A0A089G7G7_HUMAN Loading...

C-C chemokine receptor type 5

Receptor for a number of inflammatory CC-chemokines including CCL3/MIP-1-alpha, CCL4/MIP-1-beta and RANTES and subsequently transduces a signal by increasing the intracellular calcium ion level. May play a role in the control of granulocytic lineage proliferation or differentiation. Participates in T-lymphocyte migration to the infection site by acting as a chemotactic receptor.

AlphaFold DB , UniProt , Accession A0A089G7G7, Species HUMAN (Homo sapiens, Human), Gene CCR5, Length 352 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.9Very low39.6Very low218 Ų218151.6 Ų151.6100%1.07478%0.784SS**  090.20-82.7-171.3-179.800105.1Y3M1-Y3 PolarHBondContact O-N 3.04Å
2D34.3Very low39.7Very low158 Ų158151.3 Ų151.385%0.84578%0.782SS**  trans-86.4109.2-168.5-59.7-27.2000108.9Q4D2-Q4 PolarHBondContact O-N 3.44Å
3Y40.8Very low39.7Very low213 Ų213148.2 Ų148.284%0.83577%0.767SS**  trans-79.2100.3168.3-77.8-88.5000108.4M1 V5M1-Y3 PolarHBondContact O-N 3.04Å; Y3-V5 PolarHBondContact O-N 3.07Å
4Q35.1Very low39.8Very low174 Ų174152.2 Ų152.281%0.81377%0.77SS**  trans-88.299.7163.4-84.6173.5-37.800109.1D2D2-Q4 PolarHBondContact O-N 3.44Å
5V47.9Very low40.1Very low140 Ų140156.4 Ų156.485%0.84878%0.775SS**  trans-91.193.8157.5179.70000106.6Y3Y3-V5 PolarHBondContact O-N 3.07Å
6S39.1Very low40.8Very low106 Ų106154.8 Ų154.874%0.74178%0.776SS**  trans-110.299.1169.443.30000109.4
7S44.8Very low41.3Very low92 Ų92152.1 Ų152.164%0.64378%0.776SS**  trans-143.8126.9155.2-176.10000109.3I9S7-I9 PolarHBondContact OG-N 3.25Å
8P42.1Very low41.9Very low105 Ų105152.8 Ų152.868%0.68278%0.775SS**  trans-133.375.2133.636-21.8000109.1Y10P8-Y10 HydrophobicContact CB-CD2 4.4Å; P8-Y10 HydrophobicContact CB-CE2 4.06Å
9I36.5Very low43Very low137 Ų137150.6 Ų150.670%0.70377%0.772SS**  trans-95.3100.7147.9-64177.1000104.8S7 D11S7-I9 PolarHBondContact OG-N 3.25Å; I9-D11 PolarHBondContact O-N 3.4Å
10Y37.8Very low44.2Very low209 Ų209145.2 Ų145.282%0.8275%0.748SS**  trans-68.787.4170-72.8-84.6000107.9P8 I12P8-Y10 HydrophobicContact CB-CD2 4.4Å; P8-Y10 HydrophobicContact CB-CE2 4.06Å; Y10-I12 PolarHBondContact O-N 3.13Å
11D36.7Very low45.2Very low116 Ų116145.1 Ų145.162%0.6275%0.745SS**  trans-65.9110.2159.8-86.9-29.3000107.3I9 N13I9-D11 PolarHBondContact O-N 3.4Å; D11-N13 PolarHBondContact O-N 3.48Å
12I40.8Very low46.5Very low148 Ų148139 Ų13976%0.75971%0.712SS**  trans-70.577.8168.1-57.2175.6000106.5Y10 Y14Y10-I12 PolarHBondContact O-N 3.13Å; I12-Y14 HydrophobicContact CG2-CD2 4.01Å; I12-Y14 HydrophobicContact CG2-CE2 4.12Å; I12-Y14 PolarHBondContact O-N 3.47Å; I12-Y14 VanDerWaalsContact O-N 3.1Å
13N39.9Very low47.9Very low111 Ų111135.9 Ų135.959%0.59469%0.694SS**  trans-76.591.6175.8-82.9-38.4000109.5D11 Y15D11-N13 PolarHBondContact O-N 3.48Å; N13-Y15 PolarHBondContact O-N 3.15Å
14Y40.9Very low49.2Very low204 Ų204131.5 Ų131.580%0.869%0.685SS**  trans-71.1103.7154.9-91-91.1000107.8I12 T16I12-Y14 HydrophobicContact CG2-CD2 4.01Å; I12-Y14 HydrophobicContact CG2-CE2 4.12Å; I12-Y14 PolarHBondContact O-N 3.47Å; I12-Y14 VanDerWaalsContact O-N 3.1Å; Y14-T16 PolarHBondContact O-N 3.27Å; Y14-T16 VanDerWaalsContact O-N 3.12Å
15Y44.2Very low51Low215 Ų215124.8 Ų124.884%0.84366%0.656SS**THydrogen-bonded Turntrans-50117.3173.8-113.3-108.7000109.9N13N13-Y15 PolarHBondContact O-N 3.15Å
16T51.2Low52.3Low131 Ų131124.1 Ų124.180%0.80464%0.642SS**THydrogen-bonded Turntrans65.967.1174.557.20000117.7Y14Y14-T16 PolarHBondContact O-N 3.27Å; Y14-T16 VanDerWaalsContact O-N 3.12Å
17S49Very low54.2Low109 Ų109124.6 Ų124.676%0.76263%0.632SS**  173.586.5126.3300000109.5
18E52.4Low56Low164 Ų164125.8 Ų125.877%0.76663%0.63SS**  trans-57.9129.4167.8-73.3-175.4173.400109.1C20E18-C20 PolarHBondContact O-N 3.37Å
19P61.9Low57.9Low111 Ų111121.6 Ų121.672%0.72160%0.604SS**  trans-59.8124.5174.521.9-29.8000109.1Q21P19-Q21 PolarHBondContact O-N 3.22Å
20C67.9Low60.2Low42 Ų42116.5 Ų116.528%0.28458%0.583SS.*  trans-49.5107.2-179.5-174.20000110E18 K22 C269E18-C20 PolarHBondContact O-N 3.37Å; C20-K22 PolarHBondContact O-N 3.43Å; C20-C269 HydrophobicContact CB-CB 4.07Å; C20-C269 WeakPolarHBondContact CB-SG 3.41Å; C20-C269 WeakPolarHBondContact SG-CB 3.07Å; C20-C269 CovalentContact SG-SG 2.06Å; C20-C269 PolarHBondContact SG-SG 3.46Å
21Q65.9Low62.6Low145 Ų145116.6 Ų116.668%0.67858%0.581SS**  trans-74.2123.2-172-72.2-166.8-1000111.8P19 I23P19-Q21 PolarHBondContact O-N 3.22Å; Q21-I23 HydrophobicContact CB-CD1 4.44Å; Q21-I23 HydrophobicContact CB-CG1 4.46Å
22K67.4Low65.1Low90 Ų90116.3 Ų116.339%0.39158%0.579SS.*  trans-108.727-175.8-56-179.6-168.71720114.1C20 N24 V25 D276C20-K22 PolarHBondContact O-N 3.43Å; K22-N24 VanDerWaalsContact C-N 3.34Å; K22-N24 PolarHBondContact O-N 3.04Å; K22-V25 PolarHBondContact O-N 3.1Å; K22-D276 WeakPolarHBondContact CE-OD2 3.38Å; K22-D276 VanDerWaalsContact NZ-CG 3.34Å; K22-D276 IonicContact NZ-OD1 3.86Å; K22-D276 IonicContact NZ-OD2 3.69Å; K22-D276 PolarHBondContact NZ-OD2 3.02Å
23I63.6Low67.5Low92 Ų92109.7 Ų109.747%0.47255%0.545SS..Hα-helixtrans-56.5-42.3-165.6-61.8171000112.9Q21 V25Q21-I23 HydrophobicContact CB-CD1 4.44Å; Q21-I23 HydrophobicContact CB-CG1 4.46Å; I23-V25 PolarHBondContact O-N 3.42Å
24N68.4Low70Confident120 Ų120105.5 Ų105.564%0.64252%0.524SS*.Hα-helixtrans-67.3-32.2-175.7-68.5-12.2000113.7K22 I28K22-N24 VanDerWaalsContact C-N 3.34Å; K22-N24 PolarHBondContact O-N 3.04Å; N24-I28 WeakPolarHBondContact O-CG1 3.15Å; N24-I28 PolarHBondContact O-N 2.9Å
25V72.9Confident72.6Confident33 Ų3399.6 Ų99.620%0.251%0.511CS..Hα-helixtrans-74.7-41.8-175.5-176.10000110.9K22 I23 Q27 I28 A29 Q277K22-V25 PolarHBondContact O-N 3.1Å; I23-V25 PolarHBondContact O-N 3.42Å; V25-Q27 VanDerWaalsContact C-N 3.34Å; V25-Q27 PolarHBondContact O-N 3.25Å; V25-I28 PolarHBondContact O-N 3.12Å; V25-A29 WeakPolarHBondContact O-CB 3.23Å; V25-A29 PolarHBondContact O-N 3.02Å; V25-Q277 HydrophobicContact CB-CG 4.36Å; V25-Q277 HydrophobicContact CG1-CG 3.9Å; V25-Q277 HydrophobicContact CG2-CG 3.47Å; V25-Q277 VanDerWaalsContact CG2-CG 3.47Å
26K74Confident74.9Confident127 Ų12792 Ų9255%0.55249%0.485SS*.Hα-helixtrans-63.1-40.2-179.2-168.8178.5179.1-1760111.7A29 A30K26-A29 PolarHBondContact O-N 3.37Å; K26-A30 VanDerWaalsContact O-CB 3.31Å; K26-A30 WeakPolarHBondContact O-CB 3.32Å; K26-A30 PolarHBondContact O-N 2.94Å
27Q79.9Confident77Confident116 Ų11686 Ų8654%0.54245%0.448SS..Hα-helixtrans-67.7-40.4179.3-69.3-179.8-600112.9V25 A30 R31V25-Q27 VanDerWaalsContact C-N 3.34Å; V25-Q27 PolarHBondContact O-N 3.25Å; Q27-A30 PolarHBondContact O-N 3.22Å; Q27-R31 PolarHBondContact O-N 3.35Å
28I81.9Confident79.2Confident117 Ų11783.7 Ų83.760%0.643%0.431SS*.Hα-helixtrans-66.4-46176.2-65.9169.5000110N24 V25 A30 R31 L32N24-I28 WeakPolarHBondContact O-CG1 3.15Å; N24-I28 PolarHBondContact O-N 2.9Å; V25-I28 PolarHBondContact O-N 3.12Å; I28-A30 VanDerWaalsContact C-N 3.32Å; I28-A30 PolarHBondContact O-N 3.44Å; I28-R31 PolarHBondContact O-N 3.31Å; I28-L32 PolarHBondContact O-N 2.9Å; I28-L32 VanDerWaalsContact O-N 3.07Å
29A82.5Confident81.2Confident17 Ų1780 Ų8014%0.1442%0.416CS..Hα-helixtrans-58.4-42.6176.400000112V25 K26 R31 L32 L33V25-A29 WeakPolarHBondContact O-CB 3.23Å; V25-A29 PolarHBondContact O-N 3.02Å; K26-A29 PolarHBondContact O-N 3.37Å; A29-R31 PolarHBondContact O-N 3.16Å; A29-L32 PolarHBondContact O-N 3.48Å; A29-L33 HydrophobicContact CB-CD1 3.8Å; A29-L33 HydrophobicContact CB-CG 4.26Å; A29-L33 VanDerWaalsContact O-CB 3.27Å; A29-L33 WeakPolarHBondContact O-CB 3.33Å; A29-L33 VanDerWaalsContact O-CG 3.25Å; A29-L33 WeakPolarHBondContact O-CG 3.49Å; A29-L33 PolarHBondContact O-N 3.48Å
30A84.4Confident82.8Confident30 Ų3075 Ų7525%0.24838%0.384CS..Hα-helixtrans-63.1-26.3178.800000114.1K26 Q27 I28 P34 A90K26-A30 VanDerWaalsContact O-CB 3.31Å; K26-A30 WeakPolarHBondContact O-CB 3.32Å; K26-A30 PolarHBondContact O-N 2.94Å; Q27-A30 PolarHBondContact O-N 3.22Å; I28-A30 VanDerWaalsContact C-N 3.32Å; I28-A30 PolarHBondContact O-N 3.44Å; A30-P34 VanDerWaalsContact O-CD 3.26Å; A30-P34 WeakPolarHBondContact O-CD 3.36Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.37Å; A30-A90 WeakPolarHBondContact CA-O 3.15Å; A30-A90 WeakPolarHBondContact CB-O 3.5Å
31R88.4Confident84.1Confident210 Ų21076 Ų7679%0.79238%0.383SS*.Hα-helixtrans-87.3-36.5176.3-67.3-178.2-177.4-173.11.7112.9Q27 I28 A29 P35Q27-R31 PolarHBondContact O-N 3.35Å; I28-R31 PolarHBondContact O-N 3.31Å; A29-R31 PolarHBondContact O-N 3.16Å; R31-P35 WeakPolarHBondContact O-CD 3.42Å
