-CG 3.91Å; Y106-E344 VanDerWaalsContact OH-CB 3.25Å; Y106-E344 WeakPolarHBondContact OH-CB 3.49Å; Y106-H346 PolarHBondContact OH-CD2 2.88Å
107S84.4Confident82.4Confident12 Ų1229.1 Ų29.18%0.08416%0.162CC..Hα-helixtrans-70.3-35.5179.6-56.80000111.7S102 A104 E105 M110 E111S102-S107 PolarHBondContact O-OG 3.22Å; A104-S107 WeakPolarHBondContact O-CB 3.25Å; A104-S107 PolarHBondContact O-N 3.49Å; E105-S107 VanDerWaalsContact C-N 3.34Å; E105-S107 PolarHBondContact O-N 3.43Å; S107-M110 PolarHBondContact O-N 3.22Å; S107-E111 PolarHBondContact O-N 2.92Å
108Y86.9Confident82.8Confident0 Ų028.9 Ų28.90%016%0.16CC..Hα-helixtrans-67.8-44.9177.7-51.2-27000111.6Y92 L95 G96 I99 A104 E105 M110 E111 A112 T399Y92-Y108 HydrophobicContact CD1-CE2 4.23Å; L95-Y108 HydrophobicContact CB-CD1 3.99Å; L95-Y108 HydrophobicContact CB-CD2 3.81Å; L95-Y108 HydrophobicContact CB-CE1 3.99Å; L95-Y108 HydrophobicContact CB-CE2 3.79Å; L95-Y108 HydrophobicContact CB-CG 3.93Å; L95-Y108 HydrophobicContact CD1-CD2 3.81Å; L95-Y108 HydrophobicContact CD1-CE2 4.41Å; L95-Y108 HydrophobicContact CD1-CG 4.14Å; L95-Y108 HydrophobicContact CG-CD2 4.39Å; L95-Y108 HydrophobicContact CG-CG 4.46Å; L95-Y108 WeakPolarHBondContact O-CE1 3.32Å; G96-Y108 WeakPolarHBondContact CA-OH 3.31Å; G96-Y108 PolarHBondContact N-OH 2.82Å; I99-Y108 HydrophobicContact CB-CD1 4.07Å; I99-Y108 HydrophobicContact CB-CE1 4.12Å; I99-Y108 HydrophobicContact CD1-CD1 4.07Å; I99-Y108 HydrophobicContact CG2-CD1 4.4Å; A104-Y108 VanDerWaalsContact C-CE2 3.45Å; A104-Y108 HydrophobicContact CB-CE2 4.37Å; A104-Y108 WeakPolarHBondContact O-CD1 3.41Å; A104-Y108 WeakPolarHBondContact O-CD2 3.22Å; A104-Y108 PolarHBondContact O-N 3.32Å; E105-Y108 PolarHBondContact O-N 3.41Å; Y108-M110 VanDerWaalsContact C-N 3.32Å; Y108-E111 PolarHBondContact O-N 2.88Å; Y108-A112 WeakPolarHBondContact O-CB 2.91Å; Y108-A112 PolarHBondContact O-N 3.36Å; Y108-A112 VanDerWaalsContact O-N 3.17Å; Y108-T399 HydrophobicContact CD2-CG2 3.97Å
109L88.9Confident83.1Confident0 Ų028.3 Ų28.30%016%0.157CC..Hα-helixtrans-68-34.2177.8-68.1174000111.9E105 F113 G114 V117 Y121 F395 L398 A402E105-L109 WeakPolarHBondContact O-CB 3.49Å; E105-L109 VanDerWaalsContact O-CG 3.22Å; E105-L109 WeakPolarHBondContact O-CG 3.25Å; E105-L109 PolarHBondContact O-N 3.36Å; L109-F113 HydrophobicContact CD2-CD2 3.9Å; L109-F113 HydrophobicContact CD2-CE2 4.17Å; L109-F113 PolarHBondContact O-N 3.29Å; L109-G114 PolarHBondContact O-N 3.26Å; L109-V117 HydrophobicContact CB-CG1 4.2Å; L109-V117 HydrophobicContact CD1-CG1 4.28Å; L109-V117 HydrophobicContact CD2-CG1 4.06Å; L109-V117 HydrophobicContact CG-CG1 4.42Å; L109-Y121 HydrophobicContact CD1-CD2 4.05Å; L109-Y121 HydrophobicContact CD1-CG 3.81Å; L109-F395 HydrophobicContact CD1-CD1 4.36Å; L109-L398 HydrophobicContact CD2-CB 4.32Å; L109-L398 HydrophobicContact CD2-CD2 4.11Å; L109-L398 HydrophobicContact CD2-CG 3.76Å; L109-A402 HydrophobicContact CD2-CB 4.34Å
110M88.1Confident83.6Confident48 Ų4828.8 Ų28.824%0.23616%0.159CC..Hα-helixtrans-61.2-45.4174.2-175.664.678.800111.7Y106 S107 Y108 G114 A118 H346Y106-M110 HydrophobicContact CE1-CE 4.39Å; Y106-M110 HydrophobicContact CE2-CE 4.28Å; Y106-M110 WeakPolarHBondContact O-CB 3.42Å; Y106-M110 PolarHBondContact O-N 3.14Å; Y106-M110 WeakPolarHBondContact OH-CE 3.47Å; S107-M110 PolarHBondContact O-N 3.22Å; Y108-M110 VanDerWaalsContact C-N 3.32Å; M110-G114 VanDerWaalsContact O-CA 3.24Å; M110-G114 WeakPolarHBondContact O-CA 3.49Å; M110-G114 PolarHBondContact O-N 3.21Å; M110-G114 VanDerWaalsContact O-N 3.14Å; M110-A118 HydrophobicContact CB-CB 3.87Å; M110-A118 HydrophobicContact CE-CB 3.6Å; M110-A118 HydrophobicContact SD-CB 4.03Å; M110-H346 WeakPolarHBondContact CE-NE2 3.48Å
111E86.9Confident84.5Confident51 Ų5125.3 Ų25.324%0.23814%0.138CC..Hα-helixtrans-72.8-30.4-177.2-16165.9-140.400112.9I99 K101 S107 Y108 M406 R410I99-E111 HydrophobicContact CD1-CB 3.73Å; I99-E111 HydrophobicContact CD1-CG 3.92Å; K101-E111 IonicContact NZ-OE2 3.31Å; S107-E111 PolarHBondContact O-N 2.92Å; Y108-E111 PolarHBondContact O-N 2.88Å; E111-M406 HydrophobicContact CB-SD 4.48Å; E111-R410 IonicContact OE1-CZ 2.98Å; E111-R410 IonicContact OE1-NE 3.41Å; E111-R410 PolarHBondContact OE1-NE 3.48Å; E111-R410 IonicContact OE1-NH1 3.52Å; E111-R410 IonicContact OE1-NH2 3.81Å; E111-R410 PolarHBondContact OE1-NH2 3.46Å
112A88.1Confident85.3Confident21 Ų2120 Ų2017%0.17412%0.115CC..Hα-helixtrans-90.5-46.7-175.900000114.4Y108 A402 M406Y108-A112 WeakPolarHBondContact O-CB 2.91Å; Y108-A112 PolarHBondContact O-N 3.36Å; Y108-A112 VanDerWaalsContact O-N 3.17Å; A112-A402 HydrophobicContact CB-CB 3.56Å; A112-M406 HydrophobicContact CB-CE 4.1Å; A112-M406 HydrophobicContact CB-CG 3.9Å; A112-M406 HydrophobicContact CB-SD 4.04Å
113F87.8Confident86.4Confident72 Ų7221.1 Ų21.132%0.31612%0.119SC..Hα-helixtrans-117.1-6.6-172.5-62.2-65.1000113.5L109 V117 L398 L401 A402 V405L109-F113 HydrophobicContact CD2-CD2 3.9Å; L109-F113 HydrophobicContact CD2-CE2 4.17Å; L109-F113 PolarHBondContact O-N 3.29Å; F113-V117 HydrophobicContact CB-CB 3.8Å; F113-V117 HydrophobicContact CB-CG1 4.22Å; F113-V117 HydrophobicContact CB-CG2 3.68Å; F113-V117 HydrophobicContact CD2-CG1 4.21Å; F113-V117 HydrophobicContact CG-CG2 4.36Å; F113-L398 HydrophobicContact CD2-CD1 4.28Å; F113-L398 HydrophobicContact CD2-CG 4.37Å; F113-L398 HydrophobicContact CE2-CD1 3.69Å; F113-L398 HydrophobicContact CE2-CG 3.99Å; F113-L398 HydrophobicContact CZ-CD1 4.05Å; F113-L401 HydrophobicContact CZ-CD2 4.17Å; F113-L401 HydrophobicContact CZ-CG 4.16Å; F113-A402 HydrophobicContact CD2-CB 4.25Å; F113-A402 HydrophobicContact CE2-CB 3.66Å; F113-A402 HydrophobicContact CZ-CB 4.39Å; F113-V405 HydrophobicContact CE1-CG2 4.17Å; F113-V405 HydrophobicContact CZ-CG2 4.22Å
114G86.9Confident87.4Confident25 Ų2521.1 Ų21.126%0.25812%0.119SC..  trans85.1-166.5179.100000114.5L109 M110 L116 A118L109-G114 PolarHBondContact O-N 3.26Å; M110-G114 VanDerWaalsContact O-CA 3.24Å; M110-G114 WeakPolarHBondContact O-CA 3.49Å; M110-G114 PolarHBondContact O-N 3.21Å; M110-G114 VanDerWaalsContact O-N 3.14Å; G114-L116 PolarHBondContact O-N 2.91Å; G114-A118 PolarHBondContact O-N 3.33Å
115S85.5Confident87.9Confident53 Ų5321.2 Ų21.237%0.37112%0.119SC..Hα-helixtrans-68.8-29.6-165.551.10000115.4Y119 Y461S115-Y119 VanDerWaalsContact O-CB 3.25Å; S115-Y119 WeakPolarHBondContact O-CB 3.05Å; S115-Y119 PolarHBondContact O-N 2.96Å; S115-Y461 PolarHBondContact OG-OH 2.89Å; S115-Y461 VanDerWaalsContact OG-OH 3.04Å
116L88.1Confident88.1Confident69 Ų6921.5 Ų21.536%0.36112%0.121SC..Hα-helixtrans-66.7-51.7-178.6-175.272.5000111.4G114 Y119 L120 L458 Y461G114-L116 PolarHBondContact O-N 2.91Å; L116-Y119 WeakPolarHBondContact O-CB 3.13Å; L116-Y119 PolarHBondContact O-N 3.47Å; L116-L120 WeakPolarHBondContact O-CG 3.07Å; L116-L120 PolarHBondContact O-N 3.02Å; L116-L458 HydrophobicContact CD1-CD2 3.58Å; L116-L458 HydrophobicContact CG-CD2 4.23Å; L116-Y461 HydrophobicContact CD1-CD1 3.43Å; L116-Y461 VanDerWaalsContact CD1-CD1 3.43Å; L116-Y461 HydrophobicContact CD1-CE1 3.37Å; L116-Y461 HydrophobicContact CD1-CE2 4.47Å; L116-Y461 HydrophobicContact CD1-CG 4.03Å
117V89.6Confident88.1Confident29 Ų2923.1 Ų23.118%0.17613%0.129CC..Hα-helixtrans-69.5-41.3-177.1176.60000110.7L109 F113 Y119 L120 Y121 L398L109-V117 HydrophobicContact CB-CG1 4.2Å; L109-V117 HydrophobicContact CD1-CG1 4.28Å; L109-V117 HydrophobicContact CD2-CG1 4.06Å; L109-V117 HydrophobicContact CG-CG1 4.42Å; F113-V117 HydrophobicContact CB-CB 3.8Å; F113-V117 HydrophobicContact CB-CG1 4.22Å; F113-V117 HydrophobicContact CB-CG2 3.68Å; F113-V117 HydrophobicContact CD2-CG1 4.21Å; F113-V117 HydrophobicContact CG-CG2 4.36Å; V117-Y119 VanDerWaalsContact C-N 3.29Å; V117-Y119 PolarHBondContact O-N 2.9Å; V117-L120 PolarHBondContact O-N 3.03Å; V117-Y121 PolarHBondContact O-N 3.46Å; V117-L398 HydrophobicContact CG1-CD2 3.31Å; V117-L398 HydrophobicContact CG1-CG 4.2Å
118A87.9Confident88.3Confident0 Ų022.6 Ų22.60%013%0.126CC..Hα-helixtrans-60.3-40174.100000111.8Y106 M110 G114 Y121 S122Y106-A118 HydrophobicContact CD2-CB 3.99Å; Y106-A118 VanDerWaalsContact CD2-O 3.24Å; Y106-A118 WeakPolarHBondContact CD2-O 3.19Å; Y106-A118 HydrophobicContact CE2-CB 3.74Å; Y106-A118 WeakPolarHBondContact CE2-O 3.41Å; M110-A118 HydrophobicContact CB-CB 3.87Å; M110-A118 HydrophobicContact CE-CB 3.6Å; M110-A118 HydrophobicContact SD-CB 4.03Å; G114-A118 PolarHBondContact O-N 3.33Å; A118-Y121 PolarHBondContact O-N 3.26Å; A118-S122 PolarHBondContact O-N 3.34Å
119Y89Confident88.3Confident11 Ų1122.8 Ų22.84%0.04313%0.126CC..Hα-helixtrans-62.8-49174.2176.2-90.8000111.9S115 L116 V117 Y121 S122 W123 H346 G457 L460 Y461 V465S115-Y119 VanDerWaalsContact O-CB 3.25Å; S115-Y119 WeakPolarHBondContact O-CB 3.05Å; S115-Y119 PolarHBondContact O-N 2.96Å; L116-Y119 WeakPolarHBondContact O-CB 3.13Å; L116-Y119 PolarHBondContact O-N 3.47Å; V117-Y119 VanDerWaalsContact C-N 3.29Å; V117-Y119 PolarHBondContact O-N 2.9Å; Y119-Y121 VanDerWaalsContact C-N 3.26Å; Y119-Y121 PolarHBondContact O-N 3.37Å; Y119-S122 PolarHBondContact O-N 2.67Å; Y119-S122 PolarHBondContact O-OG 2.65Å; Y119-W123 HydrophobicContact CE1-CB 4.24Å; Y119-W123 WeakPolarHBondContact O-CB 3.43Å; Y119-W123 PolarHBondContact O-N 2.85Å; Y119-H346 HydrophobicContact CD2-CB 3.98Å; Y119-H346 AromaticContact CD2-ND1 3.8Å; Y119-H346 VanDerWaalsContact CD2-O 3.31Å; Y119-H346 WeakPolarHBondContact CD2-O 3.26Å; Y119-H346 WeakPolarHBondContact CE2-O 3.5Å; Y119-G457 VanDerWaalsContact CE1-O 3.22Å; Y119-G457 WeakPolarHBondContact CE1-O 3.3Å; Y119-L460 WeakPolarHBondContact OH-CB 3.4Å; Y119-Y461 AromaticContact CD1-CD2 3.56Å; Y119-Y461 HydrophobicContact CD1-CD2 3.56Å; Y119-Y461 HydrophobicContact CD1-CG 4.06Å; Y119-Y461 AromaticContact CD2-CD2 3.82Å; Y119-Y461 HydrophobicContact CD2-CD2 3.82Å; Y119-Y461 HydrophobicContact CD2-CE2 4.47Å; Y119-Y461 HydrophobicContact CE1-CD2 4.15Å; Y119-Y461 HydrophobicContact CE1-CG 4.39Å; Y119-Y461 HydrophobicContact CE2-CD2 4.32Å; Y119-Y461 AromaticContact CG-CD2 3.38Å; Y119-Y461 HydrophobicContact CG-CD2 3.38Å; Y119-Y461 HydrophobicContact CG-CE2 4.03Å; Y119-Y461 HydrophobicContact CG-CG 4.32Å; Y119-V465 HydrophobicContact CD2-CG2 3.92Å; Y119-V465 HydrophobicContact CE2-CG2 3.8Å
120L90.4Very high88.3Confident22 Ų2224.2 Ų24.212%0.11513%0.132CC..Hα-helixtrans-57.8-40.9178.6-73.2179000112.1L116 V117 W123 T124 I454 L458L116-L120 WeakPolarHBondContact O-CG 3.07Å; L116-L120 PolarHBondContact O-N 3.02Å; V117-L120 PolarHBondContact O-N 3.03Å; L120-W123 PolarHBondContact O-N 3.03Å; L120-T124 PolarHBondContact O-N 3.3Å; L120-T124 PolarHBondContact O-OG1 2.57Å; L120-I454 WeakPolarHBondContact CD2-O 3.47Å; L120-L458 HydrophobicContact CD1-CD2 4.04Å; L120-L458 HydrophobicContact CD2-CD2 3.87Å; L120-L458 HydrophobicContact CD2-CG 3.99Å; L120-L458 HydrophobicContact CG-CD2 4.18Å
121Y89.8Confident88.3Confident3 Ų321.9 Ų21.91%0.01212%0.121CC..Hα-helixtrans-60.2-51.9172.1174.3-99.2000111.6E105 Y106 L109 V117 A118 Y119 W123 T124 T125 L337 F395E105-Y121 HydrophobicContact CB-CD1 4.43Å; E105-Y121 HydrophobicContact CB-CD2 4.45Å; E105-Y121 HydrophobicContact CB-CE1 3.79Å; E105-Y121 HydrophobicContact CB-CE2 3.8Å; E105-Y121 VanDerWaalsContact CB-CZ 3.42Å; E105-Y121 WeakPolarHBondContact CB-OH 3.39Å; E105-Y121 HydrophobicContact CG-CE2 4.5Å; E105-Y121 WeakPolarHBondContact OE2-CE2 3.14Å; E105-Y121 PolarHBondContact OE2-OH 3.2Å; Y106-Y121 HydrophobicContact CD2-CD1 4.39Å; L109-Y121 HydrophobicContact CD1-CD2 4.05Å; L109-Y121 HydrophobicContact CD1-CG 3.81Å; V117-Y121 PolarHBondContact O-N 3.46Å; A118-Y121 PolarHBondContact O-N 3.26Å; Y119-Y121 VanDerWaalsContact C-N 3.26Å; Y119-Y121 PolarHBondContact O-N 3.37Å; Y121-W123 VanDerWaalsContact C-N 3.28Å; Y121-W123 PolarHBondContact O-N 3.03Å; Y121-T124 PolarHBondContact O-N 3.08Å; Y121-T125 VanDerWaalsContact CE2-OG1 3.24Å; Y121-T125 WeakPolarHBondContact CE2-OG1 2.93Å; Y121-T125 VanDerWaalsContact CZ-OG1 3.3Å; Y121-T125 WeakPolarHBondContact O-CB 3.46Å; Y121-T125 PolarHBondContact O-N 3.37Å; Y121-T125 PolarHBondContact O-OG1 3.26Å; Y121-L337 HydrophobicContact CE1-CD1 4.19Å; Y121-L337 HydrophobicContact CE1-CD2 4.47Å; Y121-F395 HydrophobicContact CD2-CB 3.95Å; Y121-F395 AromaticContact CD2-CD1 3.66Å; Y121-F395 HydrophobicContact CD2-CD1 3.66Å; Y121-F395 HydrophobicContact CD2-CD2 4.27Å; Y121-F395 HydrophobicContact CD2-CE1 4.2Å; Y121-F395 AromaticContact CD2-CG 3.69Å; Y121-F395 HydrophobicContact CD2-CG 3.69Å; Y121-F395 HydrophobicContact CE2-CB 4.21Å; Y121-F395 HydrophobicContact CE2-CG 4.36Å; Y121-F395 HydrophobicContact CG-CD1 4.34Å
122S89Confident88.5Confident0 Ų019.5 Ų19.50%011%0.11CC..Hα-helixtrans-60.7-37.8-179.870.90000113A118 Y119 V126A118-S122 PolarHBondContact O-N 3.34Å; Y119-S122 PolarHBondContact O-N 2.67Å; Y119-S122 PolarHBondContact O-OG 2.65Å; S122-V126 VanDerWaalsContact O-CB 3.31Å; S122-V126 WeakPolarHBondContact O-CB 3.47Å; S122-V126 VanDerWaalsContact O-CG2 3.31Å; S122-V126 WeakPolarHBondContact O-CG2 3.24Å; S122-V126 PolarHBondContact O-N 3.4Å; S122-V126 VanDerWaalsContact O-N 3.07Å
123W89.9Confident88.5Confident23 Ų2319 Ų199%0.08711%0.105CC..Hα-helixtrans-62.4-54.8176.3168.9-103.4000110.9Y119 L120 Y121 T125 M127 F453 L460Y119-W123 HydrophobicContact CE1-CB 4.24Å; Y119-W123 WeakPolarHBondContact O-CB 3.43Å; Y119-W123 PolarHBondContact O-N 2.85Å; L120-W123 PolarHBondContact O-N 3.03Å; Y121-W123 VanDerWaalsContact C-N 3.28Å; Y121-W123 PolarHBondContact O-N 3.03Å; W123-T125 VanDerWaalsContact C-N 3.34Å; W123-T125 PolarHBondContact O-N 2.96Å; W123-M127 HydrophobicContact CD2-CG 4.08Å; W123-M127 HydrophobicContact CE3-CG 3.83Å; W123-M127 HydrophobicContact CH2-CE 3.59Å; W123-M127 HydrophobicContact CH2-CG 4.09Å; W123-M127 HydrophobicContact CZ2-CE 4.35Å; W123-M127 HydrophobicContact CZ2-CG 4.31Å; W123-M127 HydrophobicContact CZ3-CE 3.82Å; W123-M127 HydrophobicContact CZ3-CG 3.83Å; W123-M127 HydrophobicContact CZ3-SD 4.32Å; W123-M127 VanDerWaalsContact O-CB 3.27Å; W123-M127 WeakPolarHBondContact O-CB 3.4Å; W123-M127 WeakPolarHBondContact O-CG 3.38Å; W123-M127 PolarHBondContact O-N 3.31Å; W123-F453 AromaticContact CE2-CE1 3.6Å; W123-F453 AromaticContact CE2-CZ 3.83Å; W123-F453 HydrophobicContact CH2-CZ 4.26Å; W123-F453 AromaticContact CZ2-CE1 3.76Å; W123-F453 HydrophobicContact CZ2-CE1 3.76Å; W123-F453 HydrophobicContact CZ2-CE2 4.15Å; W123-F453 AromaticContact CZ2-CZ 3.46Å; W123-F453 HydrophobicContact CZ2-CZ 3.46Å; W123-F453 VanDerWaalsContact CZ2-CZ 3.46Å; W123-F453 AromaticContact NE1-CD1 3.72Å; W123-F453 AromaticContact NE1-CE1 3.33Å; W123-F453 VanDerWaalsContact NE1-CE1 3.33Å; W123-F453 AromaticContact NE1-CZ 3.99Å; W123-F453 PolarHBondContact NE1-O 3.21Å; W123-L460 HydrophobicContact CE3-CD1 4.37Å; W123-L460 HydrophobicContact CH2-CD1 3.41Å; W123-L460 VanDerWaalsContact CH2-CD1 3.41Å; W123-L460 HydrophobicContact CZ2-CD1 4.18Å; W123-L460 HydrophobicContact CZ3-CD1 3.53Å
124T90.6Very high88.5Confident0 Ų015.5 Ų15.50%09%0.09CC..Hα-helixtrans-65.5-39.5-179-53.50000111.3L120 Y121 V126 V128 L129 A391 F395 I454L120-T124 PolarHBondContact O-N 3.3Å; L120-T124 PolarHBondContact O-OG1 2.57Å; Y121-T124 PolarHBondContact O-N 3.08Å; T124-V126 PolarHBondContact O-N 3.41Å; T124-V128 HydrophobicContact CG2-CB 4.03Å; T124-V128 HydrophobicContact CG2-CG1 4.42Å; T124-V128 HydrophobicContact CG2-CG2 4.43Å; T124-V128 VanDerWaalsContact O-CA 3.32Å; T124-V128 WeakPolarHBondContact O-CA 3.36Å; T124-V128 VanDerWaalsContact O-CB 3.22Å; T124-V128 WeakPolarHBondContact O-CB 3.25Å; T124-V128 PolarHBondContact O-N 2.87Å; T124-L129 HydrophobicContact CG2-CG 4.39Å; T124-L129 PolarHBondContact O-N 3.05Å; T124-A391 HydrophobicContact CG2-CB 4.13Å; T124-F395 HydrophobicContact CG2-CE2 3.71Å; T124-I454 HydrophobicContact CG2-CD1 4.5Å; T124-I454 HydrophobicContact CG2-CG1 3.92Å
125T88.4Confident88.7Confident3 Ų314.3 Ų14.32%0.0188%0.078CC..Iπ-helixtrans-68.9-40.6-177.7-54.50000112.5Y121 W123 L129 K130 L337Y121-T125 VanDerWaalsContact CE2-OG1 3.24Å; Y121-T125 WeakPolarHBondContact CE2-OG1 2.93Å; Y121-T125 VanDerWaalsContact CZ-OG1 3.3Å; Y121-T125 WeakPolarHBondContact O-CB 3.46Å; Y121-T125 PolarHBondContact O-N 3.37Å; Y121-T125 PolarHBondContact O-OG1 3.26Å; W123-T125 VanDerWaalsContact C-N 3.34Å; W123-T125 PolarHBondContact O-N 2.96Å; T125-L129 HydrophobicContact CG2-CB 4.26Å; T125-L129 HydrophobicContact CG2-CD1 4.28Å; T125-L129 PolarHBondContact O-N 3.09Å; T125-K130 HydrophobicContact CG2-CG 3.94Å; T125-K130 WeakPolarHBondContact O-CB 3.41Å; T125-K130 WeakPolarHBondContact O-CG 3.45Å; T125-K130 PolarHBondContact O-N 3.01Å; T125-L337 HydrophobicContact CG2-CD2 3.15Å
126V86.8Confident88.9Confident7 Ų711.8 Ų11.84%0.0426%0.06CC..Iπ-helixtrans-76.1-35.8-179.5170.30000112.3S122 T124 P131 L337 M347 F367S122-V126 VanDerWaalsContact O-CB 3.31Å; S122-V126 WeakPolarHBondContact O-CB 3.47Å; S122-V126 VanDerWaalsContact O-CG2 3.31Å; S122-V126 WeakPolarHBondContact O-CG2 3.24Å; S122-V126 PolarHBondContact O-N 3.4Å; S122-V126 VanDerWaalsContact O-N 3.07Å; T124-V126 PolarHBondContact O-N 3.41Å; V126-P131 VanDerWaalsContact O-CD 3.29Å; V126-P131 WeakPolarHBondContact O-CD 3.47Å; V126-P131 VanDerWaalsContact O-CG 3.26Å; V126-P131 WeakPolarHBondContact O-CG 3.37Å; V126-L337 HydrophobicContact CG2-CD2 4.27Å; V126-M347 HydrophobicContact CB-CE 3.92Å; V126-M347 HydrophobicContact CG1-CE 4.07Å; V126-M347 HydrophobicContact CG2-CE 3.99Å; V126-F367 HydrophobicContact CG1-CD1 4.15Å; V126-F367 HydrophobicContact CG1-CE1 3.81Å
127M87.6Confident89Confident37 Ų379.1 Ų9.118%0.1825%0.046CC..Iπ-helixtrans-93.5-28.4-175.5-62.9-65.2-9500114.2W123 F367 L371 Y375 F453W123-M127 HydrophobicContact CD2-CG 4.08Å; W123-M127 HydrophobicContact CE3-CG 3.83Å; W123-M127 HydrophobicContact CH2-CE 3.59Å; W123-M127 HydrophobicContact CH2-CG 4.09Å; W123-M127 HydrophobicContact CZ2-CE 4.35Å; W123-M127 HydrophobicContact CZ2-CG 4.31Å; W123-M127 HydrophobicContact CZ3-CE 3.82Å; W123-M127 HydrophobicContact CZ3-CG 3.83Å; W123-M127 HydrophobicContact CZ3-SD 4.32Å; W123-M127 VanDerWaalsContact O-CB 3.27Å; W123-M127 WeakPolarHBondContact O-CB 3.4Å; W123-M127 WeakPolarHBondContact O-CG 3.38Å; W123-M127 PolarHBondContact O-N 3.31Å; M127-F367 HydrophobicContact CE-CZ 4.33Å; M127-F367 HydrophobicContact SD-CE1 3.71Å; M127-F367 HydrophobicContact SD-CZ 3.51Å; M127-F367 VanDerWaalsContact SD-CZ 3.51Å; M127-L371 HydrophobicContact SD-CD1 3.85Å; M127-Y375 WeakPolarHBondContact O-CE2 3.42Å; M127-Y375 PolarHBondContact O-OH 3.33Å; M127-F453 HydrophobicContact CB-CE1 3.49Å; M127-F453 VanDerWaalsContact CB-CE1 3.49Å; M127-F453 HydrophobicContact CB-CZ 3.49Å; M127-F453 VanDerWaalsContact CB-CZ 3.49Å; M127-F453 HydrophobicContact CE-CZ 4.33Å; M127-F453 HydrophobicContact CG-CE1 4.25Å; M127-F453 HydrophobicContact CG-CZ 4.06Å
128V87.7Confident89Confident1 Ų17.8 Ų7.81%0.0064%0.038CC..Iπ-helixtrans-115.8-67.6-175169.50000110.4T124 K130 P131 S132 Y387 A391 F453T124-V128 HydrophobicContact CG2-CB 4.03Å; T124-V128 HydrophobicContact CG2-CG1 4.42Å; T124-V128 HydrophobicContact CG2-CG2 4.43Å; T124-V128 VanDerWaalsContact O-CA 3.32Å; T124-V128 WeakPolarHBondContact O-CA 3.36Å; T124-V128 VanDerWaalsContact O-CB 3.22Å; T124-V128 WeakPolarHBondContact O-CB 3.25Å; T124-V128 PolarHBondContact O-N 2.87Å; V128-K130 PolarHBondContact O-N 2.98Å; V128-P131 WeakPolarHBondContact O-CD 3.42Å; V128-S132 WeakPolarHBondContact O-CB 3.46Å; V128-S132 PolarHBondContact O-N 3.02Å; V128-S132 PolarHBondContact O-OG 2.87Å; V128-Y387 HydrophobicContact CB-CE1 4.32Å; V128-Y387 HydrophobicContact CG1-CD1 4.04Å; V128-Y387 HydrophobicContact CG1-CE1 3.3Å; V128-Y387 HydrophobicContact CG2-CE1 4.28Å; V128-Y387 WeakPolarHBondContact CG2-OH 3.42Å; V128-A391 HydrophobicContact CG1-CB 4.47Å; V128-F453 HydrophobicContact CG2-CD1 3.35Å; V128-F453 HydrophobicContact CG2-CE1 3.52Å; V128-F453 HydrophobicContact CG2-CG 4.12Å; V128-F453 HydrophobicContact CG2-CZ 4.36Å
129L88.3Confident89.1Confident3 Ų38 Ų82%0.0164%0.039CC..Iπ-helixtrans-63.3-49.3-164.3-61.9172.3000113.1T124 T125 S133 F388 A391 Q392T124-L129 HydrophobicContact CG2-CG 4.39Å; T124-L129 PolarHBondContact O-N 3.05Å; T125-L129 HydrophobicContact CG2-CB 4.26Å; T125-L129 HydrophobicContact CG2-CD1 4.28Å; T125-L129 PolarHBondContact O-N 3.09Å; L129-S133 WeakPolarHBondContact O-CB 3.44Å; L129-S133 PolarHBondContact O-N 2.88Å; L129-F388 HydrophobicContact CB-CD2 4.26Å; L129-F388 HydrophobicContact CB-CE2 3.98Å; L129-F388 HydrophobicContact CD2-CD2 3.7Å; L129-F388 HydrophobicContact CD2-CE2 3.85Å; L129-F388 HydrophobicContact CD2-CG 4.4Å; L129-F388 WeakPolarHBondContact O-CE2 3.35Å; L129-A391 HydrophobicContact CD2-CB 3.64Å; L129-A391 HydrophobicContact CG-CB 4.45Å; L129-Q392 HydrophobicContact CD2-CB 3.96Å
130K87.9Confident89.2Confident30 Ų307.5 Ų7.513%0.134%0.037CC..Hα-helixtrans-69.2-47.1-177.7-65.7-67.8179.5-176.40112.7T125 V128 F134 T333 A334T125-K130 HydrophobicContact CG2-CG 3.94Å; T125-K130 WeakPolarHBondContact O-CB 3.41Å; T125-K130 WeakPolarHBondContact O-CG 3.45Å; T125-K130 PolarHBondContact O-N 3.01Å; V128-K130 PolarHBondContact O-N 2.98Å; K130-F134 WeakPolarHBondContact O-CB 3.46Å; K130-F134 PolarHBondContact O-N 3.45Å; K130-T333 PolarHBondContact NZ-OG1 2.56Å; K130-A334 HydrophobicContact CB-CB 4.23Å; K130-A334 HydrophobicContact CD-CB 4.3Å; K130-A334 HydrophobicContact CG-CB 4.25Å
131P89Confident89.2Confident0 Ų08.3 Ų8.30%04%0.04CC..Hα-helixtrans-63.4-42.7175.4-24.934.8000113.2V126 V128 F134 A135 N368 L371 A372 Y375V126-P131 VanDerWaalsContact O-CD 3.29Å; V126-P131 WeakPolarHBondContact O-CD 3.47Å; V126-P131 VanDerWaalsContact O-CG 3.26Å; V126-P131 WeakPolarHBondContact O-CG 3.37Å; V128-P131 WeakPolarHBondContact O-CD 3.42Å; P131-F134 PolarHBondContact O-N 3.09Å; P131-A135 WeakPolarHBondContact O-CB 3.28Å; P131-A135 PolarHBondContact O-N 3.22Å; P131-N368 WeakPolarHBondContact CD-OD1 3.28Å; P131-N368 WeakPolarHBondContact CG-OD1 3.25Å; P131-L371 HydrophobicContact CB-CB 3.65Å; P131-L371 HydrophobicContact CG-CB 3.65Å; P131-L371 HydrophobicContact CG-CD1 3.78Å; P131-L371 HydrophobicContact CG-CG 4.4Å; P131-A372 HydrophobicContact CB-CB 4.41Å; P131-Y375 HydrophobicContact CB-CD2 3.71Å; P131-Y375 HydrophobicContact CB-CE2 3.76Å; P131-Y375 HydrophobicContact CG-CE2 4.49Å
132S89.4Confident89.2Confident0 Ų08.2 Ų8.20%04%0.039CC..Hα-helixtrans-65.2-44.7178.9-60.20000111.5V128 F134 A135 I136V128-S132 WeakPolarHBondContact O-CB 3.46Å; V128-S132 PolarHBondContact O-N 3.02Å; V128-S132 PolarHBondContact O-OG 2.87Å; S132-F134 VanDerWaalsContact C-N 3.3Å; S132-F134 PolarHBondContact O-N 3.37Å; S132-A135 PolarHBondContact O-N 3.18Å; S132-I136 VanDerWaalsContact O-CG1 3.27Å; S132-I136 WeakPolarHBondContact O-CG1 3.38Å; S132-I136 PolarHBondContact O-N 2.97Å
133S89.1Confident89.1Confident10 Ų109.9 Ų9.97%0.075%0.047CC..Hα-helixtrans-57.6-44.4174.7173.80000111.5L129 I136 I137L129-S133 WeakPolarHBondContact O-CB 3.44Å; L129-S133 PolarHBondContact O-N 2.88Å; S133-I136 PolarHBondContact O-N 3.4Å; S133-I137 WeakPolarHBondContact O-CD1 3.47Å; S133-I137 VanDerWaalsContact O-CG1 3.26Å; S133-I137 WeakPolarHBondContact O-CG1 3.33Å; S133-I137 PolarHBondContact O-N 3.44Å; S133-I137 VanDerWaalsContact O-N 3.08Å
134F88.2Confident89Confident0 Ų08.8 Ų8.80%04%0.043CC..Hα-helixtrans-65.5-40.1178.4-165.9-123.8000112.4K130 P131 S132 T138 I168 I171 I172 A327 C331 A372K130-F134 WeakPolarHBondContact O-CB 3.46Å; K130-F134 PolarHBondContact O-N 3.45Å; P131-F134 PolarHBondContact O-N 3.09Å; S132-F134 VanDerWaalsContact C-N 3.3Å; S132-F134 PolarHBondContact O-N 3.37Å; F134-T138 WeakPolarHBondContact O-CG2 3.5Å; F134-T138 PolarHBondContact O-N 3.46Å; F134-T138 VanDerWaalsContact O-N 3.09Å; F134-T138 PolarHBondContact O-OG1 2.83Å; F134-I168 HydrophobicContact CD1-CD1 3.93Å; F134-I168 HydrophobicContact CD1-CG1 3.96Å; F134-I168 HydrophobicContact CE1-CB 3.94Å; F134-I168 HydrophobicContact CE1-CD1 3.98Å; F134-I168 HydrophobicContact CE1-CG1 3.54Å; F134-I168 HydrophobicContact CE1-CG2 3.76Å; F134-I168 HydrophobicContact CZ-CG1 4.17Å; F134-I171 HydrophobicContact CE2-CG2 4.23Å; F134-I171 HydrophobicContact CZ-CB 4.35Å; F134-I171 HydrophobicContact CZ-CG2 4.08Å; F134-I172 HydrophobicContact CD1-CD1 4.43Å; F134-I172 HydrophobicContact CE1-CD1 3.52Å; F134-I172 HydrophobicContact CE1-CG1 3.97Å; F134-I172 HydrophobicContact CZ-CD1 3.99Å; F134-I172 HydrophobicContact CZ-CG1 3.9Å; F134-A327 HydrophobicContact CD2-CB 4.03Å; F134-A327 HydrophobicContact CE2-CB 3.62Å; F134-A327 WeakPolarHBondContact CE2-O 3.49Å; F134-C331 VanDerWaalsContact CE2-SG 3.51Å; F134-A372 HydrophobicContact CB-CB 4.28Å; F134-A372 HydrophobicContact CD1-CB 3.64Å; F134-A372 HydrophobicContact CG-CB 4.45Å
135A90.4Very high88.9Confident0 Ų010 Ų100%05%0.053CC..Hα-helixtrans-62.9-45.5173.900000112.1P131 S132 I137 T138 L139 I376 L384P131-A135 WeakPolarHBondContact O-CB 3.28Å; P131-A135 PolarHBondContact O-N 3.22Å; S132-A135 PolarHBondContact O-N 3.18Å; A135-I137 PolarHBondContact O-N 3.08Å; A135-T138 PolarHBondContact O-N 2.81Å; A135-T138 PolarHBondContact O-OG1 3.37Å; A135-T138 VanDerWaalsContact O-OG1 3.11Å; A135-L139 WeakPolarHBondContact O-CB 3.42Å; A135-L139 VanDerWaalsContact O-CG 3.3Å; A135-L139 WeakPolarHBondContact O-CG 3.42Å; A135-L139 PolarHBondContact O-N 3.34Å; A135-I376 HydrophobicContact CB-CG1 3.93Å; A135-L384 HydrophobicContact CB-CD2 3.9Å
136I90.3Very high88.9Confident0 Ų010 Ų100%05%0.053CC..Hα-helixtrans-58.1-49.5177.1-63.9160.8000110.5S132 S133 T138 L139 S140 W240 I381 L384 I385 F388S132-I136 VanDerWaalsContact O-CG1 3.27Å; S132-I136 WeakPolarHBondContact O-CG1 3.38Å; S132-I136 PolarHBondContact O-N 2.97Å; S133-I136 PolarHBondContact O-N 3.4Å; I136-T138 VanDerWaalsContact C-N 3.33Å; I136-T138 PolarHBondContact O-N 3.4Å; I136-L139 PolarHBondContact O-N 3.15Å; I136-S140 PolarHBondContact O-N 3.3Å; I136-S140 PolarHBondContact O-OG 3.39Å; I136-W240 HydrophobicContact CB-CH2 3.91Å; I136-W240 HydrophobicContact CB-CZ2 3.75Å; I136-W240 HydrophobicContact CD1-CE3 4.37Å; I136-W240 HydrophobicContact CD1-CH2 3.85Å; I136-W240 HydrophobicContact CD1-CZ2 4.21Å; I136-W240 HydrophobicContact CD1-CZ3 3.93Å; I136-W240 HydrophobicContact CG1-CH2 4.5Å; I136-W240 HydrophobicContact CG2-CH2 3.96Å; I136-W240 HydrophobicContact CG2-CZ2 3.28Å; I136-I381 HydrophobicContact CG2-CG2 4.27Å; I136-L384 HydrophobicContact CD1-CB 4.36Å; I136-L384 HydrophobicContact CD1-CD2 4.39Å; I136-L384 HydrophobicContact CD1-CG 4.03Å; I136-L384 HydrophobicContact CG1-CB 4.01Å; I136-L384 HydrophobicContact CG1-CD2 3.56Å; I136-L384 HydrophobicContact CG1-CG 3.69Å; I136-I385 HydrophobicContact CD1-CG1 3.84Å; I136-I385 HydrophobicContact CG1-CG1 4.31Å; I136-I385 HydrophobicContact CG2-CD1 4.26Å; I136-I385 HydrophobicContact CG2-CG1 3.98Å; I136-F388 HydrophobicContact CD1-CB 4.25Å
137I89.8Confident88.8Confident12 Ų1210.2 Ų10.26%0.0626%0.055CC..Hα-helixtrans-63.8-38.5-177.1-62.5164.3000111.6S133 A135 S140 F141 W240 T323 A327S133-I137 WeakPolarHBondContact O-CD1 3.47Å; S133-I137 VanDerWaalsContact O-CG1 3.26Å; S133-I137 WeakPolarHBondContact O-CG1 3.33Å; S133-I137 PolarHBondContact O-N 3.44Å; S133-I137 VanDerWaalsContact O-N 3.08Å; A135-I137 PolarHBondContact O-N 3.08Å; I137-S140 WeakPolarHBondContact O-CB 3.46Å; I137-S140 PolarHBondContact O-N 3.04Å; I137-F141 PolarHBondContact O-N 3.34Å; I137-W240 HydrophobicContact CG1-CH2 4.25Å; I137-W240 HydrophobicContact CG1-CZ2 4.07Å; I137-T323 WeakPolarHBondContact CG2-O 3.48Å; I137-A327 HydrophobicContact CB-CB 4.5Å; I137-A327 HydrophobicContact CG2-CB 3.8Å
138T89.9Confident88.6Confident1 Ų111.2 Ų11.21%0.0066%0.064CC..Hα-helixtrans-77.2-32.718051.80000113.5F134 A135 I136 S140 F141 A142 S164 I168 I171 A327F134-T138 WeakPolarHBondContact O-CG2 3.5Å; F134-T138 PolarHBondContact O-N 3.46Å; F134-T138 VanDerWaalsContact O-N 3.09Å; F134-T138 PolarHBondContact O-OG1 2.83Å; A135-T138 PolarHBondContact O-N 2.81Å; A135-T138 PolarHBondContact O-OG1 3.37Å; A135-T138 VanDerWaalsContact O-OG1 3.11Å; I136-T138 VanDerWaalsContact C-N 3.33Å; I136-T138 PolarHBondContact O-N 3.4Å; T138-S140 VanDerWaalsContact C-N 3.3Å; T138-F141 WeakPolarHBondContact O-CB 3.34Å; T138-F141 PolarHBondContact O-N 3.1Å; T138-A142 PolarHBondContact O-N 3.33Å; T138-S164 PolarHBondContact O-OG 2.69Å; T138-I168 HydrophobicContact CG2-CD1 4.34Å; T138-I168 HydrophobicContact CG2-CG1 3.46Å; T138-I168 VanDerWaalsContact CG2-CG1 3.46Å; T138-I168 WeakPolarHBondContact OG1-CD1 3.48Å; T138-I168 WeakPolarHBondContact OG1-CG1 3.44Å; T138-I171 HydrophobicContact CG2-CD1 4.33Å; T138-A327 HydrophobicContact CG2-CB 4.29Å
139L90.3Very high88.6Confident6 Ų619 Ų193%0.03110%0.099CC..Hα-helixtrans-60.2-42.8165.8-75.4167.6000111.2A135 I136 F141 A142 E143 I160 K161 S164 I376 A379 I381A135-L139 WeakPolarHBondContact O-CB 3.42Å; A135-L139 VanDerWaalsContact O-CG 3.3Å; A135-L139 WeakPolarHBondContact O-CG 3.42Å; A135-L139 PolarHBondContact O-N 3.34Å; I136-L139 PolarHBondContact O-N 3.15Å; L139-F141 VanDerWaalsContact C-N 3.34Å; L139-F141 PolarHBondContact O-N 3.18Å; L139-A142 PolarHBondContact O-N 3.15Å; L139-E143 PolarHBondContact O-N 2.96Å; L139-I160 HydrophobicContact CD2-CG2 4.17Å; L139-K161 HydrophobicContact CD2-CG 4.44Å; L139-S164 VanDerWaalsContact CA-OG 3.3Å; L139-S164 WeakPolarHBondContact CA-OG 3.36Å; L139-I376 HydrophobicContact CD2-CG2 4.22Å; L139-I376 HydrophobicContact CG-CG1 4.35Å; L139-A379 HydrophobicContact CD1-CB 4.1Å; L139-I381 HydrophobicContact CB-CD1 3.96Å; L139-I381 HydrophobicContact CB-CG1 3.89Å; L139-I381 HydrophobicContact CD1-CG1 4.11Å
140S89.7Confident88.4Confident0 Ų023.1 Ų23.10%012%0.115CC..Hα-helixtrans-57.6-47.4174.9-45.70000111.8S52 I56 I136 I137 T138 A142 E143 Y144S52-S140 VanDerWaalsContact CB-CB 3.48Å; S52-S140 WeakPolarHBondContact CB-OG 3.4Å; S52-S140 PolarHBondContact OG-OG 3.4Å; I56-S140 WeakPolarHBondContact CD1-OG 3.49Å; I136-S140 PolarHBondContact O-N 3.3Å; I136-S140 PolarHBondContact O-OG 3.39Å; I137-S140 WeakPolarHBondContact O-CB 3.46Å; I137-S140 PolarHBondContact O-N 3.04Å; T138-S140 VanDerWaalsContact C-N 3.3Å; S140-A142 VanDerWaalsContact C-N 3.3Å; S140-A142 PolarHBondContact O-N 3.35Å; S140-E143 PolarHBondContact O-N 3.36Å; S140-Y144 WeakPolarHBondContact O-CD2 3.34Å; S140-Y144 PolarHBondContact O-N 3.08Å; S140-Y144 VanDerWaalsContact O-N 3.12Å
141F90.4Very high87.8Confident39 Ų3926.7 Ų26.717%0.17114%0.141CC..Hα-helixtrans-56.9-46.9176.7166.1-96.4000110.9I137 T138 L139 Y144 A145 L163 A167 A320 T323I137-F141 PolarHBondContact O-N 3.34Å; T138-F141 WeakPolarHBondContact O-CB 3.34Å; T138-F141 PolarHBondContact O-N 3.1Å; L139-F141 VanDerWaalsContact C-N 3.34Å; L139-F141 PolarHBondContact O-N 3.18Å; F141-Y144 PolarHBondContact O-N 3.07Å; F141-A145 HydrophobicContact CE1-CB 4.49Å; F141-A145 HydrophobicContact CZ-CB 4.4Å; F141-A145 WeakPolarHBondContact O-CB 3.26Å; F141-A145 PolarHBondContact O-N 3.47Å; F141-L163 HydrophobicContact CE1-CD1 4.46Å; F141-L163 HydrophobicContact CE1-CG 4.23Å; F141-A167 HydrophobicContact CD1-CB 3.65Å; F141-A167 HydrophobicContact CE1-CB 3.71Å; F141-A320 HydrophobicContact CD2-CB 3.88Å; F141-A320 HydrophobicContact CE2-CB 3.78Å; F141-T323 WeakPolarHBondContact CA-OG1 3.42Å; F141-T323 VanDerWaalsContact CB-OG1 3.28Å; F141-T323 WeakPolarHBondContact CB-OG1 3.21Å; F141-T323 WeakPolarHBondContact CD2-OG1 3.44Å