32L90Very high85.5Confident110 Ų11073.7 Ų73.758%0.57637%0.374SS*.Hα-helixtrans-89.5-41.4-172.4-169.376.6000113.4I28 A29 P35 L36I28-L32 PolarHBondContact O-N 2.9Å; I28-L32 VanDerWaalsContact O-N 3.07Å; A29-L32 PolarHBondContact O-N 3.48Å; L32-P35 WeakPolarHBondContact O-CD 3.46Å; L32-P35 WeakPolarHBondContact O-CG 3.42Å; L32-L36 WeakPolarHBondContact O-CB 3.22Å; L32-L36 PolarHBondContact O-N 3.07Å
33L90.8Very high86.8Confident9 Ų975.3 Ų75.35%0.04738%0.382CS..Hα-helixtrans-68.6-43.8-171.6-62.2178.1000113.6A29 L36 Y37 A90 T284A29-L33 HydrophobicContact CB-CD1 3.8Å; A29-L33 HydrophobicContact CB-CG 4.26Å; A29-L33 VanDerWaalsContact O-CB 3.27Å; A29-L33 WeakPolarHBondContact O-CB 3.33Å; A29-L33 VanDerWaalsContact O-CG 3.25Å; A29-L33 WeakPolarHBondContact O-CG 3.49Å; A29-L33 PolarHBondContact O-N 3.48Å; L33-L36 PolarHBondContact O-N 3.07Å; L33-Y37 HydrophobicContact CB-CD2 4.34Å; L33-Y37 HydrophobicContact CB-CE2 4.1Å; L33-Y37 HydrophobicContact CD2-CE1 4.29Å; L33-Y37 VanDerWaalsContact O-CB 3.29Å; L33-Y37 WeakPolarHBondContact O-CB 3.38Å; L33-Y37 PolarHBondContact O-N 3.26Å; L33-A90 HydrophobicContact CB-CB 3.84Å; L33-A90 HydrophobicContact CD1-CB 3.97Å; L33-T284 HydrophobicContact CD2-CG2 3.57Å; L33-T284 VanDerWaalsContact CD2-OG1 3.28Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.44Å
34P93.1Very high88.3Confident23 Ų2370.9 Ų70.915%0.14936%0.359CS..Hα-helixtrans-59-49.1-177.9-22.433000114.9A30 S38 A90 A91A30-P34 VanDerWaalsContact O-CD 3.26Å; A30-P34 WeakPolarHBondContact O-CD 3.36Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.37Å; P34-S38 WeakPolarHBondContact O-CB 3.38Å; P34-S38 PolarHBondContact O-N 3.27Å; P34-S38 PolarHBondContact O-OG 3.25Å; P34-A90 HydrophobicContact CG-CB 4.36Å; P34-A91 HydrophobicContact CB-CB 4.38Å; P34-A91 HydrophobicContact CG-CB 3.71Å
35P94.3Very high89.6Confident80 Ų8068.9 Ų68.952%0.51935%0.345SS..Hα-helixtrans-66.5-37.7177.225.2-32.7000112.1R31 L32 S38 L39R31-P35 WeakPolarHBondContact O-CD 3.42Å; L32-P35 WeakPolarHBondContact O-CD 3.46Å; L32-P35 WeakPolarHBondContact O-CG 3.42Å; P35-S38 PolarHBondContact O-N 2.97Å; P35-L39 PolarHBondContact O-N 3.09Å
36L94Very high90.7Very high56 Ų5671.7 Ų71.729%0.29336%0.362SS..Hα-helixtrans-63.5-49177.5179.262.9000111.8L32 L33 S38 L39 V40 T284L32-L36 WeakPolarHBondContact O-CB 3.22Å; L32-L36 PolarHBondContact O-N 3.07Å; L33-L36 PolarHBondContact O-N 3.07Å; L36-S38 VanDerWaalsContact C-N 3.31Å; L36-S38 PolarHBondContact O-N 3.44Å; L36-L39 WeakPolarHBondContact O-CB 3.48Å; L36-L39 PolarHBondContact O-N 2.7Å; L36-V40 WeakPolarHBondContact O-CG2 3.32Å; L36-V40 PolarHBondContact O-N 3.49Å; L36-T284 HydrophobicContact CD2-CG2 3.53Å
37Y94.3Very high91.6Very high6 Ų666.3 Ų66.32%0.02434%0.342CS..Hα-helixtrans-64.8-35.2177.8-74.1-7.1000112.3L33 L39 V40 F41 V83 W86 A87 T284 M287L33-Y37 HydrophobicContact CB-CD2 4.34Å; L33-Y37 HydrophobicContact CB-CE2 4.1Å; L33-Y37 HydrophobicContact CD2-CE1 4.29Å; L33-Y37 VanDerWaalsContact O-CB 3.29Å; L33-Y37 WeakPolarHBondContact O-CB 3.38Å; L33-Y37 PolarHBondContact O-N 3.26Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; Y37-V40 PolarHBondContact O-N 2.91Å; Y37-F41 WeakPolarHBondContact O-CB 3.49Å; Y37-F41 PolarHBondContact O-N 3.4Å; Y37-V83 HydrophobicContact CG-CG1 4.06Å; Y37-V83 VanDerWaalsContact O-CG1 3.28Å; Y37-V83 WeakPolarHBondContact O-CG1 3.15Å; Y37-W86 HydrophobicContact CD2-CB 4.14Å; Y37-W86 HydrophobicContact CE2-CB 4.01Å; Y37-A87 HydrophobicContact CD2-CB 4.17Å; Y37-T284 HydrophobicContact CE1-CG2 3.92Å; Y37-T284 PolarHBondContact OH-OG1 3.03Å; Y37-M287 HydrophobicContact CE1-CB 4.2Å; Y37-M287 HydrophobicContact CE1-SD 3.85Å; Y37-M287 HydrophobicContact CE2-SD 4.06Å; Y37-M287 VanDerWaalsContact CZ-SD 3.53Å; Y37-M287 PolarHBondContact OH-SD 2.64Å
38S94.6Very high92.4Very high59 Ų5960.8 Ų60.841%0.41332%0.317SS..Hα-helixtrans-62.1-42.7172.3-590000111.5P34 P35 L36 F41 I42P34-S38 WeakPolarHBondContact O-CB 3.38Å; P34-S38 PolarHBondContact O-N 3.27Å; P34-S38 PolarHBondContact O-OG 3.25Å; P35-S38 PolarHBondContact O-N 2.97Å; L36-S38 VanDerWaalsContact C-N 3.31Å; L36-S38 PolarHBondContact O-N 3.44Å; S38-F41 PolarHBondContact O-N 2.91Å; S38-I42 VanDerWaalsContact O-CG1 3.31Å; S38-I42 WeakPolarHBondContact O-CG1 3.4Å; S38-I42 PolarHBondContact O-N 3.12Å
39L94.9Very high93Very high87 Ų8758.5 Ų58.546%0.45530%0.304SS..Hα-helixtrans-64.5-44.8176.3-167.569000112P35 L36 Y37 F41 I42 F43P35-L39 PolarHBondContact O-N 3.09Å; L36-L39 WeakPolarHBondContact O-CB 3.48Å; L36-L39 PolarHBondContact O-N 2.7Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.06Å; L39-I42 PolarHBondContact O-N 2.95Å; L39-F43 HydrophobicContact CD1-CD2 3.85Å; L39-F43 HydrophobicContact CD1-CE2 3.26Å; L39-F43 HydrophobicContact CD1-CZ 3.94Å; L39-F43 HydrophobicContact CD2-CD2 4.47Å; L39-F43 HydrophobicContact CD2-CE2 4.04Å; L39-F43 HydrophobicContact CG-CD2 3.69Å; L39-F43 HydrophobicContact CG-CE2 3.49Å; L39-F43 VanDerWaalsContact CG-CE2 3.49Å; L39-F43 WeakPolarHBondContact O-CD2 3.37Å; L39-F43 PolarHBondContact O-N 3.46Å
40V95.3Very high93.4Very high7 Ų759.3 Ų59.34%0.04231%0.306CS..Hα-helixtrans-59.3-43.5174.91710000110.6L36 Y37 G44 L80 T288L36-V40 WeakPolarHBondContact O-CG2 3.32Å; L36-V40 PolarHBondContact O-N 3.49Å; Y37-V40 PolarHBondContact O-N 2.91Å; V40-G44 WeakPolarHBondContact O-CA 3.46Å; V40-G44 PolarHBondContact O-N 3.32Å; V40-L80 HydrophobicContact CG1-CD2 4.27Å; V40-T288 HydrophobicContact CG2-CG2 3.74Å
41F96.1Very high93.8Very high61 Ų6158 Ų5827%0.26830%0.295SS..Hα-helixtrans-61.5-49.7177.3179.6-102.8000111.7Y37 S38 L39 F45 L80 V83 P84Y37-F41 WeakPolarHBondContact O-CB 3.49Å; Y37-F41 PolarHBondContact O-N 3.4Å; S38-F41 PolarHBondContact O-N 2.91Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.06Å; F41-F45 HydrophobicContact CE2-CD2 4.42Å; F41-F45 HydrophobicContact CZ-CD2 4.35Å; F41-F45 WeakPolarHBondContact O-CB 3.36Å; F41-F45 PolarHBondContact O-N 3.08Å; F41-L80 HydrophobicContact CD2-CB 4.49Å; F41-L80 WeakPolarHBondContact CD2-O 3.06Å; F41-V83 HydrophobicContact CB-CG1 4.32Å; F41-P84 HydrophobicContact CD1-CG 4.37Å; F41-P84 HydrophobicContact CD2-CG 3.66Å; F41-P84 HydrophobicContact CE1-CG 4.46Å; F41-P84 HydrophobicContact CE2-CG 3.77Å; F41-P84 HydrophobicContact CG-CG 3.97Å; F41-P84 HydrophobicContact CZ-CG 4.18Å
42I95.4Very high94.1Very high97 Ų9749.1 Ų49.150%0.49726%0.263SS..Hα-helixtrans-60.9-54.6-178.8-68165.3000110.9S38 L39 V46S38-I42 VanDerWaalsContact O-CG1 3.31Å; S38-I42 WeakPolarHBondContact O-CG1 3.4Å; S38-I42 PolarHBondContact O-N 3.12Å; L39-I42 PolarHBondContact O-N 2.95Å; I42-V46 WeakPolarHBondContact O-CB 2.95Å; I42-V46 VanDerWaalsContact O-CG2 3.3Å; I42-V46 WeakPolarHBondContact O-CG2 3.36Å; I42-V46 PolarHBondContact O-N 2.73Å; I42-V46 VanDerWaalsContact O-N 3.09Å
43F94.3Very high94.2Very high124 Ų12447.4 Ų47.454%0.54425%0.254SS..Hα-helixtrans-68.5-39.9-177.9-70.3-48.4000112.4L39 G47 C291L39-F43 HydrophobicContact CD1-CD2 3.85Å; L39-F43 HydrophobicContact CD1-CE2 3.26Å; L39-F43 HydrophobicContact CD1-CZ 3.94Å; L39-F43 HydrophobicContact CD2-CD2 4.47Å; L39-F43 HydrophobicContact CD2-CE2 4.04Å; L39-F43 HydrophobicContact CG-CD2 3.69Å; L39-F43 HydrophobicContact CG-CE2 3.49Å; L39-F43 VanDerWaalsContact CG-CE2 3.49Å; L39-F43 WeakPolarHBondContact O-CD2 3.37Å; L39-F43 PolarHBondContact O-N 3.46Å; F43-G47 WeakPolarHBondContact O-CA 3.46Å; F43-G47 PolarHBondContact O-N 3.49Å; F43-C291 HydrophobicContact CB-CB 4.43Å
44G95.2Very high94.1Very high0 Ų047 Ų470%025%0.252CS..Hα-helixtrans-64.7-45.4178.200000111.9V40 N48 L80 C291V40-G44 WeakPolarHBondContact O-CA 3.46Å; V40-G44 PolarHBondContact O-N 3.32Å; G44-N48 VanDerWaalsContact O-CB 3.28Å; G44-N48 WeakPolarHBondContact O-CB 3.43Å; G44-N48 PolarHBondContact O-N 2.84Å; G44-N48 PolarHBondContact O-ND2 3.48Å; G44-L80 WeakPolarHBondContact O-CD1 3.28Å; G44-C291 VanDerWaalsContact CA-CB 3.47Å
45F95.9Very high93.9Very high77 Ų7746 Ų4634%0.33825%0.246SC..Hα-helixtrans-66.2-51.4-179.1-172.7-92.7000111.1F41 G47 M49 L77F41-F45 HydrophobicContact CE2-CD2 4.42Å; F41-F45 HydrophobicContact CZ-CD2 4.35Å; F41-F45 WeakPolarHBondContact O-CB 3.36Å; F41-F45 PolarHBondContact O-N 3.08Å; F45-G47 PolarHBondContact O-N 3.2Å; F45-M49 HydrophobicContact CD1-CG 4.2Å; F45-M49 HydrophobicContact CD2-CE 4.4Å; F45-M49 HydrophobicContact CE1-CE 4.37Å; F45-M49 HydrophobicContact CE1-CG 3.96Å; F45-M49 HydrophobicContact CE2-CE 3.6Å; F45-M49 HydrophobicContact CE2-CG 4.46Å; F45-M49 HydrophobicContact CZ-CE 3.58Å; F45-M49 HydrophobicContact CZ-CG 4.11Å; F45-M49 VanDerWaalsContact O-CB 3.24Å; F45-M49 WeakPolarHBondContact O-CB 3.49Å; F45-M49 WeakPolarHBondContact O-CG 3.3Å; F45-M49 PolarHBondContact O-N 3.39Å; F45-L77 HydrophobicContact CD2-CD2 3.97Å; F45-L77 HydrophobicContact CE2-CD2 4.39Å
46V94.9Very high93.7Very high92 Ų9246 Ų4656%0.55824%0.24SC*.Hα-helixtrans-61.7-45178.8175.20000110.9I42 L50I42-V46 WeakPolarHBondContact O-CB 2.95Å; I42-V46 VanDerWaalsContact O-CG2 3.3Å; I42-V46 WeakPolarHBondContact O-CG2 3.36Å; I42-V46 PolarHBondContact O-N 2.73Å; I42-V46 VanDerWaalsContact O-N 3.09Å; V46-L50 WeakPolarHBondContact O-CB 3.19Å; V46-L50 PolarHBondContact O-N 3.12Å
47G93.8Very high93.3Very high14 Ų1447.5 Ų47.514%0.14425%0.249CC..Hα-helixtrans-62.3-52.3-179.700000112.5F43 F45 L50 V51 P294F43-G47 WeakPolarHBondContact O-CA 3.46Å; F43-G47 PolarHBondContact O-N 3.49Å; F45-G47 PolarHBondContact O-N 3.2Å; G47-L50 WeakPolarHBondContact O-CB 3.44Å; G47-L50 PolarHBondContact O-N 3.36Å; G47-V51 WeakPolarHBondContact O-CG2 3.35Å; G47-V51 PolarHBondContact O-N 2.87Å; G47-P294 VanDerWaalsContact C-CG 3.42Å
48N95.8Very high92.8Very high1 Ų149.1 Ų49.11%0.00526%0.26CS..Hα-helixtrans-69.1-36.4-178.3-74.1-63000112.2G44 L50 V51 I52 L77 C290 P294G44-N48 VanDerWaalsContact O-CB 3.28Å; G44-N48 WeakPolarHBondContact O-CB 3.43Å; G44-N48 PolarHBondContact O-N 2.84Å; G44-N48 PolarHBondContact O-ND2 3.48Å; N48-L50 VanDerWaalsContact C-N 3.34Å; N48-L50 PolarHBondContact O-N 3.16Å; N48-V51 WeakPolarHBondContact O-CB 3.37Å; N48-V51 PolarHBondContact O-N 2.86Å; N48-I52 WeakPolarHBondContact O-CG1 3.36Å; N48-I52 PolarHBondContact O-N 2.7Å; N48-L77 HydrophobicContact CB-CD2 3.94Å; N48-L77 HydrophobicContact CB-CG 4.08Å; N48-C290 PolarHBondContact ND2-O 3.18Å; N48-P294 WeakPolarHBondContact OD1-CG 3.38Å
49M94.9Very high92.2Very high68 Ų6848 Ų4834%0.33525%0.248SC..Hα-helixtrans-61.8-41.7172-74.6-62.6178.200112F45 V51 I52 L53 L77F45-M49 HydrophobicContact CD1-CG 4.2Å; F45-M49 HydrophobicContact CD2-CE 4.4Å; F45-M49 HydrophobicContact CE1-CE 4.37Å; F45-M49 HydrophobicContact CE1-CG 3.96Å; F45-M49 HydrophobicContact CE2-CE 3.6Å; F45-M49 HydrophobicContact CE2-CG 4.46Å; F45-M49 HydrophobicContact CZ-CE 3.58Å; F45-M49 HydrophobicContact CZ-CG 4.11Å; F45-M49 VanDerWaalsContact O-CB 3.24Å; F45-M49 WeakPolarHBondContact O-CB 3.49Å; F45-M49 WeakPolarHBondContact O-CG 3.3Å; F45-M49 PolarHBondContact O-N 3.39Å; M49-V51 VanDerWaalsContact C-N 3.33Å; M49-V51 PolarHBondContact O-N 2.87Å; M49-I52 PolarHBondContact O-N 2.84Å; M49-I52 HydrophobicContact SD-CD1 4.48Å; M49-L53 WeakPolarHBondContact O-CB 3.34Å; M49-L53 VanDerWaalsContact O-CG 3.31Å; M49-L53 WeakPolarHBondContact O-CG 3.39Å; M49-L53 PolarHBondContact O-N 2.94Å; M49-L77 HydrophobicContact CE-CD1 3.49Å; M49-L77 VanDerWaalsContact CE-CD1 3.49Å; M49-L77 HydrophobicContact CE-CD2 3.99Å; M49-L77 HydrophobicContact CE-CG 4.4Å; M49-L77 HydrophobicContact CG-CD2 4.41Å; M49-L77 HydrophobicContact SD-CD1 3.9Å
50L92.3Very high91.8Very high34 Ų3452.6 Ų52.618%0.17826%0.259CS..Hα-helixtrans-62.7-40.6175.6-175.962.9000111.7V46 G47 N48 L53 I54 L308 F311 F312V46-L50 WeakPolarHBondContact O-CB 3.19Å; V46-L50 PolarHBondContact O-N 3.12Å; G47-L50 WeakPolarHBondContact O-CB 3.44Å; G47-L50 PolarHBondContact O-N 3.36Å; N48-L50 VanDerWaalsContact C-N 3.34Å; N48-L50 PolarHBondContact O-N 3.16Å; L50-L53 PolarHBondContact O-N 3.41Å; L50-I54 HydrophobicContact CD1-CD1 4.07Å; L50-I54 HydrophobicContact CD1-CG1 4.37Å; L50-I54 HydrophobicContact CG-CD1 3.88Å; L50-I54 WeakPolarHBondContact O-CB 3.46Å; L50-I54 VanDerWaalsContact O-CG1 3.32Å; L50-I54 WeakPolarHBondContact O-CG1 3.34Å; L50-I54 PolarHBondContact O-N 3.09Å; L50-L308 HydrophobicContact CD2-CD1 3.75Å; L50-L308 HydrophobicContact CD2-CG 4.31Å; L50-F311 HydrophobicContact CD1-CD1 3.79Å; L50-F311 HydrophobicContact CD1-CE1 3.66Å; L50-F311 HydrophobicContact CD1-CZ 4.35Å; L50-F312 HydrophobicContact CD2-CE2 4.39Å
51V92.8Very high91.5Very high2 Ų254.1 Ų54.11%0.01227%0.267CS..Hα-helixtrans-58.4-49.6174.4172.20000110.8G47 N48 M49 L53 I54 L55 A73 P294 Y297 F304G47-V51 WeakPolarHBondContact O-CG2 3.35Å; G47-V51 PolarHBondContact O-N 2.87Å; N48-V51 WeakPolarHBondContact O-CB 3.37Å; N48-V51 PolarHBondContact O-N 2.86Å; M49-V51 VanDerWaalsContact C-N 3.33Å; M49-V51 PolarHBondContact O-N 2.87Å; V51-L53 PolarHBondContact O-N 2.83Å; V51-I54 PolarHBondContact O-N 3.48Å; V51-L55 HydrophobicContact CG1-CD1 3.73Å; V51-L55 HydrophobicContact CG1-CG 4.29Å; V51-L55 WeakPolarHBondContact O-CB 3.4Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.45Å; V51-L55 PolarHBondContact O-N 3.04Å; V51-A73 HydrophobicContact CB-CB 4.46Å; V51-A73 HydrophobicContact CG1-CB 4.06Å; V51-P294 HydrophobicContact CG2-CB 4.05Å; V51-P294 HydrophobicContact CG2-CG 4.14Å; V51-Y297 HydrophobicContact CG1-CD2 4.21Å; V51-Y297 HydrophobicContact CG1-CE2 4.08Å; V51-Y297 HydrophobicContact CG2-CD2 3.73Å; V51-Y297 HydrophobicContact CG2-CE2 4.18Å; V51-F304 HydrophobicContact CB-CE2 4.38Å; V51-F304 HydrophobicContact CB-CZ 4.4Å; V51-F304 HydrophobicContact CG1-CE2 4.47Å; V51-F304 HydrophobicContact CG2-CE2 3.97Å; V51-F304 HydrophobicContact CG2-CZ 3.63Å
52I94.4Very high91Very high24 Ų2458.9 Ų58.912%0.12329%0.287CS..Hα-helixtrans-58.3-48.9178.2-68.5170.2000110.8N48 M49 I54 L55 I56 L70 A73 I74 L77N48-I52 WeakPolarHBondContact O-CG1 3.36Å; N48-I52 PolarHBondContact O-N 2.7Å; M49-I52 PolarHBondContact O-N 2.84Å; M49-I52 HydrophobicContact SD-CD1 4.48Å; I52-I54 VanDerWaalsContact C-N 3.35Å; I52-I54 PolarHBondContact O-N 3.09Å; I52-L55 PolarHBondContact O-N 3.3Å; I52-I56 HydrophobicContact CG2-CD1 3.66Å; I52-I56 HydrophobicContact CG2-CG1 4.45Å; I52-I56 WeakPolarHBondContact O-CG1 3.44Å; I52-I56 PolarHBondContact O-N 3.27Å; I52-L70 HydrophobicContact CB-CD1 4.26Å; I52-L70 HydrophobicContact CG1-CD1 3.98Å; I52-L70 HydrophobicContact CG2-CD1 3.94Å; I52-A73 HydrophobicContact CD1-CB 4.26Å; I52-A73 HydrophobicContact CG1-CB 3.82Å; I52-I74 HydrophobicContact CD1-CG1 4.19Å; I52-L77 HydrophobicContact CD1-CD1 3.37Å; I52-L77 HydrophobicContact CD1-CG 4.42Å
53L91.4Very high90.7Very high75 Ų7556.1 Ų56.139%0.39328%0.277SS..Hα-helixtrans-59.6-43.4179.4-72.9171.2000112.2M49 L50 V51 N57 F311M49-L53 WeakPolarHBondContact O-CB 3.34Å; M49-L53 VanDerWaalsContact O-CG 3.31Å; M49-L53 WeakPolarHBondContact O-CG 3.39Å; M49-L53 PolarHBondContact O-N 2.94Å; L50-L53 PolarHBondContact O-N 3.41Å; V51-L53 PolarHBondContact O-N 2.83Å; L53-N57 VanDerWaalsContact O-CB 3.23Å; L53-N57 WeakPolarHBondContact O-CB 3.4Å; L53-N57 PolarHBondContact O-N 2.82Å; L53-N57 PolarHBondContact O-ND2 3.28Å; L53-F311 HydrophobicContact CD1-CZ 4.35Å
54I88.4Confident90.5Very high0 Ų051.1 Ų51.10%026%0.255CS..Iπ-helixtrans-66-42.4177.7-72.6169.1000110.9L50 V51 I52 C58 K59 F304 Y307 L308L50-I54 HydrophobicContact CD1-CD1 4.07Å; L50-I54 HydrophobicContact CD1-CG1 4.37Å; L50-I54 HydrophobicContact CG-CD1 3.88Å; L50-I54 WeakPolarHBondContact O-CB 3.46Å; L50-I54 VanDerWaalsContact O-CG1 3.32Å; L50-I54 WeakPolarHBondContact O-CG1 3.34Å; L50-I54 PolarHBondContact O-N 3.09Å; V51-I54 PolarHBondContact O-N 3.48Å; I52-I54 VanDerWaalsContact C-N 3.35Å; I52-I54 PolarHBondContact O-N 3.09Å; I54-C58 HydrophobicContact CG2-CB 4.33Å; I54-C58 WeakPolarHBondContact O-CA 3.46Å; I54-C58 VanDerWaalsContact O-CB 3.26Å; I54-C58 WeakPolarHBondContact O-CB 3.42Å; I54-C58 PolarHBondContact O-N 3.12Å; I54-K59 PolarHBondContact O-N 3.26Å; I54-F304 HydrophobicContact CB-CE2 4.09Å; I54-F304 HydrophobicContact CD1-CD2 4.48Å; I54-F304 HydrophobicContact CD1-CE1 4.25Å; I54-F304 HydrophobicContact CD1-CE2 3.72Å; I54-F304 HydrophobicContact CD1-CZ 3.58Å; I54-F304 HydrophobicContact CG2-CD2 4.11Å; I54-F304 HydrophobicContact CG2-CE2 3.92Å; I54-Y307 HydrophobicContact CG2-CG 4.3Å; I54-L308 HydrophobicContact CD1-CB 4.09Å; I54-L308 HydrophobicContact CD1-CG 4.43Å