142A90.1Very high87.2Confident0 Ų034.1 Ų34.10%018%0.181CC..Hα-helixtrans-68.6-37.2-176.400000112.9T138 L139 S140 S146 I160 L163 S164T138-A142 PolarHBondContact O-N 3.33Å; L139-A142 PolarHBondContact O-N 3.15Å; S140-A142 VanDerWaalsContact C-N 3.3Å; S140-A142 PolarHBondContact O-N 3.35Å; A142-S146 VanDerWaalsContact O-CB 3.26Å; A142-S146 WeakPolarHBondContact O-CB 3.43Å; A142-S146 PolarHBondContact O-N 3.28Å; A142-S146 PolarHBondContact O-OG 3.2Å; A142-I160 HydrophobicContact CB-CB 4.45Å; A142-I160 HydrophobicContact CB-CG2 3.74Å; A142-I160 WeakPolarHBondContact CB-O 3.25Å; A142-L163 HydrophobicContact CB-CB 3.93Å; A142-L163 HydrophobicContact CB-CD2 4.06Å; A142-L163 HydrophobicContact CB-CG 4.04Å; A142-S164 WeakPolarHBondContact CB-OG 3.25Å
143E87.7Confident86.7Confident36 Ų3638.1 Ų38.117%0.16821%0.208CC..Hα-helixtrans-62.9-47.8175-171.2166.1-162.900110.9L139 S140 S146 A147 S297 I381L139-E143 PolarHBondContact O-N 2.96Å; S140-E143 PolarHBondContact O-N 3.36Å; E143-S146 PolarHBondContact O-N 2.99Å; E143-S146 PolarHBondContact O-OG 3.35Å; E143-A147 WeakPolarHBondContact O-CB 3.05Å; E143-A147 PolarHBondContact O-N 3.26Å; E143-S297 WeakPolarHBondContact OE1-CB 3.46Å; E143-I381 WeakPolarHBondContact OE2-CD1 3.36Å
144Y87.7Confident86.1Confident0 Ų043.6 Ų43.60%024%0.241CC..Hα-helixtrans-69.8-33.1178.4-87.9-83.7000114.2F55 I56 S140 F141 P148 A298 V299 A300 V301 V319F55-Y144 HydrophobicContact CB-CE1 4.45Å; F55-Y144 HydrophobicContact CB-CE2 3.69Å; F55-Y144 WeakPolarHBondContact CB-OH 3.23Å; F55-Y144 PolarHBondContact O-OH 3.37Å; I56-Y144 HydrophobicContact CG1-CE2 4.23Å; S140-Y144 WeakPolarHBondContact O-CD2 3.34Å; S140-Y144 PolarHBondContact O-N 3.08Å; S140-Y144 VanDerWaalsContact O-N 3.12Å; F141-Y144 PolarHBondContact O-N 3.07Å; Y144-P148 WeakPolarHBondContact O-CD 3.25Å; Y144-A298 HydrophobicContact CD1-CB 4Å; Y144-A298 HydrophobicContact CE1-CB 3.68Å; Y144-V299 PolarHBondContact OH-N 3.29Å; Y144-A300 HydrophobicContact CE1-CB 3.86Å; Y144-A300 PolarHBondContact OH-N 3.33Å; Y144-V301 HydrophobicContact CD1-CG2 3.78Å; Y144-V301 HydrophobicContact CE1-CG2 3.96Å; Y144-V319 HydrophobicContact CD1-CB 3.94Å; Y144-V319 HydrophobicContact CD1-CG1 3.45Å; Y144-V319 VanDerWaalsContact CD1-CG1 3.45Å; Y144-V319 HydrophobicContact CD1-CG2 4.3Å; Y144-V319 HydrophobicContact CD2-CG1 3.87Å; Y144-V319 HydrophobicContact CE1-CB 4.46Å; Y144-V319 HydrophobicContact CE1-CG1 3.89Å; Y144-V319 HydrophobicContact CE1-CG2 4.39Å; Y144-V319 HydrophobicContact CE2-CG1 4.27Å; Y144-V319 HydrophobicContact CG-CB 4.29Å; Y144-V319 HydrophobicContact CG-CG1 3.44Å; Y144-V319 VanDerWaalsContact CG-CG1 3.44Å
145A88.6Confident85.8Confident25 Ų2544.1 Ų44.121%0.20724%0.244CC..Hα-helixtrans-75.7-29.6177.300000112.5F141 F149 L163F141-A145 HydrophobicContact CE1-CB 4.49Å; F141-A145 HydrophobicContact CZ-CB 4.4Å; F141-A145 WeakPolarHBondContact O-CB 3.26Å; F141-A145 PolarHBondContact O-N 3.47Å; A145-F149 WeakPolarHBondContact O-CD2 3.37Å; A145-F149 VanDerWaalsContact O-CE2 3.29Å; A145-F149 WeakPolarHBondContact O-CE2 3.5Å; A145-L163 HydrophobicContact CB-CD2 3.97Å
146S88.2Confident85.7Confident4 Ų447 Ų473%0.02826%0.263CS..Hα-helixtrans-88.2-29.1179.5600000113.4A142 E143 P148 F149 Y150A142-S146 VanDerWaalsContact O-CB 3.26Å; A142-S146 WeakPolarHBondContact O-CB 3.43Å; A142-S146 PolarHBondContact O-N 3.28Å; A142-S146 PolarHBondContact O-OG 3.2Å; E143-S146 PolarHBondContact O-N 2.99Å; E143-S146 PolarHBondContact O-OG 3.35Å; S146-P148 VanDerWaalsContact C-CD 3.42Å; S146-F149 PolarHBondContact O-N 3.17Å; S146-Y150 WeakPolarHBondContact O-CD2 3.21Å
147A84.8Confident85.4Confident10 Ų1053 Ų538%0.08329%0.294CS..G310 helixtrans-50-43.2-177.700000114.8E143 F149 Y150 A298E143-A147 WeakPolarHBondContact O-CB 3.05Å; E143-A147 PolarHBondContact O-N 3.26Å; A147-F149 PolarHBondContact O-N 3.01Å; A147-Y150 CarbonylContact O-C 3.48Å; A147-Y150 VanDerWaalsContact O-C 3.31Å; A147-Y150 PolarHBondContact O-N 2.9Å; A147-A298 HydrophobicContact CB-CB 3.85Å
148P83.9Confident85.2Confident58 Ų5857.4 Ų57.438%0.37732%0.322SS..G310 helixtrans-66-22.5-179.7-22.135.4000114.2Y144 S146 Y150 P316Y144-P148 WeakPolarHBondContact O-CD 3.25Å; S146-P148 VanDerWaalsContact C-CD 3.42Å; P148-Y150 VanDerWaalsContact C-N 3.33Å; P148-P316 HydrophobicContact CG-CB 3.51Å; P148-P316 HydrophobicContact CG-CG 3.54Å
149F86.1Confident85.1Confident165 Ų16560.2 Ų60.272%0.72434%0.339SS*.G310 helixtrans-85.9-9.2177.9-58.8-74.8000112.7A145 S146 A147A145-F149 WeakPolarHBondContact O-CD2 3.37Å; A145-F149 VanDerWaalsContact O-CE2 3.29Å; A145-F149 WeakPolarHBondContact O-CE2 3.5Å; S146-F149 PolarHBondContact O-N 3.17Å; A147-F149 PolarHBondContact O-N 3.01Å
150Y85.6Confident84.8Confident89 Ų8960.7 Ų60.735%0.34934%0.341SS..  trans-133.865.2179.2-63.9-89.3000110.7S146 A147 P148 D152 C153 P155S146-Y150 WeakPolarHBondContact O-CD2 3.21Å; A147-Y150 CarbonylContact O-C 3.48Å; A147-Y150 VanDerWaalsContact O-C 3.31Å; A147-Y150 PolarHBondContact O-N 2.9Å; P148-Y150 VanDerWaalsContact C-N 3.33Å; Y150-D152 PolarHBondContact O-N 3.29Å; Y150-C153 WeakPolarHBondContact CB-O 3.34Å; Y150-C153 HydrophobicContact CD1-CB 4.42Å; Y150-C153 PolarHBondContact O-N 3.43Å; Y150-P155 HydrophobicContact CD2-CB 3.88Å; Y150-P155 HydrophobicContact CE2-CB 4.31Å; Y150-P155 HydrophobicContact CG-CB 4.25Å
151P73.8Confident84.7Confident105 Ų10563.4 Ų63.468%0.68235%0.353SS*.THydrogen-bonded Turntrans-63.7-38.1-175.622.9-32.1000113.6
152D77Confident84.6Confident156 Ų15665.3 Ų65.383%0.83437%0.37SS*.THydrogen-bonded Turntrans-101.44-176.9-58.9-52.3000113.6Y150Y150-D152 PolarHBondContact O-N 3.29Å
153C79.9Confident84.3Confident85 Ų8568.3 Ų68.357%0.57439%0.386SS*.SBendtrans-140.6148-170-66.80000111.4Y150Y150-C153 WeakPolarHBondContact CB-O 3.34Å; Y150-C153 HydrophobicContact CD1-CB 4.42Å; Y150-C153 PolarHBondContact O-N 3.43Å
154T76.9Confident84Confident125 Ų12566.6 Ų66.677%0.76738%0.378SS*.PPolyproline II helixtrans-72.5126.7169.353.40000109.8
155P81.2Confident83.8Confident10 Ų1067.8 Ų67.87%0.06539%0.388CS..PPolyproline II helixtrans-59.3139178.417.1-25.8000110.8Y150 L157 I160Y150-P155 HydrophobicContact CD2-CB 3.88Å; Y150-P155 HydrophobicContact CE2-CB 4.31Å; Y150-P155 HydrophobicContact CG-CB 4.25Å; P155-L157 PolarHBondContact O-N 2.89Å; P155-I160 HydrophobicContact CB-CD1 4.32Å; P155-I160 HydrophobicContact CB-CG1 4.24Å; P155-I160 HydrophobicContact CG-CD1 4.01Å; P155-I160 HydrophobicContact CG-CG1 4.34Å
156P87.1Confident83.5Confident62 Ų6268.9 Ų68.940%0.40340%0.397SS..PPolyproline II helixtrans-59.3135.4179.7-21.330.7000111.4V158 V159 I160P156-V158 PolarHBondContact O-N 3.13Å; P156-V159 HydrophobicContact CB-CG2 4.16Å; P156-V159 HydrophobicContact CG-CG2 4.22Å; P156-V159 WeakPolarHBondContact O-CB 3.49Å; P156-V159 PolarHBondContact O-N 3.06Å; P156-I160 PolarHBondContact O-N 3.39Å
157L84.2Confident83.1Confident124 Ų12469.1 Ų69.165%0.64940%0.399SS*.Hα-helixtrans-54.2-33-179-68.9172000113.1P155 I160 K161P155-L157 PolarHBondContact O-N 2.89Å; L157-I160 PolarHBondContact O-N 3.32Å; L157-K161 WeakPolarHBondContact O-CB 3.44Å; L157-K161 VanDerWaalsContact O-CG 3.27Å; L157-K161 WeakPolarHBondContact O-CG 3.42Å; L157-K161 PolarHBondContact O-N 3.36Å
158V86.7Confident82.8Confident106 Ų10668.7 Ų68.764%0.64240%0.395SS*.Hα-helixtrans-63.5-41177.4-1790000111.3P156 K161 C162P156-V158 PolarHBondContact O-N 3.13Å; V158-K161 PolarHBondContact O-N 2.93Å; V158-C162 VanDerWaalsContact O-CB 3.31Å; V158-C162 WeakPolarHBondContact O-CB 3.22Å; V158-C162 PolarHBondContact O-N 2.91Å; V158-C162 PolarHBondContact O-SG 3.45Å
159V86.9Confident82.5Confident59 Ų5969 Ų6936%0.35840%0.396SS..Hα-helixtrans-65.5-46.2179.2177.20000110.1P156 K161 C162 L163P156-V159 HydrophobicContact CB-CG2 4.16Å; P156-V159 HydrophobicContact CG-CG2 4.22Å; P156-V159 WeakPolarHBondContact O-CB 3.49Å; P156-V159 PolarHBondContact O-N 3.06Å; V159-K161 PolarHBondContact O-N 3.25Å; V159-C162 PolarHBondContact O-N 2.82Å; V159-L163 WeakPolarHBondContact O-CB 3.25Å; V159-L163 PolarHBondContact O-N 2.86Å
160I85.1Confident82.1Confident17 Ų1765 Ų659%0.08739%0.385CS..Hα-helixtrans-59.5-48.2178-56.6175.7000110.1L139 A142 P155 P156 L157 L163 S164L139-I160 HydrophobicContact CD2-CG2 4.17Å; A142-I160 HydrophobicContact CB-CB 4.45Å; A142-I160 HydrophobicContact CB-CG2 3.74Å; A142-I160 WeakPolarHBondContact CB-O 3.25Å; P155-I160 HydrophobicContact CB-CD1 4.32Å; P155-I160 HydrophobicContact CB-CG1 4.24Å; P155-I160 HydrophobicContact CG-CD1 4.01Å; P155-I160 HydrophobicContact CG-CG1 4.34Å; P156-I160 PolarHBondContact O-N 3.39Å; L157-I160 PolarHBondContact O-N 3.32Å; I160-L163 PolarHBondContact O-N 2.91Å; I160-S164 WeakPolarHBondContact O-CB 3.36Å; I160-S164 PolarHBondContact O-N 3.39Å; I160-S164 PolarHBondContact O-OG 3.25Å
161K87.3Confident81.6Confident57 Ų5760.9 Ų60.925%0.24837%0.369CS..Hα-helixtrans-65.8-43.9-178.4-71.7-179.9177.4-174.30112.5L139 L157 V158 V159 S164 A165 I376 I377L139-K161 HydrophobicContact CD2-CG 4.44Å; L157-K161 WeakPolarHBondContact O-CB 3.44Å; L157-K161 VanDerWaalsContact O-CG 3.27Å; L157-K161 WeakPolarHBondContact O-CG 3.42Å; L157-K161 PolarHBondContact O-N 3.36Å; V158-K161 PolarHBondContact O-N 2.93Å; V159-K161 PolarHBondContact O-N 3.25Å; K161-S164 PolarHBondContact O-N 3.28Å; K161-A165 WeakPolarHBondContact O-CB 3.43Å; K161-A165 PolarHBondContact O-N 3.4Å; K161-I376 HydrophobicContact CB-CG2 3.85Å; K161-I376 WeakPolarHBondContact CE-O 3.4Å; K161-I376 HydrophobicContact CG-CG2 3.83Å; K161-I377 PolarHBondContact NZ-O 2.97Å
162C87.2Confident81.5Confident79 Ų7956.1 Ų56.153%0.53434%0.338SS..Hα-helixtrans-64.2-43.6176.3-72.60000112V158 V159 S164 A165 A166V158-C162 VanDerWaalsContact O-CB 3.31Å; V158-C162 WeakPolarHBondContact O-CB 3.22Å; V158-C162 PolarHBondContact O-N 2.91Å; V158-C162 PolarHBondContact O-SG 3.45Å; V159-C162 PolarHBondContact O-N 2.82Å; C162-S164 VanDerWaalsContact C-N 3.32Å; C162-S164 PolarHBondContact O-N 2.96Å; C162-A165 PolarHBondContact O-N 3.37Å; C162-A166 WeakPolarHBondContact O-CB 3.48Å; C162-A166 PolarHBondContact O-N 3.35Å
163L85.5Confident81Confident62 Ų6252 Ų5233%0.32532%0.318SS..Hα-helixtrans-65.7-36.8177.8-174.460.8000111.6F141 A142 A145 V159 I160 A166 A167F141-L163 HydrophobicContact CE1-CD1 4.46Å; F141-L163 HydrophobicContact CE1-CG 4.23Å; A142-L163 HydrophobicContact CB-CB 3.93Å; A142-L163 HydrophobicContact CB-CD2 4.06Å; A142-L163 HydrophobicContact CB-CG 4.04Å; A145-L163 HydrophobicContact CB-CD2 3.97Å; V159-L163 WeakPolarHBondContact O-CB 3.25Å; V159-L163 PolarHBondContact O-N 2.86Å; I160-L163 PolarHBondContact O-N 2.91Å; L163-A166 PolarHBondContact O-N 2.87Å; L163-A167 WeakPolarHBondContact O-CB 3.2Å; L163-A167 PolarHBondContact O-N 3.49Å
164S81.3Confident80.4Confident0 Ų049.3 Ų49.30%031%0.305CS..Hα-helixtrans-64-47.6174.2-56.20000111.7T138 L139 A142 I160 K161 C162 A166 A167 I168T138-S164 PolarHBondContact O-OG 2.69Å; L139-S164 VanDerWaalsContact CA-OG 3.3Å; L139-S164 WeakPolarHBondContact CA-OG 3.36Å; A142-S164 WeakPolarHBondContact CB-OG 3.25Å; I160-S164 WeakPolarHBondContact O-CB 3.36Å; I160-S164 PolarHBondContact O-N 3.39Å; I160-S164 PolarHBondContact O-OG 3.25Å; K161-S164 PolarHBondContact O-N 3.28Å; C162-S164 VanDerWaalsContact C-N 3.32Å; C162-S164 PolarHBondContact O-N 2.96Å; S164-A166 VanDerWaalsContact C-N 3.31Å; S164-A166 PolarHBondContact O-N 3.42Å; S164-A167 WeakPolarHBondContact O-CB 2.9Å; S164-A167 PolarHBondContact O-N 2.94Å; S164-I168 WeakPolarHBondContact O-CG1 3.3Å; S164-I168 PolarHBondContact O-N 3.26Å
165A81.6Confident80.2Confident25 Ų2544.1 Ų44.121%0.20727%0.273CS..Hα-helixtrans-62.9-38.217700000111.9K161 C162 T169K161-A165 WeakPolarHBondContact O-CB 3.43Å; K161-A165 PolarHBondContact O-N 3.4Å; C162-A165 PolarHBondContact O-N 3.37Å; A165-T169 WeakPolarHBondContact O-CB 3.47Å; A165-T169 PolarHBondContact O-N 3.29Å; A165-T169 PolarHBondContact O-OG1 3.23Å
166A83.4Confident79.9Confident49 Ų4944 Ų4441%0.40527%0.272SS..Hα-helixtrans-63.2-46.4172.800000111.3C162 L163 S164 I168 T169 V170C162-A166 WeakPolarHBondContact O-CB 3.48Å; C162-A166 PolarHBondContact O-N 3.35Å; L163-A166 PolarHBondContact O-N 2.87Å; S164-A166 VanDerWaalsContact C-N 3.31Å; S164-A166 PolarHBondContact O-N 3.42Å; A166-I168 PolarHBondContact O-N 3.44Å; A166-T169 PolarHBondContact O-N 2.99Å; A166-V170 VanDerWaalsContact O-CG2 3.3Å; A166-V170 WeakPolarHBondContact O-CG2 3.29Å; A166-V170 PolarHBondContact O-N 3.25Å
167A80.4Confident79.2Confident8 Ų841.4 Ų41.47%0.06626%0.256CS..Hα-helixtrans-59.8-46.717700000111.8F141 L163 S164 T169 V170 I171F141-A167 HydrophobicContact CD1-CB 3.65Å; F141-A167 HydrophobicContact CE1-CB 3.71Å; L163-A167 WeakPolarHBondContact O-CB 3.2Å; L163-A167 PolarHBondContact O-N 3.49Å; S164-A167 WeakPolarHBondContact O-CB 2.9Å; S164-A167 PolarHBondContact O-N 2.94Å; A167-T169 VanDerWaalsContact C-N 3.3Å; A167-T169 PolarHBondContact O-N 2.7Å; A167-V170 PolarHBondContact O-N 3.32Å; A167-I171 WeakPolarHBondContact O-CB 3.23Å; A167-I171 WeakPolarHBondContact O-CD1 3.24Å; A167-I171 WeakPolarHBondContact O-CG1 3.49Å; A167-I171 PolarHBondContact O-N 2.75Å
168I78.3Confident78.7Confident2 Ų239.2 Ų39.21%0.0124%0.244CC..Hα-helixtrans-52.4-51.3173.2-77.7-172000110.7F134 T138 S164 A166 V170 I171 I172 A372 I373 I376F134-I168 HydrophobicContact CD1-CD1 3.93Å; F134-I168 HydrophobicContact CD1-CG1 3.96Å; F134-I168 HydrophobicContact CE1-CB 3.94Å; F134-I168 HydrophobicContact CE1-CD1 3.98Å; F134-I168 HydrophobicContact CE1-CG1 3.54Å; F134-I168 HydrophobicContact CE1-CG2 3.76Å; F134-I168 HydrophobicContact CZ-CG1 4.17Å; T138-I168 HydrophobicContact CG2-CD1 4.34Å; T138-I168 HydrophobicContact CG2-CG1 3.46Å; T138-I168 VanDerWaalsContact CG2-CG1 3.46Å; T138-I168 WeakPolarHBondContact OG1-CD1 3.48Å; T138-I168 WeakPolarHBondContact OG1-CG1 3.44Å; S164-I168 WeakPolarHBondContact O-CG1 3.3Å; S164-I168 PolarHBondContact O-N 3.26Å; A166-I168 PolarHBondContact O-N 3.44Å; I168-V170 PolarHBondContact O-N 2.58Å; I168-I171 PolarHBondContact O-N 3.35Å; I168-I172 HydrophobicContact CG2-CD1 4.08Å; I168-I172 WeakPolarHBondContact O-CB 3.36Å; I168-I172 WeakPolarHBondContact O-CG1 3.4Å; I168-I172 PolarHBondContact O-N 3.19Å; I168-A372 HydrophobicContact CD1-CB 3.67Å; I168-I373 HydrophobicContact CD1-CG1 4.5Å; I168-I373 HydrophobicContact CG2-CD1 4.24Å; I168-I373 HydrophobicContact CG2-CG1 4.03Å; I168-I376 HydrophobicContact CD1-CD1 3.37Å; I168-I376 HydrophobicContact CD1-CG1 4.5Å; I168-I376 HydrophobicContact CG1-CD1 4.35Å
169T76.5Confident77.9Confident64 Ų6436.2 Ų36.239%0.39323%0.227SC..Hα-helixtrans-62.7-47.3-176.5-560000110.1A165 A166 A167 I172 T173A165-T169 WeakPolarHBondContact O-CB 3.47Å; A165-T169 PolarHBondContact O-N 3.29Å; A165-T169 PolarHBondContact O-OG1 3.23Å; A166-T169 PolarHBondContact O-N 2.99Å; A167-T169 VanDerWaalsContact C-N 3.3Å; A167-T169 PolarHBondContact O-N 2.7Å; T169-I172 PolarHBondContact O-N 2.88Å; T169-T173 HydrophobicContact CG2-CG2 4.22Å; T169-T173 VanDerWaalsContact O-CB 3.32Å; T169-T173 WeakPolarHBondContact O-CB 3.44Å; T169-T173 PolarHBondContact O-N 3.15Å; T169-T173 PolarHBondContact O-OG1 2.87Å
170V78.9Confident77.1Confident82 Ų8236.5 Ų36.550%0.49723%0.229SC..Iπ-helixtrans-62.4-43.4178.3171.60000112A166 A167 I168 G174 V175 F324A166-V170 VanDerWaalsContact O-CG2 3.3Å; A166-V170 WeakPolarHBondContact O-CG2 3.29Å; A166-V170 PolarHBondContact O-N 3.25Å; A167-V170 PolarHBondContact O-N 3.32Å; I168-V170 PolarHBondContact O-N 2.58Å; V170-G174 WeakPolarHBondContact O-CA 3.46Å; V170-G174 PolarHBondContact O-N 3.32Å; V170-V175 PolarHBondContact O-N 3.33Å; V170-F324 HydrophobicContact CG1-CE2 4.49Å
171I74.8Confident76.5Confident2 Ų243.2 Ų43.21%0.0126%0.258CS..Iπ-helixtrans-64.5-47.4179.9-69.3160.6000110.8F134 T138 A167 I168 V175 N176 F324 A327 N328F134-I171 HydrophobicContact CE2-CG2 4.23Å; F134-I171 HydrophobicContact CZ-CB 4.35Å; F134-I171 HydrophobicContact CZ-CG2 4.08Å; T138-I171 HydrophobicContact CG2-CD1 4.33Å; A167-I171 WeakPolarHBondContact O-CB 3.23Å; A167-I171 WeakPolarHBondContact O-CD1 3.24Å; A167-I171 WeakPolarHBondContact O-CG1 3.49Å; A167-I171 PolarHBondContact O-N 2.75Å; I168-I171 PolarHBondContact O-N 3.35Å; I171-V175 WeakPolarHBondContact O-CB 3.31Å; I171-V175 PolarHBondContact O-N 3.47Å; I171-N176 PolarHBondContact O-N 3.48Å; I171-N176 VanDerWaalsContact O-N 3.13Å; I171-N176 PolarHBondContact O-ND2 3.12Å; I171-F324 HydrophobicContact CB-CZ 4.42Å; I171-F324 HydrophobicContact CD1-CD2 3.84Å; I171-F324 HydrophobicContact CD1-CE2 3.88Å; I171-F324 HydrophobicContact CD1-CG 4.23Å; I171-F324 HydrophobicContact CD1-CZ 4.31Å; I171-F324 HydrophobicContact CG1-CD1 4.25Å; I171-F324 HydrophobicContact CG1-CD2 3.77Å; I171-F324 HydrophobicContact CG1-CE1 3.84Å; I171-F324 HydrophobicContact CG1-CE2 3.29Å; I171-F324 HydrophobicContact CG1-CG 4.24Å; I171-F324 HydrophobicContact CG1-CZ 3.35Å; I171-A327 HydrophobicContact CD1-CB 3.67Å; I171-N328 HydrophobicContact CG2-CB 4.43Å
172I71.3Confident75.9Confident5 Ų544.3 Ų44.33%0.02627%0.266CS..Iπ-helixtrans-71.2-59.5-177.7-69.5179.3000109.8F134 I168 T169 N176 C177 L365 L366F134-I172 HydrophobicContact CD1-CD1 4.43Å; F134-I172 HydrophobicContact CE1-CD1 3.52Å; F134-I172 HydrophobicContact CE1-CG1 3.97Å; F134-I172 HydrophobicContact CZ-CD1 3.99Å; F134-I172 HydrophobicContact CZ-CG1 3.9Å; I168-I172 HydrophobicContact CG2-CD1 4.08Å; I168-I172 WeakPolarHBondContact O-CB 3.36Å; I168-I172 WeakPolarHBondContact O-CG1 3.4Å; I168-I172 PolarHBondContact O-N 3.19Å; T169-I172 PolarHBondContact O-N 2.88Å; I172-N176 PolarHBondContact O-N 2.87Å; I172-C177 WeakPolarHBondContact O-CB 3.08Å; I172-C177 PolarHBondContact O-N 3.14Å; I172-C177 PolarHBondContact O-SG 2.92Å; I172-L365 HydrophobicContact CG2-CB 4.24Å; I172-L366 HydrophobicContact CG2-CD2 4.3Å
173T66.5Low75.2Confident68 Ų6840.6 Ų40.642%0.41724%0.241SC..Iπ-helixtrans-76.8-34.9-172.1650000113.1T169T169-T173 HydrophobicContact CG2-CG2 4.22Å; T169-T173 VanDerWaalsContact O-CB 3.32Å; T169-T173 WeakPolarHBondContact O-CB 3.44Å; T169-T173 PolarHBondContact O-N 3.15Å; T169-T173 PolarHBondContact O-OG1 2.87Å
174G67.4Low74.7Confident29 Ų2940.4 Ų40.430%0.29925%0.245SC..Iπ-helixtrans-87.7-28.7-173.600000115V170 L178V170-G174 WeakPolarHBondContact O-CA 3.46Å; V170-G174 PolarHBondContact O-N 3.32Å; G174-L178 WeakPolarHBondContact O-CD1 3.31Å
175V73.2Confident74.5Confident16 Ų1648.6 Ų48.610%0.09728%0.277CS..Iπ-helixtrans-116.1-58.4-174.9-177.30000111V170 I171 L178 S179 A183 F324V170-V175 PolarHBondContact O-N 3.33Å; I171-V175 WeakPolarHBondContact O-CB 3.31Å; I171-V175 PolarHBondContact O-N 3.47Å; V175-L178 PolarHBondContact O-N 3.01Å; V175-S179 PolarHBondContact O-N 2.98Å; V175-A183 HydrophobicContact CG1-CB 3.79Å; V175-F324 HydrophobicContact CG2-CE1 4.5Å; V175-F324 HydrophobicContact CG2-CZ 4.36Å
176N75Confident74.5Confident8 Ų848.9 Ų48.94%0.04328%0.276CS..Iπ-helixtrans-76.4-32.7-170.3-73.8-85.5000113.5I171 I172 N328 T360 L365I171-N176 PolarHBondContact O-N 3.48Å; I171-N176 VanDerWaalsContact O-N 3.13Å; I171-N176 PolarHBondContact O-ND2 3.12Å; I172-N176 PolarHBondContact O-N 2.87Å; N176-N328 PolarHBondContact ND2-OD1 2.9Å; N176-N328 PolarHBondContact OD1-OD1 2.92Å; N176-T360 VanDerWaalsContact O-CG2 3.26Å; N176-T360 WeakPolarHBondContact O-CG2 3.35Å; N176-L365 HydrophobicContact CB-CD1 3.95Å
177C72.4Confident74.3Confident8 Ų847.6 Ų47.65%0.05426%0.262CS..THydrogen-bonded Turntrans-81.4-15.6177.6-66.70000113.8I172 R358 L362I172-C177 WeakPolarHBondContact O-CB 3.08Å; I172-C177 PolarHBondContact O-N 3.14Å; I172-C177 PolarHBondContact O-SG 2.92Å; C177-R358 WeakPolarHBondContact O-CD 3.3Å; C177-R358 PolarHBondContact O-NH1 3.38Å; C177-L362 HydrophobicContact CB-CD1 3.84Å; C177-L362 WeakPolarHBondContact SG-CD1 3.37Å
178L72.8Confident74.2Confident78 Ų7852.1 Ų52.141%0.40829%0.285SS..THydrogen-bonded Turntrans-92.8-46.8-175.5-89.8153.7000112.8G174 V175 R358G174-L178 WeakPolarHBondContact O-CD1 3.31Å; V175-L178 PolarHBondContact O-N 3.01Å; L178-R358 WeakPolarHBondContact O-CD 3.34Å
179S71.1Confident74.5Confident42 Ų4258.3 Ų58.329%0.29431%0.312SS..  trans-161127.2178.1174.10000112.1V175 K181 L182 A183V175-S179 PolarHBondContact O-N 2.98Å; S179-K181 PolarHBondContact O-N 3.17Å; S179-K181 PolarHBondContact OG-N 3.08Å; S179-L182 PolarHBondContact O-N 3.12Å; S179-L182 PolarHBondContact OG-N 3.46Å; S179-A183 PolarHBondContact O-N 2.91Å
180V68.8Low74.8Confident66 Ų6656.3 Ų56.340%0.430%0.298SS..Hα-helixtrans-58.1-38.3171.4-177.90000111A183 S184 F332 T360V180-A183 PolarHBondContact O-N 2.91Å; V180-S184 PolarHBondContact O-N 3.07Å; V180-F332 HydrophobicContact CG1-CE1 4.1Å; V180-T360 HydrophobicContact CG2-CG2 3.54Å
181K72.8Confident74.9Confident157 Ų15753 Ų5368%0.68328%0.277SS*.Hα-helixtrans-66.8-44179.5-66.1-177-179177.70111.3S179 S184 Y185S179-K181 PolarHBondContact O-N 3.17Å; S179-K181 PolarHBondContact OG-N 3.08Å; K181-S184 PolarHBondContact O-N 2.85Å; K181-Y185 WeakPolarHBondContact O-CD2 3.3Å; K181-Y185 PolarHBondContact O-N 3.07Å
182L74.6Confident75.2Confident81 Ų8154.5 Ų54.542%0.42429%0.293SS..Hα-helixtrans-60.9-47.5176.6-178.865.5000110.5S179 S184 Y185 V186S179-L182 PolarHBondContact O-N 3.12Å; S179-L182 PolarHBondContact OG-N 3.46Å; L182-S184 PolarHBondContact O-N 3.32Å; L182-Y185 PolarHBondContact O-N 3.29Å; L182-V186 HydrophobicContact CD1-CG2 4.07Å; L182-V186 HydrophobicContact CG-CG2 4.19Å; L182-V186 WeakPolarHBondContact O-CB 3.33Å; L182-V186 WeakPolarHBondContact O-CG2 3.47Å; L182-V186 PolarHBondContact O-N 3.36Å
183A73.3Confident75.8Confident0 Ų054.5 Ų54.50%030%0.295CS..Hα-helixtrans-58-36.1177.500000112.5V175 S179 V180 Q187 N328 F332V175-A183 HydrophobicContact CG1-CB 3.79Å; S179-A183 PolarHBondContact O-N 2.91Å; V180-A183 PolarHBondContact O-N 2.91Å; A183-Q187 WeakPolarHBondContact O-CB 3.43Å; A183-Q187 PolarHBondContact O-N 3.35Å; A183-N328 PolarHBondContact O-ND2 2.89Å; A183-F332 HydrophobicContact CB-CE1 4.24Å; A183-F332 HydrophobicContact CB-CE2 3.86Å; A183-F332 HydrophobicContact CB-CZ 3.34Å
184S74.2Confident76.6Confident58 Ų5851.3 Ų51.341%0.40628%0.275SS..Hα-helixtrans-70.5-45.1174.3-175.50000113.4V180 K181 L182 V186 Q187 N188V180-S184 PolarHBondContact O-N 3.07Å; K181-S184 PolarHBondContact O-N 2.85Å; L182-S184 PolarHBondContact O-N 3.32Å; S184-V186 PolarHBondContact O-N 3.31Å; S184-Q187 WeakPolarHBondContact O-CB 3.31Å; S184-Q187 PolarHBondContact O-N 2.82Å; S184-N188 PolarHBondContact O-N 2.76Å
185Y78.3Confident77.4Confident172 Ų17252.8 Ų52.868%0.67528%0.275SS*.Hα-helixtrans-61.6-44.5176.2-79-65.8000112.1K181 L182 Q187 N188 F189K181-Y185 WeakPolarHBondContact O-CD2 3.3Å; K181-Y185 PolarHBondContact O-N 3.07Å; L182-Y185 PolarHBondContact O-N 3.29Å; Y185-Q187 VanDerWaalsContact C-N 3.3Å; Y185-Q187 PolarHBondContact O-N 3.01Å; Y185-N188 PolarHBondContact O-N 3.3Å; Y185-F189 PolarHBondContact O-N 3.24Å
186V80.6Confident78.1Confident31 Ų3156.6 Ų56.619%0.18829%0.294CS..Hα-helixtrans-60.9-41.2176.3171.30000110.6L182 S184 N188 F189 F190 F324L182-V186 HydrophobicContact CD1-CG2 4.07Å; L182-V186 HydrophobicContact CG-CG2 4.19Å; L182-V186 WeakPolarHBondContact O-CB 3.33Å; L182-V186 WeakPolarHBondContact O-CG2 3.47Å; L182-V186 PolarHBondContact O-N 3.36Å; S184-V186 PolarHBondContact O-N 3.31Å; V186-N188 PolarHBondContact O-N 3.46Å; V186-F189 PolarHBondContact O-N 3.49Å; V186-F190 HydrophobicContact CG1-CD2 3.51Å; V186-F190 HydrophobicContact CG1-CE2 3.12Å; V186-F190 HydrophobicContact CG1-CZ 4.09Å; V186-F190 WeakPolarHBondContact O-CD2 3.35Å; V186-F190 WeakPolarHBondContact O-CG 3.47Å; V186-F190 PolarHBondContact O-N 2.9Å; V186-F324 HydrophobicContact CG1-CE1 4.41Å
187Q78.3Confident78.6Confident23 Ų2356.3 Ų56.311%0.10729%0.293CS..Hα-helixtrans-59.5-46.7174.7-169.564.926.900112.6A183 S184 Y185 F190 T191 G325 N328A183-Q187 WeakPolarHBondContact O-CB 3.43Å; A183-Q187 PolarHBondContact O-N 3.35Å; S184-Q187 WeakPolarHBondContact O-CB 3.31Å; S184-Q187 PolarHBondContact O-N 2.82Å; Y185-Q187 VanDerWaalsContact C-N 3.3Å; Y185-Q187 PolarHBondContact O-N 3.01Å; Q187-F190 PolarHBondContact O-N 3.21Å; Q187-T191 WeakPolarHBondContact O-CB 3.19Å; Q187-T191 PolarHBondContact O-N 3.19Å; Q187-T191 PolarHBondContact O-OG1 3Å; Q187-G325 VanDerWaalsContact CD-O 3.3Å; Q187-G325 PolarHBondContact NE2-O 3.43Å; Q187-G325 PolarHBondContact OE1-O 2.88Å; Q187-N328 PolarHBondContact OE1-ND2 3.04Å
188N79Confident79.3Confident102 Ų10256.1 Ų56.155%0.54529%0.291SS..Hα-helixtrans-64.2-42.6-178.5-69.9-20.8000111.3S184 Y185 V186 T191 G192S184-N188 PolarHBondContact O-N 2.76Å; Y185-N188 PolarHBondContact O-N 3.3Å; V186-N188 PolarHBondContact O-N 3.46Å; N188-T191 PolarHBondContact O-N 3.46Å; N188-G192 PolarHBondContact O-N 3.12Å
189F84.8Confident80Confident133 Ų13357.5 Ų57.558%0.58330%0.298SS*.Hα-helixtrans-59-50.5175176.2-99.4000111.7Y185 V186 T191 G192 A193Y185-F189 PolarHBondContact O-N 3.24Å; V186-F189 PolarHBondContact O-N 3.49Å; F189-T191 VanDerWaalsContact C-N 3.29Å; F189-T191 PolarHBondContact O-N 3.41Å; F189-G192 PolarHBondContact O-N 3.42Å; F189-A193 PolarHBondContact O-N 3.45Å
190F83.9Confident80.9Confident22 Ų2258.1 Ų58.110%0.09630%0.3CS..Hα-helixtrans-67.8-27.8179.1-67.5-41.9000113.7V186 Q187 A193 K194 F321 F324V186-F190 HydrophobicContact CG1-CD2 3.51Å; V186-F190 HydrophobicContact CG1-CE2 3.12Å; V186-F190 HydrophobicContact CG1-CZ 4.09Å; V186-F190 WeakPolarHBondContact O-CD2 3.35Å; V186-F190 WeakPolarHBondContact O-CG 3.47Å; V186-F190 PolarHBondContact O-N 2.9Å; Q187-F190 PolarHBondContact O-N 3.21Å; F190-A193 PolarHBondContact O-N 3.49Å; F190-K194 WeakPolarHBondContact O-CG 3.3Å; F190-K194 PolarHBondContact O-N 2.85Å; F190-F321 HydrophobicContact CD1-CB 3.61Å; F190-F321 HydrophobicContact CD1-CD1 4.23Å; F190-F321 AromaticContact CD1-CG 3.92Å; F190-F321 HydrophobicContact CD1-CG 3.92Å; F190-F321 HydrophobicContact CE1-CB 3.89Å; F190-F321 AromaticContact CE1-CD1 3.58Å; F190-F321 HydrophobicContact CE1-CD1 3.58Å; F190-F321 HydrophobicContact CE1-CD2 4.48Å; F190-F321 HydrophobicContact CE1-CE1 4.22Å; F190-F321 AromaticContact CE1-CG 3.73Å; F190-F321 HydrophobicContact CE1-CG 3.73Å; F190-F321 HydrophobicContact CZ-CD1 4.44Å; F190-F324 AromaticContact CD2-CD1 3.91Å; F190-F324 HydrophobicContact CD2-CD1 3.91Å; F190-F324 HydrophobicContact CE2-CB 4.41Å; F190-F324 AromaticContact CE2-CD1 3.2Å; F190-F324 HydrophobicContact CE2-CD1 3.2Å; F190-F324 AromaticContact CE2-CE1 3.67Å; F190-F324 HydrophobicContact CE2-CE1 3.67Å; F190-F324 HydrophobicContact CE2-CG 4.08Å; F190-F324 AromaticContact CZ-CD1 3.82Å; F190-F324 HydrophobicContact CZ-CD1 3.82Å; F190-F324 HydrophobicContact CZ-CE1 4.28Å; F190-F324 HydrophobicContact CZ-CG 4.36Å
191T79Confident81.8Confident11 Ų1155 Ų557%0.06728%0.281CS..Hα-helixtrans-68.4-40.5172.9-56.40000111.3Q187 N188 F189 K194 L195Q187-T191 WeakPolarHBondContact O-CB 3.19Å; Q187-T191 PolarHBondContact O-N 3.19Å; Q187-T191 PolarHBondContact O-OG1 3Å; N188-T191 PolarHBondContact O-N 3.46Å; F189-T191 VanDerWaalsContact C-N 3.29Å; F189-T191 PolarHBondContact O-N 3.41Å; T191-K194 WeakPolarHBondContact O-CG 3.43Å; T191-L195 WeakPolarHBondContact O-CG 3.44Å; T191-L195 PolarHBondContact O-N 3.48Å
192G82.6Confident82.6Confident34 Ų3448.7 Ų48.735%0.35126%0.256SS..Hα-helixtrans-62-47.1171.100000111.9N188 F189 K194 L195 I196N188-G192 PolarHBondContact O-N 3.12Å; F189-G192 PolarHBondContact O-N 3.42Å; G192-K194 PolarHBondContact O-N 2.84Å; G192-L195 PolarHBondContact O-N 2.93Å; G192-I196 WeakPolarHBondContact O-CG1 3.47Å; G192-I196 PolarHBondContact O-N 2.94Å
193A83.8Confident83.3Confident6 Ų648.7 Ų48.75%0.0526%0.259CS..Hα-helixtrans-58.5-45.7-179.900000112.8F189 F190 L195 I196 I197 F318 F321F189-A193 PolarHBondContact O-N 3.45Å; F190-A193 PolarHBondContact O-N 3.49Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-L195 PolarHBondContact O-N 3.1Å; A193-I196 PolarHBondContact O-N 2.86Å; A193-I197 PolarHBondContact O-N 3.05Å; A193-F318 HydrophobicContact CB-CD1 3.8Å; A193-F318 HydrophobicContact CB-CE1 3.91Å; A193-F318 WeakPolarHBondContact O-CD1 3.29Å; A193-F321 HydrophobicContact CB-CB 4.38Å; A193-F321 HydrophobicContact CB-CD2 4.36Å
194K82.8Confident84Confident0 Ų049.5 Ų49.50%027%0.265CS..Hα-helixtrans-66.6-32.6-179.768.5177.165.5-174.60113.6G47 I50 F190 T191 G192 I197 I198 S322 S326G47-K194 PolarHBondContact O-NZ 3.31Å; I50-K194 HydrophobicContact CB-CD 4.22Å; I50-K194 HydrophobicContact CG2-CD 3.99Å; I50-K194 HydrophobicContact CG2-CG 4.39Å; I50-K194 WeakPolarHBondContact O-CD 3.01Å; I50-K194 WeakPolarHBondContact O-CE 3.48Å; I50-K194 PolarHBondContact O-NZ 2.92Å; F190-K194 WeakPolarHBondContact O-CG 3.3Å; F190-K194 PolarHBondContact O-N 2.85Å; T191-K194 WeakPolarHBondContact O-CG 3.43Å; G192-K194 PolarHBondContact O-N 2.84Å; K194-I197 VanDerWaalsContact O-CG2 3.23Å; K194-I197 WeakPolarHBondContact O-CG2 3.1Å; K194-I198 WeakPolarHBondContact O-CG1 3.25Å; K194-I198 PolarHBondContact O-N 2.91Å; K194-S322 WeakPolarHBondContact CB-OG 3.38Å; K194-S326 PolarHBondContact NZ-OG 3.47Å
195L84.1Confident84.6Confident60 Ų6046.8 Ų46.831%0.31425%0.246SC..Hα-helixtrans-70.7-38.9177.2-70.7176.8000111.3V46 I50 T191 G192 A193 I197 I198 I199V46-L195 HydrophobicContact CG1-CD2 3.9Å; I50-L195 HydrophobicContact CD1-CD2 3.9Å; T191-L195 WeakPolarHBondContact O-CG 3.44Å; T191-L195 PolarHBondContact O-N 3.48Å; G192-L195 PolarHBondContact O-N 2.93Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-L195 PolarHBondContact O-N 3.1Å; L195-I197 PolarHBondContact O-N 3.37Å; L195-I198 PolarHBondContact O-N 3.19Å; L195-I199 VanDerWaalsContact O-CG1 3.29Å; L195-I199 WeakPolarHBondContact O-CG1 3.35Å; L195-I199 PolarHBondContact O-N 3.23Å
196I87Confident85Confident96 Ų9642.5 Ų42.549%0.49224%0.235SC..Hα-helixtrans-59.1-49.7177.5-67.9165.1000110.6G192 A193 I198 I199 V200G192-I196 WeakPolarHBondContact O-CG1 3.47Å; G192-I196 PolarHBondContact O-N 2.94Å; A193-I196 PolarHBondContact O-N 2.86Å; I196-I198 VanDerWaalsContact C-N 3.33Å; I196-I198 PolarHBondContact O-N 3.29Å; I196-I199 PolarHBondContact O-N 3.42Å; I196-V200 HydrophobicContact CG2-CG2 4.46Å; I196-V200 WeakPolarHBondContact O-CG2 3.44Å; I196-V200 PolarHBondContact O-N 3.44Å
197I85.8Confident85.4Confident2 Ų244.5 Ų44.51%0.0125%0.247CC..Hα-helixtrans-65.9-35.2-176.8-169.761.4000112.6F55 A193 K194 L195 V200 I201 V315 F318F55-I197 HydrophobicContact CZ-CG2 4.4Å; A193-I197 PolarHBondContact O-N 3.05Å; K194-I197 VanDerWaalsContact O-CG2 3.23Å; K194-I197 WeakPolarHBondContact O-CG2 3.1Å; L195-I197 PolarHBondContact O-N 3.37Å; I197-V200 PolarHBondContact O-N 3.39Å; I197-I201 HydrophobicContact CG1-CD1 4.23Å; I197-I201 WeakPolarHBondContact O-CG1 3.33Å; I197-I201 PolarHBondContact O-N 3.3Å; I197-V315 HydrophobicContact CD1-CG1 4.48Å; I197-V315 HydrophobicContact CD1-CG2 4.27Å; I197-F318 HydrophobicContact CB-CB 3.76Å; I197-F318 HydrophobicContact CB-CD1 4.49Å; I197-F318 HydrophobicContact CB-CG 4.28Å; I197-F318 HydrophobicContact CD1-CB 4.23Å; I197-F318 HydrophobicContact CG1-CB 3.93Å; I197-F318 HydrophobicContact CG2-CB 4.09Å