55L89.6Confident90.3Very high3 Ų352 Ų522%0.01626%0.261CS..Iπ-helixtrans-64.4-42.4-179.6-72.9173.9000112.1V51 I52 K59 R60 L61 D66 L69 L70V51-L55 HydrophobicContact CG1-CD1 3.73Å; V51-L55 HydrophobicContact CG1-CG 4.29Å; V51-L55 WeakPolarHBondContact O-CB 3.4Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.45Å; V51-L55 PolarHBondContact O-N 3.04Å; I52-L55 PolarHBondContact O-N 3.3Å; L55-K59 HydrophobicContact CD2-CD 3.76Å; L55-K59 CarbonylContact O-C 3.08Å; L55-R60 PolarHBondContact O-N 3.45Å; L55-L61 HydrophobicContact CB-CD2 3.91Å; L55-L61 PolarHBondContact O-N 3.19Å; L55-D66 HydrophobicContact CD2-CB 4.25Å; L55-L69 HydrophobicContact CD1-CB 3.94Å; L55-L69 HydrophobicContact CD2-CB 4.47Å; L55-L70 HydrophobicContact CD1-CB 4.04Å
56I90.5Very high90.1Very high78 Ų7849.1 Ų49.140%0.425%0.249SC..Iπ-helixtrans-76-53.6-179.9-64174.2000110.9I52 R60 L61 L70I52-I56 HydrophobicContact CG2-CD1 3.66Å; I52-I56 HydrophobicContact CG2-CG1 4.45Å; I52-I56 WeakPolarHBondContact O-CG1 3.44Å; I52-I56 PolarHBondContact O-N 3.27Å; I56-R60 WeakPolarHBondContact O-CA 3.3Å; I56-R60 PolarHBondContact O-N 2.92Å; I56-L61 HydrophobicContact CG1-CD1 4.36Å; I56-L70 HydrophobicContact CD1-CD1 4.36Å; I56-L70 HydrophobicContact CG1-CD1 4.34Å
57N85.3Confident90.1Very high89 Ų8945.4 Ų45.448%0.47623%0.226SC..Iπ-helixtrans-85.7-36.8-168.1-62.6-31.1000113.5L53L53-N57 VanDerWaalsContact O-CB 3.23Å; L53-N57 WeakPolarHBondContact O-CB 3.4Å; L53-N57 PolarHBondContact O-N 2.82Å; L53-N57 PolarHBondContact O-ND2 3.28Å
58C83.1Confident90.2Very high39 Ų3945 Ų4526%0.26422%0.22SC..Iπ-helixtrans-95.3-48.6-175.8-55.70000111.8I54 Y307I54-C58 HydrophobicContact CG2-CB 4.33Å; I54-C58 WeakPolarHBondContact O-CA 3.46Å; I54-C58 VanDerWaalsContact O-CB 3.26Å; I54-C58 WeakPolarHBondContact O-CB 3.42Å; I54-C58 PolarHBondContact O-N 3.12Å; C58-Y307 HydrophobicContact CB-CD1 3.69Å; C58-Y307 HydrophobicContact CB-CE1 4.27Å; C58-Y307 HydrophobicContact CB-CG 4.25Å
59K82.6Confident90.1Very high37 Ų3745.7 Ų45.716%0.16122%0.224CC..Iπ-helixtrans-86.8-23.3-177.8-76.6179140.1-1560114.1I54 L55 L61 D66 Y307I54-K59 PolarHBondContact O-N 3.26Å; L55-K59 HydrophobicContact CD2-CD 3.76Å; L55-K59 CarbonylContact O-C 3.08Å; K59-L61 PolarHBondContact O-N 3.34Å; K59-D66 IonicContact NZ-OD1 2.58Å; K59-D66 PolarHBondContact NZ-OD1 3.28Å; K59-Y307 HydrophobicContact CD-CD2 4.23Å; K59-Y307 HydrophobicContact CD-CE2 4.05Å; K59-Y307 HydrophobicContact CG-CD2 3.91Å; K59-Y307 HydrophobicContact CG-CE1 4.38Å; K59-Y307 HydrophobicContact CG-CE2 3.56Å; K59-Y307 HydrophobicContact CG-CG 4.49Å
60R86.9Confident90.2Very high182 Ų18243.5 Ų43.569%0.68721%0.213SC*.THydrogen-bonded Turntrans55.432.5179.5-53.5-175.2-177.8-178.1-0.5113.9L55 I56 K62L55-R60 PolarHBondContact O-N 3.45Å; I56-R60 WeakPolarHBondContact O-CA 3.3Å; I56-R60 PolarHBondContact O-N 2.92Å; R60-K62 HydrophobicContact CB-CG 4.38Å; R60-K62 PolarHBondContact O-N 3.38Å
61L87.5Confident90.4Very high40 Ų4042.9 Ų42.921%0.20921%0.21CC..THydrogen-bonded Turntrans47.139.9172-55.4175.2000115.1L55 I56 K59 S63 D66 I67 L70L55-L61 HydrophobicContact CB-CD2 3.91Å; L55-L61 PolarHBondContact O-N 3.19Å; I56-L61 HydrophobicContact CG1-CD1 4.36Å; K59-L61 PolarHBondContact O-N 3.34Å; L61-S63 PolarHBondContact O-N 3.19Å; L61-D66 HydrophobicContact CD2-CB 4.23Å; L61-I67 HydrophobicContact CB-CD1 3.89Å; L61-I67 HydrophobicContact CD1-CD1 4.24Å; L61-I67 HydrophobicContact CG-CD1 4.45Å; L61-L70 HydrophobicContact CD1-CD2 3.78Å; L61-L70 HydrophobicContact CD2-CB 4.19Å; L61-L70 HydrophobicContact CD2-CD2 4.04Å
62K86.6Confident90.6Very high160 Ų16042.8 Ų42.870%0.69621%0.21SC*.  trans-74.8-5.6-172.1-65.4-176.9-179.2-172.60114.5R60R60-K62 HydrophobicContact CB-CG 4.38Å; R60-K62 PolarHBondContact O-N 3.38Å
63S88.3Confident90.7Very high39 Ų3941.7 Ų41.727%0.27320%0.204SC..SBendtrans-136.5151.8-176.875.30000112L61 T65 D66 I67L61-S63 PolarHBondContact O-N 3.19Å; S63-T65 PolarHBondContact O-N 3.03Å; S63-D66 PolarHBondContact N-OD2 3.41Å; S63-D66 WeakPolarHBondContact O-CB 3.14Å; S63-D66 PolarHBondContact O-N 3.42Å; S63-D66 PolarHBondContact OG-N 3.48Å; S63-D66 PolarHBondContact OG-OD2 3.25Å; S63-I67 PolarHBondContact O-N 3.34Å
64M91.3Very high91Very high19 Ų1940.6 Ų40.69%0.09420%0.198CC..Hα-helixtrans-53.2-37.5174.1-173.9173.6-172.800112.5D66 I67 Y68 R140M64-D66 PolarHBondContact O-N 2.96Å; M64-I67 WeakPolarHBondContact O-CB 3.35Å; M64-I67 PolarHBondContact O-N 2.98Å; M64-Y68 HydrophobicContact CE-CE2 3.91Å; M64-Y68 WeakPolarHBondContact CE-OH 3.25Å; M64-Y68 HydrophobicContact CG-CD2 4.44Å; M64-Y68 HydrophobicContact CG-CE2 3.91Å; M64-Y68 PolarHBondContact O-N 3.44Å; M64-R140 HydrophobicContact SD-CB 3.98Å; M64-R140 HydrophobicContact SD-CG 4.13Å
65T90.9Very high91.4Very high20 Ų2040.6 Ų40.612%0.12320%0.198CC..Hα-helixtrans-62.9-39.8175.1-44.80000112.2S63 I67 Y68 L69 L122 D125 R126S63-T65 PolarHBondContact O-N 3.03Å; T65-I67 VanDerWaalsContact C-N 3.3Å; T65-I67 PolarHBondContact O-N 3.49Å; T65-Y68 PolarHBondContact O-N 3.23Å; T65-L69 HydrophobicContact CG2-CD1 4.33Å; T65-L69 VanDerWaalsContact O-CG 3.31Å; T65-L69 WeakPolarHBondContact O-CG 3.2Å; T65-L69 PolarHBondContact O-N 3.39Å; T65-L122 HydrophobicContact CG2-CD2 3.73Å; T65-D125 PolarHBondContact OG1-OD2 2.83Å; T65-R126 PolarHBondContact OG1-NH2 2.85Å
66D91.6Very high91.7Very high16 Ų1640.9 Ų40.99%0.08620%0.199CC..Hα-helixtrans-67.5-33.4177.7-60.3-51.1000111.2L55 K59 L61 S63 M64 L70L55-D66 HydrophobicContact CD2-CB 4.25Å; K59-D66 IonicContact NZ-OD1 2.58Å; K59-D66 PolarHBondContact NZ-OD1 3.28Å; L61-D66 HydrophobicContact CD2-CB 4.23Å; S63-D66 PolarHBondContact N-OD2 3.41Å; S63-D66 WeakPolarHBondContact O-CB 3.14Å; S63-D66 PolarHBondContact O-N 3.42Å; S63-D66 PolarHBondContact OG-N 3.48Å; S63-D66 PolarHBondContact OG-OD2 3.25Å; M64-D66 PolarHBondContact O-N 2.96Å; D66-L70 WeakPolarHBondContact O-CB 3.44Å; D66-L70 PolarHBondContact O-N 2.88Å
67I95.1Very high92Very high14 Ų1438 Ų387%0.07219%0.185CC..Hα-helixtrans-63.9-45.6172.8-59.7-65.4000111L61 S63 M64 T65 L70 N71 V142L61-I67 HydrophobicContact CB-CD1 3.89Å; L61-I67 HydrophobicContact CD1-CD1 4.24Å; L61-I67 HydrophobicContact CG-CD1 4.45Å; S63-I67 PolarHBondContact O-N 3.34Å; M64-I67 WeakPolarHBondContact O-CB 3.35Å; M64-I67 PolarHBondContact O-N 2.98Å; T65-I67 VanDerWaalsContact C-N 3.3Å; T65-I67 PolarHBondContact O-N 3.49Å; I67-L70 WeakPolarHBondContact O-CB 3.5Å; I67-L70 PolarHBondContact O-N 3.26Å; I67-N71 PolarHBondContact O-N 2.94Å; I67-N71 PolarHBondContact O-ND2 3.07Å; I67-V142 HydrophobicContact CD1-CG1 4.23Å; I67-V142 HydrophobicContact CG1-CG1 4.24Å
68Y95.3Very high92.5Very high5 Ų537 Ų372%0.0218%0.176CC..Hα-helixtrans-67.9-39178.3-64.6-22.6000113M64 T65 L70 N71 L72 F118 L121 L122 D125 T148M64-Y68 HydrophobicContact CE-CE2 3.91Å; M64-Y68 WeakPolarHBondContact CE-OH 3.25Å; M64-Y68 HydrophobicContact CG-CD2 4.44Å; M64-Y68 HydrophobicContact CG-CE2 3.91Å; M64-Y68 PolarHBondContact O-N 3.44Å; T65-Y68 PolarHBondContact O-N 3.23Å; Y68-L70 VanDerWaalsContact C-N 3.29Å; Y68-L70 PolarHBondContact O-N 3.45Å; Y68-N71 PolarHBondContact O-N 2.84Å; Y68-L72 WeakPolarHBondContact O-CB 3.31Å; Y68-L72 PolarHBondContact O-N 3.34Å; Y68-F118 HydrophobicContact CD1-CD1 4.11Å; Y68-F118 HydrophobicContact CD1-CE1 4.25Å; Y68-L121 HydrophobicContact CD2-CB 4Å; Y68-L121 HydrophobicContact CE1-CB 4.45Å; Y68-L121 HydrophobicContact CE1-CD1 4.02Å; Y68-L121 HydrophobicContact CE2-CB 3.75Å; Y68-L121 HydrophobicContact CG-CB 4.42Å; Y68-L122 HydrophobicContact CD2-CD2 4.36Å; Y68-D125 HydrophobicContact CD2-CB 4.28Å; Y68-D125 HydrophobicContact CE2-CB 4.06Å; Y68-T148 WeakPolarHBondContact CE1-OG1 3.29Å; Y68-T148 WeakPolarHBondContact OH-CB 3.23Å; Y68-T148 PolarHBondContact OH-OG1 3.49Å
69L93.6Very high93Very high16 Ų1635.4 Ų35.48%0.08417%0.165CC..Hα-helixtrans-62.8-36.8173-71.2171.8000112.1L55 T65 A73 L122 Y297L55-L69 HydrophobicContact CD1-CB 3.94Å; L55-L69 HydrophobicContact CD2-CB 4.47Å; T65-L69 HydrophobicContact CG2-CD1 4.33Å; T65-L69 VanDerWaalsContact O-CG 3.31Å; T65-L69 WeakPolarHBondContact O-CG 3.2Å; T65-L69 PolarHBondContact O-N 3.39Å; L69-A73 PolarHBondContact O-N 2.88Å; L69-A73 VanDerWaalsContact O-N 3.09Å; L69-L122 HydrophobicContact CD2-CD1 3.9Å; L69-L122 HydrophobicContact CD2-CD2 4.24Å; L69-L122 HydrophobicContact CG-CD2 4.13Å; L69-Y297 HydrophobicContact CD2-CE1 4.2Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.38Å