198I87.1Confident85.8Confident4 Ų444.1 Ų44.12%0.02125%0.245CC..Hα-helixtrans-66.3-43.9175.6-72.6174.4000110.9I50 K194 L195 I196 V200 I201 V202 C276 V280I50-I198 HydrophobicContact CB-CD1 4.44Å; I50-I198 HydrophobicContact CD1-CD1 4.02Å; I50-I198 HydrophobicContact CG1-CD1 4.49Å; I50-I198 HydrophobicContact CG2-CD1 3.18Å; K194-I198 WeakPolarHBondContact O-CG1 3.25Å; K194-I198 PolarHBondContact O-N 2.91Å; L195-I198 PolarHBondContact O-N 3.19Å; I196-I198 VanDerWaalsContact C-N 3.33Å; I196-I198 PolarHBondContact O-N 3.29Å; I198-V200 VanDerWaalsContact C-N 3.27Å; I198-V200 PolarHBondContact O-N 3.48Å; I198-I201 PolarHBondContact O-N 3.4Å; I198-V202 HydrophobicContact CG2-CG2 4.29Å; I198-V202 WeakPolarHBondContact O-CB 3.4Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.48Å; I198-V202 PolarHBondContact O-N 3.24Å; I198-C276 HydrophobicContact CG2-CB 4.12Å; I198-V280 HydrophobicContact CG2-CG2 4.03Å
199I88.6Confident86.1Confident107 Ų10741.9 Ų41.955%0.54923%0.232SC..Hα-helixtrans-59.4-43.3175.6-68.3166.1000110.1L195 I196 I201 V202 V203L195-I199 VanDerWaalsContact O-CG1 3.29Å; L195-I199 WeakPolarHBondContact O-CG1 3.35Å; L195-I199 PolarHBondContact O-N 3.23Å; I196-I199 PolarHBondContact O-N 3.42Å; I199-I201 PolarHBondContact O-N 2.91Å; I199-V202 PolarHBondContact O-N 3.24Å; I199-V203 HydrophobicContact CG2-CG2 4.1Å; I199-V203 WeakPolarHBondContact O-CB 3.37Å; I199-V203 VanDerWaalsContact O-CG2 3.25Å; I199-V203 WeakPolarHBondContact O-CG2 3.36Å; I199-V203 PolarHBondContact O-N 3.3Å
200V88.7Confident86.1Confident56 Ų5639.8 Ų39.834%0.33924%0.24SC..Hα-helixtrans-58.9-48176.8170.60000111.4I196 I197 I198 A204 L308I196-V200 HydrophobicContact CG2-CG2 4.46Å; I196-V200 WeakPolarHBondContact O-CG2 3.44Å; I196-V200 PolarHBondContact O-N 3.44Å; I197-V200 PolarHBondContact O-N 3.39Å; I198-V200 VanDerWaalsContact C-N 3.27Å; I198-V200 PolarHBondContact O-N 3.48Å; V200-A204 WeakPolarHBondContact O-CB 3.39Å; V200-A204 PolarHBondContact O-N 3.02Å; V200-L308 HydrophobicContact CG1-CD1 4.04Å; V200-L308 HydrophobicContact CG1-CD2 4.49Å
201I88.5Confident86.2Confident1 Ų144.8 Ų44.81%0.00526%0.263CS..Hα-helixtrans-63.1-44.9179.3-67166.8000111.1F55 I197 I198 I199 A204 G205 V280 A283 Y284 F303F55-I201 HydrophobicContact CE1-CD1 4.4Å; I197-I201 HydrophobicContact CG1-CD1 4.23Å; I197-I201 WeakPolarHBondContact O-CG1 3.33Å; I197-I201 PolarHBondContact O-N 3.3Å; I198-I201 PolarHBondContact O-N 3.4Å; I199-I201 PolarHBondContact O-N 2.91Å; I201-A204 PolarHBondContact O-N 2.68Å; I201-G205 PolarHBondContact O-N 3.02Å; I201-V280 HydrophobicContact CG2-CG1 4.22Å; I201-V280 HydrophobicContact CG2-CG2 4.24Å; I201-A283 HydrophobicContact CG2-CB 3.96Å; I201-Y284 HydrophobicContact CG2-CE1 4.24Å; I201-F303 HydrophobicContact CB-CE1 4.29Å; I201-F303 HydrophobicContact CG1-CD1 4.24Å; I201-F303 HydrophobicContact CG1-CE1 4.03Å; I201-F303 HydrophobicContact CG2-CD1 4.5Å; I201-F303 HydrophobicContact CG2-CE1 4.06Å; I201-F303 HydrophobicContact CG2-CZ 4.1Å
202V89.6Confident86.2Confident24 Ų2446.5 Ų46.515%0.14528%0.283CS..Hα-helixtrans-65.1-47.3-179.4170.80000111.4I198 I199 A204 G205 I206 F279 V280I198-V202 HydrophobicContact CG2-CG2 4.29Å; I198-V202 WeakPolarHBondContact O-CB 3.4Å; I198-V202 VanDerWaalsContact O-CG2 3.3Å; I198-V202 WeakPolarHBondContact O-CG2 3.48Å; I198-V202 PolarHBondContact O-N 3.24Å; I199-V202 PolarHBondContact O-N 3.24Å; V202-A204 PolarHBondContact O-N 3.07Å; V202-G205 PolarHBondContact O-N 3.09Å; V202-I206 HydrophobicContact CG1-CD1 3.91Å; V202-I206 WeakPolarHBondContact O-CG1 3.26Å; V202-I206 PolarHBondContact O-N 3.24Å; V202-F279 HydrophobicContact CB-CB 4.49Å; V202-F279 HydrophobicContact CG1-CB 3.93Å; V202-F279 HydrophobicContact CG1-CG 4.3Å; V202-F279 HydrophobicContact CG2-CB 3.82Å; V202-V280 HydrophobicContact CG2-CG2 3.8Å
203V89.9Confident86.1Confident80 Ų8050.1 Ų50.149%0.48529%0.289SS..Hα-helixtrans-62.8-44.4178.8171.20000110.5I199 G205 I206 V207I199-V203 HydrophobicContact CG2-CG2 4.1Å; I199-V203 WeakPolarHBondContact O-CB 3.37Å; I199-V203 VanDerWaalsContact O-CG2 3.25Å; I199-V203 WeakPolarHBondContact O-CG2 3.36Å; I199-V203 PolarHBondContact O-N 3.3Å; V203-G205 VanDerWaalsContact C-N 3.34Å; V203-G205 PolarHBondContact O-N 2.99Å; V203-I206 PolarHBondContact O-N 3.47Å; V203-V207 WeakPolarHBondContact O-CG2 2.95Å; V203-V207 PolarHBondContact O-N 3.44Å
204A87.6Confident85.8Confident17 Ų1753 Ų5314%0.1431%0.306CS..Hα-helixtrans-60.4-43.3176.300000111.9V200 I201 V202 I206 V207 L208 F303 V307V200-A204 WeakPolarHBondContact O-CB 3.39Å; V200-A204 PolarHBondContact O-N 3.02Å; I201-A204 PolarHBondContact O-N 2.68Å; V202-A204 PolarHBondContact O-N 3.07Å; A204-I206 PolarHBondContact O-N 3.03Å; A204-V207 PolarHBondContact O-N 3.22Å; A204-L208 WeakPolarHBondContact O-CD1 3.48Å; A204-L208 VanDerWaalsContact O-CG 3.26Å; A204-L208 WeakPolarHBondContact O-CG 3.32Å; A204-L208 PolarHBondContact O-N 2.9Å; A204-F303 HydrophobicContact CB-CE1 4.37Å; A204-F303 HydrophobicContact CB-CZ 4.03Å; A204-V307 HydrophobicContact CB-CG1 4.06Å
205G86.4Confident85.3Confident1 Ų160.6 Ų60.61%0.0134%0.342CS..Hα-helixtrans-60.1-43.8174.700000113.3I201 V202 V203 V207 L208 M209I201-G205 PolarHBondContact O-N 3.02Å; V202-G205 PolarHBondContact O-N 3.09Å; V203-G205 VanDerWaalsContact C-N 3.34Å; V203-G205 PolarHBondContact O-N 2.99Å; G205-V207 PolarHBondContact O-N 3.49Å; G205-L208 PolarHBondContact O-N 3.06Å; G205-M209 WeakPolarHBondContact O-CG 3.11Å; G205-M209 PolarHBondContact O-N 3.05Å
206I87.8Confident84.8Confident83 Ų8360.2 Ų60.243%0.42634%0.34SS..Hα-helixtrans-62.9-43177.7-67.5166.7000111.3V202 V203 A204 L208 M209 A210V202-I206 HydrophobicContact CG1-CD1 3.91Å; V202-I206 WeakPolarHBondContact O-CG1 3.26Å; V202-I206 PolarHBondContact O-N 3.24Å; V203-I206 PolarHBondContact O-N 3.47Å; A204-I206 PolarHBondContact O-N 3.03Å; I206-L208 VanDerWaalsContact C-N 3.35Å; I206-L208 PolarHBondContact O-N 3.27Å; I206-M209 HydrophobicContact CB-CE 4.48Å; I206-M209 HydrophobicContact CG1-CE 4.09Å; I206-M209 PolarHBondContact O-N 3.24Å; I206-A210 PolarHBondContact O-N 2.9Å
207V88.7Confident83.9Confident73 Ų7358 Ų5844%0.44233%0.329SS..Hα-helixtrans-62.8-42.6177.3172.30000111.1V203 A204 G205 A210 Q211V203-V207 WeakPolarHBondContact O-CG2 2.95Å; V203-V207 PolarHBondContact O-N 3.44Å; A204-V207 PolarHBondContact O-N 3.22Å; G205-V207 PolarHBondContact O-N 3.49Å; V207-A210 WeakPolarHBondContact O-CB 3.33Å; V207-A210 PolarHBondContact O-N 2.84Å; V207-Q211 WeakPolarHBondContact O-CG 3.27Å; V207-Q211 PolarHBondContact O-N 3.43Å
208L85.8Confident82.9Confident15 Ų1562.1 Ų62.18%0.07936%0.357CS..Hα-helixtrans-67.3-36178.7-69.7165.3000112.5A204 G205 I206 Q211 K213 V287 V307A204-L208 WeakPolarHBondContact O-CD1 3.48Å; A204-L208 VanDerWaalsContact O-CG 3.26Å; A204-L208 WeakPolarHBondContact O-CG 3.32Å; A204-L208 PolarHBondContact O-N 2.9Å; G205-L208 PolarHBondContact O-N 3.06Å; I206-L208 VanDerWaalsContact C-N 3.35Å; I206-L208 PolarHBondContact O-N 3.27Å; L208-Q211 PolarHBondContact O-N 3.3Å; L208-K213 HydrophobicContact CD2-CD 3.98Å; L208-K213 PolarHBondContact O-N 3.26Å; L208-V287 HydrophobicContact CD1-CG2 3.45Å; L208-V287 VanDerWaalsContact CD1-CG2 3.45Å; L208-V307 HydrophobicContact CD1-CG1 4.05Å; L208-V307 HydrophobicContact CD1-CG2 3.82Å
209M84.9Confident81.9Confident54 Ų5466.8 Ų66.827%0.26638%0.382SS..Hα-helixtrans-63.6-42.7170.7-73.8-170.1-6600111.7G205 I206 Q211 G212 I282 T286G205-M209 WeakPolarHBondContact O-CG 3.11Å; G205-M209 PolarHBondContact O-N 3.05Å; I206-M209 HydrophobicContact CB-CE 4.48Å; I206-M209 HydrophobicContact CG1-CE 4.09Å; I206-M209 PolarHBondContact O-N 3.24Å; M209-Q211 PolarHBondContact O-N 3.23Å; M209-G212 PolarHBondContact O-N 2.97Å; M209-I282 HydrophobicContact CE-CG2 4.07Å; M209-I282 HydrophobicContact SD-CG2 3.56Å; M209-I282 VanDerWaalsContact SD-CG2 3.56Å; M209-T286 HydrophobicContact CG-CG2 3.4Å; M209-T286 HydrophobicContact SD-CG2 4.12Å
210A86.2Confident80.9Confident90 Ų9062.3 Ų62.374%0.74436%0.362SS*.Hα-helixtrans-63.8-25.5176.800000112.8I206 V207 G212I206-A210 PolarHBondContact O-N 2.9Å; V207-A210 WeakPolarHBondContact O-CB 3.33Å; V207-A210 PolarHBondContact O-N 2.84Å; A210-G212 PolarHBondContact O-N 3.2Å
211Q85.8Confident80.3Confident127 Ų12765.8 Ų65.859%0.59337%0.372SS*.THydrogen-bonded Turntrans-79.2-0.8172.6-69.1173.31.400113.8V207 L208 M209V207-Q211 WeakPolarHBondContact O-CG 3.27Å; V207-Q211 PolarHBondContact O-N 3.43Å; L208-Q211 PolarHBondContact O-N 3.3Å; M209-Q211 PolarHBondContact O-N 3.23Å
212G79.5Confident79Confident46 Ų4673.1 Ų73.147%0.47441%0.407SS..THydrogen-bonded Turntrans91.55.717500000115.6M209 A210 T214M209-G212 PolarHBondContact O-N 2.97Å; A210-G212 PolarHBondContact O-N 3.2Å; G212-T214 PolarHBondContact O-N 3.35Å
213K79.6Confident77.9Confident111 Ų11174.3 Ų74.348%0.48342%0.424SS..  trans-75.469.4178.1-65.5-177.8-179177.20112.1L208L208-K213 HydrophobicContact CD2-CD 3.98Å; L208-K213 PolarHBondContact O-N 3.26Å
214T77.4Confident76.9Confident67 Ų6773.4 Ų73.441%0.41142%0.421SS..  trans-1186.5-176.5570000113.4G212 N216 L217G212-T214 PolarHBondContact O-N 3.35Å; T214-N216 VanDerWaalsContact C-N 3.3Å; T214-N216 PolarHBondContact O-N 3.28Å; T214-L217 WeakPolarHBondContact O-CB 3.17Å; T214-L217 PolarHBondContact O-N 2.89Å
215E73.3Confident75.8Confident159 Ų15974.5 Ų74.574%0.74343%0.428SS*.Hα-helixtrans-56.4-41.8-175.1-62.9179.2-179.700112.3L217 S218E215-L217 PolarHBondContact O-N 3.49Å; E215-L217 VanDerWaalsContact O-N 3.17Å; E215-S218 WeakPolarHBondContact O-CB 3.4Å; E215-S218 PolarHBondContact O-N 3.16Å; E215-S218 PolarHBondContact O-OG 2.91Å
216N71.9Confident74.9Confident52 Ų5280.5 Ų80.528%0.27846%0.464SS..Hα-helixtrans-68.4-12.2178.5-63.8-29.4000114.5T214 F285 M288T214-N216 VanDerWaalsContact C-N 3.3Å; T214-N216 PolarHBondContact O-N 3.28Å; N216-F285 VanDerWaalsContact CB-O 3.28Å; N216-F285 WeakPolarHBondContact CB-O 3.32Å; N216-F285 PolarHBondContact ND2-O 3.38Å; N216-M288 PolarHBondContact ND2-O 3Å
217L68.8Low74.3Confident49 Ų4978.9 Ų78.926%0.25746%0.46SS..Hα-helixtrans-98.1-8.8179-67.1158000112.3V68 T214 E215 F285 T286V68-L217 HydrophobicContact CG1-CD2 4.19Å; T214-L217 WeakPolarHBondContact O-CB 3.17Å; T214-L217 PolarHBondContact O-N 2.89Å; E215-L217 PolarHBondContact O-N 3.49Å; E215-L217 VanDerWaalsContact O-N 3.17Å; L217-F285 HydrophobicContact CD2-CB 4.42Å; L217-T286 HydrophobicContact CD1-CG2 4.28Å
218S64.1Low73.7Confident88 Ų8880.8 Ų80.862%0.61546%0.463SS*.Hα-helixtrans-75-37.7-172.3630000113.8E215E215-S218 WeakPolarHBondContact O-CB 3.4Å; E215-S218 PolarHBondContact O-N 3.16Å; E215-S218 PolarHBondContact O-OG 2.91Å
219N67.6Low73.3Confident102 Ų10280.1 Ų80.155%0.54546%0.459SS..THydrogen-bonded Turntrans-109.448177.6-66.8-10.8000112F221N219-F221 PolarHBondContact O-N 3.35Å; N219-F221 VanDerWaalsContact O-N 3.09Å
220A67.6Low73.2Confident14 Ų1477.7 Ų77.712%0.11645%0.448CS..THydrogen-bonded Turntrans-72.5-0.1-167.200000116.4V68 G69 P70V68-A220 HydrophobicContact CB-CB 4.33Å; G69-A220 WeakPolarHBondContact CA-O 3.37Å; G69-A220 PolarHBondContact N-O 2.84Å; P70-A220 WeakPolarHBondContact CD-O 3.34Å
221F74.9Confident73.1Confident128 Ų12876 Ų7656%0.56143%0.426SS*.THydrogen-bonded Turntrans-128.13.3-176.1-68.3-85.2000114.2D67 P70 L73 N219 G223D67-F221 VanDerWaalsContact OD2-CA 3.29Å; D67-F221 WeakPolarHBondContact OD2-CA 3.46Å; D67-F221 PolarHBondContact OD2-N 3.3Å; P70-F221 HydrophobicContact CG-CD1 4.26Å; L73-F221 HydrophobicContact CD1-CE1 4.01Å; L73-F221 HydrophobicContact CD1-CZ 4.37Å; N219-F221 PolarHBondContact O-N 3.35Å; N219-F221 VanDerWaalsContact O-N 3.09Å; F221-G223 PolarHBondContact O-N 2.74Å
222E62.5Low73.1Confident156 Ų15669.9 Ų69.973%0.72940%0.397SS*.THydrogen-bonded Turntrans-81.963.3-179.2-67.1-170.9157.300111.6D67D67-E222 PolarHBondContact OD2-N 3.35Å
223G65.8Low73.4Confident49 Ų4967.8 Ų67.851%0.50538%0.375SS..THydrogen-bonded Turntrans160.515.2179.700000115.8D67 F221 S225D67-G223 PolarHBondContact OD2-N 3Å; F221-G223 PolarHBondContact O-N 2.74Å; G223-S225 PolarHBondContact O-N 3.47Å
224S68.5Low73.9Confident60 Ų6062.5 Ų62.542%0.4235%0.352SS..  trans-59.5124.4-172.963.10000112.2T226S224-T226 PolarHBondContact O-N 3.2Å
225S64.5Low74.4Confident41 Ų4160.7 Ų60.729%0.28734%0.339SS..  trans-68.1121.8169.5179.40000109.6Y64 S65 G223Y64-S225 WeakPolarHBondContact O-CB 2.91Å; S65-S225 PolarHBondContact O-N 2.89Å; S65-S225 VanDerWaalsContact O-N 3.08Å; G223-S225 PolarHBondContact O-N 3.47Å
226T68Low75.2Confident127 Ų12753.1 Ų53.178%0.77930%0.303SS*.  trans-96.4417654.30000112.9S224 F228S224-T226 PolarHBondContact O-N 3.2Å; T226-F228 PolarHBondContact O-N 2.74Å
227S74.4Confident76Confident49 Ų4950.7 Ų50.734%0.34329%0.29SS..  trans-71123.9-179.1170.30000111.2G229 A230 I231S227-G229 VanDerWaalsContact C-N 3.29Å; S227-G229 PolarHBondContact O-N 3.44Å; S227-A230 PolarHBondContact O-N 3.37Å; S227-I231 WeakPolarHBondContact O-CG1 3.14Å; S227-I231 PolarHBondContact O-N 3.26Å; S227-I231 VanDerWaalsContact O-N 3.09Å
228F76Confident77Confident113 Ų11348.3 Ų48.350%0.49628%0.278SS..Hα-helixtrans-57.5-38.1-176.7-175.9-103.9000113T226 G232 Y433 A437 D441T226-F228 PolarHBondContact O-N 2.74Å; F228-G232 PolarHBondContact O-N 3.39Å; F228-Y433 HydrophobicContact CD1-CE2 4.05Å; F228-Y433 AromaticContact CD2-CE2 3.87Å; F228-Y433 HydrophobicContact CD2-CE2 3.87Å; F228-Y433 AromaticContact CE1-CD2 3.93Å; F228-Y433 HydrophobicContact CE1-CD2 3.93Å; F228-Y433 AromaticContact CE1-CE2 3.55Å; F228-Y433 HydrophobicContact CE1-CE2 3.55Å; F228-Y433 AromaticContact CE2-CD2 3.87Å; F228-Y433 HydrophobicContact CE2-CD2 3.87Å; F228-Y433 AromaticContact CE2-CE2 3.34Å; F228-Y433 HydrophobicContact CE2-CE2 3.34Å; F228-Y433 HydrophobicContact CG-CE2 4.22Å; F228-Y433 AromaticContact CZ-CD2 3.39Å; F228-Y433 HydrophobicContact CZ-CD2 3.39Å; F228-Y433 AromaticContact CZ-CE2 3.18Å; F228-Y433 HydrophobicContact CZ-CE2 3.18Å; F228-Y433 PolarHBondContact O-OH 3.37Å; F228-A437 HydrophobicContact CD1-CB 3.78Å; F228-A437 HydrophobicContact CE1-CB 3.52Å; F228-A437 HydrophobicContact CZ-CB 4.38Å; F228-D441 WeakPolarHBondContact CB-OD2 3.2Å
229G77.8Confident78.2Confident0 Ų044.8 Ų44.80%025%0.252CS..Hα-helixtrans-81.9-32.7177.600000114S227 I231 G232 L233 D441S227-G229 VanDerWaalsContact C-N 3.29Å; S227-G229 PolarHBondContact O-N 3.44Å; G229-I231 VanDerWaalsContact C-N 3.32Å; G229-G232 PolarHBondContact O-N 3.47Å; G229-L233 WeakPolarHBondContact O-CG 3.15Å; G229-L233 PolarHBondContact O-N 2.81Å; G229-D441 WeakPolarHBondContact CA-OD2 3.32Å; G229-D441 PolarHBondContact N-OD2 2.98Å
230A82.1Confident79.3Confident4 Ų440.6 Ų40.63%0.03323%0.229CC..Hα-helixtrans-62.7-42.9173.500000110.6Y64 S227 G232 L233 A234Y64-A230 WeakPolarHBondContact CB-O 3.45Å; S227-A230 PolarHBondContact O-N 3.37Å; A230-G232 VanDerWaalsContact C-N 3.33Å; A230-G232 PolarHBondContact O-N 3.26Å; A230-L233 PolarHBondContact O-N 3.32Å; A230-A234 PolarHBondContact O-N 3.08Å
231I85.8Confident80.4Confident53 Ų5340 Ų4027%0.27222%0.224SC..Hα-helixtrans-60.2-43.4173.5-65.6168000110.7S227 G229 L233 A234 F235S227-I231 WeakPolarHBondContact O-CG1 3.14Å; S227-I231 PolarHBondContact O-N 3.26Å; S227-I231 VanDerWaalsContact O-N 3.09Å; G229-I231 VanDerWaalsContact C-N 3.32Å; I231-L233 PolarHBondContact O-N 3.08Å; I231-A234 WeakPolarHBondContact O-CB 3.49Å; I231-A234 PolarHBondContact O-N 3.3Å; I231-F235 HydrophobicContact CG2-CD2 3.71Å; I231-F235 HydrophobicContact CG2-CE2 3.6Å; I231-F235 VanDerWaalsContact O-CD2 3.27Å; I231-F235 WeakPolarHBondContact O-CD2 3.35Å; I231-F235 PolarHBondContact O-N 3.17Å
232G84.9Confident81Confident0 Ų034 Ų340%020%0.197CC..Hα-helixtrans-58.4-43.5174.900000113.7F228 G229 A230 F235 Y236F228-G232 PolarHBondContact O-N 3.39Å; G229-G232 PolarHBondContact O-N 3.47Å; A230-G232 VanDerWaalsContact C-N 3.33Å; A230-G232 PolarHBondContact O-N 3.26Å; G232-F235 WeakPolarHBondContact O-CB 3.47Å; G232-F235 PolarHBondContact O-N 2.86Å; G232-Y236 PolarHBondContact O-N 2.75Å
233L86.1Confident82.1Confident1 Ų127.8 Ų27.81%0.00517%0.169CC..Hα-helixtrans-67.6-35.1175.4-68176.2000112.6Y64 G229 A230 I231 Y236 N237 K442 Y447Y64-L233 HydrophobicContact CD1-CB 4.08Å; Y64-L233 HydrophobicContact CD1-CD1 4.12Å; Y64-L233 HydrophobicContact CD2-CB 3.81Å; Y64-L233 HydrophobicContact CE1-CB 4.17Å; Y64-L233 HydrophobicContact CE1-CD1 3.66Å; Y64-L233 HydrophobicContact CE2-CB 3.92Å; Y64-L233 HydrophobicContact CG-CB 3.92Å; G229-L233 WeakPolarHBondContact O-CG 3.15Å; G229-L233 PolarHBondContact O-N 2.81Å; A230-L233 PolarHBondContact O-N 3.32Å; I231-L233 PolarHBondContact O-N 3.08Å; L233-Y236 HydrophobicContact CD2-CD2 4.17Å; L233-Y236 PolarHBondContact O-N 3.3Å; L233-N237 PolarHBondContact O-N 2.9Å; L233-N237 VanDerWaalsContact O-N 3.13Å; L233-N237 PolarHBondContact O-ND2 3.38Å; L233-K442 HydrophobicContact CD1-CD 3.81Å; L233-Y447 WeakPolarHBondContact CD2-OH 3.27Å
234A89.1Confident82.7Confident0 Ų025.5 Ų25.50%015%0.145CC..Hα-helixtrans-64.2-42.1172.400000111I74 A230 I231 N237 G238I74-A234 HydrophobicContact CD1-CB 3.74Å; I74-A234 HydrophobicContact CG2-CB 4.33Å; A230-A234 PolarHBondContact O-N 3.08Å; I231-A234 WeakPolarHBondContact O-CB 3.49Å; I231-A234 PolarHBondContact O-N 3.3Å; A234-N237 PolarHBondContact O-N 2.92Å; A234-G238 PolarHBondContact O-N 2.99Å
235F89.5Confident83.2Confident30 Ų3023.7 Ų23.713%0.13213%0.129CC..Hα-helixtrans-61.7-41.3172.4-87.4-72.4000112.1A77 C78 L81 I231 G232 N237 G238 L239 L434A77-F235 HydrophobicContact CB-CE1 3.8Å; A77-F235 HydrophobicContact CB-CZ 3.85Å; C78-F235 WeakPolarHBondContact SG-CD1 3.42Å; L81-F235 HydrophobicContact CD1-CD1 3.93Å; L81-F235 HydrophobicContact CD1-CE1 3.65Å; I231-F235 HydrophobicContact CG2-CD2 3.71Å; I231-F235 HydrophobicContact CG2-CE2 3.6Å; I231-F235 VanDerWaalsContact O-CD2 3.27Å; I231-F235 WeakPolarHBondContact O-CD2 3.35Å; I231-F235 PolarHBondContact O-N 3.17Å; G232-F235 WeakPolarHBondContact O-CB 3.47Å; G232-F235 PolarHBondContact O-N 2.86Å; F235-N237 PolarHBondContact O-N 2.98Å; F235-G238 PolarHBondContact O-N 3.4Å; F235-L239 HydrophobicContact CB-CD1 4.03Å; F235-L239 HydrophobicContact CD1-CD1 4.23Å; F235-L239 WeakPolarHBondContact O-CB 3.36Å; F235-L239 VanDerWaalsContact O-CD1 3.27Å; F235-L239 WeakPolarHBondContact O-CD1 3.47Å; F235-L239 WeakPolarHBondContact O-CG 3.27Å; F235-L239 PolarHBondContact O-N 3.46Å; F235-L434 HydrophobicContact CB-CD2 3.72Å; F235-L434 HydrophobicContact CG-CD2 4.38Å
236Y89Confident83.9Confident0 Ų022.1 Ų22.10%012%0.118CC..Hα-helixtrans-57.1-48.1174.7-78.4-7000112.7G232 L233 L239 W240 F390 L434 P438 Y447G232-Y236 PolarHBondContact O-N 2.75Å; L233-Y236 HydrophobicContact CD2-CD2 4.17Å; L233-Y236 PolarHBondContact O-N 3.3Å; Y236-L239 PolarHBondContact O-N 3.33Å; Y236-W240 WeakPolarHBondContact O-CB 3.47Å; Y236-W240 PolarHBondContact O-N 3.45Å; Y236-F390 WeakPolarHBondContact OH-CA 3.44Å; Y236-L434 HydrophobicContact CD1-CD2 4.37Å; Y236-L434 HydrophobicContact CE1-CB 4.01Å; Y236-L434 HydrophobicContact CE1-CD2 4.33Å; Y236-L434 PolarHBondContact OH-O 2.95Å; Y236-P438 HydrophobicContact CE2-CB 4.23Å; Y236-P438 HydrophobicContact CE2-CG 3.65Å; Y236-Y447 HydrophobicContact CE2-CE1 4.24Å
237N89.3Confident84Confident0 Ų017.3 Ų17.30%09%0.086CC..Hα-helixtrans-68.5-37.7179.8-75.1-85.4000112.1S57 S60 V61 L233 A234 F235S57-N237 WeakPolarHBondContact CB-O 3.31Å; S57-N237 PolarHBondContact OG-O 2.93Å; S60-N237 WeakPolarHBondContact CB-OD1 3.42Å; V61-N237 HydrophobicContact CG2-CB 3.86Å; L233-N237 PolarHBondContact O-N 2.9Å; L233-N237 VanDerWaalsContact O-N 3.13Å; L233-N237 PolarHBondContact O-ND2 3.38Å; A234-N237 PolarHBondContact O-N 2.92Å; F235-N237 PolarHBondContact O-N 2.98Å
238G90.4Very high83.8Confident0 Ų015 Ų150%07%0.07CC..Hα-helixtrans-65.9-47.317400000112.3A234 F235 W240 A241 Y242A234-G238 PolarHBondContact O-N 2.99Å; F235-G238 PolarHBondContact O-N 3.4Å; G238-W240 VanDerWaalsContact C-N 3.31Å; G238-W240 PolarHBondContact O-N 3.07Å; G238-A241 WeakPolarHBondContact O-CB 3.09Å; G238-A241 PolarHBondContact O-N 2.77Å; G238-Y242 VanDerWaalsContact O-CD2 3.29Å; G238-Y242 WeakPolarHBondContact O-CD2 3.49Å; G238-Y242 PolarHBondContact O-N 2.9Å
239L89.3Confident83.8Confident13 Ų139.6 Ų9.67%0.0685%0.046CC..Hα-helixtrans-69.3-27.9-178.4-66.9161.9000112.4C78 L81 F235 Y236 A241 Y242 D243 W393 L434C78-L239 HydrophobicContact CB-CD2 3.97Å; C78-L239 HydrophobicContact CB-CG 4.37Å; L81-L239 HydrophobicContact CB-CD2 4.41Å; F235-L239 HydrophobicContact CB-CD1 4.03Å; F235-L239 HydrophobicContact CD1-CD1 4.23Å; F235-L239 WeakPolarHBondContact O-CB 3.36Å; F235-L239 VanDerWaalsContact O-CD1 3.27Å; F235-L239 WeakPolarHBondContact O-CD1 3.47Å; F235-L239 WeakPolarHBondContact O-CG 3.27Å; F235-L239 PolarHBondContact O-N 3.46Å; Y236-L239 PolarHBondContact O-N 3.33Å; L239-A241 VanDerWaalsContact C-N 3.28Å; L239-A241 PolarHBondContact O-N 3.44Å; L239-Y242 CarbonylContact O-C 3.49Å; L239-Y242 PolarHBondContact O-N 3.38Å; L239-Y242 VanDerWaalsContact O-N 3.17Å; L239-D243 PolarHBondContact O-N 2.94Å; L239-W393 HydrophobicContact CB-CZ2 4.22Å; L239-W393 HydrophobicContact CD1-CH2 4.33Å; L239-W393 HydrophobicContact CD1-CZ2 3.48Å; L239-W393 VanDerWaalsContact CD1-CZ2 3.48Å; L239-W393 HydrophobicContact CD2-CZ2 3.86Å; L239-W393 HydrophobicContact CG-CZ2 4.02Å; L239-L434 HydrophobicContact CD1-CD1 3.66Å
240W90.7Very high83.4Confident15 Ų159.9 Ų9.96%0.0575%0.048CC..Hα-helixtrans-56.3-42.9166.6167.4-108000111.8I136 I137 Y236 G238 Y242 D243 I385 F388I136-W240 HydrophobicContact CB-CH2 3.91Å; I136-W240 HydrophobicContact CB-CZ2 3.75Å; I136-W240 HydrophobicContact CD1-CE3 4.37Å; I136-W240 HydrophobicContact CD1-CH2 3.85Å; I136-W240 HydrophobicContact CD1-CZ2 4.21Å; I136-W240 HydrophobicContact CD1-CZ3 3.93Å; I136-W240 HydrophobicContact CG1-CH2 4.5Å; I136-W240 HydrophobicContact CG2-CH2 3.96Å; I136-W240 HydrophobicContact CG2-CZ2 3.28Å; I137-W240 HydrophobicContact CG1-CH2 4.25Å; I137-W240 HydrophobicContact CG1-CZ2 4.07Å; Y236-W240 WeakPolarHBondContact O-CB 3.47Å; Y236-W240 PolarHBondContact O-N 3.45Å; G238-W240 VanDerWaalsContact C-N 3.31Å; G238-W240 PolarHBondContact O-N 3.07Å; W240-Y242 PolarHBondContact O-N 3.4Å; W240-D243 WeakPolarHBondContact O-CB 3.33Å; W240-D243 PolarHBondContact O-N 3.32Å; W240-D243 VanDerWaalsContact O-N 3.1Å; W240-I385 HydrophobicContact CB-CG2 3.9Å; W240-I385 HydrophobicContact CD2-CG1 4.26Å; W240-I385 HydrophobicContact CG-CD1 4.24Å; W240-I385 HydrophobicContact CG-CG1 4.17Å; W240-I385 HydrophobicContact CG-CG2 4.17Å; W240-F388 AromaticContact CE3-CD1 3.65Å; W240-F388 HydrophobicContact CE3-CD1 3.65Å; W240-F388 AromaticContact CE3-CE1 3.59Å; W240-F388 HydrophobicContact CE3-CE1 3.59Å; W240-F388 HydrophobicContact CE3-CG 4.49Å; W240-F388 HydrophobicContact CE3-CZ 4.37Å; W240-F388 AromaticContact CZ3-CD1 3.77Å; W240-F388 HydrophobicContact CZ3-CD1 3.77Å; W240-F388 AromaticContact CZ3-CE1 3.62Å; W240-F388 HydrophobicContact CZ3-CE1 3.62Å; W240-F388 HydrophobicContact CZ3-CE2 4.42Å; W240-F388 HydrophobicContact CZ3-CG 4.25Å; W240-F388 AromaticContact CZ3-CZ 3.96Å; W240-F388 HydrophobicContact CZ3-CZ 3.96Å
241A90.3Very high82.7Confident1 Ų111.1 Ų11.11%0.0085%0.053CC..Hα-helixtrans-69.2-24.3178.400000113.5W75 G238 L239 Y277W75-A241 HydrophobicContact CH2-CB 3.46Å; W75-A241 VanDerWaalsContact CH2-CB 3.46Å; W75-A241 HydrophobicContact CZ3-CB 3.59Å; G238-A241 WeakPolarHBondContact O-CB 3.09Å; G238-A241 PolarHBondContact O-N 2.77Å; L239-A241 VanDerWaalsContact C-N 3.28Å; L239-A241 PolarHBondContact O-N 3.44Å; A241-Y277 HydrophobicContact CB-CE2 3.99Å; A241-Y277 WeakPolarHBondContact O-CE2 3.44Å; A241-Y277 PolarHBondContact O-OH 3.46Å
242Y87.5Confident81.9Confident1 Ų18.9 Ų8.90%0.0044%0.042CC..THydrogen-bonded Turntrans-89.7-3.3172.9-72.3-81.4000113.2M49 W75 C78 G79 A82 G238 L239 W240 W245 V273 T274 Y277M49-Y242 HydrophobicContact CE-CD1 3.69Å; M49-Y242 HydrophobicContact CE-CG 4.37Å; M49-Y242 VanDerWaalsContact CE-O 3.23Å; M49-Y242 WeakPolarHBondContact CE-O 3.16Å; W75-Y242 AromaticContact CE3-CE2 3.71Å; W75-Y242 HydrophobicContact CE3-CE2 3.71Å; W75-Y242 HydrophobicContact CZ3-CD2 4.5Å; W75-Y242 AromaticContact CZ3-CE2 3.97Å; W75-Y242 HydrophobicContact CZ3-CE2 3.97Å; W75-Y242 PolarHBondContact O-OH 3.36Å; C78-Y242 HydrophobicContact CB-CD2 3.61Å; C78-Y242 HydrophobicContact CB-CE2 3.46Å; C78-Y242 VanDerWaalsContact CB-CE2 3.46Å; G79-Y242 WeakPolarHBondContact CA-OH 2.91Å; A82-Y242 HydrophobicContact CB-CD1 4.34Å; A82-Y242 HydrophobicContact CB-CG 4.49Å; G238-Y242 VanDerWaalsContact O-CD2 3.29Å; G238-Y242 WeakPolarHBondContact O-CD2 3.49Å; G238-Y242 PolarHBondContact O-N 2.9Å; L239-Y242 CarbonylContact O-C 3.49Å; L239-Y242 PolarHBondContact O-N 3.38Å; L239-Y242 VanDerWaalsContact O-N 3.17Å; W240-Y242 PolarHBondContact O-N 3.4Å; Y242-W245 VanDerWaalsContact O-CD1 3.27Å; Y242-V273 HydrophobicContact CD1-CG1 4.36Å; Y242-V273 HydrophobicContact CE1-CG1 4.26Å; Y242-T274 WeakPolarHBondContact CE1-OG1 3.44Å; Y242-T274 WeakPolarHBondContact OH-CA 3.47Å; Y242-Y277 HydrophobicContact CD1-CD2 4.21Å; Y242-Y277 HydrophobicContact CD1-CE2 4.15Å; Y242-Y277 HydrophobicContact CD2-CD2 4.43Å; Y242-Y277 AromaticContact CE1-CD2 3.71Å; Y242-Y277 HydrophobicContact CE1-CD2 3.71Å; Y242-Y277 HydrophobicContact CE1-CE2 4.11Å; Y242-Y277 AromaticContact CE2-CD2 3.96Å; Y242-Y277 HydrophobicContact CE2-CD2 3.96Å; Y242-Y277 HydrophobicContact CE2-CE2 4.5Å; Y242-Y277 HydrophobicContact CG-CE2 4.37Å; Y242-Y277 AromaticContact CZ-CD2 3.59Å
243D85.3Confident81.1Confident27 Ų2711.8 Ų11.814%0.1446%0.056CC..THydrogen-bonded Turntrans-61146.8-177.6-17160.9000111.6L239 W240 Y396L239-D243 PolarHBondContact O-N 2.94Å; W240-D243 WeakPolarHBondContact O-CB 3.33Å; W240-D243 PolarHBondContact O-N 3.32Å; W240-D243 VanDerWaalsContact O-N 3.1Å; D243-Y396 PolarHBondContact OD1-OH 3.41Å; D243-Y396 VanDerWaalsContact OD1-OH 3.12Å
244G78.6Confident80.5Confident0 Ų013.9 Ų13.90%07%0.066CC..THydrogen-bonded Turntrans107-3179.300000115.7T48 N246 Q247T48-G244 PolarHBondContact OG1-O 3.44Å; G244-N246 PolarHBondContact O-N 3.02Å; G244-Q247 VanDerWaalsContact CA-NE2 3.35Å; G244-Q247 WeakPolarHBondContact O-CB 3.48Å; G244-Q247 WeakPolarHBondContact O-CG 3.46Å; G244-Q247 PolarHBondContact O-N 2.63Å; G244-Q247 VanDerWaalsContact O-N 3.15Å
245W79.3Confident79.7Confident23 Ų2314 Ų149%0.0877%0.066CC..THydrogen-bonded Turntrans-61-27.6171.157.7-98.5000112.9M49 A89 Y92 Y242 Q247 I270 Y396M49-W245 HydrophobicContact CE-CB 4.28Å; M49-W245 HydrophobicContact CG-CB 4.47Å; M49-W245 HydrophobicContact SD-CB 3.91Å; A89-W245 HydrophobicContact CB-CD2 4.41Å; A89-W245 HydrophobicContact CB-CE3 3.64Å; A89-W245 HydrophobicContact CB-CZ3 4.1Å; Y92-W245 HydrophobicContact CD1-CZ3 4.1Å; Y92-W245 AromaticContact CD2-CH2 3.82Å; Y92-W245 HydrophobicContact CD2-CH2 3.82Å; Y92-W245 AromaticContact CD2-CZ3 3.78Å; Y92-W245 HydrophobicContact CD2-CZ3 3.78Å; Y92-W245 HydrophobicContact CE1-CH2 4.39Å; Y92-W245 HydrophobicContact CE1-CZ3 4.39Å; Y92-W245 AromaticContact CE2-CH2 3.73Å; Y92-W245 HydrophobicContact CE2-CH2 3.73Å; Y92-W245 HydrophobicContact CE2-CZ3 4.14Å; Y92-W245 HydrophobicContact CG-CH2 4.21Å; Y92-W245 AromaticContact CG-CZ3 3.75Å; Y92-W245 HydrophobicContact CG-CZ3 3.75Å; Y242-W245 VanDerWaalsContact O-CD1 3.27Å; W245-Q247 VanDerWaalsContact C-N 3.33Å; W245-I270 HydrophobicContact CB-CD1 3.86Å; W245-I270 HydrophobicContact CB-CG1 4.38Å; W245-Y396 HydrophobicContact CZ2-CD2 4.07Å; W245-Y396 AromaticContact CZ2-CE2 3.74Å; W245-Y396 HydrophobicContact CZ2-CE2 3.74Å; W245-Y396 AromaticContact CZ2-CZ 3.98Å
246N77.9Confident79.2Confident8 Ų817.2 Ų17.24%0.0438%0.08CC..THydrogen-bonded Turntrans-80.8-9.8178.264.6-17.6000113.5Y92 E105 G244 L248 N249 F250 Y396Y92-N246 HydrophobicContact CD1-CB 4.33Å; Y92-N246 HydrophobicContact CE1-CB 4.23Å; E105-N246 PolarHBondContact OE1-ND2 3.04Å; G244-N246 PolarHBondContact O-N 3.02Å; N246-L248 VanDerWaalsContact C-N 3.3Å; N246-L248 PolarHBondContact O-N 3.25Å; N246-N249 WeakPolarHBondContact O-CB 3.29Å; N246-N249 PolarHBondContact O-N 3.41Å; N246-N249 VanDerWaalsContact O-N 3.1Å; N246-N249 PolarHBondContact O-ND2 3.28Å; N246-F250 WeakPolarHBondContact O-CD2 3.4Å; N246-Y396 WeakPolarHBondContact ND2-CE1 3.43Å; N246-Y396 PolarHBondContact ND2-OH 2.95Å; N246-Y396 VanDerWaalsContact ND2-OH 3.08Å
247Q71.7Confident78.9Confident26 Ų2622.7 Ų22.712%0.12111%0.109CC..Hα-helixtrans-63.4-34.4-175.8-69.9-172.762.300113G244 W245 N249 F250 T333G244-Q247 VanDerWaalsContact CA-NE2 3.35Å; G244-Q247 WeakPolarHBondContact O-CB 3.48Å; G244-Q247 WeakPolarHBondContact O-CG 3.46Å; G244-Q247 PolarHBondContact O-N 2.63Å; G244-Q247 VanDerWaalsContact O-N 3.15Å; W245-Q247 VanDerWaalsContact C-N 3.33Å; Q247-N249 PolarHBondContact O-N 3.03Å; Q247-F250 WeakPolarHBondContact O-CB 3.38Å; Q247-F250 PolarHBondContact O-N 3.48Å; Q247-T333 HydrophobicContact CG-CG2 4.22Å
248L70Confident78.2Confident0 Ų023.6 Ų23.60%012%0.115CC..Hα-helixtrans-61-27177.7-161.374000111.9L44 I45 N246 F250 I251 T252 L255 L262 A265L44-L248 HydrophobicContact CD2-CD1 3.86Å; I45-L248 HydrophobicContact CD1-CB 4.32Å; I45-L248 HydrophobicContact CD1-CD2 3.61Å; I45-L248 HydrophobicContact CD1-CG 4.45Å; I45-L248 HydrophobicContact CG1-CB 4.08Å; I45-L248 HydrophobicContact CG1-CD1 4.41Å; I45-L248 HydrophobicContact CG1-CD2 4.03Å; I45-L248 HydrophobicContact CG1-CG 4.39Å; N246-L248 VanDerWaalsContact C-N 3.3Å; N246-L248 PolarHBondContact O-N 3.25Å; L248-F250 VanDerWaalsContact C-N 3.28Å; L248-F250 PolarHBondContact O-N 3.37Å; L248-I251 HydrophobicContact CD1-CD1 4.11Å; L248-I251 HydrophobicContact CD1-CG1 4.35Å; L248-I251 WeakPolarHBondContact O-CG1 3.48Å; L248-I251 PolarHBondContact O-N 3.35Å; L248-T252 PolarHBondContact O-N 3.41Å; L248-L255 HydrophobicContact CD1-CD1 4.41Å; L248-L255 HydrophobicContact CD1-CD2 4.27Å; L248-L255 HydrophobicContact CD2-CD1 4.26Å; L248-L255 HydrophobicContact CG-CD1 4Å; L248-L262 HydrophobicContact CB-CD1 4.22Å; L248-L262 HydrophobicContact CD2-CD1 3.52Å; L248-L262 HydrophobicContact CG-CD1 3.83Å; L248-A265 HydrophobicContact CD2-CB 3.84Å
249N75.4Confident77.8Confident0 Ų029.5 Ų29.50%014%0.138CC..Hα-helixtrans-68.4-26.2177.2-62.8-57.1000112.9A104 N246 Q247 I251 T252A104-N249 HydrophobicContact CB-CB 4.08Å; N246-N249 WeakPolarHBondContact O-CB 3.29Å; N246-N249 PolarHBondContact O-N 3.41Å; N246-N249 VanDerWaalsContact O-N 3.1Å; N246-N249 PolarHBondContact O-ND2 3.28Å; Q247-N249 PolarHBondContact O-N 3.03Å; N249-I251 VanDerWaalsContact C-N 3.29Å; N249-I251 PolarHBondContact O-N 2.97Å; N249-T252 PolarHBondContact O-OG1 3.48Å
250F69.5Low77.4Confident6 Ų637.4 Ų37.43%0.02617%0.167CC..Hα-helixtrans-74.2-21.1178.6-67.8-92.5000113A104 N246 Q247 L248 L337A104-F250 HydrophobicContact CB-CD1 3.62Å; A104-F250 HydrophobicContact CB-CD2 3.87Å; A104-F250 HydrophobicContact CB-CE1 3.61Å; A104-F250 HydrophobicContact CB-CE2 3.88Å; A104-F250 HydrophobicContact CB-CG 3.76Å; A104-F250 HydrophobicContact CB-CZ 3.76Å; N246-F250 WeakPolarHBondContact O-CD2 3.4Å; Q247-F250 WeakPolarHBondContact O-CB 3.38Å; Q247-F250 PolarHBondContact O-N 3.48Å; L248-F250 VanDerWaalsContact C-N 3.28Å; L248-F250 PolarHBondContact O-N 3.37Å; F250-L337 HydrophobicContact CE1-CD1 4.45Å
251I68.2Low77Confident30 Ų3037.9 Ų37.915%0.15417%0.171CC..THydrogen-bonded Turntrans-114.325.9-17958.4168.7000111.9I36 L44 L248 N249 E253 E254 L255I36-I251 HydrophobicContact CD1-CD1 3.8Å; L44-I251 HydrophobicContact CD1-CD1 3.76Å; L44-I251 HydrophobicContact CD2-CD1 3.9Å; L44-I251 HydrophobicContact CG-CD1 4.48Å; L248-I251 HydrophobicContact CD1-CD1 4.11Å; L248-I251 HydrophobicContact CD1-CG1 4.35Å; L248-I251 WeakPolarHBondContact O-CG1 3.48Å; L248-I251 PolarHBondContact O-N 3.35Å; N249-I251 VanDerWaalsContact C-N 3.29Å; N249-I251 PolarHBondContact O-N 2.97Å; I251-E253 PolarHBondContact O-N 3.45Å; I251-E254 PolarHBondContact O-N 3.17Å; I251-L255 PolarHBondContact O-N 3.03Å