70L95.9Very high93.7Very high22 Ų2233.6 Ų33.612%0.11516%0.157CC..Hα-helixtrans-63.6-49174.8177.770.2000111I52 L55 I56 L61 D66 I67 Y68 L72 A73 I74I52-L70 HydrophobicContact CB-CD1 4.26Å; I52-L70 HydrophobicContact CG1-CD1 3.98Å; I52-L70 HydrophobicContact CG2-CD1 3.94Å; L55-L70 HydrophobicContact CD1-CB 4.04Å; I56-L70 HydrophobicContact CD1-CD1 4.36Å; I56-L70 HydrophobicContact CG1-CD1 4.34Å; L61-L70 HydrophobicContact CD1-CD2 3.78Å; L61-L70 HydrophobicContact CD2-CB 4.19Å; L61-L70 HydrophobicContact CD2-CD2 4.04Å; D66-L70 WeakPolarHBondContact O-CB 3.44Å; D66-L70 PolarHBondContact O-N 2.88Å; I67-L70 WeakPolarHBondContact O-CB 3.5Å; I67-L70 PolarHBondContact O-N 3.26Å; Y68-L70 VanDerWaalsContact C-N 3.29Å; Y68-L70 PolarHBondContact O-N 3.45Å; L70-L72 VanDerWaalsContact C-N 3.31Å; L70-L72 PolarHBondContact O-N 3.02Å; L70-A73 PolarHBondContact O-N 3.37Å; L70-I74 HydrophobicContact CD1-CD1 4.46Å; L70-I74 HydrophobicContact CG-CD1 4.07Å; L70-I74 WeakPolarHBondContact O-CG1 3.39Å; L70-I74 PolarHBondContact O-N 2.96Å
71N97.8Very high94.1Very high20 Ų2028.8 Ų28.811%0.10715%0.145CC..Hα-helixtrans-66.2-34.3180-75.5-80.5000112.4I67 Y68 I74 S75 F118 S149 W153I67-N71 PolarHBondContact O-N 2.94Å; I67-N71 PolarHBondContact O-ND2 3.07Å; Y68-N71 PolarHBondContact O-N 2.84Å; N71-I74 PolarHBondContact O-N 2.97Å; N71-S75 WeakPolarHBondContact O-CB 3.47Å; N71-S75 PolarHBondContact O-N 2.79Å; N71-F118 HydrophobicContact CB-CD1 3.82Å; N71-F118 HydrophobicContact CB-CD2 3.78Å; N71-F118 HydrophobicContact CB-CE1 3.49Å; N71-F118 VanDerWaalsContact CB-CE1 3.49Å; N71-F118 HydrophobicContact CB-CE2 3.46Å; N71-F118 VanDerWaalsContact CB-CE2 3.46Å; N71-F118 HydrophobicContact CB-CG 3.99Å; N71-F118 HydrophobicContact CB-CZ 3.32Å; N71-S149 PolarHBondContact ND2-OG 2.81Å; N71-W153 PolarHBondContact OD1-NE1 3.27Å
72L96Very high94.4Very high1 Ų126.9 Ų26.91%0.00514%0.135CC..Hα-helixtrans-61.3-45.6172.4-177.658.9000111.4Y68 L70 I74 S75 D76 G115 F118 I119 L122 Y297Y68-L72 WeakPolarHBondContact O-CB 3.31Å; Y68-L72 PolarHBondContact O-N 3.34Å; L70-L72 VanDerWaalsContact C-N 3.31Å; L70-L72 PolarHBondContact O-N 3.02Å; L72-I74 VanDerWaalsContact C-N 3.33Å; L72-I74 PolarHBondContact O-N 3.3Å; L72-S75 VanDerWaalsContact O-CB 3.24Å; L72-S75 WeakPolarHBondContact O-CB 3.36Å; L72-S75 PolarHBondContact O-N 3.49Å; L72-D76 PolarHBondContact O-N 3.26Å; L72-G115 WeakPolarHBondContact CD1-O 3.35Å; L72-F118 HydrophobicContact CB-CB 4.16Å; L72-F118 HydrophobicContact CD1-CB 4.33Å; L72-I119 HydrophobicContact CD1-CD1 4.38Å; L72-I119 HydrophobicContact CD1-CG1 4.02Å; L72-I119 HydrophobicContact CD2-CG1 4.06Å; L72-L122 HydrophobicContact CD2-CD1 3.95Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.34Å
73A96.5Very high94.8Very high1 Ų119.3 Ų19.31%0.00810%0.102CC..Hα-helixtrans-64-36.7175.600000112.6V51 I52 L69 L70 S75 D76 L77V51-A73 HydrophobicContact CB-CB 4.46Å; V51-A73 HydrophobicContact CG1-CB 4.06Å; I52-A73 HydrophobicContact CD1-CB 4.26Å; I52-A73 HydrophobicContact CG1-CB 3.82Å; L69-A73 PolarHBondContact O-N 2.88Å; L69-A73 VanDerWaalsContact O-N 3.09Å; L70-A73 PolarHBondContact O-N 3.37Å; A73-S75 VanDerWaalsContact C-N 3.35Å; A73-D76 PolarHBondContact O-N 3.41Å; A73-L77 WeakPolarHBondContact O-CG 3.35Å; A73-L77 PolarHBondContact O-N 2.87Å
74I97.6Very high95Very high52 Ų5220 Ų2027%0.26711%0.105SC..Hα-helixtrans-65.3-40.4173.6-66.6166.9000110.8I52 L70 N71 L72 L77 F78 W153I52-I74 HydrophobicContact CD1-CG1 4.19Å; L70-I74 HydrophobicContact CD1-CD1 4.46Å; L70-I74 HydrophobicContact CG-CD1 4.07Å; L70-I74 WeakPolarHBondContact O-CG1 3.39Å; L70-I74 PolarHBondContact O-N 2.96Å; N71-I74 PolarHBondContact O-N 2.97Å; L72-I74 VanDerWaalsContact C-N 3.33Å; L72-I74 PolarHBondContact O-N 3.3Å; I74-L77 WeakPolarHBondContact O-CB 3.48Å; I74-L77 PolarHBondContact O-N 3.19Å; I74-F78 HydrophobicContact CG2-CE1 4.47Å; I74-F78 HydrophobicContact CG2-CE2 4.29Å; I74-F78 HydrophobicContact CG2-CZ 4.19Å; I74-F78 PolarHBondContact O-N 3.47Å; I74-W153 HydrophobicContact CB-CZ2 4.26Å; I74-W153 HydrophobicContact CG2-CH2 3.99Å; I74-W153 HydrophobicContact CG2-CZ2 3.78Å
75S97.4Very high95.1Very high0 Ų021.4 Ų21.40%011%0.111CC..Hα-helixtrans-59.2-46.3174.8-166.10000112N71 L72 A73 L77 F78 F79 G111 S114 G115N71-S75 WeakPolarHBondContact O-CB 3.47Å; N71-S75 PolarHBondContact O-N 2.79Å; L72-S75 VanDerWaalsContact O-CB 3.24Å; L72-S75 WeakPolarHBondContact O-CB 3.36Å; L72-S75 PolarHBondContact O-N 3.49Å; A73-S75 VanDerWaalsContact C-N 3.35Å; S75-L77 VanDerWaalsContact C-N 3.29Å; S75-L77 PolarHBondContact O-N 3.24Å; S75-F78 PolarHBondContact O-N 3.3Å; S75-F79 PolarHBondContact O-N 2.98Å; S75-F79 VanDerWaalsContact O-N 3.14Å; S75-G111 PolarHBondContact OG-O 2.96Å; S75-S114 WeakPolarHBondContact CB-OG 3.43Å; S75-S114 PolarHBondContact OG-OG 3.31Å; S75-G115 WeakPolarHBondContact OG-CA 3.43Å; S75-G115 PolarHBondContact OG-N 3.22Å
76D96.8Very high95.1Very high8 Ų821.9 Ų21.94%0.04311%0.111CC..Hα-helixtrans-62.8-36.9175.7-71-34.1000111.2L72 A73 F79 L80 C290 N293L72-D76 PolarHBondContact O-N 3.26Å; A73-D76 PolarHBondContact O-N 3.41Å; D76-F79 WeakPolarHBondContact O-CB 3.24Å; D76-F79 PolarHBondContact O-N 2.95Å; D76-L80 WeakPolarHBondContact O-CB 3.38Å; D76-L80 WeakPolarHBondContact O-CD1 3.31Å; D76-L80 WeakPolarHBondContact O-CG 3.19Å; D76-L80 PolarHBondContact O-N 2.64Å; D76-C290 HydrophobicContact CB-CB 4.36Å; D76-N293 PolarHBondContact OD2-ND2 2.69Å
77L96.8Very high95.1Very high17 Ų1721.5 Ų21.59%0.08911%0.109CC..Hα-helixtrans-65-43.1174.7-73.6178.2000112.9F45 N48 M49 I52 A73 I74 S75 F79 L80 L81F45-L77 HydrophobicContact CD2-CD2 3.97Å; F45-L77 HydrophobicContact CE2-CD2 4.39Å; N48-L77 HydrophobicContact CB-CD2 3.94Å; N48-L77 HydrophobicContact CB-CG 4.08Å; M49-L77 HydrophobicContact CE-CD1 3.49Å; M49-L77 VanDerWaalsContact CE-CD1 3.49Å; M49-L77 HydrophobicContact CE-CD2 3.99Å; M49-L77 HydrophobicContact CE-CG 4.4Å; M49-L77 HydrophobicContact CG-CD2 4.41Å; M49-L77 HydrophobicContact SD-CD1 3.9Å; I52-L77 HydrophobicContact CD1-CD1 3.37Å; I52-L77 HydrophobicContact CD1-CG 4.42Å; A73-L77 WeakPolarHBondContact O-CG 3.35Å; A73-L77 PolarHBondContact O-N 2.87Å; I74-L77 WeakPolarHBondContact O-CB 3.48Å; I74-L77 PolarHBondContact O-N 3.19Å; S75-L77 VanDerWaalsContact C-N 3.29Å; S75-L77 PolarHBondContact O-N 3.24Å; L77-F79 PolarHBondContact O-N 2.87Å; L77-L80 HydrophobicContact CD2-CD1 4.22Å; L77-L80 PolarHBondContact O-N 3.29Å; L77-L81 VanDerWaalsContact O-CG 3.29Å; L77-L81 WeakPolarHBondContact O-CG 3.49Å; L77-L81 PolarHBondContact O-N 2.77Å
78F95.6Very high94.9Very high68 Ų6824.2 Ų24.230%0.29812%0.122SC..Hα-helixtrans-58.9-40174.3-74-16.1000111.8I74 S75 L81 L107 I110 W153I74-F78 HydrophobicContact CG2-CE1 4.47Å; I74-F78 HydrophobicContact CG2-CE2 4.29Å; I74-F78 HydrophobicContact CG2-CZ 4.19Å; I74-F78 PolarHBondContact O-N 3.47Å; S75-F78 PolarHBondContact O-N 3.3Å; F78-L81 HydrophobicContact CD1-CD1 4.43Å; F78-L107 HydrophobicContact CB-CD2 4.47Å; F78-L107 HydrophobicContact CD1-CD2 4.43Å; F78-L107 HydrophobicContact CG-CD2 4.34Å; F78-I110 HydrophobicContact CD2-CG2 4.06Å; F78-W153 AromaticContact CD2-CH2 3.54Å; F78-W153 HydrophobicContact CD2-CH2 3.54Å; F78-W153 AromaticContact CD2-CZ3 3.55Å; F78-W153 HydrophobicContact CD2-CZ3 3.55Å; F78-W153 HydrophobicContact CE2-CE3 4.32Å; F78-W153 AromaticContact CE2-CH2 3.43Å; F78-W153 HydrophobicContact CE2-CH2 3.43Å; F78-W153 VanDerWaalsContact CE2-CH2 3.43Å; F78-W153 HydrophobicContact CE2-CZ2 4.36Å; F78-W153 AromaticContact CE2-CZ3 3.42Å; F78-W153 HydrophobicContact CE2-CZ3 3.42Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.42Å
79F94.1Very high94.6Very high6 Ų627.2 Ų27.23%0.02613%0.133CC..Hα-helixtrans-64.1-48.8173.9-164-87.5000111.6S75 D76 L77 L81 T82 V83 Y108 W248 M287 C290S75-F79 PolarHBondContact O-N 2.98Å; S75-F79 VanDerWaalsContact O-N 3.14Å; D76-F79 WeakPolarHBondContact O-CB 3.24Å; D76-F79 PolarHBondContact O-N 2.95Å; L77-F79 PolarHBondContact O-N 2.87Å; F79-L81 VanDerWaalsContact C-N 3.32Å; F79-L81 PolarHBondContact O-N 2.91Å; F79-T82 WeakPolarHBondContact O-CB 3.37Å; F79-T82 PolarHBondContact O-N 3.04Å; F79-T82 PolarHBondContact O-OG1 2.9Å; F79-V83 HydrophobicContact CD1-CG2 4.41Å; F79-Y108 HydrophobicContact CD2-CD2 4.04Å; F79-Y108 HydrophobicContact CD2-CE2 4.33Å; F79-Y108 HydrophobicContact CE1-CE2 4.44Å; F79-Y108 AromaticContact CE2-CD2 3.37Å; F79-Y108 HydrophobicContact CE2-CD2 3.37Å; F79-Y108 AromaticContact CE2-CE2 3.25Å; F79-Y108 HydrophobicContact CE2-CE2 3.25Å; F79-Y108 HydrophobicContact CE2-CG 4.12Å; F79-Y108 AromaticContact CE2-CZ 3.89Å; F79-Y108 AromaticContact CZ-CD2 3.74Å; F79-Y108 HydrophobicContact CZ-CD2 3.74Å; F79-Y108 AromaticContact CZ-CE2 3.33Å; F79-Y108 HydrophobicContact CZ-CE2 3.33Å; F79-W248 HydrophobicContact CE2-CH2 4.07Å; F79-W248 HydrophobicContact CE2-CZ2 4.21Å; F79-W248 AromaticContact CZ-CH2 3.93Å; F79-W248 HydrophobicContact CZ-CH2 3.93Å; F79-W248 HydrophobicContact CZ-CZ2 4.05Å; F79-M287 HydrophobicContact CE1-CB 4.1Å; F79-M287 HydrophobicContact CE1-CG 4.1Å; F79-M287 HydrophobicContact CZ-CB 4.4Å; F79-M287 HydrophobicContact CZ-CG 4Å; F79-C290 HydrophobicContact CD1-CB 3.98Å