252T68.7Low76.6Confident6 Ų637.8 Ų37.84%0.03717%0.17CC..G310 helixtrans-60.6-31.1179.234.20000113.4L248 N249 E254 L255 L262L248-T252 PolarHBondContact O-N 3.41Å; N249-T252 PolarHBondContact O-OG1 3.48Å; T252-E254 PolarHBondContact O-N 3.1Å; T252-L255 HydrophobicContact CG2-CD1 4.27Å; T252-L255 PolarHBondContact O-N 3.01Å; T252-L262 HydrophobicContact CG2-CD1 4.17Å; T252-L262 HydrophobicContact CG2-CD2 3.84Å
253E68.1Low76.3Confident61 Ų6138.8 Ų38.829%0.28518%0.177SC..G310 helixtrans-64.5-23.7174.9-67.8177.117700113Q34 S102 I251 R336Q34-E253 WeakPolarHBondContact CG-O 3.33Å; S102-E253 WeakPolarHBondContact CB-OE1 3.43Å; S102-E253 VanDerWaalsContact CB-OE2 3.32Å; S102-E253 WeakPolarHBondContact CB-OE2 3.19Å; S102-E253 PolarHBondContact N-OE1 2.94Å; I251-E253 PolarHBondContact O-N 3.45Å; E253-R336 IonicContact OE2-NH2 2.71Å; E253-R336 PolarHBondContact OE2-NH2 3.49Å
254E72.4Confident76.2Confident45 Ų4540.4 Ų40.421%0.2119%0.185CC..G310 helixtrans-97.2-7.3-176.5-64.6170.5-143.700113L32 Q34 D35 I36 I251 T252L32-E254 HydrophobicContact CB-CG 4.02Å; L32-E254 HydrophobicContact CD2-CG 4.19Å; Q34-E254 CarbonylContact C-O 2.88Å; Q34-E254 VanDerWaalsContact CA-O 3.31Å; Q34-E254 WeakPolarHBondContact CA-O 3.22Å; D35-E254 PolarHBondContact N-O 3Å; I36-E254 HydrophobicContact CD1-CB 3.96Å; I36-E254 HydrophobicContact CG1-CB 4.4Å; I36-E254 PolarHBondContact N-O 2.99Å; I36-E254 VanDerWaalsContact N-O 3.14Å; I251-E254 PolarHBondContact O-N 3.17Å; T252-E254 PolarHBondContact O-N 3.1Å
255L73.2Confident76.4Confident2 Ų240.5 Ų40.51%0.0119%0.186CC..BIsolated β-bridgetrans-79.7131.1179.1-75.4165.4000111.1I36 L248 I251 T252 N257 P258 L262I36-L255 HydrophobicContact CB-CD2 4.09Å; I36-L255 HydrophobicContact CG2-CD2 3.7Å; L248-L255 HydrophobicContact CD1-CD1 4.41Å; L248-L255 HydrophobicContact CD1-CD2 4.27Å; L248-L255 HydrophobicContact CD2-CD1 4.26Å; L248-L255 HydrophobicContact CG-CD1 4Å; I251-L255 PolarHBondContact O-N 3.03Å; T252-L255 HydrophobicContact CG2-CD1 4.27Å; T252-L255 PolarHBondContact O-N 3.01Å; L255-N257 PolarHBondContact O-N 3.44Å; L255-P258 HydrophobicContact CB-CB 4.36Å; L255-L262 HydrophobicContact CD1-CB 4.38Å; L255-L262 HydrophobicContact CD1-CD1 3.99Å
256K79.4Confident76.5Confident97 Ų9739.5 Ų39.542%0.42218%0.182SC..SBendtrans-66.5127.4165.8-67.3-179.7179173.60108.7Q34 I36 N261Q34-K256 HydrophobicContact CB-CG 4.32Å; Q34-K256 WeakPolarHBondContact O-CE 3.32Å; Q34-K256 WeakPolarHBondContact O-CG 3.32Å; I36-K256 PolarHBondContact O-N 3.5Å; K256-N261 PolarHBondContact O-ND2 2.83Å
257N80.9Confident76.8Confident116 Ų11642 Ų4262%0.6220%0.198SC*.SBendtrans48.465.9178.7-67.6-29.2000113.6L255 Y259 R260 N261L255-N257 PolarHBondContact O-N 3.44Å; N257-Y259 PolarHBondContact O-N 2.86Å; N257-R260 PolarHBondContact O-N 2.91Å; N257-N261 WeakPolarHBondContact O-CB 3.23Å; N257-N261 PolarHBondContact O-N 3.24Å
258P76.3Confident77.5Confident18 Ų1844.6 Ų44.612%0.11721%0.211CC..Hα-helixtrans-58.4-35.5-173.123.3-33.1000112.6L255 R260 L262L255-P258 HydrophobicContact CB-CB 4.36Å; P258-R260 PolarHBondContact O-N 2.83Å; P258-R260 VanDerWaalsContact O-N 3.12Å; P258-L262 WeakPolarHBondContact O-CB 3.45Å; P258-L262 PolarHBondContact O-N 3.45Å
259Y80.6Confident78.2Confident124 Ų12444.6 Ų44.649%0.48621%0.211SC..Hα-helixtrans-56-31.6-179.8-51.7-59.3000114.6T97 N257 P263 P416T97-Y259 HydrophobicContact CG2-CD1 3.92Å; N257-Y259 PolarHBondContact O-N 2.86Å; Y259-P263 WeakPolarHBondContact O-CG 3.27Å; Y259-P416 HydrophobicContact CD1-CB 3.62Å; Y259-P416 HydrophobicContact CD1-CG 3.61Å; Y259-P416 HydrophobicContact CE1-CB 4.21Å; Y259-P416 HydrophobicContact CE1-CG 3.66Å; Y259-P416 HydrophobicContact CG-CB 4.18Å; Y259-P416 HydrophobicContact CG-CG 4.47Å
260R81.9Confident78.7Confident180 Ų18044.7 Ų44.768%0.67921%0.212SC*.Hα-helixtrans-105.7-42.4-179.7-178.1177.1176.1-170.30.1111.8N257 P258 P263 L264N257-R260 PolarHBondContact O-N 2.91Å; P258-R260 PolarHBondContact O-N 2.83Å; P258-R260 VanDerWaalsContact O-N 3.12Å; R260-P263 WeakPolarHBondContact O-CD 3.41Å; R260-P263 WeakPolarHBondContact O-CG 3.49Å; R260-L264 HydrophobicContact CG-CD1 3.64Å; R260-L264 WeakPolarHBondContact O-CB 3.21Å; R260-L264 WeakPolarHBondContact O-CD1 3.15Å; R260-L264 VanDerWaalsContact O-CG 3.25Å; R260-L264 WeakPolarHBondContact O-CG 3.38Å; R260-L264 PolarHBondContact O-N 2.89Å
261N82.5Confident79.7Confident24 Ų2446.5 Ų46.513%0.12822%0.224CC..Hα-helixtrans-78.3-33.5-170.9-72.3-9.5000112.9L38 K256 N257 A265L38-N261 HydrophobicContact CB-CB 4.5Å; L38-N261 HydrophobicContact CD1-CB 4.18Å; K256-N261 PolarHBondContact O-ND2 2.83Å; N257-N261 WeakPolarHBondContact O-CB 3.23Å; N257-N261 PolarHBondContact O-N 3.24Å; N261-A265 WeakPolarHBondContact O-CB 3.43Å; N261-A265 PolarHBondContact O-N 3.31Å
262L80.6Confident80.6Confident0 Ų049.2 Ų49.20%024%0.238CC..Hα-helixtrans-60.5-55.8175.6-178.468.1000112.2A93 T97 L248 T252 L255 P258 L264 A265 I266A93-L262 HydrophobicContact CB-CD2 4.06Å; A93-L262 HydrophobicContact CB-CG 4.24Å; T97-L262 HydrophobicContact CG2-CD2 4.27Å; L248-L262 HydrophobicContact CB-CD1 4.22Å; L248-L262 HydrophobicContact CD2-CD1 3.52Å; L248-L262 HydrophobicContact CG-CD1 3.83Å; T252-L262 HydrophobicContact CG2-CD1 4.17Å; T252-L262 HydrophobicContact CG2-CD2 3.84Å; L255-L262 HydrophobicContact CD1-CB 4.38Å; L255-L262 HydrophobicContact CD1-CD1 3.99Å; P258-L262 WeakPolarHBondContact O-CB 3.45Å; P258-L262 PolarHBondContact O-N 3.45Å; L262-L264 PolarHBondContact O-N 2.97Å; L262-A265 PolarHBondContact O-N 3.02Å; L262-I266 HydrophobicContact CD1-CD1 4.24Å; L262-I266 HydrophobicContact CG-CD1 4.26Å; L262-I266 WeakPolarHBondContact O-CG1 3.29Å; L262-I266 PolarHBondContact O-N 2.71Å
263P81.9Confident81.6Confident21 Ų2148.9 Ų48.914%0.13624%0.237CC..Hα-helixtrans-66.1-37.1-179.525.8-35.1000112.5L90 Y259 R260 I266 V267 V417L90-P263 HydrophobicContact CD2-CB 3.53Å; Y259-P263 WeakPolarHBondContact O-CG 3.27Å; R260-P263 WeakPolarHBondContact O-CD 3.41Å; R260-P263 WeakPolarHBondContact O-CG 3.49Å; P263-I266 PolarHBondContact O-N 3.2Å; P263-V267 WeakPolarHBondContact O-CB 3.26Å; P263-V267 VanDerWaalsContact O-CG2 3.25Å; P263-V267 WeakPolarHBondContact O-CG2 3.38Å; P263-V267 PolarHBondContact O-N 2.77Å; P263-V417 HydrophobicContact CG-CG2 4.34Å
264L83.3Confident82.6Confident62 Ų6246.8 Ų46.833%0.32523%0.228SC..Hα-helixtrans-65.6-41.9177.1-75.4172.6000112.2L38 R260 L262 I266 V267 I268L38-L264 HydrophobicContact CD1-CB 3.78Å; L38-L264 HydrophobicContact CD2-CD1 4.46Å; R260-L264 HydrophobicContact CG-CD1 3.64Å; R260-L264 WeakPolarHBondContact O-CB 3.21Å; R260-L264 WeakPolarHBondContact O-CD1 3.15Å; R260-L264 VanDerWaalsContact O-CG 3.25Å; R260-L264 WeakPolarHBondContact O-CG 3.38Å; R260-L264 PolarHBondContact O-N 2.89Å; L262-L264 PolarHBondContact O-N 2.97Å; L264-I266 VanDerWaalsContact C-N 3.26Å; L264-I266 PolarHBondContact O-N 2.93Å; L264-V267 PolarHBondContact O-N 2.89Å; L264-I268 WeakPolarHBondContact O-CB 3.46Å; L264-I268 VanDerWaalsContact O-CG1 3.3Å; L264-I268 WeakPolarHBondContact O-CG1 3.44Å; L264-I268 PolarHBondContact O-N 3.01Å
265A83Confident83.5Confident1 Ų148.1 Ų48.11%0.00824%0.239CC..Hα-helixtrans-61-39.8178.300000111.4L38 I42 I45 L248 N261 L262 G269L38-A265 HydrophobicContact CD1-CB 4.22Å; I42-A265 HydrophobicContact CG1-CB 4.02Å; I45-A265 HydrophobicContact CD1-CB 3.86Å; L248-A265 HydrophobicContact CD2-CB 3.84Å; N261-A265 WeakPolarHBondContact O-CB 3.43Å; N261-A265 PolarHBondContact O-N 3.31Å; L262-A265 PolarHBondContact O-N 3.02Å; A265-G269 WeakPolarHBondContact O-CA 3.19Å; A265-G269 PolarHBondContact O-N 3.42Å
266I81.9Confident84.3Confident3 Ų349.4 Ų49.42%0.01525%0.248CC..Hα-helixtrans-66.5-50.7176.4-72.2166.3000111.5I45 A89 A93 L262 P263 L264 I268 G269 I270I45-I266 HydrophobicContact CD1-CG1 3.86Å; A89-I266 HydrophobicContact CB-CB 4.43Å; A89-I266 HydrophobicContact CB-CD1 4.08Å; A89-I266 HydrophobicContact CB-CG1 4.31Å; A89-I266 HydrophobicContact CB-CG2 3.31Å; A93-I266 HydrophobicContact CB-CD1 4.22Å; L262-I266 HydrophobicContact CD1-CD1 4.24Å; L262-I266 HydrophobicContact CG-CD1 4.26Å; L262-I266 WeakPolarHBondContact O-CG1 3.29Å; L262-I266 PolarHBondContact O-N 2.71Å; P263-I266 PolarHBondContact O-N 3.2Å; L264-I266 VanDerWaalsContact C-N 3.26Å; L264-I266 PolarHBondContact O-N 2.93Å; I266-I268 PolarHBondContact O-N 3.21Å; I266-G269 PolarHBondContact O-N 3.3Å; I266-I270 HydrophobicContact CG2-CD1 3.76Å; I266-I270 HydrophobicContact CG2-CG1 4.44Å; I266-I270 WeakPolarHBondContact O-CG1 3.23Å; I266-I270 PolarHBondContact O-N 3.36Å; I266-I270 VanDerWaalsContact O-N 3.15Å
267V83.4Confident84.9Confident61 Ų6144.8 Ų44.837%0.3723%0.228SC..Hα-helixtrans-65.9-26-176.2170.60000112.3L90 P263 L264 P271L90-V267 HydrophobicContact CD1-CG2 4.18Å; P263-V267 WeakPolarHBondContact O-CB 3.26Å; P263-V267 VanDerWaalsContact O-CG2 3.25Å; P263-V267 WeakPolarHBondContact O-CG2 3.38Å; P263-V267 PolarHBondContact O-N 2.77Å; L264-V267 PolarHBondContact O-N 2.89Å; V267-P271 VanDerWaalsContact O-CD 3.23Å; V267-P271 WeakPolarHBondContact O-CD 3.27Å; V267-P271 WeakPolarHBondContact O-CG 3.28Å
268I86.3Confident85.4Confident80 Ų8040.6 Ų40.641%0.4121%0.206SC..Hα-helixtrans-91.4-45.8176.6-62.4167.1000110.8I42 L264 I266 L272I42-I268 HydrophobicContact CD1-CB 4.26Å; I42-I268 HydrophobicContact CD1-CD1 4.09Å; I42-I268 HydrophobicContact CD1-CG2 4.08Å; L264-I268 WeakPolarHBondContact O-CB 3.46Å; L264-I268 VanDerWaalsContact O-CG1 3.3Å; L264-I268 WeakPolarHBondContact O-CG1 3.44Å; L264-I268 PolarHBondContact O-N 3.01Å; I266-I268 PolarHBondContact O-N 3.21Å; I268-L272 WeakPolarHBondContact O-CB 3.44Å; I268-L272 PolarHBondContact O-N 3.39Å
269G84.7Confident86.2Confident0 Ų043.8 Ų43.80%022%0.218CC..Hα-helixtrans-68.1-47.8-171.800000114A265 I266 L272 V273A265-G269 WeakPolarHBondContact O-CA 3.19Å; A265-G269 PolarHBondContact O-N 3.42Å; I266-G269 PolarHBondContact O-N 3.3Å; G269-L272 WeakPolarHBondContact O-CB 3.46Å; G269-L272 PolarHBondContact O-N 2.97Å; G269-V273 WeakPolarHBondContact O-CG2 3.45Å; G269-V273 PolarHBondContact O-N 3.39Å; G269-V273 VanDerWaalsContact O-N 3.08Å
270I86.9Confident86.7Confident1 Ų138 Ų381%0.00520%0.196CC..Hα-helixtrans-66.9-46.8-175.5-53.5-179000112.7M49 A82 T83 A89 W245 I266 L272 V273 T274M49-I270 HydrophobicContact CE-CG1 4.37Å; M49-I270 HydrophobicContact CE-CG2 4.05Å; M49-I270 HydrophobicContact SD-CG1 4.03Å; A82-I270 HydrophobicContact CB-CG2 3.57Å; A82-I270 WeakPolarHBondContact O-CD1 3.02Å; T83-I270 WeakPolarHBondContact OG1-CG2 3.25Å; A89-I270 HydrophobicContact CB-CD1 3.8Å; W245-I270 HydrophobicContact CB-CD1 3.86Å; W245-I270 HydrophobicContact CB-CG1 4.38Å; I266-I270 HydrophobicContact CG2-CD1 3.76Å; I266-I270 HydrophobicContact CG2-CG1 4.44Å; I266-I270 WeakPolarHBondContact O-CG1 3.23Å; I266-I270 PolarHBondContact O-N 3.36Å; I266-I270 VanDerWaalsContact O-N 3.15Å; I270-L272 VanDerWaalsContact C-N 3.29Å; I270-L272 PolarHBondContact O-N 3.42Å; I270-V273 PolarHBondContact O-N 3.34Å; I270-T274 PolarHBondContact O-N 3.18Å; I270-T274 PolarHBondContact O-OG1 3.36Å
271P88.6Confident87.2Confident44 Ų4429.4 Ų29.429%0.28616%0.163SC..Hα-helixtrans-65.8-32.4176.711.7-14.8000112.5T83 V267 V273 T274 V275T83-P271 HydrophobicContact CG2-CB 3.93Å; T83-P271 HydrophobicContact CG2-CG 3.67Å; V267-P271 VanDerWaalsContact O-CD 3.23Å; V267-P271 WeakPolarHBondContact O-CD 3.27Å; V267-P271 WeakPolarHBondContact O-CG 3.28Å; P271-V273 PolarHBondContact O-N 3.21Å; P271-T274 WeakPolarHBondContact O-CB 3.27Å; P271-T274 PolarHBondContact O-N 3.27Å; P271-V275 VanDerWaalsContact O-CG2 3.3Å; P271-V275 WeakPolarHBondContact O-CG2 3.29Å; P271-V275 PolarHBondContact O-N 2.72Å
272L87.9Confident87.6Confident87 Ų8729.8 Ų29.846%0.45517%0.165SC..Hα-helixtrans-58.9-47.5172.318065.7000111.1V46 I268 G269 I270 T274 V275 C276V46-L272 HydrophobicContact CG2-CD2 4.17Å; I268-L272 WeakPolarHBondContact O-CB 3.44Å; I268-L272 PolarHBondContact O-N 3.39Å; G269-L272 WeakPolarHBondContact O-CB 3.46Å; G269-L272 PolarHBondContact O-N 2.97Å; I270-L272 VanDerWaalsContact C-N 3.29Å; I270-L272 PolarHBondContact O-N 3.42Å; L272-T274 VanDerWaalsContact C-N 3.33Å; L272-T274 PolarHBondContact O-N 3.45Å; L272-V275 PolarHBondContact O-N 3.37Å; L272-C276 PolarHBondContact O-N 2.85Å; L272-C276 PolarHBondContact O-SG 3.49Å
273V89.1Confident88Confident0 Ų029.8 Ų29.80%017%0.165CC..Hα-helixtrans-61.7-41.9175.6175.10000111.2V46 M49 I50 Y242 G269 I270 P271 V275 C276 Y277V46-V273 HydrophobicContact CB-CG2 4.44Å; V46-V273 HydrophobicContact CG1-CG2 4.29Å; V46-V273 HydrophobicContact CG2-CG2 4.19Å; M49-V273 HydrophobicContact CB-CG1 4.39Å; M49-V273 HydrophobicContact CB-CG2 4.33Å; M49-V273 HydrophobicContact CE-CB 4.48Å; M49-V273 HydrophobicContact CE-CG1 4.26Å; M49-V273 HydrophobicContact SD-CG2 4.42Å; I50-V273 HydrophobicContact CD1-CG2 4.18Å; I50-V273 HydrophobicContact CG1-CG1 4.09Å; I50-V273 HydrophobicContact CG1-CG2 3.92Å; Y242-V273 HydrophobicContact CD1-CG1 4.36Å; Y242-V273 HydrophobicContact CE1-CG1 4.26Å; G269-V273 WeakPolarHBondContact O-CG2 3.45Å; G269-V273 PolarHBondContact O-N 3.39Å; G269-V273 VanDerWaalsContact O-N 3.08Å; I270-V273 PolarHBondContact O-N 3.34Å; P271-V273 PolarHBondContact O-N 3.21Å; V273-V275 PolarHBondContact O-N 3.32Å; V273-C276 WeakPolarHBondContact O-CB 3.41Å; V273-C276 PolarHBondContact O-N 2.87Å; V273-Y277 HydrophobicContact CG1-CD1 4.11Å; V273-Y277 HydrophobicContact CG1-CD2 3.91Å; V273-Y277 HydrophobicContact CG1-CE1 3.78Å; V273-Y277 HydrophobicContact CG1-CE2 3.57Å; V273-Y277 HydrophobicContact CG1-CG 4.19Å; V273-Y277 WeakPolarHBondContact O-CB 3.36Å; V273-Y277 PolarHBondContact O-N 3.46Å
274T90.4Very high88.4Confident16 Ų1628.8 Ų28.810%0.09816%0.159CC..Hα-helixtrans-58.8-48.1178.4-570000111.4G79 Y242 I270 P271 L272 C276 Y277 V278G79-T274 WeakPolarHBondContact CA-OG1 3.49Å; Y242-T274 WeakPolarHBondContact CE1-OG1 3.44Å; Y242-T274 WeakPolarHBondContact OH-CA 3.47Å; I270-T274 PolarHBondContact O-N 3.18Å; I270-T274 PolarHBondContact O-OG1 3.36Å; P271-T274 WeakPolarHBondContact O-CB 3.27Å; P271-T274 PolarHBondContact O-N 3.27Å; L272-T274 VanDerWaalsContact C-N 3.33Å; L272-T274 PolarHBondContact O-N 3.45Å; T274-C276 PolarHBondContact O-N 3.42Å; T274-Y277 PolarHBondContact O-N 3.29Å; T274-V278 WeakPolarHBondContact O-CG2 3.49Å; T274-V278 PolarHBondContact O-N 3.31Å
275V90.7Very high88.7Confident74 Ų7425.9 Ų25.945%0.44814%0.143SC..Hα-helixtrans-60.9-45.8177.51710000110.4P271 L272 V273 Y277 V278 F279P271-V275 VanDerWaalsContact O-CG2 3.3Å; P271-V275 WeakPolarHBondContact O-CG2 3.29Å; P271-V275 PolarHBondContact O-N 2.72Å; L272-V275 PolarHBondContact O-N 3.37Å; V273-V275 PolarHBondContact O-N 3.32Å; V275-Y277 PolarHBondContact O-N 2.82Å; V275-V278 PolarHBondContact O-N 3.2Å; V275-F279 HydrophobicContact CG1-CD2 3.52Å; V275-F279 HydrophobicContact CG1-CE2 3.37Å; V275-F279 WeakPolarHBondContact O-CD2 3.39Å; V275-F279 PolarHBondContact O-N 3.35Å
276C90.4Very high88.9Confident29 Ų2926.1 Ų26.120%0.19615%0.145CC..Hα-helixtrans-59.4-45175.9-69.10000112.4I198 L272 V273 T274 F279 V280I198-C276 HydrophobicContact CG2-CB 4.12Å; L272-C276 PolarHBondContact O-N 2.85Å; L272-C276 PolarHBondContact O-SG 3.49Å; V273-C276 WeakPolarHBondContact O-CB 3.41Å; V273-C276 PolarHBondContact O-N 2.87Å; T274-C276 PolarHBondContact O-N 3.42Å; C276-F279 PolarHBondContact O-N 2.99Å; C276-V280 WeakPolarHBondContact O-CB 3.19Å; C276-V280 VanDerWaalsContact O-CG2 3.23Å; C276-V280 WeakPolarHBondContact O-CG2 3.43Å; C276-V280 PolarHBondContact O-N 3Å
277Y91.9Very high89.1Confident0 Ų027.2 Ų27.20%015%0.152CC..Hα-helixtrans-67-42.2-178.4-74.2-0.1000112.6M49 I50 I54 W75 A241 Y242 V273 T274 V275 V280 N281M49-Y277 PolarHBondContact O-OH 2.87Å; I50-Y277 WeakPolarHBondContact CA-OH 3.45Å; I50-Y277 HydrophobicContact CG1-CE1 4.12Å; I54-Y277 HydrophobicContact CB-CD1 3.98Å; I54-Y277 HydrophobicContact CB-CE1 3.63Å; I54-Y277 HydrophobicContact CD1-CD1 3.65Å; I54-Y277 HydrophobicContact CD1-CD2 4.3Å; I54-Y277 HydrophobicContact CD1-CE1 4.2Å; I54-Y277 HydrophobicContact CD1-CG 3.69Å; I54-Y277 HydrophobicContact CG1-CD1 3.65Å; I54-Y277 HydrophobicContact CG1-CE1 3.85Å; I54-Y277 HydrophobicContact CG1-CG 4.22Å; I54-Y277 HydrophobicContact CG2-CE1 4.12Å; W75-Y277 AromaticContact CE3-CD2 3.98Å; W75-Y277 HydrophobicContact CE3-CD2 3.98Å; W75-Y277 HydrophobicContact CE3-CG 4.41Å; W75-Y277 HydrophobicContact CH2-CD2 4.49Å; W75-Y277 AromaticContact CZ3-CD2 3.48Å; W75-Y277 HydrophobicContact CZ3-CD2 3.48Å; W75-Y277 VanDerWaalsContact CZ3-CD2 3.48Å; W75-Y277 HydrophobicContact CZ3-CE2 4.09Å; W75-Y277 HydrophobicContact CZ3-CG 4.08Å; A241-Y277 HydrophobicContact CB-CE2 3.99Å; A241-Y277 WeakPolarHBondContact O-CE2 3.44Å; A241-Y277 PolarHBondContact O-OH 3.46Å; Y242-Y277 HydrophobicContact CD1-CD2 4.21Å; Y242-Y277 HydrophobicContact CD1-CE2 4.15Å; Y242-Y277 HydrophobicContact CD2-CD2 4.43Å; Y242-Y277 AromaticContact CE1-CD2 3.71Å; Y242-Y277 HydrophobicContact CE1-CD2 3.71Å; Y242-Y277 HydrophobicContact CE1-CE2 4.11Å; Y242-Y277 AromaticContact CE2-CD2 3.96Å; Y242-Y277 HydrophobicContact CE2-CD2 3.96Å; Y242-Y277 HydrophobicContact CE2-CE2 4.5Å; Y242-Y277 HydrophobicContact CG-CE2 4.37Å; Y242-Y277 AromaticContact CZ-CD2 3.59Å; V273-Y277 HydrophobicContact CG1-CD1 4.11Å; V273-Y277 HydrophobicContact CG1-CD2 3.91Å; V273-Y277 HydrophobicContact CG1-CE1 3.78Å; V273-Y277 HydrophobicContact CG1-CE2 3.57Å; V273-Y277 HydrophobicContact CG1-CG 4.19Å; V273-Y277 WeakPolarHBondContact O-CB 3.36Å; V273-Y277 PolarHBondContact O-N 3.46Å; T274-Y277 PolarHBondContact O-N 3.29Å; V275-Y277 PolarHBondContact O-N 2.82Å; Y277-V280 PolarHBondContact O-N 2.95Å; Y277-N281 PolarHBondContact O-N 2.84Å; Y277-N281 PolarHBondContact O-ND2 3Å
278V92Very high89.2Confident27 Ų2724.3 Ų24.316%0.16413%0.134CC..Hα-helixtrans-62.4-46.2175.5172.60000110.2W75 T274 V275 V280 N281 I282W75-V278 HydrophobicContact CB-CG2 4.34Å; T274-V278 WeakPolarHBondContact O-CG2 3.49Å; T274-V278 PolarHBondContact O-N 3.31Å; V275-V278 PolarHBondContact O-N 3.2Å; V278-V280 PolarHBondContact O-N 3.43Å; V278-N281 PolarHBondContact O-N 3.49Å; V278-I282 HydrophobicContact CG1-CD1 3.8Å; V278-I282 HydrophobicContact CG1-CG1 4.44Å; V278-I282 VanDerWaalsContact O-CG1 3.3Å; V278-I282 WeakPolarHBondContact O-CG1 3.11Å; V278-I282 PolarHBondContact O-N 3.41Å
279F91.9Very high89.3Confident86 Ų8622.9 Ų22.938%0.37713%0.129SC..Hα-helixtrans-64.7-36.9178.1-79-54.5000113.7V202 V275 C276 I282 A283V202-F279 HydrophobicContact CB-CB 4.49Å; V202-F279 HydrophobicContact CG1-CB 3.93Å; V202-F279 HydrophobicContact CG1-CG 4.3Å; V202-F279 HydrophobicContact CG2-CB 3.82Å; V275-F279 HydrophobicContact CG1-CD2 3.52Å; V275-F279 HydrophobicContact CG1-CE2 3.37Å; V275-F279 WeakPolarHBondContact O-CD2 3.39Å; V275-F279 PolarHBondContact O-N 3.35Å; C276-F279 PolarHBondContact O-N 2.99Å; F279-I282 HydrophobicContact CD1-CD1 4.4Å; F279-I282 PolarHBondContact O-N 2.95Å; F279-A283 WeakPolarHBondContact O-CB 3.39Å; F279-A283 PolarHBondContact O-N 2.92Å
280V91.6Very high89.3Confident1 Ų124.7 Ų24.71%0.00614%0.141CC..Hα-helixtrans-64-43.7174.7166.50000111I54 I198 I201 V202 C276 Y277 V278 A283 Y284I54-V280 HydrophobicContact CD1-CG1 4.29Å; I54-V280 HydrophobicContact CG1-CB 4.4Å; I54-V280 HydrophobicContact CG1-CG1 3.95Å; I198-V280 HydrophobicContact CG2-CG2 4.03Å; I201-V280 HydrophobicContact CG2-CG1 4.22Å; I201-V280 HydrophobicContact CG2-CG2 4.24Å; V202-V280 HydrophobicContact CG2-CG2 3.8Å; C276-V280 WeakPolarHBondContact O-CB 3.19Å; C276-V280 VanDerWaalsContact O-CG2 3.23Å; C276-V280 WeakPolarHBondContact O-CG2 3.43Å; C276-V280 PolarHBondContact O-N 3Å; Y277-V280 PolarHBondContact O-N 2.95Å; V278-V280 PolarHBondContact O-N 3.43Å; V280-A283 WeakPolarHBondContact O-CB 3.34Å; V280-A283 PolarHBondContact O-N 2.8Å; V280-Y284 HydrophobicContact CG1-CD2 4.1Å; V280-Y284 HydrophobicContact CG1-CE1 4.32Å; V280-Y284 HydrophobicContact CG1-CE2 3.44Å; V280-Y284 VanDerWaalsContact CG1-CE2 3.44Å; V280-Y284 PolarHBondContact O-N 3Å
281N91.8Very high89.3Confident0 Ų028.8 Ų28.80%017%0.169CC..Hα-helixtrans-65-42.3176.8-78.8-83.7000111.7P58 L72 W75 Y277 V278 A283 Y284 F285P58-N281 WeakPolarHBondContact CB-OD1 3.35Å; L72-N281 HydrophobicContact CD2-CB 3.8Å; W75-N281 VanDerWaalsContact CE2-ND2 3.27Å; W75-N281 PolarHBondContact NE1-ND2 3.02Å; W75-N281 PolarHBondContact NE1-OD1 3.02Å; W75-N281 VanDerWaalsContact NE1-OD1 3.14Å; Y277-N281 PolarHBondContact O-N 2.84Å; Y277-N281 PolarHBondContact O-ND2 3Å; V278-N281 PolarHBondContact O-N 3.49Å; N281-A283 VanDerWaalsContact C-N 3.29Å; N281-A283 PolarHBondContact O-N 3.23Å; N281-Y284 PolarHBondContact O-N 3.39Å; N281-F285 HydrophobicContact CB-CE2 4.31Å; N281-F285 WeakPolarHBondContact O-CD2 3.39Å; N281-F285 PolarHBondContact O-N 2.99Å; N281-F285 VanDerWaalsContact O-N 3.1Å
282I90.3Very high89.3Confident32 Ų3229.1 Ų29.116%0.16417%0.167CC..Hα-helixtrans-57.6-45.1172.9-67.4167.4000110.2L72 M209 V278 F279 Y284 F285 T286L72-I282 HydrophobicContact CD1-CG1 4.12Å; L72-I282 HydrophobicContact CD2-CG1 3.94Å; M209-I282 HydrophobicContact CE-CG2 4.07Å; M209-I282 HydrophobicContact SD-CG2 3.56Å; M209-I282 VanDerWaalsContact SD-CG2 3.56Å; V278-I282 HydrophobicContact CG1-CD1 3.8Å; V278-I282 HydrophobicContact CG1-CG1 4.44Å; V278-I282 VanDerWaalsContact O-CG1 3.3Å; V278-I282 WeakPolarHBondContact O-CG1 3.11Å; V278-I282 PolarHBondContact O-N 3.41Å; F279-I282 HydrophobicContact CD1-CD1 4.4Å; F279-I282 PolarHBondContact O-N 2.95Å; I282-Y284 VanDerWaalsContact C-N 3.32Å; I282-Y284 PolarHBondContact O-N 3.31Å; I282-F285 PolarHBondContact O-N 3.21Å; I282-T286 HydrophobicContact CG2-CG2 4.44Å; I282-T286 VanDerWaalsContact O-CG2 3.28Å; I282-T286 WeakPolarHBondContact O-CG2 3.36Å; I282-T286 PolarHBondContact O-N 3.04Å; I282-T286 VanDerWaalsContact O-N 3.07Å
283A90.6Very high89.3Confident1 Ų125 Ų251%0.00815%0.146CC..Hα-helixtrans-58.7-41.8176.900000112.1I201 F279 V280 N281 F285 T286 F303I201-A283 HydrophobicContact CG2-CB 3.96Å; F279-A283 WeakPolarHBondContact O-CB 3.39Å; F279-A283 PolarHBondContact O-N 2.92Å; V280-A283 WeakPolarHBondContact O-CB 3.34Å; V280-A283 PolarHBondContact O-N 2.8Å; N281-A283 VanDerWaalsContact C-N 3.29Å; N281-A283 PolarHBondContact O-N 3.23Å; A283-F285 PolarHBondContact O-N 3.02Å; A283-T286 PolarHBondContact O-N 3.06Å; A283-T286 PolarHBondContact O-OG1 3.49Å; A283-F303 HydrophobicContact CB-CE2 4.24Å
284Y90.3Very high89.2Confident0 Ų027.8 Ų27.80%016%0.16CC..Hα-helixtrans-60.5-44.6175.1-65.2-32.1000112.6P58 I201 V280 N281 I282 T286 V287 M288 V299 F303P58-Y284 HydrophobicContact CB-CD2 4.47Å; P58-Y284 HydrophobicContact CG-CD2 4.4Å; P58-Y284 HydrophobicContact CG-CE2 4.15Å; I201-Y284 HydrophobicContact CG2-CE1 4.24Å; V280-Y284 HydrophobicContact CG1-CD2 4.1Å; V280-Y284 HydrophobicContact CG1-CE1 4.32Å; V280-Y284 HydrophobicContact CG1-CE2 3.44Å; V280-Y284 VanDerWaalsContact CG1-CE2 3.44Å; V280-Y284 PolarHBondContact O-N 3Å; N281-Y284 PolarHBondContact O-N 3.39Å; I282-Y284 VanDerWaalsContact C-N 3.32Å; I282-Y284 PolarHBondContact O-N 3.31Å; Y284-T286 VanDerWaalsContact C-N 3.29Å; Y284-T286 PolarHBondContact O-N 3.44Å; Y284-V287 PolarHBondContact O-N 3.26Å; Y284-M288 PolarHBondContact O-N 2.82Å; Y284-V299 HydrophobicContact CD1-CG1 4.11Å; Y284-V299 HydrophobicContact CD2-CG1 3.78Å; Y284-V299 HydrophobicContact CE1-CG1 4.25Å; Y284-V299 HydrophobicContact CE2-CG1 3.92Å; Y284-V299 HydrophobicContact CG-CG1 3.89Å; Y284-F303 HydrophobicContact CD1-CB 4.02Å; Y284-F303 AromaticContact CD1-CD2 3.83Å; Y284-F303 HydrophobicContact CD1-CD2 3.83Å; Y284-F303 HydrophobicContact CD1-CG 4.05Å; Y284-F303 HydrophobicContact CE1-CB 3.96Å; Y284-F303 HydrophobicContact CE1-CD2 4.3Å; Y284-F303 HydrophobicContact CE1-CG 4.09Å
285F89.1Confident89Confident0 Ų031.4 Ų31.40%019%0.186CC..Hα-helixtrans-69.4-23179.7-64.7-55.9000114.1L62 V68 C71 L72 N216 L217 N281 I282 A283 V287 L293L62-F285 HydrophobicContact CD1-CE1 4.16Å; L62-F285 HydrophobicContact CD1-CZ 4.17Å; L62-F285 HydrophobicContact CD2-CE1 4.01Å; V68-F285 HydrophobicContact CG1-CB 4.31Å; V68-F285 HydrophobicContact CG1-CD1 4.02Å; V68-F285 HydrophobicContact CG1-CD2 3.6Å; V68-F285 HydrophobicContact CG1-CE1 4.22Å; V68-F285 HydrophobicContact CG1-CE2 3.83Å; V68-F285 HydrophobicContact CG1-CG 3.71Å; V68-F285 HydrophobicContact CG1-CZ 4.14Å; V68-F285 HydrophobicContact CG2-CD1 3.91Å; V68-F285 HydrophobicContact CG2-CE1 3.92Å; V68-F285 HydrophobicContact CG2-CG 4.43Å; V68-F285 HydrophobicContact CG2-CZ 4.43Å; C71-F285 HydrophobicContact CB-CZ 4.46Å; L72-F285 HydrophobicContact CD2-CD2 4.34Å; L72-F285 HydrophobicContact CD2-CE2 4.14Å; L72-F285 HydrophobicContact CG-CE2 4.33Å; N216-F285 VanDerWaalsContact CB-O 3.28Å; N216-F285 WeakPolarHBondContact CB-O 3.32Å; N216-F285 PolarHBondContact ND2-O 3.38Å; L217-F285 HydrophobicContact CD2-CB 4.42Å; N281-F285 HydrophobicContact CB-CE2 4.31Å; N281-F285 WeakPolarHBondContact O-CD2 3.39Å; N281-F285 PolarHBondContact O-N 2.99Å; N281-F285 VanDerWaalsContact O-N 3.1Å; I282-F285 PolarHBondContact O-N 3.21Å; A283-F285 PolarHBondContact O-N 3.02Å; F285-V287 PolarHBondContact O-N 3.46Å; F285-L293 HydrophobicContact CD1-CD1 4.35Å; F285-L293 HydrophobicContact CE1-CD1 3.92Å; F285-L293 HydrophobicContact CZ-CD1 4.47Å
286T86.8Confident88.8Confident7 Ų728.4 Ų28.44%0.04317%0.168CC..Hα-helixtrans-71.5-19.6174.3640000113.5M209 L217 I282 A283 Y284M209-T286 HydrophobicContact CG-CG2 3.4Å; M209-T286 HydrophobicContact SD-CG2 4.12Å; L217-T286 HydrophobicContact CD1-CG2 4.28Å; I282-T286 HydrophobicContact CG2-CG2 4.44Å; I282-T286 VanDerWaalsContact O-CG2 3.28Å; I282-T286 WeakPolarHBondContact O-CG2 3.36Å; I282-T286 PolarHBondContact O-N 3.04Å; I282-T286 VanDerWaalsContact O-N 3.07Å; A283-T286 PolarHBondContact O-N 3.06Å; A283-T286 PolarHBondContact O-OG1 3.49Å; Y284-T286 VanDerWaalsContact C-N 3.29Å; Y284-T286 PolarHBondContact O-N 3.44Å
287V86Confident88.2Confident25 Ų2528.9 Ų28.915%0.15217%0.172CC..Hα-helixtrans-112-32.5-173.5175.70000112.5L208 Y284 F285 F303 K306 V307L208-V287 HydrophobicContact CD1-CG2 3.45Å; L208-V287 VanDerWaalsContact CD1-CG2 3.45Å; Y284-V287 PolarHBondContact O-N 3.26Å; F285-V287 PolarHBondContact O-N 3.46Å; V287-F303 HydrophobicContact CB-CD2 4.04Å; V287-F303 HydrophobicContact CB-CE2 4.25Å; V287-F303 HydrophobicContact CG1-CD2 4.3Å; V287-F303 HydrophobicContact CG2-CD2 3.87Å; V287-F303 HydrophobicContact CG2-CE2 3.58Å; V287-K306 HydrophobicContact CG1-CB 3.62Å; V287-K306 HydrophobicContact CG1-CD 3.53Å; V287-K306 HydrophobicContact CG1-CG 4.24Å; V287-K306 PolarHBondContact O-NZ 3.03Å; V287-V307 HydrophobicContact CB-CG2 4.39Å; V287-V307 HydrophobicContact CG1-CG2 3.89Å; V287-V307 HydrophobicContact CG2-CG2 3.56Å
288M86.8Confident87.8Confident0 Ų029 Ų290%017%0.173CC..SBendtrans-121.1146.4-175.7-61.7179.2-154.500111.4N216 Y284 E292 V299 T302 F303 K306N216-M288 PolarHBondContact ND2-O 3Å; Y284-M288 PolarHBondContact O-N 2.82Å; M288-E292 HydrophobicContact CB-CB 4.47Å; M288-E292 HydrophobicContact CB-CG 4.49Å; M288-E292 HydrophobicContact CG-CG 4.5Å; M288-V299 WeakPolarHBondContact CE-O 3.37Å; M288-T302 VanDerWaalsContact CE-CB 3.47Å; M288-T302 HydrophobicContact CE-CG2 3.58Å; M288-T302 HydrophobicContact SD-CG2 3.86Å; M288-F303 HydrophobicContact CE-CB 3.62Å; M288-K306 HydrophobicContact CG-CD 4.5Å
289T88.2Confident87.6Confident51 Ų5127.8 Ų27.831%0.31317%0.166SC..  trans-75.7158.1167.460.10000110.3S291 E292 L293T289-S291 VanDerWaalsContact C-N 3.28Å; T289-S291 PolarHBondContact O-N 2.97Å; T289-S291 PolarHBondContact OG1-OG 3.37Å; T289-E292 PolarHBondContact O-N 3.13Å; T289-E292 VanDerWaalsContact OG1-CB 3.31Å; T289-E292 WeakPolarHBondContact OG1-CB 3.18Å; T289-E292 PolarHBondContact OG1-N 3.48Å; T289-L293 PolarHBondContact O-N 3.46Å
290P85.1Confident87.4Confident38 Ų3823.7 Ų23.725%0.24715%0.148CC..Hα-helixtrans-56-40.5177.1-28.536.9000113.4L62 V68 L293 L294L62-P290 HydrophobicContact CD2-CB 4.07Å; V68-P290 HydrophobicContact CG2-CG 3.66Å; P290-L293 PolarHBondContact O-N 2.96Å; P290-L294 VanDerWaalsContact O-CG 3.29Å; P290-L294 WeakPolarHBondContact O-CG 3.46Å; P290-L294 PolarHBondContact O-N 3.42Å
291S86.3Confident87.2Confident86 Ų8624.2 Ų24.260%0.60115%0.151SC*.Hα-helixtrans-64.8-41.4178.149.80000112.3T289 L294 S295T289-S291 VanDerWaalsContact C-N 3.28Å; T289-S291 PolarHBondContact O-N 2.97Å; T289-S291 PolarHBondContact OG1-OG 3.37Å; S291-L294 PolarHBondContact O-N 3.01Å; S291-S295 PolarHBondContact O-N 3.03Å
292E87.9Confident87Confident51 Ų5125.8 Ų25.824%0.23816%0.161CC..Hα-helixtrans-65.1-43176.5-175.6174.6-159.900111.9M288 T289 L294 S295 S296 K306M288-E292 HydrophobicContact CB-CB 4.47Å; M288-E292 HydrophobicContact CB-CG 4.49Å; M288-E292 HydrophobicContact CG-CG 4.5Å; T289-E292 PolarHBondContact O-N 3.13Å; T289-E292 VanDerWaalsContact OG1-CB 3.31Å; T289-E292 WeakPolarHBondContact OG1-CB 3.18Å; T289-E292 PolarHBondContact OG1-N 3.48Å; E292-L294 VanDerWaalsContact C-N 3.3Å; E292-L294 PolarHBondContact O-N 3.08Å; E292-S295 WeakPolarHBondContact CA-OG 3.33Å; E292-S295 PolarHBondContact O-N 3.3Å; E292-S295 VanDerWaalsContact O-N 3.13Å; E292-S295 PolarHBondContact O-OG 2.9Å; E292-S296 PolarHBondContact O-N 3.04Å; E292-K306 WeakPolarHBondContact OE1-CE 3.08Å; E292-K306 IonicContact OE1-NZ 2.76Å; E292-K306 PolarHBondContact OE1-NZ 3.31Å; E292-K306 IonicContact OE2-NZ 2.65Å; E292-K306 PolarHBondContact OE2-NZ 2.86Å
293L88.2Confident86.9Confident0 Ų024.2 Ų24.20%015%0.153CC..Hα-helixtrans-60.2-41.1176.2-165.2154.3000111.5K59 L62 F285 T289 P290 S295 S296 V299K59-L293 HydrophobicContact CB-CD2 4.22Å; L62-L293 HydrophobicContact CB-CD2 4.48Å; L62-L293 HydrophobicContact CD2-CB 4.11Å; L62-L293 HydrophobicContact CD2-CD1 4.41Å; L62-L293 HydrophobicContact CD2-CD2 3.82Å; L62-L293 HydrophobicContact CD2-CG 4.32Å; F285-L293 HydrophobicContact CD1-CD1 4.35Å; F285-L293 HydrophobicContact CE1-CD1 3.92Å; F285-L293 HydrophobicContact CZ-CD1 4.47Å; T289-L293 PolarHBondContact O-N 3.46Å; P290-L293 PolarHBondContact O-N 2.96Å; L293-S295 VanDerWaalsContact C-N 3.34Å; L293-S296 PolarHBondContact O-N 3.37Å; L293-V299 HydrophobicContact CD1-CG1 4.16Å; L293-V299 HydrophobicContact CD2-CG2 4.1Å; L293-V299 HydrophobicContact CG-CG1 4.02Å; L293-V299 HydrophobicContact CG-CG2 4.21Å
294L87.4Confident86.7Confident60 Ų6024.2 Ų24.231%0.31415%0.152SC..Hα-helixtrans-68.2-31.9176.4-68.2175.6000113K59 L62 L63 P290 S291 E292K59-L294 WeakPolarHBondContact CE-O 3.27Å; K59-L294 HydrophobicContact CG-CD2 4.44Å; K59-L294 PolarHBondContact NZ-O 3.45Å; K59-L294 WeakPolarHBondContact O-CD2 3.36Å; L62-L294 HydrophobicContact CB-CD2 4.22Å; L62-L294 HydrophobicContact CD2-CD2 4.18Å; L62-L294 HydrophobicContact CD2-CG 4.07Å; L62-L294 HydrophobicContact CG-CD2 4.2Å; L62-L294 HydrophobicContact CG-CG 4.44Å; L63-L294 HydrophobicContact CB-CD2 3.82Å; L63-L294 HydrophobicContact CD1-CD2 4.27Å; P290-L294 VanDerWaalsContact O-CG 3.29Å; P290-L294 WeakPolarHBondContact O-CG 3.46Å; P290-L294 PolarHBondContact O-N 3.42Å; S291-L294 PolarHBondContact O-N 3.01Å; E292-L294 VanDerWaalsContact C-N 3.3Å; E292-L294 PolarHBondContact O-N 3.08Å
295S86.7Confident86.6Confident91 Ų9128.3 Ų28.364%0.63617%0.174SC*.Hα-helixtrans-75.6-28.3177.772.60000113.3S291 E292 L293S291-S295 PolarHBondContact O-N 3.03Å; E292-S295 WeakPolarHBondContact CA-OG 3.33Å; E292-S295 PolarHBondContact O-N 3.3Å; E292-S295 VanDerWaalsContact O-N 3.13Å; E292-S295 PolarHBondContact O-OG 2.9Å; L293-S295 VanDerWaalsContact C-N 3.34Å
296S85.2Confident86.5Confident11 Ų1133 Ų338%0.07720%0.195CC..  trans-70.8136-179-178.40000111.8K59 E292 L293 A298 T302K59-S296 WeakPolarHBondContact CD-O 3.44Å; K59-S296 PolarHBondContact NZ-O 3.27Å; E292-S296 PolarHBondContact O-N 3.04Å; L293-S296 PolarHBondContact O-N 3.37Å; S296-A298 VanDerWaalsContact OG-C 3.27Å; S296-A298 PolarHBondContact OG-N 3.06Å; S296-A298 PolarHBondContact OG-O 2.71Å; S296-T302 PolarHBondContact OG-OG1 3.18Å
297S77.4Confident86.5Confident40 Ų4034.7 Ų34.728%0.2821%0.205SC..SBendtrans-76.8-38.2167.548.80000111.3E143E143-S297 WeakPolarHBondContact OE1-CB 3.46Å
298A85.1Confident86.3Confident2 Ų235.2 Ų35.22%0.01721%0.207CC..  trans-125.485.1-17500000111.1Y144 A147 S296 A300 V301 T302Y144-A298 HydrophobicContact CD1-CB 4Å; Y144-A298 HydrophobicContact CE1-CB 3.68Å; A147-A298 HydrophobicContact CB-CB 3.85Å; S296-A298 VanDerWaalsContact OG-C 3.27Å; S296-A298 PolarHBondContact OG-N 3.06Å; S296-A298 PolarHBondContact OG-O 2.71Å; A298-A300 VanDerWaalsContact C-N 3.26Å; A298-A300 PolarHBondContact O-N 3.14Å; A298-A300 VanDerWaalsContact O-N 3.16Å; A298-V301 HydrophobicContact CB-CB 4.01Å; A298-V301 HydrophobicContact CB-CG2 3.83Å; A298-V301 PolarHBondContact O-N 3.06Å; A298-T302 PolarHBondContact O-N 3.38Å; A298-T302 VanDerWaalsContact O-N 3.17Å; A298-T302 PolarHBondContact O-OG1 2.66Å
299V87.3Confident85.9Confident2 Ų244.7 Ų44.71%0.01224%0.244CC..Hα-helixtrans-52.8-41.3-174.2-1780000112.6K59 Y144 Y284 M288 L293 V301 F303K59-V299 HydrophobicContact CB-CG2 4.35Å; Y144-V299 PolarHBondContact OH-N 3.29Å; Y284-V299 HydrophobicContact CD1-CG1 4.11Å; Y284-V299 HydrophobicContact CD2-CG1 3.78Å; Y284-V299 HydrophobicContact CE1-CG1 4.25Å; Y284-V299 HydrophobicContact CE2-CG1 3.92Å; Y284-V299 HydrophobicContact CG-CG1 3.89Å; M288-V299 WeakPolarHBondContact CE-O 3.37Å; L293-V299 HydrophobicContact CD1-CG1 4.16Å; L293-V299 HydrophobicContact CD2-CG2 4.1Å; L293-V299 HydrophobicContact CG-CG1 4.02Å; L293-V299 HydrophobicContact CG-CG2 4.21Å; V299-V301 PolarHBondContact O-N 3.05Å; V299-F303 PolarHBondContact O-N 3.33Å; V299-F303 VanDerWaalsContact O-N 3.15Å
300A86.9Confident85.5Confident0 Ų047.1 Ų47.10%026%0.261CS..Hα-helixtrans-69.7-34.2-179.800000112.9F55 Y144 A298 F303 G304 V315 V319F55-A300 HydrophobicContact CD1-CB 3.8Å; F55-A300 HydrophobicContact CE1-CB 4.25Å; Y144-A300 HydrophobicContact CE1-CB 3.86Å; Y144-A300 PolarHBondContact OH-N 3.33Å; A298-A300 VanDerWaalsContact C-N 3.26Å; A298-A300 PolarHBondContact O-N 3.14Å; A298-A300 VanDerWaalsContact O-N 3.16Å; A300-F303 WeakPolarHBondContact O-CB 3.39Å; A300-F303 PolarHBondContact O-N 3.43Å; A300-G304 PolarHBondContact O-N 2.94Å; A300-V315 HydrophobicContact CB-CG1 3.86Å; A300-V315 VanDerWaalsContact O-CG1 3.26Å; A300-V315 WeakPolarHBondContact O-CG1 3.19Å; A300-V319 HydrophobicContact CB-CG2 4.09Å
301V87.1Confident85.4Confident12 Ų1248.3 Ų48.37%0.07327%0.267CS..Hα-helixtrans-67.1-47.7178.7179.90000109.7Y144 A298 V299 F303 G304 D305 P316Y144-V301 HydrophobicContact CD1-CG2 3.78Å; Y144-V301 HydrophobicContact CE1-CG2 3.96Å; A298-V301 HydrophobicContact CB-CB 4.01Å; A298-V301 HydrophobicContact CB-CG2 3.83Å; A298-V301 PolarHBondContact O-N 3.06Å; V299-V301 PolarHBondContact O-N 3.05Å; V301-F303 PolarHBondContact O-N 3.21Å; V301-F303 VanDerWaalsContact O-N 3.16Å; V301-G304 WeakPolarHBondContact O-CA 3.2Å; V301-G304 PolarHBondContact O-N 2.81Å; V301-D305 PolarHBondContact O-N 3.42Å; V301-P316 HydrophobicContact CG2-CB 3.88Å; V301-P316 HydrophobicContact CG2-CG 4.42Å
302T88.3Confident85.1Confident32 Ų3244.9 Ų44.920%0.19624%0.244CC..Hα-helixtrans-57.7-32.8175.4-48.70000111.8M288 S296 A298 K306M288-T302 VanDerWaalsContact CE-CB 3.47Å; M288-T302 HydrophobicContact CE-CG2 3.58Å; M288-T302 HydrophobicContact SD-CG2 3.86Å; S296-T302 PolarHBondContact OG-OG1 3.18Å; A298-T302 PolarHBondContact O-N 3.38Å; A298-T302 VanDerWaalsContact O-N 3.17Å; A298-T302 PolarHBondContact O-OG1 2.66Å; T302-K306 PolarHBondContact O-N 3.33Å
303F88.9Confident84.9Confident0 Ų050.3 Ų50.30%026%0.262CS..Hα-helixtrans-69.8-44.5175.8175.2-87.9000110.6I201 A204 A283 Y284 V287 M288 V299 A300 V301 D305 K306 V307I201-F303 HydrophobicContact CB-CE1 4.29Å; I201-F303 HydrophobicContact CG1-CD1 4.24Å; I201-F303 HydrophobicContact CG1-CE1 4.03Å; I201-F303 HydrophobicContact CG2-CD1 4.5Å; I201-F303 HydrophobicContact CG2-CE1 4.06Å; I201-F303 HydrophobicContact CG2-CZ 4.1Å; A204-F303 HydrophobicContact CB-CE1 4.37Å; A204-F303 HydrophobicContact CB-CZ 4.03Å; A283-F303 HydrophobicContact CB-CE2 4.24Å; Y284-F303 HydrophobicContact CD1-CB 4.02Å; Y284-F303 AromaticContact CD1-CD2 3.83Å; Y284-F303 HydrophobicContact CD1-CD2 3.83Å; Y284-F303 HydrophobicContact CD1-CG 4.05Å; Y284-F303 HydrophobicContact CE1-CB 3.96Å; Y284-F303 HydrophobicContact CE1-CD2 4.3Å; Y284-F303 HydrophobicContact CE1-CG 4.09Å; V287-F303 HydrophobicContact CB-CD2 4.04Å; V287-F303 HydrophobicContact CB-CE2 4.25Å; V287-F303 HydrophobicContact CG1-CD2 4.3Å; V287-F303 HydrophobicContact CG2-CD2 3.87Å; V287-F303 HydrophobicContact CG2-CE2 3.58Å; M288-F303 HydrophobicContact CE-CB 3.62Å; V299-F303 PolarHBondContact O-N 3.33Å; V299-F303 VanDerWaalsContact O-N 3.15Å; A300-F303 WeakPolarHBondContact O-CB 3.39Å; A300-F303 PolarHBondContact O-N 3.43Å; V301-F303 PolarHBondContact O-N 3.21Å; V301-F303 VanDerWaalsContact O-N 3.16Å; F303-D305 VanDerWaalsContact C-N 3.34Å; F303-D305 PolarHBondContact O-N 3.09Å; F303-K306 PolarHBondContact O-N 3.2Å; F303-V307 HydrophobicContact CD2-CG2 4.24Å; F303-V307 HydrophobicContact CE1-CB 4.35Å; F303-V307 HydrophobicContact CE1-CG2 4.27Å; F303-V307 HydrophobicContact CE2-CG2 3.97Å; F303-V307 HydrophobicContact CZ-CB 4.43Å; F303-V307 HydrophobicContact CZ-CG1 4.5Å; F303-V307 HydrophobicContact CZ-CG2 3.99Å; F303-V307 WeakPolarHBondContact O-CB 3.16Å; F303-V307 WeakPolarHBondContact O-CG2 3.38Å; F303-V307 PolarHBondContact O-N 3.22Å; F303-V307 VanDerWaalsContact O-N 3.09Å
304G86.5Confident84.8Confident0 Ų052.6 Ų52.60%027%0.274CS..Hα-helixtrans-57.3-44.5175.300000112.8A300 V301 K306 V307 L308A300-G304 PolarHBondContact O-N 2.94Å; V301-G304 WeakPolarHBondContact O-CA 3.2Å; V301-G304 PolarHBondContact O-N 2.81Å; G304-K306 VanDerWaalsContact C-N 3.31Å; G304-K306 PolarHBondContact O-N 3.11Å; G304-V307 PolarHBondContact O-N 2.89Å; G304-L308 WeakPolarHBondContact O-CA 3.44Å; G304-L308 WeakPolarHBondContact O-CB 3.37Å; G304-L308 PolarHBondContact O-N 3.27Å
305D87.2Confident84.7Confident86 Ų8649.8 Ų49.846%0.4626%0.259SS..Hα-helixtrans-63.4-36.4-178.8-66.1-31.7000112.5V301 F303 A312V301-D305 PolarHBondContact O-N 3.42Å; F303-D305 VanDerWaalsContact C-N 3.34Å; F303-D305 PolarHBondContact O-N 3.09Å; D305-A312 WeakPolarHBondContact OD1-CB 3.43Å
306K86.6Confident84.8Confident99 Ų9945.9 Ų45.943%0.4323%0.232SC..Hα-helixtrans-82.2-31.4-178.8-73.6-174.5169.8-159.20114.8V287 M288 E292 T302 F303 G304V287-K306 HydrophobicContact CG1-CB 3.62Å; V287-K306 HydrophobicContact CG1-CD 3.53Å; V287-K306 HydrophobicContact CG1-CG 4.24Å; V287-K306 PolarHBondContact O-NZ 3.03Å; M288-K306 HydrophobicContact CG-CD 4.5Å; E292-K306 WeakPolarHBondContact OE1-CE 3.08Å; E292-K306 IonicContact OE1-NZ 2.76Å; E292-K306 PolarHBondContact OE1-NZ 3.31Å; E292-K306 IonicContact OE2-NZ 2.65Å; E292-K306 PolarHBondContact OE2-NZ 2.86Å; T302-K306 PolarHBondContact O-N 3.33Å; F303-K306 PolarHBondContact O-N 3.2Å; G304-K306 VanDerWaalsContact C-N 3.31Å; G304-K306 PolarHBondContact O-N 3.11Å
307V86.6Confident84.9Confident43 Ų4348.5 Ų48.526%0.26125%0.245SC..Hα-helixtrans-107.1-39.9-170.1-177.60000112.5A204 L208 V287 F303 G304A204-V307 HydrophobicContact CB-CG1 4.06Å; L208-V307 HydrophobicContact CD1-CG1 4.05Å; L208-V307 HydrophobicContact CD1-CG2 3.82Å; V287-V307 HydrophobicContact CB-CG2 4.39Å; V287-V307 HydrophobicContact CG1-CG2 3.89Å; V287-V307 HydrophobicContact CG2-CG2 3.56Å; F303-V307 HydrophobicContact CD2-CG2 4.24Å; F303-V307 HydrophobicContact CE1-CB 4.35Å; F303-V307 HydrophobicContact CE1-CG2 4.27Å; F303-V307 HydrophobicContact CE2-CG2 3.97Å; F303-V307 HydrophobicContact CZ-CB 4.43Å; F303-V307 HydrophobicContact CZ-CG1 4.5Å; F303-V307 HydrophobicContact CZ-CG2 3.99Å; F303-V307 WeakPolarHBondContact O-CB 3.16Å; F303-V307 WeakPolarHBondContact O-CG2 3.38Å; F303-V307 PolarHBondContact O-N 3.22Å; F303-V307 VanDerWaalsContact O-N 3.09Å; G304-V307 PolarHBondContact O-N 2.89Å
308L82.4Confident85.4Confident36 Ų3648.9 Ų48.919%0.18824%0.241CC..SBendtrans-105.123.5-167.7-62.9175.4000112.6V200 G304 P310 V311 A312 V315V200-L308 HydrophobicContact CG1-CD1 4.04Å; V200-L308 HydrophobicContact CG1-CD2 4.49Å; G304-L308 WeakPolarHBondContact O-CA 3.44Å; G304-L308 WeakPolarHBondContact O-CB 3.37Å; G304-L308 PolarHBondContact O-N 3.27Å; L308-P310 CarbonylContact O-C 3.43Å; L308-V311 HydrophobicContact CB-CG2 4.17Å; L308-V311 CarbonylContact O-C 3.33Å; L308-V311 WeakPolarHBondContact O-CA 3.36Å; L308-V311 VanDerWaalsContact O-CG2 3.28Å; L308-V311 WeakPolarHBondContact O-CG2 3.48Å; L308-V311 PolarHBondContact O-N 3.2Å; L308-A312 PolarHBondContact O-N 2.91Å; L308-V315 HydrophobicContact CD1-CG2 3.82Å
309Y79.4Confident85.6Confident199 Ų19948.8 Ų48.878%0.7824%0.241SC*.THydrogen-bonded Turntrans-61.4118.2173.2-168.7-97.7000109.5
310P79.3Confident85.6Confident102 Ų10249.1 Ų49.166%0.66224%0.244SC*.THydrogen-bonded Turncis-108.1724.719.9-0.5000116.8L308L308-P310 CarbonylContact O-C 3.43Å
311V81.7Confident85.6Confident62 Ų6252 Ų5238%0.37626%0.256SS..  trans-96.225.9-177.3-64.20000113.7L308 W313 I314L308-V311 HydrophobicContact CB-CG2 4.17Å; L308-V311 CarbonylContact O-C 3.33Å; L308-V311 WeakPolarHBondContact O-CA 3.36Å; L308-V311 VanDerWaalsContact O-CG2 3.28Å; L308-V311 WeakPolarHBondContact O-CG2 3.48Å; L308-V311 PolarHBondContact O-N 3.2Å; V311-W313 PolarHBondContact O-N 2.86Å; V311-W313 VanDerWaalsContact O-N 3.12Å; V311-I314 HydrophobicContact CB-CD1 3.82Å; V311-I314 HydrophobicContact CB-CG1 4.27Å; V311-I314 HydrophobicContact CG1-CD1 4.41Å; V311-I314 HydrophobicContact CG2-CD1 4.31Å; V311-I314 VanDerWaalsContact O-CB 3.3Å; V311-I314 WeakPolarHBondContact O-CB 3.42Å; V311-I314 WeakPolarHBondContact O-CG1 3.31Å; V311-I314 PolarHBondContact O-N 3.45Å
312A80.1Confident85.6Confident15 Ų1551.4 Ų51.412%0.12425%0.253CS..THydrogen-bonded Turntrans-57.3-29.7-176.100000114D305 L308 I314 V315 P316D305-A312 WeakPolarHBondContact OD1-CB 3.43Å; L308-A312 PolarHBondContact O-N 2.91Å; A312-I314 PolarHBondContact O-N 3.32Å; A312-I314 VanDerWaalsContact O-N 3.1Å; A312-V315 PolarHBondContact O-N 2.95Å; A312-V315 VanDerWaalsContact O-N 3.12Å; A312-P316 WeakPolarHBondContact O-CD 3.46Å
313W83.8Confident85.6Confident164 Ų16449.9 Ų49.962%0.62124%0.244SC*.THydrogen-bonded Turntrans-60-19.8176.964.9-92.7000114.4V311 V315 P316 L317V311-W313 PolarHBondContact O-N 2.86Å; V311-W313 VanDerWaalsContact O-N 3.12Å; W313-V315 VanDerWaalsContact C-N 3.34Å; W313-P316 WeakPolarHBondContact O-CD 3.43Å; W313-P316 WeakPolarHBondContact O-CG 3.47Å; W313-L317 HydrophobicContact CE3-CD2 4.25Å; W313-L317 HydrophobicContact CZ3-CD2 3.83Å
314I86.1Confident85.4Confident49 Ų4951.4 Ų51.425%0.25125%0.25SS..Hα-helixtrans-63.9-41.5175.9-69.8-175.2000110.3V311 A312 L317 F318V311-I314 HydrophobicContact CB-CD1 3.82Å; V311-I314 HydrophobicContact CB-CG1 4.27Å; V311-I314 HydrophobicContact CG1-CD1 4.41Å; V311-I314 HydrophobicContact CG2-CD1 4.31Å; V311-I314 VanDerWaalsContact O-CB 3.3Å; V311-I314 WeakPolarHBondContact O-CB 3.42Å; V311-I314 WeakPolarHBondContact O-CG1 3.31Å; V311-I314 PolarHBondContact O-N 3.45Å; A312-I314 PolarHBondContact O-N 3.32Å; A312-I314 VanDerWaalsContact O-N 3.1Å; I314-L317 PolarHBondContact O-N 3.13Å; I314-F318 HydrophobicContact CB-CD2 4.43Å; I314-F318 HydrophobicContact CG2-CD2 3.38Å; I314-F318 HydrophobicContact CG2-CE2 3.55Å; I314-F318 VanDerWaalsContact O-CD2 3.28Å; I314-F318 WeakPolarHBondContact O-CD2 3.45Å; I314-F318 PolarHBondContact O-N 2.98Å
315V86.5Confident85.2Confident0 Ų051.4 Ų51.40%025%0.25CS..Hα-helixtrans-61-55.8-174.3-173.10000113.2I197 A300 L308 A312 W313 L317 F318 V319I197-V315 HydrophobicContact CD1-CG1 4.48Å; I197-V315 HydrophobicContact CD1-CG2 4.27Å; A300-V315 HydrophobicContact CB-CG1 3.86Å; A300-V315 VanDerWaalsContact O-CG1 3.26Å; A300-V315 WeakPolarHBondContact O-CG1 3.19Å; L308-V315 HydrophobicContact CD1-CG2 3.82Å; A312-V315 PolarHBondContact O-N 2.95Å; A312-V315 VanDerWaalsContact O-N 3.12Å; W313-V315 VanDerWaalsContact C-N 3.34Å; V315-L317 VanDerWaalsContact C-N 3.25Å; V315-L317 PolarHBondContact O-N 3.24Å; V315-F318 PolarHBondContact O-N 3.19Å; V315-V319 HydrophobicContact CG1-CG2 4.22Å; V315-V319 WeakPolarHBondContact O-CB 3.42Å; V315-V319 VanDerWaalsContact O-CG2 3.25Å; V315-V319 WeakPolarHBondContact O-CG2 3.36Å; V315-V319 PolarHBondContact O-N 3.26Å
316P87.4Confident85Confident10 Ų1047.9 Ų47.97%0.06523%0.232CC..Hα-helixtrans-60.4-34.817823-32.9000112.4P148 V301 A312 W313 A320P148-P316 HydrophobicContact CG-CB 3.51Å; P148-P316 HydrophobicContact CG-CG 3.54Å; V301-P316 HydrophobicContact CG2-CB 3.88Å; V301-P316 HydrophobicContact CG2-CG 4.42Å; A312-P316 WeakPolarHBondContact O-CD 3.46Å; W313-P316 WeakPolarHBondContact O-CD 3.43Å; W313-P316 WeakPolarHBondContact O-CG 3.47Å; P316-A320 WeakPolarHBondContact O-CB 3.28Å; P316-A320 PolarHBondContact O-N 3.36Å
317L88.6Confident84.9Confident66 Ų6643.1 Ų43.135%0.34621%0.212SC..Hα-helixtrans-63.8-49.6177.4-178.765.4000112.1W313 I314 V315 A320 F321W313-L317 HydrophobicContact CE3-CD2 4.25Å; W313-L317 HydrophobicContact CZ3-CD2 3.83Å; I314-L317 PolarHBondContact O-N 3.13Å; V315-L317 VanDerWaalsContact C-N 3.25Å; V315-L317 PolarHBondContact O-N 3.24Å; L317-A320 PolarHBondContact O-N 3.41Å; L317-F321 HydrophobicContact CD1-CE1 3.84Å; L317-F321 HydrophobicContact CD1-CE2 4.07Å; L317-F321 HydrophobicContact CD1-CZ 3.56Å; L317-F321 HydrophobicContact CD2-CE2 4.3Å; L317-F321 HydrophobicContact CD2-CZ 4.41Å; L317-F321 HydrophobicContact CG-CD2 4.42Å; L317-F321 HydrophobicContact CG-CE1 4.47Å; L317-F321 HydrophobicContact CG-CE2 3.86Å; L317-F321 HydrophobicContact CG-CZ 3.9Å; L317-F321 WeakPolarHBondContact O-CG 3.25Å; L317-F321 PolarHBondContact O-N 2.91Å
318F88.6Confident84.7Confident47 Ų4741.1 Ų41.121%0.20620%0.199CC..Hα-helixtrans-70.4-33.2179.8-84.8-87.8000112.6A193 I197 I314 V315 F321 S322A193-F318 HydrophobicContact CB-CD1 3.8Å; A193-F318 HydrophobicContact CB-CE1 3.91Å; A193-F318 WeakPolarHBondContact O-CD1 3.29Å; I197-F318 HydrophobicContact CB-CB 3.76Å; I197-F318 HydrophobicContact CB-CD1 4.49Å; I197-F318 HydrophobicContact CB-CG 4.28Å; I197-F318 HydrophobicContact CD1-CB 4.23Å; I197-F318 HydrophobicContact CG1-CB 3.93Å; I197-F318 HydrophobicContact CG2-CB 4.09Å; I314-F318 HydrophobicContact CB-CD2 4.43Å; I314-F318 HydrophobicContact CG2-CD2 3.38Å; I314-F318 HydrophobicContact CG2-CE2 3.55Å; I314-F318 VanDerWaalsContact O-CD2 3.28Å; I314-F318 WeakPolarHBondContact O-CD2 3.45Å; I314-F318 PolarHBondContact O-N 2.98Å; V315-F318 PolarHBondContact O-N 3.19Å; F318-F321 PolarHBondContact O-N 2.91Å; F318-S322 PolarHBondContact O-N 3.04Å
319V87.8Confident84.4Confident0 Ų039.8 Ų39.80%020%0.195CC..Hα-helixtrans-65.2-45.3171.9175.80000110.3F55 Y144 A300 V315 F321 S322 T323F55-V319 HydrophobicContact CB-CG1 4.22Å; F55-V319 HydrophobicContact CD1-CG1 4.39Å; F55-V319 HydrophobicContact CD1-CG2 3.92Å; F55-V319 HydrophobicContact CD2-CG1 3.66Å; F55-V319 HydrophobicContact CD2-CG2 4.29Å; F55-V319 HydrophobicContact CE1-CG2 3.73Å; F55-V319 HydrophobicContact CE2-CB 4.48Å; F55-V319 HydrophobicContact CE2-CG1 4.07Å; F55-V319 HydrophobicContact CE2-CG2 4.13Å; F55-V319 HydrophobicContact CG-CG1 3.83Å; F55-V319 HydrophobicContact CG-CG2 4.19Å; F55-V319 HydrophobicContact CZ-CG2 3.84Å; Y144-V319 HydrophobicContact CD1-CB 3.94Å; Y144-V319 HydrophobicContact CD1-CG1 3.45Å; Y144-V319 VanDerWaalsContact CD1-CG1 3.45Å; Y144-V319 HydrophobicContact CD1-CG2 4.3Å; Y144-V319 HydrophobicContact CD2-CG1 3.87Å; Y144-V319 HydrophobicContact CE1-CB 4.46Å; Y144-V319 HydrophobicContact CE1-CG1 3.89Å; Y144-V319 HydrophobicContact CE1-CG2 4.39Å; Y144-V319 HydrophobicContact CE2-CG1 4.27Å; Y144-V319 HydrophobicContact CG-CB 4.29Å; Y144-V319 HydrophobicContact CG-CG1 3.44Å; Y144-V319 VanDerWaalsContact CG-CG1 3.44Å; A300-V319 HydrophobicContact CB-CG2 4.09Å; V315-V319 HydrophobicContact CG1-CG2 4.22Å; V315-V319 WeakPolarHBondContact O-CB 3.42Å; V315-V319 VanDerWaalsContact O-CG2 3.25Å; V315-V319 WeakPolarHBondContact O-CG2 3.36Å; V315-V319 PolarHBondContact O-N 3.26Å; V319-F321 VanDerWaalsContact C-N 3.3Å; V319-F321 PolarHBondContact O-N 2.94Å; V319-S322 WeakPolarHBondContact O-CA 3.31Å; V319-S322 WeakPolarHBondContact O-CB 3.2Å; V319-S322 PolarHBondContact O-N 3.14Å; V319-T323 HydrophobicContact CG1-CG2 4.34Å; V319-T323 WeakPolarHBondContact O-CG2 3.23Å; V319-T323 PolarHBondContact O-N 3.34Å; V319-T323 PolarHBondContact O-OG1 3.01Å
320A87.9Confident84.4Confident9 Ų930.7 Ų30.77%0.07416%0.16CC..Hα-helixtrans-59.6-40.1176.200000112.2F141 P316 L317 T323 F324F141-A320 HydrophobicContact CD2-CB 3.88Å; F141-A320 HydrophobicContact CE2-CB 3.78Å; P316-A320 WeakPolarHBondContact O-CB 3.28Å; P316-A320 PolarHBondContact O-N 3.36Å; L317-A320 PolarHBondContact O-N 3.41Å; A320-T323 WeakPolarHBondContact CA-OG1 3.41Å; A320-T323 PolarHBondContact O-N 2.89Å; A320-T323 PolarHBondContact O-OG1 2.73Å; A320-F324 VanDerWaalsContact O-CB 3.32Å; A320-F324 WeakPolarHBondContact O-CB 3.3Å; A320-F324 PolarHBondContact O-N 3.43Å
321F87.2Confident84.3Confident60 Ų6025.9 Ų25.926%0.26313%0.129SC..Hα-helixtrans-62-41.7171.2-72.2-11.8000112.6F190 A193 L317 F318 V319 F324 G325F190-F321 HydrophobicContact CD1-CB 3.61Å; F190-F321 HydrophobicContact CD1-CD1 4.23Å; F190-F321 AromaticContact CD1-CG 3.92Å; F190-F321 HydrophobicContact CD1-CG 3.92Å; F190-F321 HydrophobicContact CE1-CB 3.89Å; F190-F321 AromaticContact CE1-CD1 3.58Å; F190-F321 HydrophobicContact CE1-CD1 3.58Å; F190-F321 HydrophobicContact CE1-CD2 4.48Å; F190-F321 HydrophobicContact CE1-CE1 4.22Å; F190-F321 AromaticContact CE1-CG 3.73Å; F190-F321 HydrophobicContact CE1-CG 3.73Å; F190-F321 HydrophobicContact CZ-CD1 4.44Å; A193-F321 HydrophobicContact CB-CB 4.38Å; A193-F321 HydrophobicContact CB-CD2 4.36Å; L317-F321 HydrophobicContact CD1-CE1 3.84Å; L317-F321 HydrophobicContact CD1-CE2 4.07Å; L317-F321 HydrophobicContact CD1-CZ 3.56Å; L317-F321 HydrophobicContact CD2-CE2 4.3Å; L317-F321 HydrophobicContact CD2-CZ 4.41Å; L317-F321 HydrophobicContact CG-CD2 4.42Å; L317-F321 HydrophobicContact CG-CE1 4.47Å; L317-F321 HydrophobicContact CG-CE2 3.86Å; L317-F321 HydrophobicContact CG-CZ 3.9Å; L317-F321 WeakPolarHBondContact O-CG 3.25Å; L317-F321 PolarHBondContact O-N 2.91Å; F318-F321 PolarHBondContact O-N 2.91Å; V319-F321 VanDerWaalsContact C-N 3.3Å; V319-F321 PolarHBondContact O-N 2.94Å; F321-F324 PolarHBondContact O-N 2.84Å; F321-G325 PolarHBondContact O-N 2.92Å
322S87.8Confident83.8Confident0 Ų026.8 Ų26.80%013%0.128CC..Hα-helixtrans-63.1-45.9176.9-173.50000112.3K194 F318 V319 G325 S326K194-S322 WeakPolarHBondContact CB-OG 3.38Å; F318-S322 PolarHBondContact O-N 3.04Å; V319-S322 WeakPolarHBondContact O-CA 3.31Å; V319-S322 WeakPolarHBondContact O-CB 3.2Å; V319-S322 PolarHBondContact O-N 3.14Å; S322-G325 PolarHBondContact O-N 3.44Å; S322-S326 PolarHBondContact O-N 3.43Å; S322-S326 PolarHBondContact O-OG 3.44Å
323T87.3Confident83.5Confident1 Ų126.9 Ų26.91%0.00613%0.127CC..Hα-helixtrans-66.1-41.117956.10000111.1S52 I137 F141 V319 A320 S326 A327S52-T323 VanDerWaalsContact CB-CG2 3.5Å; I137-T323 WeakPolarHBondContact CG2-O 3.48Å; F141-T323 WeakPolarHBondContact CA-OG1 3.42Å; F141-T323 VanDerWaalsContact CB-OG1 3.28Å; F141-T323 WeakPolarHBondContact CB-OG1 3.21Å; F141-T323 WeakPolarHBondContact CD2-OG1 3.44Å; V319-T323 HydrophobicContact CG1-CG2 4.34Å; V319-T323 WeakPolarHBondContact O-CG2 3.23Å; V319-T323 PolarHBondContact O-N 3.34Å; V319-T323 PolarHBondContact O-OG1 3.01Å; A320-T323 WeakPolarHBondContact CA-OG1 3.41Å; A320-T323 PolarHBondContact O-N 2.89Å; A320-T323 PolarHBondContact O-OG1 2.73Å; T323-S326 PolarHBondContact O-N 3.36Å; T323-A327 WeakPolarHBondContact O-CB 3.38Å; T323-A327 PolarHBondContact O-N 2.92Å
324F84.4Confident83.1Confident31 Ų3119.2 Ų19.214%0.13610%0.099CC..Hα-helixtrans-63-44.8175.9-167.5-75.5000111.9V170 I171 V175 V186 F190 A320 F321 S326 A327 N328V170-F324 HydrophobicContact CG1-CE2 4.49Å; I171-F324 HydrophobicContact CB-CZ 4.42Å; I171-F324 HydrophobicContact CD1-CD2 3.84Å; I171-F324 HydrophobicContact CD1-CE2 3.88Å; I171-F324 HydrophobicContact CD1-CG 4.23Å; I171-F324 HydrophobicContact CD1-CZ 4.31Å; I171-F324 HydrophobicContact CG1-CD1 4.25Å; I171-F324 HydrophobicContact CG1-CD2 3.77Å; I171-F324 HydrophobicContact CG1-CE1 3.84Å; I171-F324 HydrophobicContact CG1-CE2 3.29Å; I171-F324 HydrophobicContact CG1-CG 4.24Å; I171-F324 HydrophobicContact CG1-CZ 3.35Å; V175-F324 HydrophobicContact CG2-CE1 4.5Å; V175-F324 HydrophobicContact CG2-CZ 4.36Å; V186-F324 HydrophobicContact CG1-CE1 4.41Å; F190-F324 AromaticContact CD2-CD1 3.91Å; F190-F324 HydrophobicContact CD2-CD1 3.91Å; F190-F324 HydrophobicContact CE2-CB 4.41Å; F190-F324 AromaticContact CE2-CD1 3.2Å; F190-F324 HydrophobicContact CE2-CD1 3.2Å; F190-F324 AromaticContact CE2-CE1 3.67Å; F190-F324 HydrophobicContact CE2-CE1 3.67Å; F190-F324 HydrophobicContact CE2-CG 4.08Å; F190-F324 AromaticContact CZ-CD1 3.82Å; F190-F324 HydrophobicContact CZ-CD1 3.82Å; F190-F324 HydrophobicContact CZ-CE1 4.28Å; F190-F324 HydrophobicContact CZ-CG 4.36Å; A320-F324 VanDerWaalsContact O-CB 3.32Å; A320-F324 WeakPolarHBondContact O-CB 3.3Å; A320-F324 PolarHBondContact O-N 3.43Å; F321-F324 PolarHBondContact O-N 2.84Å; F324-S326 VanDerWaalsContact C-N 3.3Å; F324-S326 PolarHBondContact O-N 3.27Å; F324-A327 PolarHBondContact O-N 3.4Å; F324-N328 WeakPolarHBondContact O-CB 3.21Å; F324-N328 PolarHBondContact O-N 3.06Å
325G82.1Confident82.5Confident0 Ų017 Ų170%09%0.088CC..Hα-helixtrans-63.1-34.9175.300000113Q187 F321 S322 G329Q187-G325 VanDerWaalsContact CD-O 3.3Å; Q187-G325 PolarHBondContact NE2-O 3.43Å; Q187-G325 PolarHBondContact OE1-O 2.88Å; F321-G325 PolarHBondContact O-N 2.92Å; S322-G325 PolarHBondContact O-N 3.44Å; G325-G329 PolarHBondContact O-N 2.94Å
326S83.6Confident81.9Confident12 Ų1219.7 Ų19.78%0.08410%0.098CC..Hα-helixtrans-70.6-40177.7-51.70000111.6G51 K194 S322 T323 F324 G329 S330G51-S326 WeakPolarHBondContact CA-OG 3.43Å; K194-S326 PolarHBondContact NZ-OG 3.47Å; S322-S326 PolarHBondContact O-N 3.43Å; S322-S326 PolarHBondContact O-OG 3.44Å; T323-S326 PolarHBondContact O-N 3.36Å; F324-S326 VanDerWaalsContact C-N 3.3Å; F324-S326 PolarHBondContact O-N 3.27Å; S326-G329 PolarHBondContact O-N 3.03Å; S326-S330 PolarHBondContact O-N 3.22Å
327A84.4Confident81.4Confident0 Ų019.2 Ų19.20%010%0.095CC..Hα-helixtrans-62.5-45174.400000111.4F134 I137 T138 I171 T323 F324 G329 S330 C331F134-A327 HydrophobicContact CD2-CB 4.03Å; F134-A327 HydrophobicContact CE2-CB 3.62Å; F134-A327 WeakPolarHBondContact CE2-O 3.49Å; I137-A327 HydrophobicContact CB-CB 4.5Å; I137-A327 HydrophobicContact CG2-CB 3.8Å; T138-A327 HydrophobicContact CG2-CB 4.29Å; I171-A327 HydrophobicContact CD1-CB 3.67Å; T323-A327 WeakPolarHBondContact O-CB 3.38Å; T323-A327 PolarHBondContact O-N 2.92Å; F324-A327 PolarHBondContact O-N 3.4Å; A327-G329 PolarHBondContact O-N 2.8Å; A327-S330 WeakPolarHBondContact O-CB 3.28Å; A327-S330 PolarHBondContact O-N 2.97Å; A327-C331 PolarHBondContact O-N 3.5Å; A327-C331 PolarHBondContact O-SG 2.66Å
328N82.7Confident81Confident0 Ų016.4 Ų16.40%08%0.081CC..Hα-helixtrans-60-44.1174.7-176.269.2000112.4I171 N176 A183 Q187 F324 S330 C331 F332I171-N328 HydrophobicContact CG2-CB 4.43Å; N176-N328 PolarHBondContact ND2-OD1 2.9Å; N176-N328 PolarHBondContact OD1-OD1 2.92Å; A183-N328 PolarHBondContact O-ND2 2.89Å; Q187-N328 PolarHBondContact OE1-ND2 3.04Å; F324-N328 WeakPolarHBondContact O-CB 3.21Å; F324-N328 PolarHBondContact O-N 3.06Å; N328-S330 VanDerWaalsContact C-N 3.33Å; N328-S330 PolarHBondContact O-N 3.36Å; N328-C331 WeakPolarHBondContact O-CB 3.17Å; N328-C331 PolarHBondContact O-N 3.27Å; N328-F332 WeakPolarHBondContact O-CD2 3.42Å
329G76.2Confident80.3Confident9 Ų916.7 Ų16.79%0.0938%0.081CC..Hα-helixtrans-58.7-41.1173.500000113.3G325 S326 A327 C331 F332G325-G329 PolarHBondContact O-N 2.94Å; S326-G329 PolarHBondContact O-N 3.03Å; A327-G329 PolarHBondContact O-N 2.8Å; G329-C331 VanDerWaalsContact C-N 3.32Å; G329-C331 PolarHBondContact O-N 3.4Å; G329-F332 PolarHBondContact O-N 2.92Å
330S78.9Confident79.6Confident8 Ų816.7 Ų16.76%0.0568%0.081CC..Hα-helixtrans-62.2-38178.2-168.50000112.4S326 A327 N328 F332 T333 A334S326-S330 PolarHBondContact O-N 3.22Å; A327-S330 WeakPolarHBondContact O-CB 3.28Å; A327-S330 PolarHBondContact O-N 2.97Å; N328-S330 VanDerWaalsContact C-N 3.33Å; N328-S330 PolarHBondContact O-N 3.36Å; S330-F332 PolarHBondContact O-N 3.49Å; S330-T333 PolarHBondContact O-N 2.96Å; S330-T333 PolarHBondContact O-OG1 3.22Å; S330-A334 PolarHBondContact O-N 2.98Å
331C78.1Confident79.1Confident1 Ų116.3 Ų16.31%0.0078%0.077CC..Hα-helixtrans-58.9-41.5176.8-69.20000113.2F134 A327 N328 G329 T333 A334 G335 L365F134-C331 VanDerWaalsContact CE2-SG 3.51Å; A327-C331 PolarHBondContact O-N 3.5Å; A327-C331 PolarHBondContact O-SG 2.66Å; N328-C331 WeakPolarHBondContact O-CB 3.17Å; N328-C331 PolarHBondContact O-N 3.27Å; G329-C331 VanDerWaalsContact C-N 3.32Å; G329-C331 PolarHBondContact O-N 3.4Å; C331-T333 VanDerWaalsContact C-N 3.33Å; C331-T333 PolarHBondContact O-N 2.96Å; C331-A334 PolarHBondContact O-N 3.42Å; C331-G335 PolarHBondContact O-N 3.16Å; C331-L365 HydrophobicContact CB-CD2 3.87Å; C331-L365 WeakPolarHBondContact O-CD2 3.16Å
332F71.3Confident78.6Confident81 Ų8113.5 Ų13.536%0.3557%0.066SC..Hα-helixtrans-58.7-44.9177.3-77.3-73.4000111.9V180 A183 N328 G329 S330 R336V180-F332 HydrophobicContact CG1-CE1 4.1Å; A183-F332 HydrophobicContact CB-CE1 4.24Å; A183-F332 HydrophobicContact CB-CE2 3.86Å; A183-F332 HydrophobicContact CB-CZ 3.34Å; N328-F332 WeakPolarHBondContact O-CD2 3.42Å; G329-F332 PolarHBondContact O-N 2.92Å; S330-F332 PolarHBondContact O-N 3.49Å; F332-R336 PolarHBondContact O-N 3.46Å
333T72.4Confident77.9Confident16 Ų1620 Ų2010%0.0989%0.091CC..Hα-helixtrans-72.3-35.2-178.766.50000113.2K130 Q247 S330 C331 G335 R336 L337K130-T333 PolarHBondContact NZ-OG1 2.56Å; Q247-T333 HydrophobicContact CG-CG2 4.22Å; S330-T333 PolarHBondContact O-N 2.96Å; S330-T333 PolarHBondContact O-OG1 3.22Å; C331-T333 VanDerWaalsContact C-N 3.33Å; C331-T333 PolarHBondContact O-N 2.96Å; T333-G335 VanDerWaalsContact C-N 3.35Å; T333-G335 PolarHBondContact O-N 3.32Å; T333-R336 PolarHBondContact O-N 3.49Å; T333-L337 PolarHBondContact O-N 2.89Å
334A76.8Confident77.4Confident4 Ų424.8 Ų24.83%0.03311%0.113CC..Hα-helixtrans-62.8-40.7178.100000112.1K130 S330 C331 S338K130-A334 HydrophobicContact CB-CB 4.23Å; K130-A334 HydrophobicContact CD-CB 4.3Å; K130-A334 HydrophobicContact CG-CB 4.25Å; S330-A334 PolarHBondContact O-N 2.98Å; C331-A334 PolarHBondContact O-N 3.42Å; A334-S338 PolarHBondContact O-N 3.05Å; A334-S338 PolarHBondContact O-OG 2.9Å
335G73.3Confident77Confident2 Ų225 Ų252%0.02112%0.124CC..Hα-helixtrans-62.9-42.7175.100000112.6C331 T333 S338 Y339C331-G335 PolarHBondContact O-N 3.16Å; T333-G335 VanDerWaalsContact C-N 3.35Å; T333-G335 PolarHBondContact O-N 3.32Å; G335-S338 PolarHBondContact O-N 3.23Å; G335-Y339 WeakPolarHBondContact O-CB 3.34Å; G335-Y339 PolarHBondContact O-N 3.11Å
336R73.7Confident76.8Confident56 Ų5626 Ų2621%0.21113%0.128CC..Hα-helixtrans-66.4-42.6-177.2-167.569.9-175.4-162.22.1113L32 S102 E253 F332 T333 Y339 V340L32-R336 VanDerWaalsContact CD1-NH1 3.32Å; S102-R336 PolarHBondContact OG-NE 3.27Å; S102-R336 PolarHBondContact OG-NH2 3.47Å; E253-R336 IonicContact OE2-NH2 2.71Å; E253-R336 PolarHBondContact OE2-NH2 3.49Å; F332-R336 PolarHBondContact O-N 3.46Å; T333-R336 PolarHBondContact O-N 3.49Å; R336-Y339 WeakPolarHBondContact O-CB 3.34Å; R336-Y339 PolarHBondContact O-N 3.36Å; R336-V340 WeakPolarHBondContact O-CG2 3.37Å; R336-V340 PolarHBondContact O-N 3.08Å; R336-V340 VanDerWaalsContact O-N 3.13Å
337L77.4Confident76.6Confident1 Ų126.6 Ų26.61%0.00513%0.13CC..Hα-helixtrans-65.4-43.8177.8-18065.2000111.6Y121 T125 V126 F250 T333 Y339 V340 A341Y121-L337 HydrophobicContact CE1-CD1 4.19Å; Y121-L337 HydrophobicContact CE1-CD2 4.47Å; T125-L337 HydrophobicContact CG2-CD2 3.15Å; V126-L337 HydrophobicContact CG2-CD2 4.27Å; F250-L337 HydrophobicContact CE1-CD1 4.45Å; T333-L337 PolarHBondContact O-N 2.89Å; L337-Y339 PolarHBondContact O-N 3.37Å; L337-V340 PolarHBondContact O-N 3.38Å; L337-A341 WeakPolarHBondContact O-CB 3.49Å; L337-A341 PolarHBondContact O-N 3.33Å
338S79.1Confident76.4Confident7 Ų729.2 Ų29.25%0.04915%0.146CC..Hα-helixtrans-60.7-37.4177.7-57.50000111.6A334 G335 G342A334-S338 PolarHBondContact O-N 3.05Å; A334-S338 PolarHBondContact O-OG 2.9Å; G335-S338 PolarHBondContact O-N 3.23Å; S338-G342 PolarHBondContact O-N 3.49Å
339Y74.1Confident76.3Confident52 Ų5235.6 Ų35.620%0.20417%0.174CC..Hα-helixtrans-61.7-52174.8178-90.4000112.6G335 R336 L337 G342 R343 S352 I354 P492G335-Y339 WeakPolarHBondContact O-CB 3.34Å; G335-Y339 PolarHBondContact O-N 3.11Å; R336-Y339 WeakPolarHBondContact O-CB 3.34Å; R336-Y339 PolarHBondContact O-N 3.36Å; L337-Y339 PolarHBondContact O-N 3.37Å; Y339-G342 PolarHBondContact O-N 2.96Å; Y339-R343 PolarHBondContact O-N 2.89Å; Y339-S352 WeakPolarHBondContact CD2-O 3.38Å; Y339-I354 HydrophobicContact CE2-CD1 4.21Å; Y339-P492 HydrophobicContact CE2-CB 3.71Å; Y339-P492 HydrophobicContact CE2-CG 3.5Å; Y339-P492 VanDerWaalsContact CE2-CG 3.5Å
340V74.1Confident76.5Confident1 Ų135.8 Ų35.81%0.00617%0.173CC..Hα-helixtrans-64.6-46.1-179.1175.70000111.2S102 Y106 R336 L337 G342 R343 E344S102-V340 WeakPolarHBondContact O-CG1 3.4Å; S102-V340 WeakPolarHBondContact OG-CG2 3.34Å; Y106-V340 HydrophobicContact CD1-CG1 3.86Å; Y106-V340 HydrophobicContact CE1-CG1 4.04Å; R336-V340 WeakPolarHBondContact O-CG2 3.37Å; R336-V340 PolarHBondContact O-N 3.08Å; R336-V340 VanDerWaalsContact O-N 3.13Å; L337-V340 PolarHBondContact O-N 3.38Å; V340-G342 VanDerWaalsContact C-N 3.28Å; V340-G342 PolarHBondContact O-N 2.88Å; V340-R343 WeakPolarHBondContact O-CB 3.41Å; V340-R343 PolarHBondContact O-N 3.03Å; V340-R343 VanDerWaalsContact O-N 3.17Å; V340-E344 PolarHBondContact O-N 3.37Å
341A77.3Confident76.6Confident0 Ų036 Ų360%017%0.173CC..Hα-helixtrans-64.3-33.7179.300000112.4L337 G345 H346 M347L337-A341 WeakPolarHBondContact O-CB 3.49Å; L337-A341 PolarHBondContact O-N 3.33Å; A341-G345 PolarHBondContact O-N 3.36Å; A341-H346 PolarHBondContact O-N 3.45Å; A341-H346 VanDerWaalsContact O-N 3.07Å; A341-M347 HydrophobicContact CB-CB 3.83Å; A341-M347 PolarHBondContact O-N 3.49Å; A341-M347 VanDerWaalsContact O-N 3.08Å
342G76.4Confident76.6Confident2 Ų236.3 Ų36.32%0.02118%0.176CC..Hα-helixtrans-68.5-36.1174.100000113.1S338 Y339 V340 G345S338-G342 PolarHBondContact O-N 3.49Å; Y339-G342 PolarHBondContact O-N 2.96Å; V340-G342 VanDerWaalsContact C-N 3.28Å; V340-G342 PolarHBondContact O-N 2.88Å; G342-G345 PolarHBondContact O-N 2.92Å