80L96Very high94.2Very high0 Ų027.5 Ų27.50%014%0.138CC..Hα-helixtrans-60.1-36.5-179.9-78.2161.2000113.3V40 F41 G44 D76 L77 T82 V83 P84 C290V40-L80 HydrophobicContact CG1-CD2 4.27Å; F41-L80 HydrophobicContact CD2-CB 4.49Å; F41-L80 WeakPolarHBondContact CD2-O 3.06Å; G44-L80 WeakPolarHBondContact O-CD1 3.28Å; D76-L80 WeakPolarHBondContact O-CB 3.38Å; D76-L80 WeakPolarHBondContact O-CD1 3.31Å; D76-L80 WeakPolarHBondContact O-CG 3.19Å; D76-L80 PolarHBondContact O-N 2.64Å; L77-L80 HydrophobicContact CD2-CD1 4.22Å; L77-L80 PolarHBondContact O-N 3.29Å; L80-T82 PolarHBondContact O-N 3.41Å; L80-T82 VanDerWaalsContact O-N 3.13Å; L80-V83 WeakPolarHBondContact O-CB 3.4Å; L80-V83 PolarHBondContact O-N 3.36Å; L80-P84 VanDerWaalsContact O-CD 3.28Å; L80-P84 WeakPolarHBondContact O-CD 3.28Å; L80-C290 WeakPolarHBondContact CD2-SG 3.24Å; L80-C290 HydrophobicContact CG-CB 4.21Å
81L95.5Very high93.8Very high81 Ų8129.2 Ų29.242%0.42416%0.155SC..Hα-helixtrans-59.9-23.2176.7-72.9172.2000112.7L77 F78 F79 F85L77-L81 VanDerWaalsContact O-CG 3.29Å; L77-L81 WeakPolarHBondContact O-CG 3.49Å; L77-L81 PolarHBondContact O-N 2.77Å; F78-L81 HydrophobicContact CD1-CD1 4.43Å; F79-L81 VanDerWaalsContact C-N 3.32Å; F79-L81 PolarHBondContact O-N 2.91Å; L81-F85 WeakPolarHBondContact O-CD2 3.28Å; L81-F85 WeakPolarHBondContact O-CE2 3.49Å
82T94.3Very high93.2Very high0 Ų030.8 Ų30.80%017%0.171CC..Hα-helixtrans-84.6-25177750000113.4F79 L80 F85 W86 L104 L107F79-T82 WeakPolarHBondContact O-CB 3.37Å; F79-T82 PolarHBondContact O-N 3.04Å; F79-T82 PolarHBondContact O-OG1 2.9Å; L80-T82 PolarHBondContact O-N 3.41Å; L80-T82 VanDerWaalsContact O-N 3.13Å; T82-F85 WeakPolarHBondContact O-CB 3.45Å; T82-F85 PolarHBondContact O-N 3.02Å; T82-F85 VanDerWaalsContact O-N 3.09Å; T82-W86 VanDerWaalsContact C-CD1 3.42Å; T82-W86 PolarHBondContact O-N 3.45Å; T82-W86 PolarHBondContact OG1-NE1 2.99Å; T82-L104 HydrophobicContact CG2-CB 4.49Å; T82-L104 HydrophobicContact CG2-CD2 3.95Å; T82-L104 WeakPolarHBondContact CG2-O 3.42Å; T82-L107 HydrophobicContact CG2-CB 3.59Å
83V94.1Very high92.5Very high0 Ų033.5 Ų33.50%018%0.184CC..Hα-helixtrans-56.9-43.1-172.3176.60000113.9Y37 F41 F79 L80 F85 W86 A87Y37-V83 HydrophobicContact CG-CG1 4.06Å; Y37-V83 VanDerWaalsContact O-CG1 3.28Å; Y37-V83 WeakPolarHBondContact O-CG1 3.15Å; F41-V83 HydrophobicContact CB-CG1 4.32Å; F79-V83 HydrophobicContact CD1-CG2 4.41Å; L80-V83 WeakPolarHBondContact O-CB 3.4Å; L80-V83 PolarHBondContact O-N 3.36Å; V83-F85 VanDerWaalsContact C-N 3.27Å; V83-F85 PolarHBondContact O-N 3.45Å; V83-W86 PolarHBondContact O-N 2.97Å; V83-A87 PolarHBondContact O-N 3.36Å
84P93.9Very high91.9Very high53 Ų5333.6 Ų33.634%0.34418%0.184SC..Hα-helixtrans-60.2-35.2177.2-25.935.5000113.6F41 L80 A87 H88F41-P84 HydrophobicContact CD1-CG 4.37Å; F41-P84 HydrophobicContact CD2-CG 3.66Å; F41-P84 HydrophobicContact CE1-CG 4.46Å; F41-P84 HydrophobicContact CE2-CG 3.77Å; F41-P84 HydrophobicContact CG-CG 3.97Å; F41-P84 HydrophobicContact CZ-CG 4.18Å; L80-P84 VanDerWaalsContact O-CD 3.28Å; L80-P84 WeakPolarHBondContact O-CD 3.28Å; P84-A87 WeakPolarHBondContact O-CB 3.23Å; P84-A87 PolarHBondContact O-N 3.47Å; P84-H88 PolarHBondContact O-N 3.02Å
85F92.6Very high91.3Very high50 Ų5035.4 Ų35.422%0.21919%0.194CC..Hα-helixtrans-70.8-37.5178.3-62.1-90.3000111.3L81 T82 V83 A87 H88 Y89 F96 M100 L104L81-F85 WeakPolarHBondContact O-CD2 3.28Å; L81-F85 WeakPolarHBondContact O-CE2 3.49Å; T82-F85 WeakPolarHBondContact O-CB 3.45Å; T82-F85 PolarHBondContact O-N 3.02Å; T82-F85 VanDerWaalsContact O-N 3.09Å; V83-F85 VanDerWaalsContact C-N 3.27Å; V83-F85 PolarHBondContact O-N 3.45Å; F85-A87 VanDerWaalsContact C-N 3.34Å; F85-H88 PolarHBondContact O-N 3.3Å; F85-Y89 WeakPolarHBondContact O-CB 3.33Å; F85-Y89 PolarHBondContact O-N 3.48Å; F85-F96 HydrophobicContact CD1-CD1 4.05Å; F85-F96 AromaticContact CD1-CD2 3.86Å; F85-F96 HydrophobicContact CD1-CD2 3.86Å; F85-F96 AromaticContact CD1-CE1 3.89Å; F85-F96 HydrophobicContact CD1-CE1 3.89Å; F85-F96 AromaticContact CD1-CE2 3.69Å; F85-F96 HydrophobicContact CD1-CE2 3.69Å; F85-F96 HydrophobicContact CD1-CG 4.04Å; F85-F96 AromaticContact CD1-CZ 3.7Å; F85-F96 HydrophobicContact CD1-CZ 3.7Å; F85-F96 AromaticContact CE1-CD1 3.97Å; F85-F96 HydrophobicContact CE1-CD1 3.97Å; F85-F96 AromaticContact CE1-CE1 3.86Å; F85-F96 HydrophobicContact CE1-CE1 3.86Å; F85-F96 HydrophobicContact CE1-CE2 4.48Å; F85-F96 HydrophobicContact CE1-CG 4.33Å; F85-F96 HydrophobicContact CE1-CZ 4.14Å; F85-M100 HydrophobicContact CE1-CE 4.08Å; F85-M100 HydrophobicContact CE1-CG 4.43Å; F85-M100 HydrophobicContact CE1-SD 4.49Å; F85-M100 HydrophobicContact CZ-CE 4.19Å; F85-L104 HydrophobicContact CB-CD1 3.59Å; F85-L104 HydrophobicContact CD1-CD1 3.63Å; F85-L104 HydrophobicContact CD2-CD1 3.82Å; F85-L104 HydrophobicContact CD2-CD2 3.63Å; F85-L104 HydrophobicContact CD2-CG 4.41Å; F85-L104 HydrophobicContact CE1-CD1 4.22Å; F85-L104 HydrophobicContact CE2-CD1 4.39Å; F85-L104 HydrophobicContact CE2-CD2 3.88Å; F85-L104 HydrophobicContact CG-CD1 3.39Å; F85-L104 HydrophobicContact CG-CD2 4.12Å; F85-L104 HydrophobicContact CG-CG 4.43Å
86W90.7Very high90.7Very high30 Ų3039 Ų3911%0.11421%0.21CC..Hα-helixtrans-67.6-35.2173-58124.7000112.4Y37 T82 V83 Y89 A90 Y108 M287Y37-W86 HydrophobicContact CD2-CB 4.14Å; Y37-W86 HydrophobicContact CE2-CB 4.01Å; T82-W86 VanDerWaalsContact C-CD1 3.42Å; T82-W86 PolarHBondContact O-N 3.45Å; T82-W86 PolarHBondContact OG1-NE1 2.99Å; V83-W86 PolarHBondContact O-N 2.97Å; W86-Y89 HydrophobicContact CE3-CD1 4.42Å; W86-Y89 PolarHBondContact O-N 3.04Å; W86-A90 WeakPolarHBondContact O-CB 3.46Å; W86-A90 PolarHBondContact O-N 3.06Å; W86-Y108 HydrophobicContact CZ2-CD2 4.45Å; W86-M287 HydrophobicContact CG-CE 4.38Å
87A91.6Very high90.1Very high7 Ų740.4 Ų40.46%0.05823%0.226CC..Hα-helixtrans-62.9-46.6173.600000111.3Y37 V83 P84 F85 A90 A91Y37-A87 HydrophobicContact CD2-CB 4.17Å; V83-A87 PolarHBondContact O-N 3.36Å; P84-A87 WeakPolarHBondContact O-CB 3.23Å; P84-A87 PolarHBondContact O-N 3.47Å; F85-A87 VanDerWaalsContact C-N 3.34Å; A87-A90 PolarHBondContact O-N 2.64Å; A87-A91 PolarHBondContact O-N 3.36Å; A87-A91 VanDerWaalsContact O-N 3.13Å
88H91.3Very high89.5Confident72 Ų7242.4 Ų42.433%0.33324%0.237SC..Hα-helixtrans-62.5-45.8174.6-17777.8000112P84 F85 A90 A91 A92 D95 F96P84-H88 PolarHBondContact O-N 3.02Å; F85-H88 PolarHBondContact O-N 3.3Å; H88-A90 VanDerWaalsContact C-N 3.28Å; H88-A90 PolarHBondContact O-N 3.45Å; H88-A91 PolarHBondContact O-N 3.39Å; H88-A91 VanDerWaalsContact O-N 3.09Å; H88-A92 PolarHBondContact O-N 3.33Å; H88-D95 IonicContact CD2-OD2 2.85Å; H88-D95 IonicContact CE1-OD2 3.77Å; H88-D95 IonicContact NE2-OD2 3.75Å; H88-D95 PolarHBondContact NE2-OD2 3.27Å; H88-F96 HydrophobicContact CB-CE2 4.36Å; H88-F96 HydrophobicContact CB-CZ 4.46Å; H88-F96 AromaticContact CD2-CE2 3.62Å; H88-F96 AromaticContact CD2-CZ 3.88Å
89Y87.9Confident89.1Confident68 Ų6844.7 Ų44.727%0.26726%0.256SS..Hα-helixtrans-59.8-38.5178.5177.8-112.3000112.4F85 W86 W94 C178F85-Y89 WeakPolarHBondContact O-CB 3.33Å; F85-Y89 PolarHBondContact O-N 3.48Å; W86-Y89 HydrophobicContact CE3-CD1 4.42Å; W86-Y89 PolarHBondContact O-N 3.04Å; Y89-W94 HydrophobicContact CD2-CB 3.89Å; Y89-W94 AromaticContact CD2-CE3 3.92Å; Y89-W94 HydrophobicContact CD2-CE3 3.92Å; Y89-W94 HydrophobicContact CE2-CB 3.99Å; Y89-W94 HydrophobicContact CG-CE3 4.21Å; Y89-C178 HydrophobicContact CE2-CB 4Å; Y89-C178 PolarHBondContact OH-N 2.92Å
90A86.6Confident88.9Confident21 Ų2147.5 Ų47.517%0.17427%0.27CS..Hα-helixtrans-67.3-37.6175.200000112.4A30 L33 P34 W86 A87 H88A30-A90 WeakPolarHBondContact CA-O 3.15Å; A30-A90 WeakPolarHBondContact CB-O 3.5Å; L33-A90 HydrophobicContact CB-CB 3.84Å; L33-A90 HydrophobicContact CD1-CB 3.97Å; P34-A90 HydrophobicContact CG-CB 4.36Å; W86-A90 WeakPolarHBondContact O-CB 3.46Å; W86-A90 PolarHBondContact O-N 3.06Å; A87-A90 PolarHBondContact O-N 2.64Å; H88-A90 VanDerWaalsContact C-N 3.28Å; H88-A90 PolarHBondContact O-N 3.45Å