343R73.5Confident77.1Confident137 Ų13733.9 Ų33.952%0.51716%0.164SC..Hα-helixtrans-64-43.6177.7-171.5176.769.9-172.8-0.7112.3Y339 V340 G345Y339-R343 PolarHBondContact O-N 2.89Å; V340-R343 WeakPolarHBondContact O-CB 3.41Å; V340-R343 PolarHBondContact O-N 3.03Å; V340-R343 VanDerWaalsContact O-N 3.17Å; R343-G345 PolarHBondContact O-N 3.28Å
344E75.6Confident77.5Confident100 Ų10035.3 Ų35.347%0.46717%0.171SC..THydrogen-bonded Turntrans-76.6-0.8177.9-60.8-59.7148.800113.1Y106 V340 H346Y106-E344 HydrophobicContact CE1-CB 4.41Å; Y106-E344 HydrophobicContact CE1-CG 3.91Å; Y106-E344 VanDerWaalsContact OH-CB 3.25Å; Y106-E344 WeakPolarHBondContact OH-CB 3.49Å; V340-E344 PolarHBondContact O-N 3.37Å; E344-H346 VanDerWaalsContact C-N 3.26Å; E344-H346 PolarHBondContact O-CD2 3.49Å; E344-H346 PolarHBondContact O-N 2.92Å
345G75.3Confident77.7Confident37 Ų3735.6 Ų35.638%0.38117%0.172SC..THydrogen-bonded Turntrans74.413.3178.400000114.7A341 G342 R343A341-G345 PolarHBondContact O-N 3.36Å; G342-G345 PolarHBondContact O-N 2.92Å; R343-G345 PolarHBondContact O-N 3.28Å
346H78.8Confident77.8Confident19 Ų1940.2 Ų40.29%0.08820%0.196CC..SBendtrans-86.1-16.4175.7-74.6-71.3000112.9Y106 M110 Y119 A341 E344Y106-H346 PolarHBondContact OH-CD2 2.88Å; M110-H346 WeakPolarHBondContact CE-NE2 3.48Å; Y119-H346 HydrophobicContact CD2-CB 3.98Å; Y119-H346 AromaticContact CD2-ND1 3.8Å; Y119-H346 VanDerWaalsContact CD2-O 3.31Å; Y119-H346 WeakPolarHBondContact CD2-O 3.26Å; Y119-H346 WeakPolarHBondContact CE2-O 3.5Å; A341-H346 PolarHBondContact O-N 3.45Å; A341-H346 VanDerWaalsContact O-N 3.07Å; E344-H346 VanDerWaalsContact C-N 3.26Å; E344-H346 PolarHBondContact O-CD2 3.49Å; E344-H346 PolarHBondContact O-N 2.92Å
347M79.7Confident77.9Confident26 Ų2644.6 Ų44.613%0.12822%0.217CC..SBendtrans-124.4164.1175.2-166.856.572.200111V126 A341 K349 L351V126-M347 HydrophobicContact CB-CE 3.92Å; V126-M347 HydrophobicContact CG1-CE 4.07Å; V126-M347 HydrophobicContact CG2-CE 3.99Å; A341-M347 HydrophobicContact CB-CB 3.83Å; A341-M347 PolarHBondContact O-N 3.49Å; A341-M347 VanDerWaalsContact O-N 3.08Å; M347-K349 PolarHBondContact O-N 3.25Å; M347-L351 HydrophobicContact CG-CD1 3.8Å; M347-L351 HydrophobicContact SD-CD1 4.09Å
348V80.3Confident77.6Confident55 Ų5550.1 Ų50.133%0.33324%0.238SC..  trans-59.5121.8174.4-173.70000109.7I350 L351 M476V348-I350 HydrophobicContact CG1-CB 4.41Å; V348-I350 HydrophobicContact CG1-CG2 3.74Å; V348-I350 PolarHBondContact O-N 2.98Å; V348-L351 WeakPolarHBondContact O-CB 3.41Å; V348-L351 PolarHBondContact O-N 3.24Å; V348-M476 HydrophobicContact CB-CE 4.17Å; V348-M476 HydrophobicContact CG1-CE 3.25Å; V348-M476 HydrophobicContact CG2-CE 3.78Å
349K79.3Confident77.3Confident133 Ų13357.5 Ų57.558%0.57827%0.269SS*.G310 helixtrans-54.6-27.9-175.5-67.2-173.6176.8-172.70114.4M347 L351 S352 Y353M347-K349 PolarHBondContact O-N 3.25Å; K349-L351 PolarHBondContact O-N 3.04Å; K349-S352 PolarHBondContact O-N 3.4Å; K349-S352 VanDerWaalsContact O-N 3.09Å; K349-S352 PolarHBondContact O-OG 3.4Å; K349-Y353 HydrophobicContact CB-CE1 4.37Å; K349-Y353 WeakPolarHBondContact O-CD1 3.41Å; K349-Y353 WeakPolarHBondContact O-CE1 3.39Å
350I81Confident77.3Confident13 Ų1355.1 Ų55.17%0.06726%0.26CS..G310 helixtrans-63.9-30179.1-158.8173.2000113V348 S352 Y353 P363 T480 L483 M487V348-I350 HydrophobicContact CG1-CB 4.41Å; V348-I350 HydrophobicContact CG1-CG2 3.74Å; V348-I350 PolarHBondContact O-N 2.98Å; I350-S352 PolarHBondContact O-N 3.38Å; I350-Y353 HydrophobicContact CG1-CD2 4.07Å; I350-Y353 HydrophobicContact CG1-CE2 4.49Å; I350-Y353 HydrophobicContact CG1-CG 4.42Å; I350-Y353 WeakPolarHBondContact O-CB 3.21Å; I350-Y353 PolarHBondContact O-N 3.36Å; I350-P363 HydrophobicContact CG1-CB 4.47Å; I350-P363 HydrophobicContact CG1-CG 4.49Å; I350-P363 WeakPolarHBondContact O-CB 3.38Å; I350-T480 HydrophobicContact CB-CG2 4.23Å; I350-T480 HydrophobicContact CD1-CG2 4.44Å; I350-T480 HydrophobicContact CG1-CG2 4.41Å; I350-L483 HydrophobicContact CD1-CB 3.1Å; I350-L483 HydrophobicContact CD1-CD1 3.64Å; I350-L483 HydrophobicContact CD1-CG 4.02Å; I350-M487 HydrophobicContact CD1-CE 4.16Å
351L80.8Confident77.5Confident12 Ų1256.9 Ų56.96%0.06327%0.272CS..G310 helixtrans-68.9-16.8178.1-61.4179.2000111.9M347 V348 K349 P363 A364 F367M347-L351 HydrophobicContact CG-CD1 3.8Å; M347-L351 HydrophobicContact SD-CD1 4.09Å; V348-L351 WeakPolarHBondContact O-CB 3.41Å; V348-L351 PolarHBondContact O-N 3.24Å; K349-L351 PolarHBondContact O-N 3.04Å; L351-P363 HydrophobicContact CD2-CB 4.49Å; L351-A364 WeakPolarHBondContact O-CB 3.42Å; L351-F367 HydrophobicContact CD1-CD1 4.19Å; L351-F367 HydrophobicContact CD1-CE1 4.41Å; L351-F367 HydrophobicContact CD2-CB 3.78Å; L351-F367 HydrophobicContact CD2-CD1 4.36Å; L351-F367 HydrophobicContact CD2-CG 3.98Å
352S78.3Confident77.6Confident9 Ų958.3 Ų58.36%0.06328%0.279CS..G310 helixtrans-93.83.8172.969.90000113.8Y339 K349 I350 P492Y339-S352 WeakPolarHBondContact CD2-O 3.38Å; K349-S352 PolarHBondContact O-N 3.4Å; K349-S352 VanDerWaalsContact O-N 3.09Å; K349-S352 PolarHBondContact O-OG 3.4Å; I350-S352 PolarHBondContact O-N 3.38Å; S352-P492 WeakPolarHBondContact O-CD 3.37Å
353Y82.7Confident78Confident30 Ų3058.6 Ų58.612%0.11828%0.281CS..  trans-80.3151.9-179.5-71.99.8000111.7K349 I350 T480 Q484 V489 V490 P491K349-Y353 HydrophobicContact CB-CE1 4.37Å; K349-Y353 WeakPolarHBondContact O-CD1 3.41Å; K349-Y353 WeakPolarHBondContact O-CE1 3.39Å; I350-Y353 HydrophobicContact CG1-CD2 4.07Å; I350-Y353 HydrophobicContact CG1-CE2 4.49Å; I350-Y353 HydrophobicContact CG1-CG 4.42Å; I350-Y353 WeakPolarHBondContact O-CB 3.21Å; I350-Y353 PolarHBondContact O-N 3.36Å; Y353-T480 HydrophobicContact CE2-CG2 4.07Å; Y353-Q484 HydrophobicContact CD2-CG 4.19Å; Y353-Q484 HydrophobicContact CE2-CB 4.41Å; Y353-Q484 HydrophobicContact CE2-CG 4Å; Y353-V489 HydrophobicContact CD2-CB 4.48Å; Y353-V489 HydrophobicContact CD2-CG2 3.88Å; Y353-V489 HydrophobicContact CG-CG2 4.47Å; Y353-V490 WeakPolarHBondContact CA-O 3.49Å; Y353-V490 WeakPolarHBondContact CB-O 3.25Å; Y353-P491 HydrophobicContact CD1-CB 4.16Å; Y353-P491 HydrophobicContact CE1-CB 3.78Å
354I80.6Confident78.5Confident45 Ų4552.2 Ų52.223%0.23126%0.257CS..EExtended strand (participates in β ladder)trans-119.4140.1-175.6-57.6177.7000108.9Y339 F359 V489 V490 P492Y339-I354 HydrophobicContact CE2-CD1 4.21Å; I354-F359 VanDerWaalsContact CG2-C 3.4Å; I354-F359 HydrophobicContact CG2-CB 4.4Å; I354-V489 CarbonylContact O-C 3.57Å; I354-V489 WeakPolarHBondContact O-CA 3.34Å; I354-V490 PolarHBondContact N-O 3.06Å; I354-V490 PolarHBondContact O-N 3.39Å; I354-P492 HydrophobicContact CD1-CB 4.11Å
355S80.4Confident78.8Confident10 Ų1047.7 Ų47.77%0.0724%0.236CC..EExtended strand (participates in β ladder)trans-69.5132.8176.3179.80000111.7K357 F359 T360S355-K357 PolarHBondContact O-N 2.74Å; S355-F359 WeakPolarHBondContact O-CA 3.46Å; S355-F359 PolarHBondContact O-N 3.25Å; S355-T360 PolarHBondContact N-O 3.49Å
356L76.1Confident79.3Confident100 Ų10048.7 Ų48.752%0.52423%0.232SC..THydrogen-bonded Turntrans-63-41.3-179.1-78.8169.8000113.5E488 V490L356-E488 PolarHBondContact N-O 3.32Å; L356-E488 VanDerWaalsContact N-O 3.16Å; L356-V490 HydrophobicContact CD1-CG1 3.73Å; L356-V490 HydrophobicContact CD2-CB 4.25Å; L356-V490 HydrophobicContact CD2-CG1 3.77Å; L356-V490 HydrophobicContact CD2-CG2 3.47Å; L356-V490 VanDerWaalsContact CD2-CG2 3.47Å; L356-V490 HydrophobicContact CG-CB 4.39Å; L356-V490 HydrophobicContact CG-CG1 3.7Å; L356-V490 HydrophobicContact CG-CG2 3.84Å
357K74.9Confident79.7Confident148 Ų14850.8 Ų50.864%0.64324%0.241SC*.THydrogen-bonded Turntrans-77.1-28.4-174.3-73.3175177.6151.60113S355 E488S355-K357 PolarHBondContact O-N 2.74Å; K357-E488 WeakPolarHBondContact CD-OE2 3.29Å; K357-E488 WeakPolarHBondContact CE-OE2 3.34Å; K357-E488 VanDerWaalsContact NZ-CD 3.31Å; K357-E488 IonicContact NZ-OE1 2.65Å; K357-E488 PolarHBondContact NZ-OE1 3.31Å; K357-E488 IonicContact NZ-OE2 3.06Å; K357-E488 PolarHBondContact NZ-OE2 2.9Å
358R70.5Confident80.1Confident116 Ų11649.9 Ų49.944%0.43824%0.237SC..THydrogen-bonded Turntrans-127.5-8.2-164.5-61.6179.8-178.4178.61.1114.6C177 L178 T360C177-R358 WeakPolarHBondContact O-CD 3.3Å; C177-R358 PolarHBondContact O-NH1 3.38Å; L178-R358 WeakPolarHBondContact O-CD 3.34Å; R358-T360 HydrophobicContact CB-CG2 4.37Å; R358-T360 PolarHBondContact O-N 2.98Å
359F74.1Confident80.4Confident163 Ų16347.5 Ų47.572%0.71522%0.223SC*.  trans54.931.7-178.2-57.3-81.4000114I354 S355I354-F359 VanDerWaalsContact CG2-C 3.4Å; I354-F359 HydrophobicContact CG2-CB 4.4Å; S355-F359 WeakPolarHBondContact O-CA 3.46Å; S355-F359 PolarHBondContact O-N 3.25Å
360T73.7Confident80.9Confident2 Ų245.7 Ų45.71%0.01222%0.219CC..  trans-107.2145.8179.551.40000111.5N176 V180 S355 R358 L362N176-T360 VanDerWaalsContact O-CG2 3.26Å; N176-T360 WeakPolarHBondContact O-CG2 3.35Å; V180-T360 HydrophobicContact CG2-CG2 3.54Å; S355-T360 PolarHBondContact N-O 3.49Å; R358-T360 HydrophobicContact CB-CG2 4.37Å; R358-T360 PolarHBondContact O-N 2.98Å; T360-L362 PolarHBondContact O-N 3.49Å
361P77.8Confident81.3Confident38 Ų3846.4 Ų46.425%0.24722%0.223CC..  trans-78.665.1176.333.3-35.5000111.4A364 L365P361-A364 PolarHBondContact O-N 2.95Å; P361-L365 HydrophobicContact CG-CD1 4.37Å; P361-L365 HydrophobicContact CG-CG 4.4Å; P361-L365 WeakPolarHBondContact O-CG 3.44Å; P361-L365 PolarHBondContact O-N 3.07Å
362L80.5Confident81.6Confident30 Ų3045.8 Ų45.816%0.15722%0.22CC..Hα-helixtrans-53.2-46.9-173.6178.564.8000114C177 T360 A364 L365 L366 M487 V489C177-L362 HydrophobicContact CB-CD1 3.84Å; C177-L362 WeakPolarHBondContact SG-CD1 3.37Å; T360-L362 PolarHBondContact O-N 3.49Å; L362-A364 PolarHBondContact O-N 3.42Å; L362-L365 PolarHBondContact O-N 3.42Å; L362-L366 HydrophobicContact CD1-CD1 3.87Å; L362-L366 HydrophobicContact CD1-CD2 4.48Å; L362-L366 HydrophobicContact CD1-CG 3.95Å; L362-L366 HydrophobicContact CG-CD1 3.97Å; L362-L366 HydrophobicContact CG-CG 4.4Å; L362-L366 WeakPolarHBondContact O-CG 3.48Å; L362-L366 PolarHBondContact O-N 3.34Å; L362-M487 HydrophobicContact CD2-CB 4.01Å; L362-M487 HydrophobicContact CD2-CG 4.23Å; L362-M487 HydrophobicContact CD2-SD 4.42Å; L362-M487 HydrophobicContact CG-SD 4.37Å; L362-V489 HydrophobicContact CB-CG1 4.4Å
363P84.6Confident82.2Confident8 Ų848.3 Ų48.35%0.05223%0.232CC..Hα-helixtrans-65.5-38.9-176.4-2235.5000113.1I350 L351 F367 M487 V489I350-P363 HydrophobicContact CG1-CB 4.47Å; I350-P363 HydrophobicContact CG1-CG 4.49Å; I350-P363 WeakPolarHBondContact O-CB 3.38Å; L351-P363 HydrophobicContact CD2-CB 4.49Å; P363-F367 VanDerWaalsContact O-CB 3.25Å; P363-F367 WeakPolarHBondContact O-CB 3.37Å; P363-F367 PolarHBondContact O-N 3.48Å; P363-M487 HydrophobicContact CB-CE 4Å; P363-M487 HydrophobicContact CB-SD 4.33Å; P363-M487 HydrophobicContact CG-CE 3.85Å; P363-M487 HydrophobicContact CG-SD 4.09Å; P363-V489 HydrophobicContact CG-CB 4.42Å; P363-V489 HydrophobicContact CG-CG1 3.94Å; P363-V489 HydrophobicContact CG-CG2 4.13Å
364A82.8Confident82.5Confident2 Ų253.2 Ų53.22%0.01725%0.254CS..Hα-helixtrans-65.9-41.7176.900000112.1L351 P361 L362 F367 N368L351-A364 WeakPolarHBondContact O-CB 3.42Å; P361-A364 PolarHBondContact O-N 2.95Å; L362-A364 PolarHBondContact O-N 3.42Å; A364-F367 PolarHBondContact O-N 3.27Å; A364-N368 WeakPolarHBondContact O-CB 3.12Å; A364-N368 PolarHBondContact O-N 3.39Å
365L82.9Confident82.8Confident6 Ų653.1 Ų53.13%0.03125%0.251CS..Hα-helixtrans-64.4-46.8178.4-68.3173.2000111.4I172 N176 C331 P361 L362 F367 N368 G369I172-L365 HydrophobicContact CG2-CB 4.24Å; N176-L365 HydrophobicContact CB-CD1 3.95Å; C331-L365 HydrophobicContact CB-CD2 3.87Å; C331-L365 WeakPolarHBondContact O-CD2 3.16Å; P361-L365 HydrophobicContact CG-CD1 4.37Å; P361-L365 HydrophobicContact CG-CG 4.4Å; P361-L365 WeakPolarHBondContact O-CG 3.44Å; P361-L365 PolarHBondContact O-N 3.07Å; L362-L365 PolarHBondContact O-N 3.42Å; L365-F367 VanDerWaalsContact C-N 3.34Å; L365-F367 PolarHBondContact O-N 2.91Å; L365-N368 PolarHBondContact O-N 3.42Å; L365-G369 PolarHBondContact O-N 3.01Å
366L86.4Confident83.1Confident57 Ų5752.9 Ų52.930%0.29825%0.249SC..Hα-helixtrans-62.1-42.5176.5-69.8177.2000111.7I172 L362 G369 I370 M487I172-L366 HydrophobicContact CG2-CD2 4.3Å; L362-L366 HydrophobicContact CD1-CD1 3.87Å; L362-L366 HydrophobicContact CD1-CD2 4.48Å; L362-L366 HydrophobicContact CD1-CG 3.95Å; L362-L366 HydrophobicContact CG-CD1 3.97Å; L362-L366 HydrophobicContact CG-CG 4.4Å; L362-L366 WeakPolarHBondContact O-CG 3.48Å; L362-L366 PolarHBondContact O-N 3.34Å; L366-G369 PolarHBondContact O-N 2.96Å; L366-I370 VanDerWaalsContact O-CG1 3.28Å; L366-I370 WeakPolarHBondContact O-CG1 3.11Å; L366-I370 PolarHBondContact O-N 2.96Å; L366-M487 HydrophobicContact CD1-SD 3.86Å
367F87.4Confident83.4Confident64 Ų6453.3 Ų53.328%0.28125%0.251SS..Hα-helixtrans-60.3-48177.4-174.4-106.1000112.1V126 M127 L351 P363 A364 L365 G369 I370 L371V126-F367 HydrophobicContact CG1-CD1 4.15Å; V126-F367 HydrophobicContact CG1-CE1 3.81Å; M127-F367 HydrophobicContact CE-CZ 4.33Å; M127-F367 HydrophobicContact SD-CE1 3.71Å; M127-F367 HydrophobicContact SD-CZ 3.51Å; M127-F367 VanDerWaalsContact SD-CZ 3.51Å; L351-F367 HydrophobicContact CD1-CD1 4.19Å; L351-F367 HydrophobicContact CD1-CE1 4.41Å; L351-F367 HydrophobicContact CD2-CB 3.78Å; L351-F367 HydrophobicContact CD2-CD1 4.36Å; L351-F367 HydrophobicContact CD2-CG 3.98Å; P363-F367 VanDerWaalsContact O-CB 3.25Å; P363-F367 WeakPolarHBondContact O-CB 3.37Å; P363-F367 PolarHBondContact O-N 3.48Å; A364-F367 PolarHBondContact O-N 3.27Å; L365-F367 VanDerWaalsContact C-N 3.34Å; L365-F367 PolarHBondContact O-N 2.91Å; F367-G369 VanDerWaalsContact C-N 3.32Å; F367-G369 PolarHBondContact O-N 2.98Å; F367-I370 PolarHBondContact O-N 2.96Å; F367-L371 HydrophobicContact CD1-CD1 3.95Å; F367-L371 HydrophobicContact CE1-CD1 3.4Å; F367-L371 VanDerWaalsContact CE1-CD1 3.4Å; F367-L371 HydrophobicContact CE1-CG 4.3Å; F367-L371 HydrophobicContact CE2-CD1 4.42Å; F367-L371 HydrophobicContact CZ-CD1 3.68Å; F367-L371 HydrophobicContact CZ-CG 4.28Å; F367-L371 WeakPolarHBondContact O-CG 3.23Å; F367-L371 PolarHBondContact O-N 3.29Å
368N87Confident83.7Confident6 Ų651.3 Ų51.33%0.03225%0.252CS..Hα-helixtrans-62-39.5176.5-172.365.6000112.1P131 A364 L365 A372P131-N368 WeakPolarHBondContact CD-OD1 3.28Å; P131-N368 WeakPolarHBondContact CG-OD1 3.25Å; A364-N368 WeakPolarHBondContact O-CB 3.12Å; A364-N368 PolarHBondContact O-N 3.39Å; L365-N368 PolarHBondContact O-N 3.42Å; N368-A372 VanDerWaalsContact O-CB 3.3Å; N368-A372 WeakPolarHBondContact O-CB 3.3Å; N368-A372 PolarHBondContact O-N 2.95Å
369G86.9Confident83.6Confident5 Ų546.4 Ų46.45%0.05224%0.237CC..Hα-helixtrans-63.9-46.817700000113.7L365 L366 F367 L371 A372 I373L365-G369 PolarHBondContact O-N 3.01Å; L366-G369 PolarHBondContact O-N 2.96Å; F367-G369 VanDerWaalsContact C-N 3.32Å; F367-G369 PolarHBondContact O-N 2.98Å; G369-L371 VanDerWaalsContact C-N 3.35Å; G369-L371 PolarHBondContact O-N 3.41Å; G369-A372 PolarHBondContact O-N 3.47Å; G369-I373 WeakPolarHBondContact O-CG1 3.32Å; G369-I373 PolarHBondContact O-N 2.91Å
370I89.1Confident84Confident95 Ų9542.7 Ų42.749%0.48722%0.224SC..Hα-helixtrans-60.1-47.4177.2-69.9165.3000110L366 F367 A372 I373 F374L366-I370 VanDerWaalsContact O-CG1 3.28Å; L366-I370 WeakPolarHBondContact O-CG1 3.11Å; L366-I370 PolarHBondContact O-N 2.96Å; F367-I370 PolarHBondContact O-N 2.96Å; I370-A372 VanDerWaalsContact C-N 3.35Å; I370-A372 PolarHBondContact O-N 2.96Å; I370-I373 PolarHBondContact O-N 2.96Å; I370-F374 HydrophobicContact CG2-CD2 3.91Å; I370-F374 HydrophobicContact CG2-CE2 3.55Å; I370-F374 WeakPolarHBondContact O-CD2 3.46Å; I370-F374 PolarHBondContact O-N 2.96Å; I370-F374 VanDerWaalsContact O-N 3.12Å
371L89.6Confident84.4Confident28 Ų2843.4 Ų43.415%0.14723%0.228CC..Hα-helixtrans-61.6-42.8176.9-70.9-178.1000112M127 P131 F367 G369 I373 F374 Y375M127-L371 HydrophobicContact SD-CD1 3.85Å; P131-L371 HydrophobicContact CB-CB 3.65Å; P131-L371 HydrophobicContact CG-CB 3.65Å; P131-L371 HydrophobicContact CG-CD1 3.78Å; P131-L371 HydrophobicContact CG-CG 4.4Å; F367-L371 HydrophobicContact CD1-CD1 3.95Å; F367-L371 HydrophobicContact CE1-CD1 3.4Å; F367-L371 VanDerWaalsContact CE1-CD1 3.4Å; F367-L371 HydrophobicContact CE1-CG 4.3Å; F367-L371 HydrophobicContact CE2-CD1 4.42Å; F367-L371 HydrophobicContact CZ-CD1 3.68Å; F367-L371 HydrophobicContact CZ-CG 4.28Å; F367-L371 WeakPolarHBondContact O-CG 3.23Å; F367-L371 PolarHBondContact O-N 3.29Å; G369-L371 VanDerWaalsContact C-N 3.35Å; G369-L371 PolarHBondContact O-N 3.41Å; L371-I373 VanDerWaalsContact C-N 3.31Å; L371-I373 PolarHBondContact O-N 3.42Å; L371-F374 WeakPolarHBondContact O-CB 3.34Å; L371-F374 PolarHBondContact O-N 3.47Å; L371-F374 VanDerWaalsContact O-N 3.09Å; L371-Y375 WeakPolarHBondContact O-CD2 3.17Å; L371-Y375 PolarHBondContact O-N 3.45Å
372A88.6Confident84.7Confident0 Ų043.6 Ų43.60%023%0.227CC..Hα-helixtrans-63-37.3178.800000112.3P131 F134 I168 N368 G369 I370 F374 Y375 I376P131-A372 HydrophobicContact CB-CB 4.41Å; F134-A372 HydrophobicContact CB-CB 4.28Å; F134-A372 HydrophobicContact CD1-CB 3.64Å; F134-A372 HydrophobicContact CG-CB 4.45Å; I168-A372 HydrophobicContact CD1-CB 3.67Å; N368-A372 VanDerWaalsContact O-CB 3.3Å; N368-A372 WeakPolarHBondContact O-CB 3.3Å; N368-A372 PolarHBondContact O-N 2.95Å; G369-A372 PolarHBondContact O-N 3.47Å; I370-A372 VanDerWaalsContact C-N 3.35Å; I370-A372 PolarHBondContact O-N 2.96Å; A372-F374 VanDerWaalsContact C-N 3.33Å; A372-F374 PolarHBondContact O-N 3.39Å; A372-Y375 PolarHBondContact O-N 2.82Å; A372-I376 WeakPolarHBondContact O-CG1 3.33Å; A372-I376 PolarHBondContact O-N 3.49Å
373I88.9Confident85Confident61 Ų6144.8 Ų44.831%0.31324%0.236SC..Hα-helixtrans-61.7-41.9172.2-67.5166.1000110.8I168 G369 I370 L371 Y375 I376I168-I373 HydrophobicContact CD1-CG1 4.5Å; I168-I373 HydrophobicContact CG2-CD1 4.24Å; I168-I373 HydrophobicContact CG2-CG1 4.03Å; G369-I373 WeakPolarHBondContact O-CG1 3.32Å; G369-I373 PolarHBondContact O-N 2.91Å; I370-I373 PolarHBondContact O-N 2.96Å; L371-I373 VanDerWaalsContact C-N 3.31Å; L371-I373 PolarHBondContact O-N 3.42Å; I373-Y375 VanDerWaalsContact C-N 3.31Å; I373-Y375 PolarHBondContact O-N 3.06Å; I373-I376 PolarHBondContact O-N 3.17Å
374F89.4Confident85.1Confident133 Ų13344.9 Ų44.958%0.58324%0.236SC*.Hα-helixtrans-61.5-38.6174.8-78-64.5000112.6I370 L371 A372 I377 P378I370-F374 HydrophobicContact CG2-CD2 3.91Å; I370-F374 HydrophobicContact CG2-CE2 3.55Å; I370-F374 WeakPolarHBondContact O-CD2 3.46Å; I370-F374 PolarHBondContact O-N 2.96Å; I370-F374 VanDerWaalsContact O-N 3.12Å; L371-F374 WeakPolarHBondContact O-CB 3.34Å; L371-F374 PolarHBondContact O-N 3.47Å; L371-F374 VanDerWaalsContact O-N 3.09Å; A372-F374 VanDerWaalsContact C-N 3.33Å; A372-F374 PolarHBondContact O-N 3.39Å; F374-I377 HydrophobicContact CD1-CD1 4.45Å; F374-I377 PolarHBondContact O-N 2.85Å; F374-P378 WeakPolarHBondContact O-CD 3.41Å
375Y86.9Confident85.3Confident43 Ų4344.8 Ų44.817%0.16924%0.235CC..Hα-helixtrans-67.8-31.5175.8-80-74.8000113M127 P131 L371 A372 I373 I377 P378 A379 L384 Y387M127-Y375 WeakPolarHBondContact O-CE2 3.42Å; M127-Y375 PolarHBondContact O-OH 3.33Å; P131-Y375 HydrophobicContact CB-CD2 3.71Å; P131-Y375 HydrophobicContact CB-CE2 3.76Å; P131-Y375 HydrophobicContact CG-CE2 4.49Å; L371-Y375 WeakPolarHBondContact O-CD2 3.17Å; L371-Y375 PolarHBondContact O-N 3.45Å; A372-Y375 PolarHBondContact O-N 2.82Å; I373-Y375 VanDerWaalsContact C-N 3.31Å; I373-Y375 PolarHBondContact O-N 3.06Å; Y375-I377 VanDerWaalsContact C-N 3.31Å; Y375-I377 PolarHBondContact O-N 2.8Å; Y375-P378 WeakPolarHBondContact O-CD 3.32Å; Y375-A379 WeakPolarHBondContact O-CB 3.5Å; Y375-A379 PolarHBondContact O-N 3.09Å; Y375-L384 HydrophobicContact CD1-CD1 3.98Å; Y375-Y387 HydrophobicContact CE1-CE1 4.01Å
376I86.9Confident85.5Confident5 Ų544.6 Ų44.63%0.02623%0.234CC..Hα-helixtrans-64.4-32.6178.8-72.5169.4000112.6A135 L139 K161 I168 A372 I373 A379A135-I376 HydrophobicContact CB-CG1 3.93Å; L139-I376 HydrophobicContact CD2-CG2 4.22Å; L139-I376 HydrophobicContact CG-CG1 4.35Å; K161-I376 HydrophobicContact CB-CG2 3.85Å; K161-I376 WeakPolarHBondContact CE-O 3.4Å; K161-I376 HydrophobicContact CG-CG2 3.83Å; I168-I376 HydrophobicContact CD1-CD1 3.37Å; I168-I376 HydrophobicContact CD1-CG1 4.5Å; I168-I376 HydrophobicContact CG1-CD1 4.35Å; A372-I376 WeakPolarHBondContact O-CG1 3.33Å; A372-I376 PolarHBondContact O-N 3.49Å; I373-I376 PolarHBondContact O-N 3.17Å; I376-A379 PolarHBondContact O-N 3.19Å
377I82.9Confident85.5Confident110 Ų11043 Ų4356%0.56422%0.224SC*.THydrogen-bonded Turntrans-61-55.3-173.9-62.2167.1000111.9K161 F374 Y375K161-I377 PolarHBondContact NZ-O 2.97Å; F374-I377 HydrophobicContact CD1-CD1 4.45Å; F374-I377 PolarHBondContact O-N 2.85Å; Y375-I377 VanDerWaalsContact C-N 3.31Å; Y375-I377 PolarHBondContact O-N 2.8Å
378P79.9Confident85.6Confident105 Ų10540.1 Ų40.168%0.68221%0.212SC*.THydrogen-bonded Turntrans-84.4-13.2177.934.7-37.4000113.8F374 Y375F374-P378 WeakPolarHBondContact O-CD 3.41Å; Y375-P378 WeakPolarHBondContact O-CD 3.32Å
379A68.6Low85.7Confident14 Ų1440 Ų4012%0.11621%0.211CC..  trans-71.4136.1-164.400000114.7L139 Y375 I376 L384L139-A379 HydrophobicContact CD1-CB 4.1Å; Y375-A379 WeakPolarHBondContact O-CB 3.5Å; Y375-A379 PolarHBondContact O-N 3.09Å; I376-A379 PolarHBondContact O-N 3.19Å; A379-L384 HydrophobicContact CB-CB 4.44Å; A379-L384 HydrophobicContact CB-CD2 3.89Å
380D83.2Confident85.8Confident84 Ų8440.2 Ų40.245%0.44921%0.21SC..  trans-102.1141.1147.2171.843.5000108.7N382 T383 L384D380-N382 VanDerWaalsContact C-N 3.33Å; D380-N382 PolarHBondContact O-N 3.24Å; D380-T383 HydrophobicContact CB-CG2 4.2Å; D380-T383 PolarHBondContact O-N 3.08Å; D380-T383 PolarHBondContact O-OG1 3.27Å; D380-L384 WeakPolarHBondContact O-CB 3.06Å; D380-L384 PolarHBondContact O-N 2.92Å
381I82.9Confident85.9Confident17 Ų1735.7 Ų35.79%0.08719%0.187CC..Hα-helixtrans-58.2-45.4-172-66.6174.8000110.9I56 I136 L139 E143 L384 I385I56-I381 HydrophobicContact CD1-CD1 4.42Å; I56-I381 HydrophobicContact CD1-CG2 4.41Å; I56-I381 HydrophobicContact CG2-CG2 4.01Å; I136-I381 HydrophobicContact CG2-CG2 4.27Å; L139-I381 HydrophobicContact CB-CD1 3.96Å; L139-I381 HydrophobicContact CB-CG1 3.89Å; L139-I381 HydrophobicContact CD1-CG1 4.11Å; E143-I381 WeakPolarHBondContact OE2-CD1 3.36Å; I381-L384 PolarHBondContact O-N 3.1Å; I381-I385 HydrophobicContact CG2-CD1 3.78Å; I381-I385 HydrophobicContact CG2-CG1 4.44Å; I381-I385 VanDerWaalsContact O-CG1 3.31Å; I381-I385 WeakPolarHBondContact O-CG1 3.29Å; I381-I385 PolarHBondContact O-N 3.25Å
382N83.9Confident85.8Confident43 Ų4335 Ų3523%0.2318%0.183CC..Hα-helixtrans-66.2-45.7-177.6-69.1-47.5000111.8S60 D380 L384 I385 N386S60-N382 PolarHBondContact OG-OD1 3.15Å; D380-N382 VanDerWaalsContact C-N 3.33Å; D380-N382 PolarHBondContact O-N 3.24Å; N382-L384 VanDerWaalsContact C-N 3.26Å; N382-L384 PolarHBondContact O-N 3.08Å; N382-I385 PolarHBondContact O-N 3.49Å; N382-N386 VanDerWaalsContact O-CG 3.3Å; N382-N386 PolarHBondContact O-N 3.47Å
383T85.8Confident85.8Confident55 Ų5536 Ų3634%0.33719%0.187SC..Hα-helixtrans-61.6-36.9176.764.70000112D380 N386 Y387D380-T383 HydrophobicContact CB-CG2 4.2Å; D380-T383 PolarHBondContact O-N 3.08Å; D380-T383 PolarHBondContact O-OG1 3.27Å; T383-N386 PolarHBondContact O-N 2.94Å; T383-Y387 WeakPolarHBondContact O-CB 3.24Å; T383-Y387 PolarHBondContact O-N 3.27Å
384L86.6Confident85.9Confident10 Ų1034.9 Ų34.95%0.05219%0.187CC..Hα-helixtrans-72.6-36.2179-164.362.1000111.8A135 I136 Y375 A379 D380 I381 N382 Y387 F388A135-L384 HydrophobicContact CB-CD2 3.9Å; I136-L384 HydrophobicContact CD1-CB 4.36Å; I136-L384 HydrophobicContact CD1-CD2 4.39Å; I136-L384 HydrophobicContact CD1-CG 4.03Å; I136-L384 HydrophobicContact CG1-CB 4.01Å; I136-L384 HydrophobicContact CG1-CD2 3.56Å; I136-L384 HydrophobicContact CG1-CG 3.69Å; Y375-L384 HydrophobicContact CD1-CD1 3.98Å; A379-L384 HydrophobicContact CB-CB 4.44Å; A379-L384 HydrophobicContact CB-CD2 3.89Å; D380-L384 WeakPolarHBondContact O-CB 3.06Å; D380-L384 PolarHBondContact O-N 2.92Å; I381-L384 PolarHBondContact O-N 3.1Å; N382-L384 VanDerWaalsContact C-N 3.26Å; N382-L384 PolarHBondContact O-N 3.08Å; L384-Y387 HydrophobicContact CD1-CD1 4.32Å; L384-Y387 PolarHBondContact O-N 2.68Å; L384-F388 VanDerWaalsContact O-CB 3.28Å; L384-F388 WeakPolarHBondContact O-CB 3.49Å; L384-F388 PolarHBondContact O-N 3.41Å
385I88Confident85.9Confident0 Ų029.1 Ų29.10%016%0.162CC..Hα-helixtrans-62.5-44.9171-71.6167.9000110.5I56 I136 W240 I381 N382 F388 S389I56-I385 HydrophobicContact CG2-CD1 4.48Å; I136-I385 HydrophobicContact CD1-CG1 3.84Å; I136-I385 HydrophobicContact CG1-CG1 4.31Å; I136-I385 HydrophobicContact CG2-CD1 4.26Å; I136-I385 HydrophobicContact CG2-CG1 3.98Å; W240-I385 HydrophobicContact CB-CG2 3.9Å; W240-I385 HydrophobicContact CD2-CG1 4.26Å; W240-I385 HydrophobicContact CG-CD1 4.24Å; W240-I385 HydrophobicContact CG-CG1 4.17Å; W240-I385 HydrophobicContact CG-CG2 4.17Å; I381-I385 HydrophobicContact CG2-CD1 3.78Å; I381-I385 HydrophobicContact CG2-CG1 4.44Å; I381-I385 VanDerWaalsContact O-CG1 3.31Å; I381-I385 WeakPolarHBondContact O-CG1 3.29Å; I381-I385 PolarHBondContact O-N 3.25Å; N382-I385 PolarHBondContact O-N 3.49Å; I385-F388 PolarHBondContact O-N 2.76Å; I385-S389 WeakPolarHBondContact O-CB 3.41Å; I385-S389 PolarHBondContact O-N 3.11Å; I385-S389 PolarHBondContact O-OG 2.98Å
386N86.6Confident85.9Confident1 Ų127.4 Ų27.41%0.00516%0.155CC..Hα-helixtrans-61.5-45.9176.9-69-12.4000111.1N382 T383 S389 F390 Y447N382-N386 VanDerWaalsContact O-CG 3.3Å; N382-N386 PolarHBondContact O-N 3.47Å; T383-N386 PolarHBondContact O-N 2.94Å; N386-S389 PolarHBondContact O-N 3.34Å; N386-F390 WeakPolarHBondContact O-CB 3.15Å; N386-F390 PolarHBondContact O-N 3.2Å; N386-Y447 HydrophobicContact CB-CE1 4.28Å
387Y86.8Confident85.9Confident23 Ų2327.5 Ų27.59%0.0916%0.157CC..Hα-helixtrans-59.5-47.7176.9-179.2-104.6000112.5V128 Y375 T383 L384 A391 A446 C450V128-Y387 HydrophobicContact CB-CE1 4.32Å; V128-Y387 HydrophobicContact CG1-CD1 4.04Å; V128-Y387 HydrophobicContact CG1-CE1 3.3Å; V128-Y387 HydrophobicContact CG2-CE1 4.28Å; V128-Y387 WeakPolarHBondContact CG2-OH 3.42Å; Y375-Y387 HydrophobicContact CE1-CE1 4.01Å; T383-Y387 WeakPolarHBondContact O-CB 3.24Å; T383-Y387 PolarHBondContact O-N 3.27Å; L384-Y387 HydrophobicContact CD1-CD1 4.32Å; L384-Y387 PolarHBondContact O-N 2.68Å; Y387-A391 PolarHBondContact O-N 2.95Å; Y387-A446 HydrophobicContact CD2-CB 4.28Å; Y387-A446 WeakPolarHBondContact CD2-O 3.41Å; Y387-C450 HydrophobicContact CD2-CB 3.73Å; Y387-C450 VanDerWaalsContact CE2-CA 3.46Å; Y387-C450 HydrophobicContact CE2-CB 3.35Å
388F89.3Confident86.3Confident5 Ų524.5 Ų24.52%0.02214%0.142CC..Hα-helixtrans-62.5-49.7176.6169.8-92.8000111.5L129 I136 W240 L384 I385 F390 A391 Q392L129-F388 HydrophobicContact CB-CD2 4.26Å; L129-F388 HydrophobicContact CB-CE2 3.98Å; L129-F388 HydrophobicContact CD2-CD2 3.7Å; L129-F388 HydrophobicContact CD2-CE2 3.85Å; L129-F388 HydrophobicContact CD2-CG 4.4Å; L129-F388 WeakPolarHBondContact O-CE2 3.35Å; I136-F388 HydrophobicContact CD1-CB 4.25Å; W240-F388 AromaticContact CE3-CD1 3.65Å; W240-F388 HydrophobicContact CE3-CD1 3.65Å; W240-F388 AromaticContact CE3-CE1 3.59Å; W240-F388 HydrophobicContact CE3-CE1 3.59Å; W240-F388 HydrophobicContact CE3-CG 4.49Å; W240-F388 HydrophobicContact CE3-CZ 4.37Å; W240-F388 AromaticContact CZ3-CD1 3.77Å; W240-F388 HydrophobicContact CZ3-CD1 3.77Å; W240-F388 AromaticContact CZ3-CE1 3.62Å; W240-F388 HydrophobicContact CZ3-CE1 3.62Å; W240-F388 HydrophobicContact CZ3-CE2 4.42Å; W240-F388 HydrophobicContact CZ3-CG 4.25Å; W240-F388 AromaticContact CZ3-CZ 3.96Å; W240-F388 HydrophobicContact CZ3-CZ 3.96Å; L384-F388 VanDerWaalsContact O-CB 3.28Å; L384-F388 WeakPolarHBondContact O-CB 3.49Å; L384-F388 PolarHBondContact O-N 3.41Å; I385-F388 PolarHBondContact O-N 2.76Å; F388-F390 VanDerWaalsContact C-N 3.32Å; F388-F390 PolarHBondContact O-N 2.92Å; F388-A391 PolarHBondContact O-N 3.32Å; F388-Q392 HydrophobicContact CE1-CB 4.32Å; F388-Q392 HydrophobicContact CE1-CG 4.41Å; F388-Q392 HydrophobicContact CZ-CB 4.45Å; F388-Q392 HydrophobicContact CZ-CG 4.34Å; F388-Q392 WeakPolarHBondContact O-CB 3.41Å; F388-Q392 PolarHBondContact O-N 3.44Å
389S88.9Confident86.7Confident3 Ų319.5 Ų19.52%0.02111%0.11CC..Hα-helixtrans-63.5-40.2-174.6-60.30000111.4I385 N386 Q392 W393I385-S389 WeakPolarHBondContact O-CB 3.41Å; I385-S389 PolarHBondContact O-N 3.11Å; I385-S389 PolarHBondContact O-OG 2.98Å; N386-S389 PolarHBondContact O-N 3.34Å; S389-Q392 PolarHBondContact O-N 3.46Å; S389-W393 WeakPolarHBondContact O-CB 3.4Å; S389-W393 VanDerWaalsContact O-CD1 3.25Å; S389-W393 PolarHBondContact O-N 3.25Å
390F89.1Confident87.5Confident9 Ų918.9 Ų18.94%0.03911%0.105CC..Hα-helixtrans-58.3-51.7176.2177-98.4000112.5Y236 N386 F388 A394 V435 I439 Y447 C450Y236-F390 WeakPolarHBondContact OH-CA 3.44Å; N386-F390 WeakPolarHBondContact O-CB 3.15Å; N386-F390 PolarHBondContact O-N 3.2Å; F388-F390 VanDerWaalsContact C-N 3.32Å; F388-F390 PolarHBondContact O-N 2.92Å; F390-A394 PolarHBondContact O-N 2.98Å; F390-V435 HydrophobicContact CD2-CG1 4.45Å; F390-V435 HydrophobicContact CE2-CG1 3.72Å; F390-V435 HydrophobicContact CZ-CG1 4.24Å; F390-I439 HydrophobicContact CE2-CD1 3.72Å; F390-I439 HydrophobicContact CE2-CG1 4.07Å; F390-I439 HydrophobicContact CZ-CD1 4.04Å; F390-Y447 HydrophobicContact CB-CD1 3.78Å; F390-Y447 HydrophobicContact CB-CE1 3.9Å; F390-Y447 HydrophobicContact CD1-CD1 4.27Å; F390-Y447 AromaticContact CD2-CD1 3.81Å; F390-Y447 HydrophobicContact CD2-CD1 3.81Å; F390-Y447 HydrophobicContact CD2-CE1 4.3Å; F390-Y447 HydrophobicContact CD2-CG 4.47Å; F390-Y447 HydrophobicContact CE2-CD1 4.49Å; F390-Y447 AromaticContact CG-CD1 3.68Å; F390-Y447 HydrophobicContact CG-CD1 3.68Å; F390-Y447 HydrophobicContact CG-CE1 4.23Å; F390-C450 HydrophobicContact CD1-CB 3.87Å; F390-C450 HydrophobicContact CE1-CB 4.16Å
391A90.3Very high87.8Confident0 Ų018.1 Ų18.10%010%0.1CC..Hα-helixtrans-62.5-45.7177.600000111.8T124 V128 L129 Y387 F388 A394 F395T124-A391 HydrophobicContact CG2-CB 4.13Å; V128-A391 HydrophobicContact CG1-CB 4.47Å; L129-A391 HydrophobicContact CD2-CB 3.64Å; L129-A391 HydrophobicContact CG-CB 4.45Å; Y387-A391 PolarHBondContact O-N 2.95Å; F388-A391 PolarHBondContact O-N 3.32Å; A391-A394 PolarHBondContact O-N 3.43Å; A391-F395 VanDerWaalsContact O-CD2 3.25Å; A391-F395 WeakPolarHBondContact O-CD2 3.33Å; A391-F395 PolarHBondContact O-N 2.69Å
392Q88.6Confident88.1Confident14 Ų1417.3 Ų17.37%0.06510%0.096CC..Hα-helixtrans-63.3-47.3-176.1-171.675.2-6900111.3L129 F388 S389 A394 F395 Y396L129-Q392 HydrophobicContact CD2-CB 3.96Å; F388-Q392 HydrophobicContact CE1-CB 4.32Å; F388-Q392 HydrophobicContact CE1-CG 4.41Å; F388-Q392 HydrophobicContact CZ-CB 4.45Å; F388-Q392 HydrophobicContact CZ-CG 4.34Å; F388-Q392 WeakPolarHBondContact O-CB 3.41Å; F388-Q392 PolarHBondContact O-N 3.44Å; S389-Q392 PolarHBondContact O-N 3.46Å; Q392-A394 VanDerWaalsContact C-N 3.31Å; Q392-A394 PolarHBondContact O-N 2.85Å; Q392-F395 PolarHBondContact O-N 3.17Å; Q392-F395 VanDerWaalsContact O-N 3.15Å; Q392-Y396 VanDerWaalsContact CD-CZ 3.41Å; Q392-Y396 VanDerWaalsContact CD-OH 3.3Å; Q392-Y396 HydrophobicContact CG-CD1 4.27Å; Q392-Y396 HydrophobicContact CG-CD2 4.04Å; Q392-Y396 HydrophobicContact CG-CE1 3.71Å; Q392-Y396 HydrophobicContact CG-CE2 3.46Å; Q392-Y396 VanDerWaalsContact CG-CE2 3.46Å; Q392-Y396 HydrophobicContact CG-CG 4.44Å; Q392-Y396 WeakPolarHBondContact CG-OH 3.01Å; Q392-Y396 PolarHBondContact NE2-OH 3.36Å; Q392-Y396 PolarHBondContact O-N 3.37Å
393W88.8Confident88.3Confident22 Ų2215.4 Ų15.48%0.0839%0.086CC..Hα-helixtrans-67.1-30.3-178.9-84.1100000113.3L239 S389 Y396 G397 S431 L434 V435L239-W393 HydrophobicContact CB-CZ2 4.22Å; L239-W393 HydrophobicContact CD1-CH2 4.33Å; L239-W393 HydrophobicContact CD1-CZ2 3.48Å; L239-W393 VanDerWaalsContact CD1-CZ2 3.48Å; L239-W393 HydrophobicContact CD2-CZ2 3.86Å; L239-W393 HydrophobicContact CG-CZ2 4.02Å; S389-W393 WeakPolarHBondContact O-CB 3.4Å; S389-W393 VanDerWaalsContact O-CD1 3.25Å; S389-W393 PolarHBondContact O-N 3.25Å; W393-Y396 HydrophobicContact CD2-CD2 4.18Å; W393-Y396 HydrophobicContact CE3-CD2 4.26Å; W393-Y396 HydrophobicContact CZ2-CD2 4.39Å; W393-Y396 HydrophobicContact CZ3-CD2 4.46Å; W393-G397 PolarHBondContact O-N 2.98Å; W393-S431 PolarHBondContact O-OG 3.31Å; W393-L434 HydrophobicContact CD2-CD1 3.58Å; W393-L434 HydrophobicContact CE3-CD1 3.8Å; W393-L434 HydrophobicContact CG-CB 4.49Å; W393-L434 HydrophobicContact CG-CD1 4.05Å; W393-L434 HydrophobicContact CH2-CD1 4.29Å; W393-L434 HydrophobicContact CZ2-CD1 4.14Å; W393-L434 HydrophobicContact CZ3-CD1 4.12Å; W393-V435 HydrophobicContact CB-CG2 4.41Å
394A89.8Confident88.4Confident36 Ų3614.4 Ų14.430%0.2988%0.078SC..Hα-helixtrans-61.8-43.9171.500000111.8F390 A391 Q392 G397 L398 V435F390-A394 PolarHBondContact O-N 2.98Å; A391-A394 PolarHBondContact O-N 3.43Å; Q392-A394 VanDerWaalsContact C-N 3.31Å; Q392-A394 PolarHBondContact O-N 2.85Å; A394-G397 PolarHBondContact O-N 3.31Å; A394-L398 PolarHBondContact O-N 2.83Å; A394-V435 HydrophobicContact CB-CG2 4.14Å
395F89.4Confident88.5Confident13 Ų1316 Ų166%0.0579%0.088CC..Hα-helixtrans-76.4-31178-73.5-69.1000113.7L109 Y121 T124 A391 Q392 G397 L398 T399 I454L109-F395 HydrophobicContact CD1-CD1 4.36Å; Y121-F395 HydrophobicContact CD2-CB 3.95Å; Y121-F395 AromaticContact CD2-CD1 3.66Å; Y121-F395 HydrophobicContact CD2-CD1 3.66Å; Y121-F395 HydrophobicContact CD2-CD2 4.27Å; Y121-F395 HydrophobicContact CD2-CE1 4.2Å; Y121-F395 AromaticContact CD2-CG 3.69Å; Y121-F395 HydrophobicContact CD2-CG 3.69Å; Y121-F395 HydrophobicContact CE2-CB 4.21Å; Y121-F395 HydrophobicContact CE2-CG 4.36Å; Y121-F395 HydrophobicContact CG-CD1 4.34Å; T124-F395 HydrophobicContact CG2-CE2 3.71Å; A391-F395 VanDerWaalsContact O-CD2 3.25Å; A391-F395 WeakPolarHBondContact O-CD2 3.33Å; A391-F395 PolarHBondContact O-N 2.69Å; Q392-F395 PolarHBondContact O-N 3.17Å; Q392-F395 VanDerWaalsContact O-N 3.15Å; F395-G397 VanDerWaalsContact C-N 3.34Å; F395-L398 HydrophobicContact CD1-CD2 4.26Å; F395-L398 HydrophobicContact CE1-CD2 4.49Å; F395-L398 PolarHBondContact O-N 3.31Å; F395-T399 WeakPolarHBondContact O-CB 3.43Å; F395-T399 PolarHBondContact O-N 3.07Å; F395-T399 PolarHBondContact O-OG1 3.36Å; F395-I454 HydrophobicContact CZ-CG2 4.45Å
396Y87.3Confident88.5Confident6 Ų616 Ų162%0.0249%0.088CC..Hα-helixtrans-62.9-41.8169.8-69.9-7.4000111.1Y92 E105 D243 W245 N246 Q392 W393 T399 T400Y92-Y396 WeakPolarHBondContact OH-CD1 3.41Å; E105-Y396 WeakPolarHBondContact OE1-CD1 3.18Å; E105-Y396 WeakPolarHBondContact OE1-CE1 3.44Å; D243-Y396 PolarHBondContact OD1-OH 3.41Å; D243-Y396 VanDerWaalsContact OD1-OH 3.12Å; W245-Y396 HydrophobicContact CZ2-CD2 4.07Å; W245-Y396 AromaticContact CZ2-CE2 3.74Å; W245-Y396 HydrophobicContact CZ2-CE2 3.74Å; W245-Y396 AromaticContact CZ2-CZ 3.98Å; N246-Y396 WeakPolarHBondContact ND2-CE1 3.43Å; N246-Y396 PolarHBondContact ND2-OH 2.95Å; N246-Y396 VanDerWaalsContact ND2-OH 3.08Å; Q392-Y396 VanDerWaalsContact CD-CZ 3.41Å; Q392-Y396 VanDerWaalsContact CD-OH 3.3Å; Q392-Y396 HydrophobicContact CG-CD1 4.27Å; Q392-Y396 HydrophobicContact CG-CD2 4.04Å; Q392-Y396 HydrophobicContact CG-CE1 3.71Å; Q392-Y396 HydrophobicContact CG-CE2 3.46Å; Q392-Y396 VanDerWaalsContact CG-CE2 3.46Å; Q392-Y396 HydrophobicContact CG-CG 4.44Å; Q392-Y396 WeakPolarHBondContact CG-OH 3.01Å; Q392-Y396 PolarHBondContact NE2-OH 3.36Å; Q392-Y396 PolarHBondContact O-N 3.37Å; W393-Y396 HydrophobicContact CD2-CD2 4.18Å; W393-Y396 HydrophobicContact CE3-CD2 4.26Å; W393-Y396 HydrophobicContact CZ2-CD2 4.39Å; W393-Y396 HydrophobicContact CZ3-CD2 4.46Å; Y396-T399 PolarHBondContact O-N 3.17Å; Y396-T400 WeakPolarHBondContact O-CG2 3.28Å; Y396-T400 PolarHBondContact O-N 3.31Å; Y396-T400 PolarHBondContact O-OG1 3.38Å
397G88Confident88.4Confident8 Ų817.5 Ų17.58%0.0829%0.094CC..Hα-helixtrans-59.9-45.3171.800000112.3W393 A394 F395 T399 T400 L401 S431W393-G397 PolarHBondContact O-N 2.98Å; A394-G397 PolarHBondContact O-N 3.31Å; F395-G397 VanDerWaalsContact C-N 3.34Å; G397-T399 PolarHBondContact O-N 3.27Å; G397-T400 PolarHBondContact O-N 3.18Å; G397-T400 PolarHBondContact O-OG1 3.17Å; G397-L401 WeakPolarHBondContact O-CB 3.14Å; G397-L401 PolarHBondContact O-N 3.41Å; G397-S431 WeakPolarHBondContact CA-OG 3.01Å; G397-S431 PolarHBondContact N-OG 3.31Å
398L90.2Very high88.4Confident47 Ų4722.7 Ų22.725%0.24612%0.117CC..Hα-helixtrans-66.3-37.2179.3-166.359.1000112.7L109 F113 V117 A394 F395 L401 A402L109-L398 HydrophobicContact CD2-CB 4.32Å; L109-L398 HydrophobicContact CD2-CD2 4.11Å; L109-L398 HydrophobicContact CD2-CG 3.76Å; F113-L398 HydrophobicContact CD2-CD1 4.28Å; F113-L398 HydrophobicContact CD2-CG 4.37Å; F113-L398 HydrophobicContact CE2-CD1 3.69Å; F113-L398 HydrophobicContact CE2-CG 3.99Å; F113-L398 HydrophobicContact CZ-CD1 4.05Å; V117-L398 HydrophobicContact CG1-CD2 3.31Å; V117-L398 HydrophobicContact CG1-CG 4.2Å; A394-L398 PolarHBondContact O-N 2.83Å; F395-L398 HydrophobicContact CD1-CD2 4.26Å; F395-L398 HydrophobicContact CE1-CD2 4.49Å; F395-L398 PolarHBondContact O-N 3.31Å; L398-L401 HydrophobicContact CD1-CD2 4.41Å; L398-L401 PolarHBondContact O-N 3.2Å; L398-A402 WeakPolarHBondContact O-CB 3.25Å; L398-A402 PolarHBondContact O-N 3.37Å
399T87.9Confident88.2Confident0 Ų027 Ų270%014%0.144CC..Hα-helixtrans-70.4-38.6177.6-57.20000111.7Y92 L95 E105 Y108 F395 Y396 G397 A402 L403Y92-T399 HydrophobicContact CE1-CG2 4.15Å; Y92-T399 HydrophobicContact CE2-CG2 3.9Å; L95-T399 HydrophobicContact CD1-CG2 3.61Å; E105-T399 HydrophobicContact CG-CG2 4.35Å; Y108-T399 HydrophobicContact CD2-CG2 3.97Å; F395-T399 WeakPolarHBondContact O-CB 3.43Å; F395-T399 PolarHBondContact O-N 3.07Å; F395-T399 PolarHBondContact O-OG1 3.36Å; Y396-T399 PolarHBondContact O-N 3.17Å; G397-T399 PolarHBondContact O-N 3.27Å; T399-A402 VanDerWaalsContact O-CB 3.29Å; T399-A402 WeakPolarHBondContact O-CB 3.36Å; T399-A402 PolarHBondContact O-N 2.85Å; T399-L403 PolarHBondContact O-N 2.92Å
400T87.3Confident88Confident1 Ų132.3 Ų32.31%0.00616%0.163CC..Hα-helixtrans-69.1-37.5173.752.50000111.9Y396 G397 A402 L403 I404 V427 T428Y396-T400 WeakPolarHBondContact O-CG2 3.28Å; Y396-T400 PolarHBondContact O-N 3.31Å; Y396-T400 PolarHBondContact O-OG1 3.38Å; G397-T400 PolarHBondContact O-N 3.18Å; G397-T400 PolarHBondContact O-OG1 3.17Å; T400-A402 VanDerWaalsContact C-N 3.31Å; T400-A402 PolarHBondContact O-N 3.48Å; T400-L403 WeakPolarHBondContact O-CB 3.34Å; T400-L403 PolarHBondContact O-N 3.1Å; T400-I404 PolarHBondContact O-N 3.27Å; T400-V427 HydrophobicContact CG2-CB 4.29Å; T400-V427 HydrophobicContact CG2-CG1 3.77Å; T400-T428 PolarHBondContact OG1-OG1 3.35Å
401L89.4Confident87.6Confident68 Ų6839 Ų3936%0.35619%0.192SC..Hα-helixtrans-61.9-39.6170.3-175.365.3000111.5F113 G397 L398 L403 I404 V405F113-L401 HydrophobicContact CZ-CD2 4.17Å; F113-L401 HydrophobicContact CZ-CG 4.16Å; G397-L401 WeakPolarHBondContact O-CB 3.14Å; G397-L401 PolarHBondContact O-N 3.41Å; L398-L401 HydrophobicContact CD1-CD2 4.41Å; L398-L401 PolarHBondContact O-N 3.2Å; L401-L403 VanDerWaalsContact C-N 3.27Å; L401-L403 PolarHBondContact O-N 3.46Å; L401-I404 WeakPolarHBondContact O-CB 3.27Å; L401-I404 PolarHBondContact O-N 3.28Å; L401-I404 VanDerWaalsContact O-N 3.1Å; L401-V405 HydrophobicContact CG-CG2 4.38Å; L401-V405 WeakPolarHBondContact O-CG2 3.19Å; L401-V405 PolarHBondContact O-N 3.03Å
402A88Confident87.1Confident0 Ų046.8 Ų46.80%023%0.234CC..Hα-helixtrans-56.9-40.9174.600000111.7L109 A112 F113 L398 T399 T400 V405 M406L109-A402 HydrophobicContact CD2-CB 4.34Å; A112-A402 HydrophobicContact CB-CB 3.56Å; F113-A402 HydrophobicContact CD2-CB 4.25Å; F113-A402 HydrophobicContact CE2-CB 3.66Å; F113-A402 HydrophobicContact CZ-CB 4.39Å; L398-A402 WeakPolarHBondContact O-CB 3.25Å; L398-A402 PolarHBondContact O-N 3.37Å; T399-A402 VanDerWaalsContact O-CB 3.29Å; T399-A402 WeakPolarHBondContact O-CB 3.36Å; T399-A402 PolarHBondContact O-N 2.85Å; T400-A402 VanDerWaalsContact C-N 3.31Å; T400-A402 PolarHBondContact O-N 3.48Å; A402-V405 PolarHBondContact O-N 2.69Å; A402-M406 HydrophobicContact CB-CE 4.23Å; A402-M406 WeakPolarHBondContact O-CB 3.46Å; A402-M406 WeakPolarHBondContact O-CE 3.31Å; A402-M406 WeakPolarHBondContact O-CG 3.07Å; A402-M406 PolarHBondContact O-N 3.33Å
403L87.5Confident86.6Confident3 Ų349.1 Ų49.12%0.01625%0.247CC..Hα-helixtrans-60.7-46.2174.8-172.2153.4000111.5C91 E94 L95 T399 T400 L401 M406 R407 V419 A424C91-L403 HydrophobicContact CB-CD1 3.58Å; C91-L403 WeakPolarHBondContact O-CD1 3.42Å; E94-L403 HydrophobicContact CB-CD1 4.13Å; E94-L403 HydrophobicContact CG-CD1 4.09Å; L95-L403 HydrophobicContact CD1-CB 4.32Å; L95-L403 HydrophobicContact CD1-CD1 4.5Å; L95-L403 HydrophobicContact CD2-CB 4.08Å; L95-L403 HydrophobicContact CD2-CD1 4.29Å; L95-L403 HydrophobicContact CD2-CG 4.27Å; L95-L403 HydrophobicContact CG-CB 4.32Å; L95-L403 HydrophobicContact CG-CD1 3.99Å; L95-L403 HydrophobicContact CG-CG 4.47Å; T399-L403 PolarHBondContact O-N 2.92Å; T400-L403 WeakPolarHBondContact O-CB 3.34Å; T400-L403 PolarHBondContact O-N 3.1Å; L401-L403 VanDerWaalsContact C-N 3.27Å; L401-L403 PolarHBondContact O-N 3.46Å; L403-M406 PolarHBondContact O-N 2.95Å; L403-R407 HydrophobicContact CD2-CG 4.2Å; L403-R407 WeakPolarHBondContact O-CG 2.91Å; L403-R407 PolarHBondContact O-N 3.11Å; L403-R407 VanDerWaalsContact O-N 3.11Å; L403-V419 HydrophobicContact CD1-CG2 4.25Å; L403-V419 HydrophobicContact CD2-CG2 4.46Å; L403-A424 HydrophobicContact CD2-CB 4.29Å
404I88.6Confident86.3Confident34 Ų3454.3 Ų54.317%0.17428%0.276CS..Hα-helixtrans-60.6-49.3178.1-61171000109.7T400 L401 M406 R407 F408 A424T400-I404 PolarHBondContact O-N 3.27Å; L401-I404 WeakPolarHBondContact O-CB 3.27Å; L401-I404 PolarHBondContact O-N 3.28Å; L401-I404 VanDerWaalsContact O-N 3.1Å; I404-M406 PolarHBondContact O-N 3.06Å; I404-R407 VanDerWaalsContact O-CB 3.26Å; I404-R407 WeakPolarHBondContact O-CB 3.48Å; I404-R407 PolarHBondContact O-N 2.63Å; I404-R407 VanDerWaalsContact O-N 3.08Å; I404-F408 HydrophobicContact CG2-CD2 4.49Å; I404-F408 HydrophobicContact CG2-CE2 4.01Å; I404-F408 WeakPolarHBondContact O-CD2 3.3Å; I404-A424 HydrophobicContact CD1-CB 4.09Å; I404-A424 HydrophobicContact CG1-CB 3.8Å
405V89.4Confident85.9Confident42 Ų4254.6 Ų54.626%0.25527%0.269SS..Hα-helixtrans-59.1-46.4178.6172.10000111.1F113 L401 A402 R407 F408 T409F113-V405 HydrophobicContact CE1-CG2 4.17Å; F113-V405 HydrophobicContact CZ-CG2 4.22Å; L401-V405 HydrophobicContact CG-CG2 4.38Å; L401-V405 WeakPolarHBondContact O-CG2 3.19Å; L401-V405 PolarHBondContact O-N 3.03Å; A402-V405 PolarHBondContact O-N 2.69Å; V405-R407 PolarHBondContact O-N 3.38Å; V405-F408 WeakPolarHBondContact O-CA 3.21Å; V405-F408 PolarHBondContact O-N 3.11Å; V405-T409 HydrophobicContact CG1-CG2 4.25Å; V405-T409 PolarHBondContact O-N 3.21Å; V405-T409 PolarHBondContact O-OG1 3Å
406M86.8Confident85.4Confident1 Ų156.9 Ų56.91%0.00529%0.286CS..Hα-helixtrans-64.4-20.3178.1-75.8-172.1-7300113.5L95 M98 I99 E111 A112 A402 L403 I404 F408 R410 R415L95-M406 HydrophobicContact CD2-CE 3.21Å; M98-M406 HydrophobicContact CE-CE 3.75Å; M98-M406 HydrophobicContact CE-SD 3.62Å; I99-M406 HydrophobicContact CD1-CE 4.49Å; I99-M406 HydrophobicContact CD1-SD 4.17Å; E111-M406 HydrophobicContact CB-SD 4.48Å; A112-M406 HydrophobicContact CB-CE 4.1Å; A112-M406 HydrophobicContact CB-CG 3.9Å; A112-M406 HydrophobicContact CB-SD 4.04Å; A402-M406 HydrophobicContact CB-CE 4.23Å; A402-M406 WeakPolarHBondContact O-CB 3.46Å; A402-M406 WeakPolarHBondContact O-CE 3.31Å; A402-M406 WeakPolarHBondContact O-CG 3.07Å; A402-M406 PolarHBondContact O-N 3.33Å; L403-M406 PolarHBondContact O-N 2.95Å; I404-M406 PolarHBondContact O-N 3.06Å; M406-F408 PolarHBondContact O-N 3.34Å; M406-R410 CarbonylContact O-C 3.48Å; M406-R410 PolarHBondContact O-N 3.43Å; M406-R410 VanDerWaalsContact O-N 3.14Å; M406-R415 PolarHBondContact O-NH2 2.59Å
407R85.1Confident85.1Confident33 Ų3357.8 Ų57.813%0.12529%0.291CS..Hα-helixtrans-65.8-29.3168.6-58.6-132157.6-175-1.2112.6E94 L403 I404 V405 K411 V419 M421E94-R407 IonicContact OE1-CZ 3.48Å; E94-R407 IonicContact OE1-NE 3.41Å; E94-R407 PolarHBondContact OE1-NE 2.92Å; E94-R407 IonicContact OE1-NH2 2.83Å; E94-R407 PolarHBondContact OE1-NH2 3.39Å; E94-R407 IonicContact OE2-CZ 3.89Å; E94-R407 IonicContact OE2-NH2 2.72Å; E94-R407 PolarHBondContact OE2-NH2 3.39Å; L403-R407 HydrophobicContact CD2-CG 4.2Å; L403-R407 WeakPolarHBondContact O-CG 2.91Å; L403-R407 PolarHBondContact O-N 3.11Å; L403-R407 VanDerWaalsContact O-N 3.11Å; I404-R407 VanDerWaalsContact O-CB 3.26Å; I404-R407 WeakPolarHBondContact O-CB 3.48Å; I404-R407 PolarHBondContact O-N 2.63Å; I404-R407 VanDerWaalsContact O-N 3.08Å; V405-R407 PolarHBondContact O-N 3.38Å; R407-K411 WeakPolarHBondContact O-CG 3.37Å; R407-V419 VanDerWaalsContact CZ-O 3.32Å; R407-V419 PolarHBondContact NH1-O 3.44Å; R407-V419 PolarHBondContact NH2-O 2.9Å; R407-M421 HydrophobicContact CB-CE 4.13Å; R407-M421 HydrophobicContact CG-CE 4.32Å
408F87.3Confident84.7Confident131 Ų13164.6 Ų64.658%0.57532%0.319SS*.Hα-helixtrans-95.2-40.3-178.8-64.9-77.9000112.5I404 V405 M406 K411 M421I404-F408 HydrophobicContact CG2-CD2 4.49Å; I404-F408 HydrophobicContact CG2-CE2 4.01Å; I404-F408 WeakPolarHBondContact O-CD2 3.3Å; V405-F408 WeakPolarHBondContact O-CA 3.21Å; V405-F408 PolarHBondContact O-N 3.11Å; M406-F408 PolarHBondContact O-N 3.34Å; F408-K411 WeakPolarHBondContact O-CE 3.4Å; F408-M421 HydrophobicContact CE2-CE 4.33Å; F408-M421 HydrophobicContact CZ-CE 4.16Å; F408-M421 HydrophobicContact CZ-SD 4.42Å
409T85.6Confident84.3Confident96 Ų9662.7 Ų62.759%0.58931%0.309SS*.Hα-helixtrans-85.1-33.4-176.245.40000114.3V405V405-T409 HydrophobicContact CG1-CG2 4.25Å; V405-T409 PolarHBondContact O-N 3.21Å; V405-T409 PolarHBondContact O-OG1 3Å
410R82.9Confident84Confident114 Ų11466.3 Ų66.343%0.4333%0.332SS..  trans-127.175.5-178.2-64.2-163.5-176.8-114.39.9112E111 M406 L413 R415E111-R410 IonicContact OE1-CZ 2.98Å; E111-R410 IonicContact OE1-NE 3.41Å; E111-R410 PolarHBondContact OE1-NE 3.48Å; E111-R410 IonicContact OE1-NH1 3.52Å; E111-R410 IonicContact OE1-NH2 3.81Å; E111-R410 PolarHBondContact OE1-NH2 3.46Å; M406-R410 CarbonylContact O-C 3.48Å; M406-R410 PolarHBondContact O-N 3.43Å; M406-R410 VanDerWaalsContact O-N 3.14Å; R410-L413 HydrophobicContact CB-CD1 3.61Å; R410-L413 HydrophobicContact CB-CG 4.21Å; R410-L413 HydrophobicContact CG-CD1 4.28Å; R410-R415 PolarHBondContact O-NH2 3.46Å
411K81.3Confident83.7Confident149 Ų14970.2 Ų70.265%0.64835%0.352SS*.THydrogen-bonded Turntrans-72.9-29.4-177.7-66.8179.1-176.6176.90113.5R407 F408 L413R407-K411 WeakPolarHBondContact O-CG 3.37Å; F408-K411 WeakPolarHBondContact O-CE 3.4Å; K411-L413 PolarHBondContact O-N 3.09Å
412D79.3Confident83.5Confident165 Ų16572.2 Ų72.288%0.88237%0.367SS*.THydrogen-bonded Turntrans-87.6-1.9-170.7-49.9-45000114.3
413L80.1Confident83.1Confident63 Ų6374 Ų7433%0.3338%0.376SS..SBendtrans-68.7133.1173.8-77.1167.8000110M98 R410 K411M98-L413 HydrophobicContact CG-CB 4.27Å; M98-L413 HydrophobicContact CG-CD1 4.25Å; M98-L413 HydrophobicContact SD-CB 4.27Å; M98-L413 HydrophobicContact SD-CD1 3.95Å; R410-L413 HydrophobicContact CB-CD1 3.61Å; R410-L413 HydrophobicContact CB-CG 4.21Å; R410-L413 HydrophobicContact CG-CD1 4.28Å; K411-L413 PolarHBondContact O-N 3.09Å
414D81.4Confident82.8Confident130 Ų13073.9 Ų73.970%0.69538%0.375SS*.  trans-64.6134.2172.7-171.116.5000110.3
415R81.9Confident82.6Confident42 Ų4273.4 Ų73.416%0.15838%0.379CS..  trans-128.187.7-175.2-63.7178.7-161.9-142.4-1.4109.4E94 M98 M406 R410 V417E94-R415 IonicContact OE1-NH1 3.24Å; E94-R415 PolarHBondContact OE1-NH1 3.07Å; M98-R415 HydrophobicContact SD-CG 4.32Å; M406-R415 PolarHBondContact O-NH2 2.59Å; R410-R415 PolarHBondContact O-NH2 3.46Å; R415-V417 PolarHBondContact O-N 3.12Å
416P79.1Confident82.4Confident62 Ų6275.5 Ų75.540%0.40339%0.388SS..SBendtrans-61.5-33.5-179.9-25.936.4000112.8Y259Y259-P416 HydrophobicContact CD1-CB 3.62Å; Y259-P416 HydrophobicContact CD1-CG 3.61Å; Y259-P416 HydrophobicContact CE1-CB 4.21Å; Y259-P416 HydrophobicContact CE1-CG 3.66Å; Y259-P416 HydrophobicContact CG-CB 4.18Å; Y259-P416 HydrophobicContact CG-CG 4.47Å
417V79.3Confident82.3Confident24 Ų2476.5 Ų76.515%0.14539%0.394CS..SBendtrans-117.3125.6174.5-1790000108.3L90 E94 T97 P263 R415L90-V417 HydrophobicContact CD2-CG1 4.44Å; E94-V417 WeakPolarHBondContact CB-O 3.18Å; E94-V417 VanDerWaalsContact CG-O 3.23Å; E94-V417 WeakPolarHBondContact CG-O 3.43Å; T97-V417 HydrophobicContact CG2-CG2 4.09Å; P263-V417 HydrophobicContact CG-CG2 4.34Å; R415-V417 PolarHBondContact O-N 3.12Å
418K79.4Confident82.4Confident152 Ų15276 Ų7666%0.66139%0.394SS*.  trans-125118.3-178.9-168.1176.6-176.4175.20110.7
419V81.9Confident82.5Confident6 Ų675.7 Ų75.74%0.03640%0.398CS..  trans-90.1150.4175-66.40000112.5S87 L90 E94 L403 R407S87-V419 WeakPolarHBondContact OG-CB 3.4Å; L90-V419 HydrophobicContact CB-CG1 3.82Å; L90-V419 WeakPolarHBondContact O-CG1 3.18Å; E94-V419 WeakPolarHBondContact OE2-CG2 3.37Å; E94-V419 PolarHBondContact OE2-N 3.26Å; L403-V419 HydrophobicContact CD1-CG2 4.25Å; L403-V419 HydrophobicContact CD2-CG2 4.46Å; R407-V419 VanDerWaalsContact CZ-O 3.32Å; R407-V419 PolarHBondContact NH1-O 3.44Å; R407-V419 PolarHBondContact NH2-O 2.9Å
420P83.2Confident82.6Confident76 Ų7672.6 Ų72.649%0.49438%0.379SS..  trans-60133.8168.1-23.532.6000112.2V422 I423P420-V422 VanDerWaalsContact C-N 3.27Å; P420-V422 PolarHBondContact O-N 3Å; P420-I423 HydrophobicContact CB-CD1 4Å; P420-I423 HydrophobicContact CB-CG1 4.21Å; P420-I423 HydrophobicContact CG-CD1 3.88Å; P420-I423 PolarHBondContact O-N 2.91Å; P420-I423 VanDerWaalsContact O-N 3.16Å
421M80.7Confident82.8Confident84 Ų8467.4 Ų67.441%0.41436%0.36SS..Hα-helixtrans-63.7-32-176.4-171.4-178.8-74.700113R407 F408 I423 A424 G425R407-M421 HydrophobicContact CB-CE 4.13Å; R407-M421 HydrophobicContact CG-CE 4.32Å; F408-M421 HydrophobicContact CE2-CE 4.33Å; F408-M421 HydrophobicContact CZ-CE 4.16Å; F408-M421 HydrophobicContact CZ-SD 4.42Å; M421-I423 PolarHBondContact O-N 3.4Å; M421-A424 PolarHBondContact O-N 2.89Å; M421-G425 PolarHBondContact O-N 3.32Å; M421-G425 VanDerWaalsContact O-N 3.09Å
422V83.8Confident83.2Confident110 Ų11063.2 Ų63.267%0.66735%0.349SS*.Hα-helixtrans-54.7-38.2176.8178.80000111P420 G425 I426P420-V422 VanDerWaalsContact C-N 3.27Å; P420-V422 PolarHBondContact O-N 3Å; V422-G425 PolarHBondContact O-N 3.44Å; V422-I426 HydrophobicContact CG1-CD1 3.98Å; V422-I426 WeakPolarHBondContact O-CG1 3.42Å; V422-I426 PolarHBondContact O-N 3.33Å
423I79.9Confident83.7Confident37 Ų3758.1 Ų58.119%0.1932%0.318CS..Hα-helixtrans-75.7-37.7-175.4-52171.5000110.8S87 P420 M421 G425 I426 V427S87-I423 VanDerWaalsContact CB-CB 3.47Å; S87-I423 WeakPolarHBondContact OG-CB 3.26Å; S87-I423 WeakPolarHBondContact OG-CD1 3.5Å; S87-I423 WeakPolarHBondContact OG-CG2 3.26Å; P420-I423 HydrophobicContact CB-CD1 4Å; P420-I423 HydrophobicContact CB-CG1 4.21Å; P420-I423 HydrophobicContact CG-CD1 3.88Å; P420-I423 PolarHBondContact O-N 2.91Å; P420-I423 VanDerWaalsContact O-N 3.16Å; M421-I423 PolarHBondContact O-N 3.4Å; I423-G425 VanDerWaalsContact C-N 3.28Å; I423-G425 PolarHBondContact O-N 3.49Å; I423-I426 PolarHBondContact O-N 2.95Å; I423-V427 WeakPolarHBondContact O-CG2 3.25Å; I423-V427 PolarHBondContact O-N 2.84Å
424A81.1Confident84Confident0 Ų055.1 Ų55.10%030%0.302CS..Hα-helixtrans-58.1-43.7170.800000110.9L403 I404 M421 V427 T428L403-A424 HydrophobicContact CD2-CB 4.29Å; I404-A424 HydrophobicContact CD1-CB 4.09Å; I404-A424 HydrophobicContact CG1-CB 3.8Å; M421-A424 PolarHBondContact O-N 2.89Å; A424-V427 PolarHBondContact O-N 3.09Å; A424-T428 PolarHBondContact O-N 3.3Å; A424-T428 PolarHBondContact O-OG1 2.99Å
425G84.9Confident84.3Confident25 Ų2550.2 Ų50.226%0.25828%0.277SS..Hα-helixtrans-60.8-43.9175.300000113.4M421 V422 I423 T428 L429M421-G425 PolarHBondContact O-N 3.32Å; M421-G425 VanDerWaalsContact O-N 3.09Å; V422-G425 PolarHBondContact O-N 3.44Å; I423-G425 VanDerWaalsContact C-N 3.28Å; I423-G425 PolarHBondContact O-N 3.49Å; G425-T428 PolarHBondContact O-N 3.31Å; G425-L429 WeakPolarHBondContact O-CG 3.43Å; G425-L429 PolarHBondContact O-N 2.88Å
426I86.2Confident84.5Confident86 Ų8652.9 Ų52.944%0.44129%0.293SS..Hα-helixtrans-60.9-46.2176.7-68.8165.3000110.9V422 I423 T428 L429 V430V422-I426 HydrophobicContact CG1-CD1 3.98Å; V422-I426 WeakPolarHBondContact O-CG1 3.42Å; V422-I426 PolarHBondContact O-N 3.33Å; I423-I426 PolarHBondContact O-N 2.95Å; I426-T428 VanDerWaalsContact C-N 3.34Å; I426-T428 PolarHBondContact O-N 3.29Å; I426-L429 PolarHBondContact O-N 3.38Å; I426-V430 HydrophobicContact CG2-CG2 4.33Å; I426-V430 WeakPolarHBondContact O-CG2 3.28Å; I426-V430 PolarHBondContact O-N 2.95Å
427V83.3Confident84.7Confident21 Ų2150 Ų5013%0.12728%0.275CS..Hα-helixtrans-64.9-39.7-179.8179.20000111.1T400 I423 A424 V430 S431T400-V427 HydrophobicContact CG2-CB 4.29Å; T400-V427 HydrophobicContact CG2-CG1 3.77Å; I423-V427 WeakPolarHBondContact O-CG2 3.25Å; I423-V427 PolarHBondContact O-N 2.84Å; A424-V427 PolarHBondContact O-N 3.09Å; V427-V430 PolarHBondContact O-N 3Å; V427-S431 WeakPolarHBondContact O-CB 3.43Å; V427-S431 PolarHBondContact O-N 3.29Å
428T87.2Confident84.6Confident23 Ų2348.8 Ų48.814%0.14127%0.268CS..Hα-helixtrans-62.7-42.5173.9-54.60000111.4T400 A424 G425 I426 S431 C432T400-T428 PolarHBondContact OG1-OG1 3.35Å; A424-T428 PolarHBondContact O-N 3.3Å; A424-T428 PolarHBondContact O-OG1 2.99Å; G425-T428 PolarHBondContact O-N 3.31Å; I426-T428 VanDerWaalsContact C-N 3.34Å; I426-T428 PolarHBondContact O-N 3.29Å; T428-S431 PolarHBondContact O-N 3.37Å; T428-C432 PolarHBondContact O-N 3.45Å; T428-C432 PolarHBondContact O-SG 2.97Å
429L89.5Confident84.8Confident124 Ų12445 Ų4565%0.64925%0.254SS*.Hα-helixtrans-63.1-42.7175.8-73.2172.4000112.6G425 I426 C432 Y433G425-L429 WeakPolarHBondContact O-CG 3.43Å; G425-L429 PolarHBondContact O-N 2.88Å; I426-L429 PolarHBondContact O-N 3.38Å; L429-C432 WeakPolarHBondContact O-CB 3.44Å; L429-C432 PolarHBondContact O-N 3.19Å; L429-Y433 PolarHBondContact O-N 3.39Å
430V87.9Confident84.8Confident32 Ų3250.4 Ų50.419%0.19428%0.281CS..Hα-helixtrans-63.8-42.4176171.70000110.8L81 I426 V427 C432 Y433 L434L81-V430 HydrophobicContact CD1-CG1 4.07Å; L81-V430 HydrophobicContact CD2-CG1 4Å; L81-V430 HydrophobicContact CD2-CG2 4.04Å; I426-V430 HydrophobicContact CG2-CG2 4.33Å; I426-V430 WeakPolarHBondContact O-CG2 3.28Å; I426-V430 PolarHBondContact O-N 2.95Å; V427-V430 PolarHBondContact O-N 3Å; V430-C432 PolarHBondContact O-N 3.37Å; V430-Y433 WeakPolarHBondContact O-CB 3.46Å; V430-Y433 PolarHBondContact O-N 3.06Å; V430-L434 HydrophobicContact CG1-CD1 4.02Å; V430-L434 HydrophobicContact CG1-CG 4.33Å; V430-L434 WeakPolarHBondContact O-CB 3.41Å; V430-L434 WeakPolarHBondContact O-CG 3.5Å; V430-L434 PolarHBondContact O-N 3.49Å
431S87.9Confident84.2Confident4 Ų449.8 Ų49.83%0.02827%0.274CS..Hα-helixtrans-59.8-44.6173.7165.70000111.6W393 G397 V427 T428 Y433 L434 V435W393-S431 PolarHBondContact O-OG 3.31Å; G397-S431 WeakPolarHBondContact CA-OG 3.01Å; G397-S431 PolarHBondContact N-OG 3.31Å; V427-S431 WeakPolarHBondContact O-CB 3.43Å; V427-S431 PolarHBondContact O-N 3.29Å; T428-S431 PolarHBondContact O-N 3.37Å; S431-Y433 VanDerWaalsContact C-N 3.35Å; S431-Y433 PolarHBondContact O-N 3.19Å; S431-L434 PolarHBondContact O-N 3.48Å; S431-V435 WeakPolarHBondContact O-CG2 3.48Å; S431-V435 PolarHBondContact O-N 2.86Å
432C89.8Confident83.6Confident61 Ų6150.3 Ų50.341%0.41227%0.274SS..Hα-helixtrans-60.2-43.4174.7-69.60000112.1T428 L429 V430 V435 L436T428-C432 PolarHBondContact O-N 3.45Å; T428-C432 PolarHBondContact O-SG 2.97Å; L429-C432 WeakPolarHBondContact O-CB 3.44Å; L429-C432 PolarHBondContact O-N 3.19Å; V430-C432 PolarHBondContact O-N 3.37Å; C432-V435 PolarHBondContact O-N 2.58Å; C432-L436 VanDerWaalsContact O-CB 3.32Å; C432-L436 WeakPolarHBondContact O-CB 3.34Å; C432-L436 VanDerWaalsContact O-CG 3.27Å; C432-L436 WeakPolarHBondContact O-CG 3.39Å; C432-L436 PolarHBondContact O-N 2.67Å
433Y88.5Confident83.3Confident58 Ų5849.8 Ų49.823%0.22727%0.273CS..Hα-helixtrans-59.3-49.2174.5163.7-108.2000111.4F228 L429 V430 S431 V435 L436 A437F228-Y433 HydrophobicContact CD1-CE2 4.05Å; F228-Y433 AromaticContact CD2-CE2 3.87Å; F228-Y433 HydrophobicContact CD2-CE2 3.87Å; F228-Y433 AromaticContact CE1-CD2 3.93Å; F228-Y433 HydrophobicContact CE1-CD2 3.93Å; F228-Y433 AromaticContact CE1-CE2 3.55Å; F228-Y433 HydrophobicContact CE1-CE2 3.55Å; F228-Y433 AromaticContact CE2-CD2 3.87Å; F228-Y433 HydrophobicContact CE2-CD2 3.87Å; F228-Y433 AromaticContact CE2-CE2 3.34Å; F228-Y433 HydrophobicContact CE2-CE2 3.34Å; F228-Y433 HydrophobicContact CG-CE2 4.22Å; F228-Y433 AromaticContact CZ-CD2 3.39Å; F228-Y433 HydrophobicContact CZ-CD2 3.39Å; F228-Y433 AromaticContact CZ-CE2 3.18Å; F228-Y433 HydrophobicContact CZ-CE2 3.18Å; F228-Y433 PolarHBondContact O-OH 3.37Å; L429-Y433 PolarHBondContact O-N 3.39Å; V430-Y433 WeakPolarHBondContact O-CB 3.46Å; V430-Y433 PolarHBondContact O-N 3.06Å; S431-Y433 VanDerWaalsContact C-N 3.35Å; S431-Y433 PolarHBondContact O-N 3.19Å; Y433-V435 VanDerWaalsContact C-N 3.3Å; Y433-V435 PolarHBondContact O-N 3.31Å; Y433-L436 PolarHBondContact O-N 3Å; Y433-A437 HydrophobicContact CD2-CB 3.84Å; Y433-A437 HydrophobicContact CE2-CB 3.5Å; Y433-A437 VanDerWaalsContact CE2-CB 3.5Å; Y433-A437 WeakPolarHBondContact O-CB 3.42Å; Y433-A437 PolarHBondContact O-N 3.39Å
434L86.6Confident83.1Confident1 Ų151 Ų511%0.00528%0.278CS..Hα-helixtrans-64-33.5-178.6-73.6178000112.7F235 Y236 L239 W393 V430 S431 P438F235-L434 HydrophobicContact CB-CD2 3.72Å; F235-L434 HydrophobicContact CG-CD2 4.38Å; Y236-L434 HydrophobicContact CD1-CD2 4.37Å; Y236-L434 HydrophobicContact CE1-CB 4.01Å; Y236-L434 HydrophobicContact CE1-CD2 4.33Å; Y236-L434 PolarHBondContact OH-O 2.95Å; L239-L434 HydrophobicContact CD1-CD1 3.66Å; W393-L434 HydrophobicContact CD2-CD1 3.58Å; W393-L434 HydrophobicContact CE3-CD1 3.8Å; W393-L434 HydrophobicContact CG-CB 4.49Å; W393-L434 HydrophobicContact CG-CD1 4.05Å; W393-L434 HydrophobicContact CH2-CD1 4.29Å; W393-L434 HydrophobicContact CZ2-CD1 4.14Å; W393-L434 HydrophobicContact CZ3-CD1 4.12Å; V430-L434 HydrophobicContact CG1-CD1 4.02Å; V430-L434 HydrophobicContact CG1-CG 4.33Å; V430-L434 WeakPolarHBondContact O-CB 3.41Å; V430-L434 WeakPolarHBondContact O-CG 3.5Å; V430-L434 PolarHBondContact O-N 3.49Å; S431-L434 PolarHBondContact O-N 3.48Å; L434-P438 WeakPolarHBondContact O-CD 3.28Å; L434-P438 WeakPolarHBondContact O-CG 3.37Å
435V87.9Confident83.1Confident26 Ų2660 Ų6016%0.15831%0.312CS..Hα-helixtrans-75.6-41.6175.8172.10000111.8F390 W393 A394 S431 C432 Y433 I439F390-V435 HydrophobicContact CD2-CG1 4.45Å; F390-V435 HydrophobicContact CE2-CG1 3.72Å; F390-V435 HydrophobicContact CZ-CG1 4.24Å; W393-V435 HydrophobicContact CB-CG2 4.41Å; A394-V435 HydrophobicContact CB-CG2 4.14Å; S431-V435 WeakPolarHBondContact O-CG2 3.48Å; S431-V435 PolarHBondContact O-N 2.86Å; C432-V435 PolarHBondContact O-N 2.58Å; Y433-V435 VanDerWaalsContact C-N 3.3Å; Y433-V435 PolarHBondContact O-N 3.31Å; V435-I439 WeakPolarHBondContact O-CD1 3.33Å; V435-I439 WeakPolarHBondContact O-CG1 3.19Å
436L85.9Confident82.7Confident98 Ų9859.7 Ų59.751%0.51331%0.307SS..Hα-helixtrans-82.1-40.7-173.8-67.9172.9000113.4C432 Y433 I439 I440C432-L436 VanDerWaalsContact O-CB 3.32Å; C432-L436 WeakPolarHBondContact O-CB 3.34Å; C432-L436 VanDerWaalsContact O-CG 3.27Å; C432-L436 WeakPolarHBondContact O-CG 3.39Å; C432-L436 PolarHBondContact O-N 2.67Å; Y433-L436 PolarHBondContact O-N 3Å; L436-I439 PolarHBondContact O-N 2.81Å; L436-I440 HydrophobicContact CB-CD1 4.34Å; L436-I440 WeakPolarHBondContact O-CG1 3.1Å; L436-I440 PolarHBondContact O-N 2.94Å; L436-I440 VanDerWaalsContact O-N 3.14Å
437A82.9Confident82.5Confident1 Ų156 Ų561%0.00829%0.287CS..Hα-helixtrans-59.8-44-173.500000113.4F228 Y433 I439 I440 D441F228-A437 HydrophobicContact CD1-CB 3.78Å; F228-A437 HydrophobicContact CE1-CB 3.52Å; F228-A437 HydrophobicContact CZ-CB 4.38Å; Y433-A437 HydrophobicContact CD2-CB 3.84Å; Y433-A437 HydrophobicContact CE2-CB 3.5Å; Y433-A437 VanDerWaalsContact CE2-CB 3.5Å; Y433-A437 WeakPolarHBondContact O-CB 3.42Å; Y433-A437 PolarHBondContact O-N 3.39Å; A437-I439 VanDerWaalsContact C-N 3.32Å; A437-I439 PolarHBondContact O-N 3.2Å; A437-I440 PolarHBondContact O-N 3.4Å; A437-D441 PolarHBondContact O-N 3.19Å
438P78.6Confident82.6Confident0 Ų059 Ų590%030%0.303CS..Hα-helixtrans-67.2-31.6177.7-21.535.3000113.2Y236 L434 K442 Y447Y236-P438 HydrophobicContact CE2-CB 4.23Å; Y236-P438 HydrophobicContact CE2-CG 3.65Å; L434-P438 WeakPolarHBondContact O-CD 3.28Å; L434-P438 WeakPolarHBondContact O-CG 3.37Å; P438-K442 CarbonylContact O-C 3.31Å; P438-K442 PolarHBondContact O-N 3.45Å; P438-K442 VanDerWaalsContact O-N 3.17Å; P438-Y447 HydrophobicContact CB-CE1 4.43Å; P438-Y447 HydrophobicContact CB-CE2 3.76Å
439I82.7Confident82.4Confident73 Ų7364.8 Ų64.837%0.37432%0.323SS..Hα-helixtrans-67.2-40.2176.9-63.4174.2000110.6F390 V435 L436 A437 P443F390-I439 HydrophobicContact CE2-CD1 3.72Å; F390-I439 HydrophobicContact CE2-CG1 4.07Å; F390-I439 HydrophobicContact CZ-CD1 4.04Å; V435-I439 WeakPolarHBondContact O-CD1 3.33Å; V435-I439 WeakPolarHBondContact O-CG1 3.19Å; L436-I439 PolarHBondContact O-N 2.81Å; A437-I439 VanDerWaalsContact C-N 3.32Å; A437-I439 PolarHBondContact O-N 3.2Å; I439-P443 WeakPolarHBondContact O-CB 3.44Å
440I81.4Confident82.2Confident118 Ų11858.9 Ų58.961%0.60529%0.292SS*.Hα-helixtrans-77.7-46.8-174.3-63.3165.4000111L436 A437L436-I440 HydrophobicContact CB-CD1 4.34Å; L436-I440 WeakPolarHBondContact O-CG1 3.1Å; L436-I440 PolarHBondContact O-N 2.94Å; L436-I440 VanDerWaalsContact O-N 3.14Å; A437-I440 PolarHBondContact O-N 3.4Å
441D70.7Confident82.1Confident64 Ų6459.6 Ų59.634%0.34230%0.296SS..Hα-helixtrans-88.7-36.5-170.2-85.126.5000113.4F228 G229 A437F228-D441 WeakPolarHBondContact CB-OD2 3.2Å; G229-D441 WeakPolarHBondContact CA-OD2 3.32Å; G229-D441 PolarHBondContact N-OD2 2.98Å; A437-D441 PolarHBondContact O-N 3.19Å
442K69.9Low82.1Confident94 Ų9464.1 Ų64.141%0.40932%0.319SS..  trans-142.671.9-178.2-70.6-172.1178.5-179.50111.2L233 P438 E444L233-K442 HydrophobicContact CD1-CD 3.81Å; P438-K442 CarbonylContact O-C 3.31Å; P438-K442 PolarHBondContact O-N 3.45Å; P438-K442 VanDerWaalsContact O-N 3.17Å; K442-E444 PolarHBondContact O-N 3.32Å
443P76.6Confident82Confident100 Ų10063.6 Ų63.665%0.64931%0.31SS*.  trans-65.2101.8179.425.6-32.9000110.8I439I439-P443 WeakPolarHBondContact O-CB 3.44Å
444E75.8Confident81.9Confident63 Ų6361.9 Ų61.929%0.29431%0.305SS..  trans-89.6149.4170-69.7-178.4-179.100111K442 A446 Y447K442-E444 PolarHBondContact O-N 3.32Å; E444-A446 HydrophobicContact CB-CB 4.39Å; E444-A446 PolarHBondContact O-N 3.31Å; E444-A446 VanDerWaalsContact O-N 3.08Å; E444-Y447 HydrophobicContact CB-CD2 4.15Å; E444-Y447 HydrophobicContact CB-CE2 4.04Å; E444-Y447 HydrophobicContact CG-CE2 4.48Å; E444-Y447 PolarHBondContact O-N 3.45Å; E444-Y447 VanDerWaalsContact O-N 3.1Å