91A86.4Confident88.4Confident58 Ų5848.3 Ų48.348%0.47927%0.273SS..Hα-helixtrans-74.3-36.3-179.200000113.3P34 A87 H88P34-A91 HydrophobicContact CB-CB 4.38Å; P34-A91 HydrophobicContact CG-CB 3.71Å; A87-A91 PolarHBondContact O-N 3.36Å; A87-A91 VanDerWaalsContact O-N 3.13Å; H88-A91 PolarHBondContact O-N 3.39Å; H88-A91 VanDerWaalsContact O-N 3.09Å
92A85.2Confident88.1Confident53 Ų5347.4 Ų47.444%0.43827%0.267SS..SBendtrans-133.7-109.5-172.100000111.3H88H88-A92 PolarHBondContact O-N 3.33Å
93Q81.4Confident88Confident59 Ų5952.1 Ų52.128%0.27629%0.292SS..  trans-147.2179-17868.5-176.1-0.200110.4D95 H175Q93-D95 VanDerWaalsContact CG-OD1 3.22Å; Q93-D95 WeakPolarHBondContact CG-OD1 3.36Å; Q93-D95 PolarHBondContact NE2-OD1 2.88Å; Q93-D95 PolarHBondContact O-N 3.49Å; Q93-H175 PolarHBondContact OE1-ND1 3.41Å
94W84.1Confident87.9Confident3 Ų352.4 Ų52.41%0.01129%0.293CS..  trans-84100177.9-170.7-94.6000112.2Y89 F96 G97 R101 L104Y89-W94 HydrophobicContact CD2-CB 3.89Å; Y89-W94 AromaticContact CD2-CE3 3.92Å; Y89-W94 HydrophobicContact CD2-CE3 3.92Å; Y89-W94 HydrophobicContact CE2-CB 3.99Å; Y89-W94 HydrophobicContact CG-CE3 4.21Å; W94-F96 HydrophobicContact CD2-CD2 4.47Å; W94-F96 HydrophobicContact CE3-CD2 4.46Å; W94-F96 HydrophobicContact CH2-CD2 4.41Å; W94-F96 HydrophobicContact CZ2-CB 4.03Å; W94-F96 HydrophobicContact CZ2-CD2 4.35Å; W94-F96 HydrophobicContact CZ3-CD2 4.45Å; W94-G97 PolarHBondContact NE1-O 3.41Å; W94-R101 HydrophobicContact CH2-CB 4.43Å; W94-R101 HydrophobicContact CZ2-CB 3.58Å; W94-R101 HydrophobicContact CZ2-CG 4.32Å; W94-L104 HydrophobicContact CH2-CD1 3.57Å; W94-L104 HydrophobicContact CZ2-CD1 4.22Å
95D85.6Confident87.8Confident89 Ų8950 Ų5048%0.47628%0.278SS..  trans-99.1-4.6-177.8-57.3-52.4000114.2H88 Q93H88-D95 IonicContact CD2-OD2 2.85Å; H88-D95 IonicContact CE1-OD2 3.77Å; H88-D95 IonicContact NE2-OD2 3.75Å; H88-D95 PolarHBondContact NE2-OD2 3.27Å; Q93-D95 VanDerWaalsContact CG-OD1 3.22Å; Q93-D95 WeakPolarHBondContact CG-OD1 3.36Å; Q93-D95 PolarHBondContact NE2-OD1 2.88Å; Q93-D95 PolarHBondContact O-N 3.49Å
96F84.3Confident87.8Confident77 Ų7747.9 Ų47.934%0.33827%0.269SS..SBendtrans-91.32.4-169.4-53.7-77.8000115.2F85 H88 W94 M100F85-F96 HydrophobicContact CD1-CD1 4.05Å; F85-F96 AromaticContact CD1-CD2 3.86Å; F85-F96 HydrophobicContact CD1-CD2 3.86Å; F85-F96 AromaticContact CD1-CE1 3.89Å; F85-F96 HydrophobicContact CD1-CE1 3.89Å; F85-F96 AromaticContact CD1-CE2 3.69Å; F85-F96 HydrophobicContact CD1-CE2 3.69Å; F85-F96 HydrophobicContact CD1-CG 4.04Å; F85-F96 AromaticContact CD1-CZ 3.7Å; F85-F96 HydrophobicContact CD1-CZ 3.7Å; F85-F96 AromaticContact CE1-CD1 3.97Å; F85-F96 HydrophobicContact CE1-CD1 3.97Å; F85-F96 AromaticContact CE1-CE1 3.86Å; F85-F96 HydrophobicContact CE1-CE1 3.86Å; F85-F96 HydrophobicContact CE1-CE2 4.48Å; F85-F96 HydrophobicContact CE1-CG 4.33Å; F85-F96 HydrophobicContact CE1-CZ 4.14Å; H88-F96 HydrophobicContact CB-CE2 4.36Å; H88-F96 HydrophobicContact CB-CZ 4.46Å; H88-F96 AromaticContact CD2-CE2 3.62Å; H88-F96 AromaticContact CD2-CZ 3.88Å; W94-F96 HydrophobicContact CD2-CD2 4.47Å; W94-F96 HydrophobicContact CE3-CD2 4.46Å; W94-F96 HydrophobicContact CH2-CD2 4.41Å; W94-F96 HydrophobicContact CZ2-CB 4.03Å; W94-F96 HydrophobicContact CZ2-CD2 4.35Å; W94-F96 HydrophobicContact CZ3-CD2 4.45Å; F96-M100 HydrophobicContact CB-CB 3.78Å; F96-M100 HydrophobicContact CB-CG 3.75Å; F96-M100 HydrophobicContact CG-CG 4.43Å; F96-M100 VanDerWaalsContact O-CB 3.27Å; F96-M100 WeakPolarHBondContact O-CB 3.39Å
97G85.2Confident88Confident37 Ų3748.2 Ų48.238%0.38127%0.273SS..Hα-helixtrans71.5177.3-179.300000114.8W94 R101W94-G97 PolarHBondContact NE1-O 3.41Å; G97-R101 PolarHBondContact O-N 3.2Å
98N84.1Confident88.1Confident58 Ų5848.5 Ų48.531%0.3127%0.273SS..Hα-helixtrans-74.1-33.9-171.5-173.170.6000113.9R101 Q102 R168 S169N98-R101 VanDerWaalsContact O-CB 3.3Å; N98-R101 WeakPolarHBondContact O-CB 3.23Å; N98-R101 PolarHBondContact O-N 3.48Å; N98-Q102 PolarHBondContact O-N 2.93Å; N98-R168 WeakPolarHBondContact OD1-CA 3.44Å; N98-S169 PolarHBondContact OD1-N 2.9Å
99T86.8Confident88.3Confident116 Ų11646.3 Ų46.371%0.71226%0.262SS*.Hα-helixtrans-65.1-47-179.4-49.60000111.4R101 Q102 L103T99-R101 PolarHBondContact O-N 3.11Å; T99-Q102 PolarHBondContact O-N 3.22Å; T99-L103 PolarHBondContact O-N 2.83Å; T99-L103 VanDerWaalsContact O-N 3.1Å
100M89.1Confident88.7Confident65 Ų6544.2 Ų44.232%0.3226%0.256SS..Hα-helixtrans-63.2-33.8175.8-171.163.197.600110.9F85 F96 L103 L104F85-M100 HydrophobicContact CE1-CE 4.08Å; F85-M100 HydrophobicContact CE1-CG 4.43Å; F85-M100 HydrophobicContact CE1-SD 4.49Å; F85-M100 HydrophobicContact CZ-CE 4.19Å; F96-M100 HydrophobicContact CB-CB 3.78Å; F96-M100 HydrophobicContact CB-CG 3.75Å; F96-M100 HydrophobicContact CG-CG 4.43Å; F96-M100 VanDerWaalsContact O-CB 3.27Å; F96-M100 WeakPolarHBondContact O-CB 3.39Å; M100-L103 PolarHBondContact O-N 2.9Å; M100-L103 HydrophobicContact SD-CD2 4.19Å; M100-L104 HydrophobicContact CG-CD1 3.6Å; M100-L104 HydrophobicContact CG-CG 4.09Å; M100-L104 WeakPolarHBondContact O-CB 3Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.38Å; M100-L104 PolarHBondContact O-N 3.34Å; M100-L104 HydrophobicContact SD-CD1 4.12Å; M100-L104 HydrophobicContact SD-CG 4.09Å
101R86.5Confident89.2Confident17 Ų1743.4 Ų43.46%0.06425%0.249CC..Hα-helixtrans-59.9-51.7176.3177.168.7-157.5137.3-5.2111.6W94 G97 N98 T99 L103 L104 T105 T167 C178W94-R101 HydrophobicContact CH2-CB 4.43Å; W94-R101 HydrophobicContact CZ2-CB 3.58Å; W94-R101 HydrophobicContact CZ2-CG 4.32Å; G97-R101 PolarHBondContact O-N 3.2Å; N98-R101 VanDerWaalsContact O-CB 3.3Å; N98-R101 WeakPolarHBondContact O-CB 3.23Å; N98-R101 PolarHBondContact O-N 3.48Å; T99-R101 PolarHBondContact O-N 3.11Å; R101-L103 VanDerWaalsContact C-N 3.33Å; R101-L103 PolarHBondContact O-N 3.44Å; R101-L104 PolarHBondContact O-N 3.4Å; R101-T105 PolarHBondContact NH1-OG1 3.06Å; R101-T105 PolarHBondContact NH2-OG1 3.28Å; R101-T105 WeakPolarHBondContact O-CB 3.47Å; R101-T105 PolarHBondContact O-N 2.97Å; R101-T105 PolarHBondContact O-OG1 3.01Å; R101-T105 VanDerWaalsContact O-OG1 3.08Å; R101-T167 HydrophobicContact CG-CG2 3.87Å; R101-C178 PolarHBondContact NE-SG 2.64Å; R101-C178 PolarHBondContact NH2-SG 3.19Å
102Q88.6Confident89.6Confident62 Ų6241.2 Ų41.229%0.2923%0.229SC..Hα-helixtrans-61.9-41.9179.2-70.8177.5-2800111.8N98 T99 G106 I164N98-Q102 PolarHBondContact O-N 2.93Å; T99-Q102 PolarHBondContact O-N 3.22Å; Q102-G106 PolarHBondContact O-N 3Å; Q102-I164 HydrophobicContact CB-CG2 4.17Å
103L91.9Very high90.2Very high100 Ų10038.7 Ų38.752%0.52421%0.208SC..Hα-helixtrans-61.9-49.8176.9-18063.4000111.9T99 M100 R101 G106 L107T99-L103 PolarHBondContact O-N 2.83Å; T99-L103 VanDerWaalsContact O-N 3.1Å; M100-L103 PolarHBondContact O-N 2.9Å; M100-L103 HydrophobicContact SD-CD2 4.19Å; R101-L103 VanDerWaalsContact C-N 3.33Å; R101-L103 PolarHBondContact O-N 3.44Å; L103-G106 WeakPolarHBondContact O-CA 3.36Å; L103-G106 PolarHBondContact O-N 3.42Å; L103-G106 VanDerWaalsContact O-N 3.13Å; L103-L107 HydrophobicContact CG-CD1 4.31Å; L103-L107 WeakPolarHBondContact O-CG 3.47Å; L103-L107 PolarHBondContact O-N 3.02Å
104L92.5Very high90.9Very high5 Ų535.9 Ų35.93%0.02620%0.195CC..Hα-helixtrans-67.6-37.7-178.2-69.7171.5000112.1T82 F85 W94 M100 R101 G106 L107 Y108T82-L104 HydrophobicContact CG2-CB 4.49Å; T82-L104 HydrophobicContact CG2-CD2 3.95Å; T82-L104 WeakPolarHBondContact CG2-O 3.42Å; F85-L104 HydrophobicContact CB-CD1 3.59Å; F85-L104 HydrophobicContact CD1-CD1 3.63Å; F85-L104 HydrophobicContact CD2-CD1 3.82Å; F85-L104 HydrophobicContact CD2-CD2 3.63Å; F85-L104 HydrophobicContact CD2-CG 4.41Å; F85-L104 HydrophobicContact CE1-CD1 4.22Å; F85-L104 HydrophobicContact CE2-CD1 4.39Å; F85-L104 HydrophobicContact CE2-CD2 3.88Å; F85-L104 HydrophobicContact CG-CD1 3.39Å; F85-L104 HydrophobicContact CG-CD2 4.12Å; F85-L104 HydrophobicContact CG-CG 4.43Å; W94-L104 HydrophobicContact CH2-CD1 3.57Å; W94-L104 HydrophobicContact CZ2-CD1 4.22Å; M100-L104 HydrophobicContact CG-CD1 3.6Å; M100-L104 HydrophobicContact CG-CG 4.09Å; M100-L104 WeakPolarHBondContact O-CB 3Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.38Å; M100-L104 PolarHBondContact O-N 3.34Å; M100-L104 HydrophobicContact SD-CD1 4.12Å; M100-L104 HydrophobicContact SD-CG 4.09Å; R101-L104 PolarHBondContact O-N 3.4Å; L104-G106 VanDerWaalsContact C-N 3.3Å; L104-G106 PolarHBondContact O-N 3.11Å; L104-L107 PolarHBondContact O-N 3.12Å; L104-Y108 VanDerWaalsContact O-CB 3.29Å; L104-Y108 WeakPolarHBondContact O-CB 3.49Å; L104-Y108 PolarHBondContact O-N 3.22Å