445W81.3Confident81.9Confident187 Ų18767.5 Ų67.571%0.70833%0.329SS*.Hα-helixtrans-55.1-28.1173.9-64.6107.8000113Y447 L448 Y449W445-Y447 VanDerWaalsContact C-N 3.3Å; W445-Y447 PolarHBondContact O-N 3.38Å; W445-L448 HydrophobicContact CE3-CD2 4.06Å; W445-L448 HydrophobicContact CZ3-CD2 4.08Å; W445-L448 PolarHBondContact O-N 3.16Å; W445-Y449 HydrophobicContact CB-CD2 4.28Å; W445-Y449 HydrophobicContact CB-CE2 3.78Å; W445-Y449 WeakPolarHBondContact O-CD2 3.29Å; W445-Y449 PolarHBondContact O-N 3.15Å
446A76.5Confident82Confident19 Ų1967.8 Ų67.816%0.15733%0.333CS..Hα-helixtrans-55-42.3176.600000112.6Y387 E444 Y449 C450Y387-A446 HydrophobicContact CD2-CB 4.28Å; Y387-A446 WeakPolarHBondContact CD2-O 3.41Å; E444-A446 HydrophobicContact CB-CB 4.39Å; E444-A446 PolarHBondContact O-N 3.31Å; E444-A446 VanDerWaalsContact O-N 3.08Å; A446-Y449 PolarHBondContact O-N 3.38Å; A446-C450 VanDerWaalsContact O-CB 3.31Å; A446-C450 WeakPolarHBondContact O-CB 3.42Å; A446-C450 PolarHBondContact O-N 3.36Å
447Y82.5Confident81.9Confident8 Ų863.1 Ų63.13%0.03131%0.308CS..Hα-helixtrans-70.2-37.1-178.6-55.1-48.4000112.3L233 Y236 N386 F390 P438 E444 W445 C450 T451L233-Y447 WeakPolarHBondContact CD2-OH 3.27Å; Y236-Y447 HydrophobicContact CE2-CE1 4.24Å; N386-Y447 HydrophobicContact CB-CE1 4.28Å; F390-Y447 HydrophobicContact CB-CD1 3.78Å; F390-Y447 HydrophobicContact CB-CE1 3.9Å; F390-Y447 HydrophobicContact CD1-CD1 4.27Å; F390-Y447 AromaticContact CD2-CD1 3.81Å; F390-Y447 HydrophobicContact CD2-CD1 3.81Å; F390-Y447 HydrophobicContact CD2-CE1 4.3Å; F390-Y447 HydrophobicContact CD2-CG 4.47Å; F390-Y447 HydrophobicContact CE2-CD1 4.49Å; F390-Y447 AromaticContact CG-CD1 3.68Å; F390-Y447 HydrophobicContact CG-CD1 3.68Å; F390-Y447 HydrophobicContact CG-CE1 4.23Å; P438-Y447 HydrophobicContact CB-CE1 4.43Å; P438-Y447 HydrophobicContact CB-CE2 3.76Å; E444-Y447 HydrophobicContact CB-CD2 4.15Å; E444-Y447 HydrophobicContact CB-CE2 4.04Å; E444-Y447 HydrophobicContact CG-CE2 4.48Å; E444-Y447 PolarHBondContact O-N 3.45Å; E444-Y447 VanDerWaalsContact O-N 3.1Å; W445-Y447 VanDerWaalsContact C-N 3.3Å; W445-Y447 PolarHBondContact O-N 3.38Å; Y447-C450 PolarHBondContact O-N 3.5Å; Y447-T451 WeakPolarHBondContact O-CB 2.98Å; Y447-T451 PolarHBondContact O-N 3.36Å; Y447-T451 PolarHBondContact O-OG1 3.25Å
448L84.3Confident82Confident86 Ų8665.2 Ų65.245%0.4532%0.319SS..Hα-helixtrans-64.4-49.3174.7-177.567.5000110.7W445 C450 T451 I452W445-L448 HydrophobicContact CE3-CD2 4.06Å; W445-L448 HydrophobicContact CZ3-CD2 4.08Å; W445-L448 PolarHBondContact O-N 3.16Å; L448-C450 VanDerWaalsContact C-N 3.27Å; L448-C450 PolarHBondContact O-N 3.28Å; L448-T451 PolarHBondContact O-N 3.17Å; L448-I452 HydrophobicContact CD1-CD1 4.06Å; L448-I452 HydrophobicContact CD1-CG1 4.43Å; L448-I452 HydrophobicContact CD2-CD1 4.46Å; L448-I452 HydrophobicContact CG-CD1 3.83Å; L448-I452 VanDerWaalsContact O-CG1 3.31Å; L448-I452 WeakPolarHBondContact O-CG1 3.11Å; L448-I452 PolarHBondContact O-N 3.28Å
449Y84.1Confident82.3Confident143 Ų14371.2 Ų71.256%0.56135%0.35SS*.Hα-helixtrans-60.1-38.9176.6-63.7-38.5000112W445 A446 F453W445-Y449 HydrophobicContact CB-CD2 4.28Å; W445-Y449 HydrophobicContact CB-CE2 3.78Å; W445-Y449 WeakPolarHBondContact O-CD2 3.29Å; W445-Y449 PolarHBondContact O-N 3.15Å; A446-Y449 PolarHBondContact O-N 3.38Å; Y449-F453 WeakPolarHBondContact O-CB 3.28Å; Y449-F453 PolarHBondContact O-N 3.16Å
450C84.3Confident82.2Confident0 Ų070.9 Ų70.90%035%0.348CS..Hα-helixtrans-62-49.5177.1-162.70000111.3Y387 F390 A446 Y447 L448 F453 I454Y387-C450 HydrophobicContact CD2-CB 3.73Å; Y387-C450 VanDerWaalsContact CE2-CA 3.46Å; Y387-C450 HydrophobicContact CE2-CB 3.35Å; F390-C450 HydrophobicContact CD1-CB 3.87Å; F390-C450 HydrophobicContact CE1-CB 4.16Å; A446-C450 VanDerWaalsContact O-CB 3.31Å; A446-C450 WeakPolarHBondContact O-CB 3.42Å; A446-C450 PolarHBondContact O-N 3.36Å; Y447-C450 PolarHBondContact O-N 3.5Å; L448-C450 VanDerWaalsContact C-N 3.27Å; L448-C450 PolarHBondContact O-N 3.28Å; C450-F453 PolarHBondContact O-N 3.38Å; C450-I454 VanDerWaalsContact O-CG1 3.28Å; C450-I454 WeakPolarHBondContact O-CG1 3.37Å; C450-I454 PolarHBondContact O-N 3.49Å
451T85.7Confident82.2Confident47 Ų4766 Ų6629%0.28832%0.322SS..Hα-helixtrans-62.6-47.4-179-55.10000111.3Y447 L448 F453 I454 F455Y447-T451 WeakPolarHBondContact O-CB 2.98Å; Y447-T451 PolarHBondContact O-N 3.36Å; Y447-T451 PolarHBondContact O-OG1 3.25Å; L448-T451 PolarHBondContact O-N 3.17Å; T451-F453 VanDerWaalsContact C-N 3.28Å; T451-F453 PolarHBondContact O-N 2.97Å; T451-I454 PolarHBondContact O-N 3.09Å; T451-F455 HydrophobicContact CG2-CD2 3.78Å; T451-F455 HydrophobicContact CG2-CE2 3.6Å; T451-F455 WeakPolarHBondContact O-CD2 3.33Å; T451-F455 PolarHBondContact O-N 2.99Å; T451-F455 VanDerWaalsContact O-N 3.08Å
452I87.8Confident82.6Confident100 Ų10068.3 Ų68.351%0.51333%0.33SS..Hα-helixtrans-59.1-42.6175.9-67.4169.9000110.3L448 F455 S456L448-I452 HydrophobicContact CD1-CD1 4.06Å; L448-I452 HydrophobicContact CD1-CG1 4.43Å; L448-I452 HydrophobicContact CD2-CD1 4.46Å; L448-I452 HydrophobicContact CG-CD1 3.83Å; L448-I452 VanDerWaalsContact O-CG1 3.31Å; L448-I452 WeakPolarHBondContact O-CG1 3.11Å; L448-I452 PolarHBondContact O-N 3.28Å; I452-F455 PolarHBondContact O-N 3.46Å; I452-S456 WeakPolarHBondContact O-CB 3.39Å; I452-S456 PolarHBondContact O-N 3.44Å
453F87.2Confident82.9Confident50 Ų5065.4 Ų65.422%0.21932%0.32CS..Hα-helixtrans-66.1-41.9-179.6-168.8-84.2000112.5W123 M127 V128 Y449 C450 T451 F455 S456W123-F453 AromaticContact CE2-CE1 3.6Å; W123-F453 AromaticContact CE2-CZ 3.83Å; W123-F453 HydrophobicContact CH2-CZ 4.26Å; W123-F453 AromaticContact CZ2-CE1 3.76Å; W123-F453 HydrophobicContact CZ2-CE1 3.76Å; W123-F453 HydrophobicContact CZ2-CE2 4.15Å; W123-F453 AromaticContact CZ2-CZ 3.46Å; W123-F453 HydrophobicContact CZ2-CZ 3.46Å; W123-F453 VanDerWaalsContact CZ2-CZ 3.46Å; W123-F453 AromaticContact NE1-CD1 3.72Å; W123-F453 AromaticContact NE1-CE1 3.33Å; W123-F453 VanDerWaalsContact NE1-CE1 3.33Å; W123-F453 AromaticContact NE1-CZ 3.99Å; W123-F453 PolarHBondContact NE1-O 3.21Å; M127-F453 HydrophobicContact CB-CE1 3.49Å; M127-F453 VanDerWaalsContact CB-CE1 3.49Å; M127-F453 HydrophobicContact CB-CZ 3.49Å; M127-F453 VanDerWaalsContact CB-CZ 3.49Å; M127-F453 HydrophobicContact CE-CZ 4.33Å; M127-F453 HydrophobicContact CG-CE1 4.25Å; M127-F453 HydrophobicContact CG-CZ 4.06Å; V128-F453 HydrophobicContact CG2-CD1 3.35Å; V128-F453 HydrophobicContact CG2-CE1 3.52Å; V128-F453 HydrophobicContact CG2-CG 4.12Å; V128-F453 HydrophobicContact CG2-CZ 4.36Å; Y449-F453 WeakPolarHBondContact O-CB 3.28Å; Y449-F453 PolarHBondContact O-N 3.16Å; C450-F453 PolarHBondContact O-N 3.38Å; T451-F453 VanDerWaalsContact C-N 3.28Å; T451-F453 PolarHBondContact O-N 2.97Å; F453-F455 VanDerWaalsContact C-N 3.35Å; F453-F455 PolarHBondContact O-N 3.34Å; F453-S456 WeakPolarHBondContact O-CB 3.45Å; F453-S456 PolarHBondContact O-N 3.12Å; F453-S456 PolarHBondContact O-OG 3.5Å
454I87.2Confident82.8Confident22 Ų2264.2 Ų64.211%0.11331%0.308CS..Hα-helixtrans-58.1-49.8175.2-67.6164.5000109.6L120 T124 F395 C450 T451 S456 G457L120-I454 WeakPolarHBondContact CD2-O 3.47Å; T124-I454 HydrophobicContact CG2-CD1 4.5Å; T124-I454 HydrophobicContact CG2-CG1 3.92Å; F395-I454 HydrophobicContact CZ-CG2 4.45Å; C450-I454 VanDerWaalsContact O-CG1 3.28Å; C450-I454 WeakPolarHBondContact O-CG1 3.37Å; C450-I454 PolarHBondContact O-N 3.49Å; T451-I454 PolarHBondContact O-N 3.09Å; I454-S456 VanDerWaalsContact C-N 3.33Å; I454-S456 PolarHBondContact O-N 3.42Å; I454-G457 PolarHBondContact O-N 2.97Å
455F87.6Confident82.6Confident118 Ų11862.3 Ų62.352%0.51830%0.301SS..Hα-helixtrans-72.1-24.4-179.9-71.1-64.2000113.7T451 I452 F453 G457 L458T451-F455 HydrophobicContact CG2-CD2 3.78Å; T451-F455 HydrophobicContact CG2-CE2 3.6Å; T451-F455 WeakPolarHBondContact O-CD2 3.33Å; T451-F455 PolarHBondContact O-N 2.99Å; T451-F455 VanDerWaalsContact O-N 3.08Å; I452-F455 PolarHBondContact O-N 3.46Å; F453-F455 VanDerWaalsContact C-N 3.35Å; F453-F455 PolarHBondContact O-N 3.34Å; F455-G457 PolarHBondContact O-N 2.92Å; F455-G457 VanDerWaalsContact O-N 3.17Å; F455-L458 HydrophobicContact CD1-CD1 3.83Å; F455-L458 VanDerWaalsContact O-CB 3.25Å; F455-L458 WeakPolarHBondContact O-CB 3.35Å; F455-L458 PolarHBondContact O-N 2.86Å
456S88.8Confident82.3Confident33 Ų3361.1 Ų61.123%0.23130%0.297CS..Hα-helixtrans-59.5-26.9173.579.20000112.3I452 F453 I454 L458 I459I452-S456 WeakPolarHBondContact O-CB 3.39Å; I452-S456 PolarHBondContact O-N 3.44Å; F453-S456 WeakPolarHBondContact O-CB 3.45Å; F453-S456 PolarHBondContact O-N 3.12Å; F453-S456 PolarHBondContact O-OG 3.5Å; I454-S456 VanDerWaalsContact C-N 3.33Å; I454-S456 PolarHBondContact O-N 3.42Å; S456-L458 PolarHBondContact O-N 3.43Å; S456-I459 WeakPolarHBondContact O-CB 3.5Å; S456-I459 PolarHBondContact O-N 2.66Å; S456-I459 VanDerWaalsContact O-N 3.08Å
457G84.3Confident82.2Confident0 Ų068 Ų680%032%0.323CS..Hα-helixtrans-56.8-34.1171.400000112.7Y119 I454 F455 I459 L460 Y461Y119-G457 VanDerWaalsContact CE1-O 3.22Å; Y119-G457 WeakPolarHBondContact CE1-O 3.3Å; I454-G457 PolarHBondContact O-N 2.97Å; F455-G457 PolarHBondContact O-N 2.92Å; F455-G457 VanDerWaalsContact O-N 3.17Å; G457-I459 VanDerWaalsContact C-N 3.26Å; G457-I459 PolarHBondContact O-N 2.89Å; G457-L460 PolarHBondContact O-N 2.97Å; G457-L460 VanDerWaalsContact O-N 3.12Å; G457-Y461 PolarHBondContact O-N 3.38Å
458L85.1Confident81.8Confident45 Ų4574.2 Ų74.224%0.23635%0.351CS..Hα-helixtrans-60.9-36.4177.2-65.6177.5000112.3L116 L120 F455 S456 L460 Y461 F462L116-L458 HydrophobicContact CD1-CD2 3.58Å; L116-L458 HydrophobicContact CG-CD2 4.23Å; L120-L458 HydrophobicContact CD1-CD2 4.04Å; L120-L458 HydrophobicContact CD2-CD2 3.87Å; L120-L458 HydrophobicContact CD2-CG 3.99Å; L120-L458 HydrophobicContact CG-CD2 4.18Å; F455-L458 HydrophobicContact CD1-CD1 3.83Å; F455-L458 VanDerWaalsContact O-CB 3.25Å; F455-L458 WeakPolarHBondContact O-CB 3.35Å; F455-L458 PolarHBondContact O-N 2.86Å; S456-L458 PolarHBondContact O-N 3.43Å; L458-L460 PolarHBondContact O-N 3.18Å; L458-Y461 PolarHBondContact O-N 3.04Å; L458-F462 VanDerWaalsContact O-CD2 3.25Å; L458-F462 WeakPolarHBondContact O-CD2 3.43Å; L458-F462 PolarHBondContact O-N 3.15Å
459I84.3Confident81.4Confident126 Ų12671 Ų7165%0.64634%0.336SS*.Hα-helixtrans-62.5-36.5179.3-57.4174.4000110.2S456 G457 P463S456-I459 WeakPolarHBondContact O-CB 3.5Å; S456-I459 PolarHBondContact O-N 2.66Å; S456-I459 VanDerWaalsContact O-N 3.08Å; G457-I459 VanDerWaalsContact C-N 3.26Å; G457-I459 PolarHBondContact O-N 2.89Å; I459-P463 WeakPolarHBondContact O-CD 3.2Å; I459-P463 VanDerWaalsContact O-CG 3.25Å; I459-P463 WeakPolarHBondContact O-CG 3.35Å
460L81.2Confident80.8Confident65 Ų6569.9 Ų69.934%0.3434%0.34SS..Hα-helixtrans-83.2-30.2177.3-64177.7000112.6Y119 W123 G457 L458 P463 L464Y119-L460 WeakPolarHBondContact OH-CB 3.4Å; W123-L460 HydrophobicContact CE3-CD1 4.37Å; W123-L460 HydrophobicContact CH2-CD1 3.41Å; W123-L460 VanDerWaalsContact CH2-CD1 3.41Å; W123-L460 HydrophobicContact CZ2-CD1 4.18Å; W123-L460 HydrophobicContact CZ3-CD1 3.53Å; G457-L460 PolarHBondContact O-N 2.97Å; G457-L460 VanDerWaalsContact O-N 3.12Å; L458-L460 PolarHBondContact O-N 3.18Å; L460-P463 WeakPolarHBondContact O-CD 3.48Å; L460-L464 HydrophobicContact CB-CD1 4.11Å; L460-L464 HydrophobicContact CD2-CD1 4.44Å; L460-L464 WeakPolarHBondContact O-CB 3.41Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.36Å; L460-L464 PolarHBondContact O-N 3.48Å; L460-L464 VanDerWaalsContact O-N 3.14Å
461Y81Confident80.6Confident15 Ų1577.3 Ų77.36%0.05937%0.368CS..Hα-helixtrans-60.3-48.9177.9-179.4-102.3000112.8S115 L116 Y119 G457 L458 V465 Y466S115-Y461 PolarHBondContact OG-OH 2.89Å; S115-Y461 VanDerWaalsContact OG-OH 3.04Å; L116-Y461 HydrophobicContact CD1-CD1 3.43Å; L116-Y461 VanDerWaalsContact CD1-CD1 3.43Å; L116-Y461 HydrophobicContact CD1-CE1 3.37Å; L116-Y461 HydrophobicContact CD1-CE2 4.47Å; L116-Y461 HydrophobicContact CD1-CG 4.03Å; Y119-Y461 AromaticContact CD1-CD2 3.56Å; Y119-Y461 HydrophobicContact CD1-CD2 3.56Å; Y119-Y461 HydrophobicContact CD1-CG 4.06Å; Y119-Y461 AromaticContact CD2-CD2 3.82Å; Y119-Y461 HydrophobicContact CD2-CD2 3.82Å; Y119-Y461 HydrophobicContact CD2-CE2 4.47Å; Y119-Y461 HydrophobicContact CE1-CD2 4.15Å; Y119-Y461 HydrophobicContact CE1-CG 4.39Å; Y119-Y461 HydrophobicContact CE2-CD2 4.32Å; Y119-Y461 AromaticContact CG-CD2 3.38Å; Y119-Y461 HydrophobicContact CG-CD2 3.38Å; Y119-Y461 HydrophobicContact CG-CE2 4.03Å; Y119-Y461 HydrophobicContact CG-CG 4.32Å; G457-Y461 PolarHBondContact O-N 3.38Å; L458-Y461 PolarHBondContact O-N 3.04Å; Y461-V465 HydrophobicContact CD2-CB 3.73Å; Y461-V465 HydrophobicContact CD2-CG1 4.06Å; Y461-V465 HydrophobicContact CD2-CG2 3.96Å; Y461-V465 HydrophobicContact CE2-CB 3.8Å; Y461-V465 HydrophobicContact CE2-CG1 3.6Å; Y461-V465 HydrophobicContact CE2-CG2 4.34Å; Y461-V465 HydrophobicContact CG-CB 4.45Å; Y461-V465 WeakPolarHBondContact O-CA 3.17Å; Y461-V465 WeakPolarHBondContact O-CB 3.12Å; Y461-V465 PolarHBondContact O-N 2.96Å; Y461-Y466 PolarHBondContact O-N 3.36Å
462F79.4Confident80.1Confident114 Ų11475.4 Ų75.450%0.536%0.357SS..Iπ-helixtrans-58.4-50.9-177.1-81.9-71.7000114.3L458 Y466 K467L458-F462 VanDerWaalsContact O-CD2 3.25Å; L458-F462 WeakPolarHBondContact O-CD2 3.43Å; L458-F462 PolarHBondContact O-N 3.15Å; F462-Y466 HydrophobicContact CD1-CD1 4.32Å; F462-Y466 WeakPolarHBondContact O-CB 3.28Å; F462-K467 WeakPolarHBondContact O-CB 3.45Å; F462-K467 PolarHBondContact O-N 3.21Å
463P75.5Confident79.6Confident33 Ų3376.4 Ų76.421%0.21436%0.355CS..Iπ-helixtrans-76.5-38.1179.927.2-33000113.5I459 L460 K468 A469 W471I459-P463 WeakPolarHBondContact O-CD 3.2Å; I459-P463 VanDerWaalsContact O-CG 3.25Å; I459-P463 WeakPolarHBondContact O-CG 3.35Å; L460-P463 WeakPolarHBondContact O-CD 3.48Å; P463-K468 PolarHBondContact O-N 2.88Å; P463-A469 PolarHBondContact O-N 3.12Å; P463-W471 HydrophobicContact CB-CZ2 4.11Å
464L74.3Confident79.3Confident74 Ų7482 Ų8239%0.38738%0.379SS..Iπ-helixtrans-84.9-45.2-171.8-60.9176.3000112.8L460 A472L460-L464 HydrophobicContact CB-CD1 4.11Å; L460-L464 HydrophobicContact CD2-CD1 4.44Å; L460-L464 WeakPolarHBondContact O-CB 3.41Å; L460-L464 VanDerWaalsContact O-CG 3.29Å; L460-L464 WeakPolarHBondContact O-CG 3.36Å; L460-L464 PolarHBondContact O-N 3.48Å; L460-L464 VanDerWaalsContact O-N 3.14Å; L464-A472 HydrophobicContact CD2-CB 3.42Å; L464-A472 VanDerWaalsContact CD2-CB 3.42Å
465V73.4Confident79.1Confident23 Ų2385.2 Ų85.214%0.13940%0.395CS..Iπ-helixtrans-98.8-50.1-172.5-176.60000111.1Y119 Y461 K468Y119-V465 HydrophobicContact CD2-CG2 3.92Å; Y119-V465 HydrophobicContact CE2-CG2 3.8Å; Y461-V465 HydrophobicContact CD2-CB 3.73Å; Y461-V465 HydrophobicContact CD2-CG1 4.06Å; Y461-V465 HydrophobicContact CD2-CG2 3.96Å; Y461-V465 HydrophobicContact CE2-CB 3.8Å; Y461-V465 HydrophobicContact CE2-CG1 3.6Å; Y461-V465 HydrophobicContact CE2-CG2 4.34Å; Y461-V465 HydrophobicContact CG-CB 4.45Å; Y461-V465 WeakPolarHBondContact O-CA 3.17Å; Y461-V465 WeakPolarHBondContact O-CB 3.12Å; Y461-V465 PolarHBondContact O-N 2.96Å; V465-K468 WeakPolarHBondContact O-CG 3.49Å
466Y74.8Confident78.9Confident163 Ų16382.5 Ų82.564%0.63939%0.385SS*.Iπ-helixtrans-75.5-55.2-174.7-173.4-101.8000112.7Y461 F462Y461-Y466 PolarHBondContact O-N 3.36Å; F462-Y466 HydrophobicContact CD1-CD1 4.32Å; F462-Y466 WeakPolarHBondContact O-CB 3.28Å
467K73.9Confident78.7Confident162 Ų16289.4 Ų89.470%0.70441%0.406SS*.SBendtrans-86-10.4-179.5-71.7-164.5174.6-177.10114.5F462 A469F462-K467 WeakPolarHBondContact O-CB 3.45Å; F462-K467 PolarHBondContact O-N 3.21Å; K467-A469 PolarHBondContact O-N 3.43Å; K467-A469 VanDerWaalsContact O-N 3.09Å
468K73.4Confident78.9Confident139 Ų13992.2 Ų92.260%0.60442%0.424SS*.  trans41.347.5-176.3-64.9-177.7179.2172.70112.8P463 V465 N470 R473P463-K468 PolarHBondContact O-N 2.88Å; V465-K468 WeakPolarHBondContact O-CG 3.49Å; K468-N470 PolarHBondContact O-N 2.73Å; K468-R473 PolarHBondContact O-NE 3.37Å; K468-R473 PolarHBondContact O-NH2 2.89Å; K468-R473 VanDerWaalsContact O-NH2 3.09Å
469A75.8Confident79Confident18 Ų1893.8 Ų93.815%0.14943%0.432CS..  trans-56.5137.1-166.200000112.2P463 K467 W471 A472 R473P463-A469 PolarHBondContact O-N 3.12Å; K467-A469 PolarHBondContact O-N 3.43Å; K467-A469 VanDerWaalsContact O-N 3.09Å; A469-W471 VanDerWaalsContact C-N 3.3Å; A469-W471 HydrophobicContact CB-CG 4.39Å; A469-W471 VanDerWaalsContact CB-NE1 3.33Å; A469-W471 PolarHBondContact O-N 3.1Å; A469-A472 PolarHBondContact O-N 3.42Å; A469-R473 PolarHBondContact O-N 3.12Å
470N72.3Confident79.1Confident121 Ų12188.9 Ų88.965%0.64741%0.408SS*.Hα-helixtrans-64.4-33.8-175.2-72.9-16.9000112.7K468 R473 K474K468-N470 PolarHBondContact O-N 2.73Å; N470-R473 PolarHBondContact O-N 2.9Å; N470-R473 PolarHBondContact OD1-NH2 2.87Å; N470-K474 WeakPolarHBondContact O-CB 3.44Å; N470-K474 PolarHBondContact O-N 3.07Å
471W80.5Confident79.3Confident155 Ų15590.7 Ų90.759%0.58742%0.416SS*.Hα-helixtrans-63-42.4177.668.1-97.5000111.8P463 A469 R473 K474 I475P463-W471 HydrophobicContact CB-CZ2 4.11Å; A469-W471 VanDerWaalsContact C-N 3.3Å; A469-W471 HydrophobicContact CB-CG 4.39Å; A469-W471 VanDerWaalsContact CB-NE1 3.33Å; A469-W471 PolarHBondContact O-N 3.1Å; W471-R473 PolarHBondContact O-N 2.78Å; W471-K474 WeakPolarHBondContact O-CB 3.44Å; W471-K474 PolarHBondContact O-N 3.38Å; W471-K474 VanDerWaalsContact O-N 3.12Å; W471-I475 HydrophobicContact CE3-CD1 3.74Å; W471-I475 HydrophobicContact CZ3-CD1 4.02Å; W471-I475 WeakPolarHBondContact O-CG1 3.43Å; W471-I475 PolarHBondContact O-N 3.02Å
472A75.3Confident79.8Confident7 Ų795.8 Ų95.86%0.05844%0.44CS..Hα-helixtrans-64.4-42.4179.400000111.4L464 A469 K474 I475 M476L464-A472 HydrophobicContact CD2-CB 3.42Å; L464-A472 VanDerWaalsContact CD2-CB 3.42Å; A469-A472 PolarHBondContact O-N 3.42Å; A472-K474 VanDerWaalsContact C-N 3.3Å; A472-K474 PolarHBondContact O-N 3.19Å; A472-I475 PolarHBondContact O-N 2.87Å; A472-M476 WeakPolarHBondContact O-CB 3.3Å; A472-M476 VanDerWaalsContact O-CG 3.27Å; A472-M476 WeakPolarHBondContact O-CG 3.42Å; A472-M476 PolarHBondContact O-N 3.17Å
473R75.6Confident80.2Confident121 Ų12193.2 Ų93.246%0.45743%0.431SS..Hα-helixtrans-63.1-36.5173.2-78.1-172.6-80.3165.1-7.3112.5K468 A469 N470 W471 I475 R477K468-R473 PolarHBondContact O-NE 3.37Å; K468-R473 PolarHBondContact O-NH2 2.89Å; K468-R473 VanDerWaalsContact O-NH2 3.09Å; A469-R473 PolarHBondContact O-N 3.12Å; N470-R473 PolarHBondContact O-N 2.9Å; N470-R473 PolarHBondContact OD1-NH2 2.87Å; W471-R473 PolarHBondContact O-N 2.78Å; R473-I475 VanDerWaalsContact C-N 3.34Å; R473-R477 WeakPolarHBondContact O-CB 3.3Å; R473-R477 VanDerWaalsContact O-CG 3.25Å; R473-R477 WeakPolarHBondContact O-CG 3.31Å; R473-R477 PolarHBondContact O-N 3.04Å; R473-R477 VanDerWaalsContact O-N 3.07Å
474K81.4Confident80.7Confident169 Ų16994.5 Ų94.574%0.73543%0.434SS*.Hα-helixtrans-67.1-33.8178.3-163.7175.9-178.4-178.50112.2N470 W471 A472 P478N470-K474 WeakPolarHBondContact O-CB 3.44Å; N470-K474 PolarHBondContact O-N 3.07Å; W471-K474 WeakPolarHBondContact O-CB 3.44Å; W471-K474 PolarHBondContact O-N 3.38Å; W471-K474 VanDerWaalsContact O-N 3.12Å; A472-K474 VanDerWaalsContact C-N 3.3Å; A472-K474 PolarHBondContact O-N 3.19Å; K474-P478 WeakPolarHBondContact O-CD 3.48Å; K474-P478 WeakPolarHBondContact O-CG 3.06Å
475I84.4Confident81.4Confident88 Ų8897.1 Ų97.145%0.45145%0.448SS..Hα-helixtrans-78-44.8174.7-64.1174.1000111.4W471 A472 R473 R477 P478 I479W471-I475 HydrophobicContact CE3-CD1 3.74Å; W471-I475 HydrophobicContact CZ3-CD1 4.02Å; W471-I475 WeakPolarHBondContact O-CG1 3.43Å; W471-I475 PolarHBondContact O-N 3.02Å; A472-I475 PolarHBondContact O-N 2.87Å; R473-I475 VanDerWaalsContact C-N 3.34Å; I475-R477 PolarHBondContact O-N 2.74Å; I475-P478 VanDerWaalsContact O-CD 3.23Å; I475-P478 WeakPolarHBondContact O-CD 2.88Å; I475-P478 VanDerWaalsContact O-CG 3.27Å; I475-P478 WeakPolarHBondContact O-CG 3.2Å; I475-I479 HydrophobicContact CG2-CD1 3.94Å; I475-I479 WeakPolarHBondContact O-CG1 3.45Å
476M82.4Confident82.1Confident61 Ų61102.5 Ų102.530%0.348%0.476SS..Hα-helixtrans-73.2-29.8-173.5-68.8-54.9-6600113.7V348 A472 I479 T480V348-M476 HydrophobicContact CB-CE 4.17Å; V348-M476 HydrophobicContact CG1-CE 3.25Å; V348-M476 HydrophobicContact CG2-CE 3.78Å; A472-M476 WeakPolarHBondContact O-CB 3.3Å; A472-M476 VanDerWaalsContact O-CG 3.27Å; A472-M476 WeakPolarHBondContact O-CG 3.42Å; A472-M476 PolarHBondContact O-N 3.17Å; M476-I479 HydrophobicContact SD-CD1 4.44Å; M476-T480 VanDerWaalsContact O-CB 3.28Å; M476-T480 WeakPolarHBondContact O-CB 3.39Å; M476-T480 PolarHBondContact O-N 2.65Å; M476-T480 PolarHBondContact O-OG1 3.38Å
477R83.9Confident82.6Confident178 Ų17896.2 Ų96.267%0.67245%0.452SS*.Hα-helixtrans-59-54.4177.9-83.3178.3177-174.2-1.5113.9R473 I475 I479 T480 M481R473-R477 WeakPolarHBondContact O-CB 3.3Å; R473-R477 VanDerWaalsContact O-CG 3.25Å; R473-R477 WeakPolarHBondContact O-CG 3.31Å; R473-R477 PolarHBondContact O-N 3.04Å; R473-R477 VanDerWaalsContact O-N 3.07Å; I475-R477 PolarHBondContact O-N 2.74Å; R477-I479 VanDerWaalsContact C-N 3.33Å; R477-I479 PolarHBondContact O-N 2.8Å; R477-T480 PolarHBondContact O-N 2.74Å; R477-M481 PolarHBondContact O-N 3.39Å
478P88.1Confident83.2Confident59 Ų5992.8 Ų92.838%0.38344%0.439SS..Hα-helixtrans-63.4-39.3179.722.3-32.3000111.9K474 I475 T480 M481 H482K474-P478 WeakPolarHBondContact O-CD 3.48Å; K474-P478 WeakPolarHBondContact O-CG 3.06Å; I475-P478 VanDerWaalsContact O-CD 3.23Å; I475-P478 WeakPolarHBondContact O-CD 2.88Å; I475-P478 VanDerWaalsContact O-CG 3.27Å; I475-P478 WeakPolarHBondContact O-CG 3.2Å; P478-T480 VanDerWaalsContact C-N 3.34Å; P478-T480 PolarHBondContact O-N 2.98Å; P478-M481 PolarHBondContact O-N 3.07Å; P478-H482 PolarHBondContact O-N 3.2Å; P478-H482 PolarHBondContact O-ND1 3.13Å
479I87.3Confident83.7Confident78 Ų7886.3 Ų86.340%0.441%0.411SS..Hα-helixtrans-60.1-47.5174.9-63.7171.5000110.2I475 M476 R477 M481 H482 L483I475-I479 HydrophobicContact CG2-CD1 3.94Å; I475-I479 WeakPolarHBondContact O-CG1 3.45Å; M476-I479 HydrophobicContact SD-CD1 4.44Å; R477-I479 VanDerWaalsContact C-N 3.33Å; R477-I479 PolarHBondContact O-N 2.8Å; I479-M481 VanDerWaalsContact C-N 3.32Å; I479-M481 PolarHBondContact O-N 2.75Å; I479-H482 PolarHBondContact O-N 2.65Å; I479-L483 HydrophobicContact CG2-CD1 3.75Å; I479-L483 HydrophobicContact CG2-CG 4.38Å; I479-L483 WeakPolarHBondContact O-CB 3.41Å; I479-L483 WeakPolarHBondContact O-CG 3.43Å; I479-L483 PolarHBondContact O-N 2.96Å
480T86.6Confident84.2Confident23 Ų2387.7 Ų87.714%0.14142%0.417CS..Hα-helixtrans-59.7-45.2179-56.70000110.8I350 Y353 M476 R477 P478 Q484I350-T480 HydrophobicContact CB-CG2 4.23Å; I350-T480 HydrophobicContact CD1-CG2 4.44Å; I350-T480 HydrophobicContact CG1-CG2 4.41Å; Y353-T480 HydrophobicContact CE2-CG2 4.07Å; M476-T480 VanDerWaalsContact O-CB 3.28Å; M476-T480 WeakPolarHBondContact O-CB 3.39Å; M476-T480 PolarHBondContact O-N 2.65Å; M476-T480 PolarHBondContact O-OG1 3.38Å; R477-T480 PolarHBondContact O-N 2.74Å; P478-T480 VanDerWaalsContact C-N 3.34Å; P478-T480 PolarHBondContact O-N 2.98Å; T480-Q484 WeakPolarHBondContact O-CB 3.27Å; T480-Q484 PolarHBondContact O-N 3.46Å
481M87.1Confident84.6Confident103 Ų10385 Ų8551%0.50741%0.406SS..Hα-helixtrans-64.3-45.4179.9-170.3-174.778.800112.6R477 P478 I479 Q484 L485R477-M481 PolarHBondContact O-N 3.39Å; P478-M481 PolarHBondContact O-N 3.07Å; I479-M481 VanDerWaalsContact C-N 3.32Å; I479-M481 PolarHBondContact O-N 2.75Å; M481-Q484 WeakPolarHBondContact O-CB 3.35Å; M481-Q484 PolarHBondContact O-N 3Å; M481-L485 HydrophobicContact CG-CD1 4.38Å; M481-L485 WeakPolarHBondContact O-CG 3.49Å; M481-L485 PolarHBondContact O-N 2.69Å
482H90.1Very high84.2Confident123 Ų12379.3 Ų79.357%0.56939%0.389SS*.Hα-helixtrans-63.9-46.4179-77.979.1000111.6P478 I479 Q484 L485 L486P478-H482 PolarHBondContact O-N 3.2Å; P478-H482 PolarHBondContact O-ND1 3.13Å; I479-H482 PolarHBondContact O-N 2.65Å; H482-Q484 VanDerWaalsContact C-N 3.29Å; H482-Q484 PolarHBondContact O-N 3.42Å; H482-L485 PolarHBondContact O-N 2.97Å; H482-L486 VanDerWaalsContact O-CB 3.24Å; H482-L486 WeakPolarHBondContact O-CB 3.26Å; H482-L486 PolarHBondContact O-N 3.46Å
483L87.4Confident83.7Confident59 Ų5987 Ų8731%0.30942%0.424SS..Hα-helixtrans-66.9-32.7177.5-73.4177.4000111.9I350 I479 L486 M487I350-L483 HydrophobicContact CD1-CB 3.1Å; I350-L483 HydrophobicContact CD1-CD1 3.64Å; I350-L483 HydrophobicContact CD1-CG 4.02Å; I479-L483 HydrophobicContact CG2-CD1 3.75Å; I479-L483 HydrophobicContact CG2-CG 4.38Å; I479-L483 WeakPolarHBondContact O-CB 3.41Å; I479-L483 WeakPolarHBondContact O-CG 3.43Å; I479-L483 PolarHBondContact O-N 2.96Å; L483-L486 HydrophobicContact CD2-CD2 4.45Å; L483-M487 HydrophobicContact CB-CE 3.67Å; L483-M487 HydrophobicContact CD2-CE 3.99Å; L483-M487 HydrophobicContact CG-CE 4.3Å; L483-M487 WeakPolarHBondContact O-CB 3.22Å; L483-M487 WeakPolarHBondContact O-CE 3.31Å; L483-M487 PolarHBondContact O-N 3.44Å
484Q87.4Confident82.6Confident60 Ų6090.5 Ų90.528%0.2844%0.443SS..Hα-helixtrans-63.5-46.4175-169-179.1-18.200111.6Y353 T480 M481 H482 E488 V489Y353-Q484 HydrophobicContact CD2-CG 4.19Å; Y353-Q484 HydrophobicContact CE2-CB 4.41Å; Y353-Q484 HydrophobicContact CE2-CG 4Å; T480-Q484 WeakPolarHBondContact O-CB 3.27Å; T480-Q484 PolarHBondContact O-N 3.46Å; M481-Q484 WeakPolarHBondContact O-CB 3.35Å; M481-Q484 PolarHBondContact O-N 3Å; H482-Q484 VanDerWaalsContact C-N 3.29Å; H482-Q484 PolarHBondContact O-N 3.42Å; Q484-E488 WeakPolarHBondContact O-CA 3.35Å; Q484-E488 PolarHBondContact O-N 3.24Å; Q484-E488 VanDerWaalsContact O-N 3.08Å; Q484-V489 HydrophobicContact CB-CG2 4.47Å; Q484-V489 HydrophobicContact CG-CG2 4.27Å; Q484-V489 WeakPolarHBondContact CG-O 3.44Å; Q484-V489 PolarHBondContact NE2-O 2.91Å; Q484-V489 PolarHBondContact O-N 3.46Å
485L88.1Confident80.7Confident129 Ų12988.3 Ų88.368%0.67544%0.444SS*.Hα-helixtrans-68.1-43.3176.5-68.9170.1000111.8M481 H482 M487M481-L485 HydrophobicContact CG-CD1 4.38Å; M481-L485 WeakPolarHBondContact O-CG 3.49Å; M481-L485 PolarHBondContact O-N 2.69Å; H482-L485 PolarHBondContact O-N 2.97Å; L485-M487 VanDerWaalsContact C-N 3.34Å; L485-M487 PolarHBondContact O-N 3.43Å
486L88.6Confident78.1Confident137 Ų13796.5 Ų96.572%0.71748%0.48SS*.Hα-helixtrans-62.3-39.9-179-177.966.6000112.6H482 L483H482-L486 VanDerWaalsContact O-CB 3.24Å; H482-L486 WeakPolarHBondContact O-CB 3.26Å; H482-L486 PolarHBondContact O-N 3.46Å; L483-L486 HydrophobicContact CD2-CD2 4.45Å
487M84.4Confident77.8Confident31 Ų3198.3 Ų98.315%0.15349%0.489CS..Hα-helixtrans-100-0.8-174.6-68-175.4-7700113.9I350 L362 P363 L366 L483 L485 V489I350-M487 HydrophobicContact CD1-CE 4.16Å; L362-M487 HydrophobicContact CD2-CB 4.01Å; L362-M487 HydrophobicContact CD2-CG 4.23Å; L362-M487 HydrophobicContact CD2-SD 4.42Å; L362-M487 HydrophobicContact CG-SD 4.37Å; P363-M487 HydrophobicContact CB-CE 4Å; P363-M487 HydrophobicContact CB-SD 4.33Å; P363-M487 HydrophobicContact CG-CE 3.85Å; P363-M487 HydrophobicContact CG-SD 4.09Å; L366-M487 HydrophobicContact CD1-SD 3.86Å; L483-M487 HydrophobicContact CB-CE 3.67Å; L483-M487 HydrophobicContact CD2-CE 3.99Å; L483-M487 HydrophobicContact CG-CE 4.3Å; L483-M487 WeakPolarHBondContact O-CB 3.22Å; L483-M487 WeakPolarHBondContact O-CE 3.31Å; L483-M487 PolarHBondContact O-N 3.44Å; L485-M487 VanDerWaalsContact C-N 3.34Å; L485-M487 PolarHBondContact O-N 3.43Å; M487-V489 HydrophobicContact CB-CG1 3.83Å; M487-V489 HydrophobicContact CB-CG2 4.13Å; M487-V489 PolarHBondContact O-N 3.26Å
488E86.6Confident77.5Confident90 Ų9094.1 Ų94.142%0.42148%0.479SS..THydrogen-bonded Turntrans49.245.8-174.3-60.2180171.500112.6L356 K357 Q484L356-E488 PolarHBondContact N-O 3.32Å; L356-E488 VanDerWaalsContact N-O 3.16Å; K357-E488 WeakPolarHBondContact CD-OE2 3.29Å; K357-E488 WeakPolarHBondContact CE-OE2 3.34Å; K357-E488 VanDerWaalsContact NZ-CD 3.31Å; K357-E488 IonicContact NZ-OE1 2.65Å; K357-E488 PolarHBondContact NZ-OE1 3.31Å; K357-E488 IonicContact NZ-OE2 3.06Å; K357-E488 PolarHBondContact NZ-OE2 2.9Å; Q484-E488 WeakPolarHBondContact O-CA 3.35Å; Q484-E488 PolarHBondContact O-N 3.24Å; Q484-E488 VanDerWaalsContact O-N 3.08Å
489V85.2Confident76.9Confident2 Ų296.1 Ų96.11%0.01249%0.485CS..EExtended strand (participates in β ladder)trans-103.7150.3-178-66.80000110.9Y353 I354 L362 P363 Q484 M487Y353-V489 HydrophobicContact CD2-CB 4.48Å; Y353-V489 HydrophobicContact CD2-CG2 3.88Å; Y353-V489 HydrophobicContact CG-CG2 4.47Å; I354-V489 CarbonylContact O-C 3.57Å; I354-V489 WeakPolarHBondContact O-CA 3.34Å; L362-V489 HydrophobicContact CB-CG1 4.4Å; P363-V489 HydrophobicContact CG-CB 4.42Å; P363-V489 HydrophobicContact CG-CG1 3.94Å; P363-V489 HydrophobicContact CG-CG2 4.13Å; Q484-V489 HydrophobicContact CB-CG2 4.47Å; Q484-V489 HydrophobicContact CG-CG2 4.27Å; Q484-V489 WeakPolarHBondContact CG-O 3.44Å; Q484-V489 PolarHBondContact NE2-O 2.91Å; Q484-V489 PolarHBondContact O-N 3.46Å; M487-V489 HydrophobicContact CB-CG1 3.83Å; M487-V489 HydrophobicContact CB-CG2 4.13Å; M487-V489 PolarHBondContact O-N 3.26Å
490V85.1Confident76.3Confident47 Ų4797.1 Ų97.129%0.28549%0.49SS..EExtended strand (participates in β ladder)trans-129.1152.5177.8-69.70000111Y353 I354 L356Y353-V490 WeakPolarHBondContact CA-O 3.49Å; Y353-V490 WeakPolarHBondContact CB-O 3.25Å; I354-V490 PolarHBondContact N-O 3.06Å; I354-V490 PolarHBondContact O-N 3.39Å; L356-V490 HydrophobicContact CD1-CG1 3.73Å; L356-V490 HydrophobicContact CD2-CB 4.25Å; L356-V490 HydrophobicContact CD2-CG1 3.77Å; L356-V490 HydrophobicContact CD2-CG2 3.47Å; L356-V490 VanDerWaalsContact CD2-CG2 3.47Å; L356-V490 HydrophobicContact CG-CB 4.39Å; L356-V490 HydrophobicContact CG-CG1 3.7Å; L356-V490 HydrophobicContact CG-CG2 3.84Å
491P81.7Confident75.7Confident65 Ų65101.8 Ų101.842%0.42251%0.512SS..PPolyproline II helixtrans-58.8140.7166.825-32.4000109.6Y353Y353-P491 HydrophobicContact CD1-CB 4.16Å; Y353-P491 HydrophobicContact CE1-CB 3.78Å
492P70.9Confident74.9Confident35 Ų35101.7 Ų101.723%0.22751%0.512CS..PPolyproline II helixtrans-60142.117230-38.6000109.7Y339 S352 I354 K494Y339-P492 HydrophobicContact CE2-CB 3.71Å; Y339-P492 HydrophobicContact CE2-CG 3.5Å; Y339-P492 VanDerWaalsContact CE2-CG 3.5Å; S352-P492 WeakPolarHBondContact O-CD 3.37Å; I354-P492 HydrophobicContact CD1-CB 4.11Å; P492-K494 PolarHBondContact O-N 3.43Å
493E65.4Low73.9Confident169 Ų169100.1 Ų100.179%0.7951%0.508SS*.PPolyproline II helixtrans-56.4125.7171.3-73.5-179.816600109T495E493-T495 PolarHBondContact O-N 2.91Å
494K52.4Low72.8Confident195 Ų195103.3 Ų103.385%0.84852%0.523SS*.PPolyproline II helixtrans-71.6123.1175.1-74.8-178.2175-175.40107.6P492 E496P492-K494 PolarHBondContact O-N 3.43Å; K494-E496 PolarHBondContact O-N 3.49Å
495T42.3Very low71.6Confident123 Ų123106.9 Ų106.976%0.75554%0.543SS*.  trans-63.9109.1155.9-4.10000106E493E493-T495 PolarHBondContact O-N 2.91Å
496E28.5Very low70.1Confident260 Ų260104.9 Ų104.9100%1.21553%0.531SS*.  trans-66.20166.1-74.5-169.7155.900111K494K494-E496 PolarHBondContact O-N 3.49Å

Retrieved 496 of 496 residues in 862.2 ms (Link to these results)