105T90.7Very high91.5Very high4 Ų436 Ų363%0.02520%0.198CC..Hα-helixtrans-61.5-40.9170-65.80000111.6R101 Y108 F109 T167R101-T105 PolarHBondContact NH1-OG1 3.06Å; R101-T105 PolarHBondContact NH2-OG1 3.28Å; R101-T105 WeakPolarHBondContact O-CB 3.47Å; R101-T105 PolarHBondContact O-N 2.97Å; R101-T105 PolarHBondContact O-OG1 3.01Å; R101-T105 VanDerWaalsContact O-OG1 3.08Å; T105-Y108 PolarHBondContact O-N 2.88Å; T105-F109 HydrophobicContact CG2-CD2 3.63Å; T105-F109 HydrophobicContact CG2-CE2 3.61Å; T105-F109 VanDerWaalsContact O-CD2 3.29Å; T105-F109 WeakPolarHBondContact O-CD2 3.25Å; T105-F109 PolarHBondContact O-N 3.29Å; T105-T167 HydrophobicContact CG2-CG2 4.39Å
106G93.3Very high92.1Very high4 Ų431.8 Ų31.84%0.04118%0.175CC..Hα-helixtrans-60.8-51.7174.800000112.1Q102 L103 L104 Y108 F109 I110Q102-G106 PolarHBondContact O-N 3Å; L103-G106 WeakPolarHBondContact O-CA 3.36Å; L103-G106 PolarHBondContact O-N 3.42Å; L103-G106 VanDerWaalsContact O-N 3.13Å; L104-G106 VanDerWaalsContact C-N 3.3Å; L104-G106 PolarHBondContact O-N 3.11Å; G106-Y108 VanDerWaalsContact C-N 3.31Å; G106-Y108 PolarHBondContact O-N 3.08Å; G106-F109 PolarHBondContact O-N 3.12Å; G106-I110 VanDerWaalsContact O-CB 3.24Å; G106-I110 WeakPolarHBondContact O-CB 3.37Å; G106-I110 WeakPolarHBondContact O-CD1 3.5Å; G106-I110 WeakPolarHBondContact O-CG1 3.44Å; G106-I110 PolarHBondContact O-N 3.18Å
107L95.6Very high92.7Very high37 Ų3729.1 Ų29.119%0.19416%0.164CC..Hα-helixtrans-60.3-39.5177.7-71.1174.7000112.5F78 T82 L103 L104 G111F78-L107 HydrophobicContact CB-CD2 4.47Å; F78-L107 HydrophobicContact CD1-CD2 4.43Å; F78-L107 HydrophobicContact CG-CD2 4.34Å; T82-L107 HydrophobicContact CG2-CB 3.59Å; L103-L107 HydrophobicContact CG-CD1 4.31Å; L103-L107 WeakPolarHBondContact O-CG 3.47Å; L103-L107 PolarHBondContact O-N 3.02Å; L104-L107 PolarHBondContact O-N 3.12Å; L107-G111 PolarHBondContact O-N 2.7Å
108Y94.3Very high93.3Very high13 Ų1327.4 Ų27.45%0.05115%0.145CC..Hα-helixtrans-59.7-53.6175.2174.6-87.3000111.5F79 W86 L104 T105 G106 G111 F112 M287F79-Y108 HydrophobicContact CD2-CD2 4.04Å; F79-Y108 HydrophobicContact CD2-CE2 4.33Å; F79-Y108 HydrophobicContact CE1-CE2 4.44Å; F79-Y108 AromaticContact CE2-CD2 3.37Å; F79-Y108 HydrophobicContact CE2-CD2 3.37Å; F79-Y108 AromaticContact CE2-CE2 3.25Å; F79-Y108 HydrophobicContact CE2-CE2 3.25Å; F79-Y108 HydrophobicContact CE2-CG 4.12Å; F79-Y108 AromaticContact CE2-CZ 3.89Å; F79-Y108 AromaticContact CZ-CD2 3.74Å; F79-Y108 HydrophobicContact CZ-CD2 3.74Å; F79-Y108 AromaticContact CZ-CE2 3.33Å; F79-Y108 HydrophobicContact CZ-CE2 3.33Å; W86-Y108 HydrophobicContact CZ2-CD2 4.45Å; L104-Y108 VanDerWaalsContact O-CB 3.29Å; L104-Y108 WeakPolarHBondContact O-CB 3.49Å; L104-Y108 PolarHBondContact O-N 3.22Å; T105-Y108 PolarHBondContact O-N 2.88Å; G106-Y108 VanDerWaalsContact C-N 3.31Å; G106-Y108 PolarHBondContact O-N 3.08Å; Y108-G111 PolarHBondContact O-N 3.12Å; Y108-F112 WeakPolarHBondContact O-CB 3.45Å; Y108-F112 PolarHBondContact O-N 3.48Å; Y108-M287 HydrophobicContact CE2-CE 3.98Å
109F94.6Very high93.8Very high26 Ų2624.7 Ų24.711%0.11413%0.131CC..Hα-helixtrans-70.5-37.3-178.5-79-61.2000112.6T105 G106 F112 F113 S160 I198T105-F109 HydrophobicContact CG2-CD2 3.63Å; T105-F109 HydrophobicContact CG2-CE2 3.61Å; T105-F109 VanDerWaalsContact O-CD2 3.29Å; T105-F109 WeakPolarHBondContact O-CD2 3.25Å; T105-F109 PolarHBondContact O-N 3.29Å; G106-F109 PolarHBondContact O-N 3.12Å; F109-F112 PolarHBondContact O-N 2.74Å; F109-F113 HydrophobicContact CB-CD2 4.23Å; F109-F113 HydrophobicContact CB-CE2 4.17Å; F109-F113 AromaticContact CD1-CE2 3.89Å; F109-F113 HydrophobicContact CD1-CE2 3.89Å; F109-F113 HydrophobicContact CD1-CZ 4.49Å; F109-F113 HydrophobicContact CG-CE2 4.37Å; F109-F113 WeakPolarHBondContact O-CB 3.04Å; F109-F113 WeakPolarHBondContact O-CD2 3.4Å; F109-F113 PolarHBondContact O-N 2.62Å; F109-S160 WeakPolarHBondContact CB-OG 3.27Å; F109-S160 PolarHBondContact O-OG 3.24Å; F109-I198 HydrophobicContact CE1-CD1 4.07Å
110I96.8Very high94.3Very high25 Ų2519.8 Ų19.813%0.12810%0.1CC..Hα-helixtrans-58.8-54.5174.7-73.3167.2000108.2F78 G106 F112 F113 S114 W153 V157 S160F78-I110 HydrophobicContact CD2-CG2 4.06Å; G106-I110 VanDerWaalsContact O-CB 3.24Å; G106-I110 WeakPolarHBondContact O-CB 3.37Å; G106-I110 WeakPolarHBondContact O-CD1 3.5Å; G106-I110 WeakPolarHBondContact O-CG1 3.44Å; G106-I110 PolarHBondContact O-N 3.18Å; I110-F112 VanDerWaalsContact C-N 3.29Å; I110-F112 PolarHBondContact O-N 3.31Å; I110-F113 PolarHBondContact O-N 2.84Å; I110-S114 WeakPolarHBondContact O-CB 3.5Å; I110-S114 PolarHBondContact O-N 3.29Å; I110-S114 PolarHBondContact O-OG 3.45Å; I110-W153 HydrophobicContact CG2-CE3 4.08Å; I110-W153 HydrophobicContact CG2-CZ3 3.6Å; I110-V157 HydrophobicContact CD1-CG2 3.97Å; I110-V157 HydrophobicContact CG1-CG2 4.2Å; I110-S160 WeakPolarHBondContact CA-OG 3.37Å; I110-S160 WeakPolarHBondContact CG1-OG 3.26Å; I110-S160 PolarHBondContact N-OG 3.02Å; I110-S160 VanDerWaalsContact N-OG 3.12Å
111G96.3Very high94.6Very high4 Ų418.2 Ų18.24%0.0419%0.093CC..Hα-helixtrans-59.1-36.8178.400000113.5S75 L107 Y108 G115S75-G111 PolarHBondContact OG-O 2.96Å; L107-G111 PolarHBondContact O-N 2.7Å; Y108-G111 PolarHBondContact O-N 3.12Å; G111-G115 PolarHBondContact O-N 2.88Å; G111-G115 VanDerWaalsContact O-N 3.11Å
112F95.1Very high94.9Very high11 Ų1117.5 Ų17.55%0.0489%0.09CC..Hα-helixtrans-65.4-54174.8174.7-100.4000112.3Y108 F109 I110 G115 I116 I198 W248Y108-F112 WeakPolarHBondContact O-CB 3.45Å; Y108-F112 PolarHBondContact O-N 3.48Å; F109-F112 PolarHBondContact O-N 2.74Å; I110-F112 VanDerWaalsContact C-N 3.29Å; I110-F112 PolarHBondContact O-N 3.31Å; F112-G115 PolarHBondContact O-N 3.33Å; F112-I116 PolarHBondContact O-N 3.44Å; F112-I198 HydrophobicContact CE1-CG2 4.25Å; F112-I198 HydrophobicContact CZ-CG2 4.32Å; F112-W248 HydrophobicContact CD2-CD2 4.19Å; F112-W248 HydrophobicContact CD2-CE3 4.04Å; F112-W248 AromaticContact CD2-CH2 3.62Å; F112-W248 HydrophobicContact CD2-CH2 3.62Å; F112-W248 AromaticContact CD2-CZ2 3.8Å; F112-W248 HydrophobicContact CD2-CZ2 3.8Å; F112-W248 AromaticContact CD2-CZ3 3.75Å; F112-W248 HydrophobicContact CD2-CZ3 3.75Å; F112-W248 AromaticContact CE2-CD2 3.7Å; F112-W248 HydrophobicContact CE2-CD2 3.7Å; F112-W248 AromaticContact CE2-CE3 3.47Å; F112-W248 HydrophobicContact CE2-CE3 3.47Å; F112-W248 VanDerWaalsContact CE2-CE3 3.47Å; F112-W248 HydrophobicContact CE2-CG 4.39Å; F112-W248 AromaticContact CE2-CH2 3.95Å; F112-W248 HydrophobicContact CE2-CH2 3.95Å; F112-W248 HydrophobicContact CE2-CZ2 4.18Å; F112-W248 AromaticContact CE2-CZ3 3.6Å; F112-W248 HydrophobicContact CE2-CZ3 3.6Å; F112-W248 HydrophobicContact CZ-CE3 4.49Å
113F96.9Very high95.2Very high0 Ų014.6 Ų14.60%08%0.077CC..Hα-helixtrans-70.1-45.3-176.6-73.4-58.2000112.4F109 I110 G115 I116 F117 A156 A159 K197 I198 L201F109-F113 HydrophobicContact CB-CD2 4.23Å; F109-F113 HydrophobicContact CB-CE2 4.17Å; F109-F113 AromaticContact CD1-CE2 3.89Å; F109-F113 HydrophobicContact CD1-CE2 3.89Å; F109-F113 HydrophobicContact CD1-CZ 4.49Å; F109-F113 HydrophobicContact CG-CE2 4.37Å; F109-F113 WeakPolarHBondContact O-CB 3.04Å; F109-F113 WeakPolarHBondContact O-CD2 3.4Å; F109-F113 PolarHBondContact O-N 2.62Å; I110-F113 PolarHBondContact O-N 2.84Å; F113-G115 PolarHBondContact O-N 3Å; F113-I116 VanDerWaalsContact O-CG2 3.26Å; F113-I116 WeakPolarHBondContact O-CG2 3.47Å; F113-I116 PolarHBondContact O-N 3.09Å; F113-F117 HydrophobicContact CB-CD2 4.44Å; F113-F117 HydrophobicContact CB-CE2 3.99Å; F113-F117 HydrophobicContact CB-CZ 4.41Å; F113-F117 HydrophobicContact CD1-CZ 4.4Å; F113-F117 WeakPolarHBondContact O-CB 3.37Å; F113-F117 WeakPolarHBondContact O-CD2 3.26Å; F113-F117 WeakPolarHBondContact O-CG 2.98Å; F113-F117 PolarHBondContact O-N 2.93Å; F113-A156 HydrophobicContact CB-CB 4.14Å; F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.8Å; F113-A159 HydrophobicContact CE2-CB 4.12Å; F113-A159 HydrophobicContact CG-CB 4Å; F113-K197 HydrophobicContact CZ-CD 4.5Å; F113-I198 HydrophobicContact CZ-CG1 4.24Å; F113-L201 HydrophobicContact CD1-CB 4.25Å; F113-L201 HydrophobicContact CD1-CD1 4.31Å; F113-L201 HydrophobicContact CE1-CB 3.99Å; F113-L201 HydrophobicContact CE1-CD1 4.02Å
114S97.8Very high95.2Very high0 Ų012.7 Ų12.70%07%0.067CC..Hα-helixtrans-62.9-34.7176.153.40000111.3S75 I110 F117 F118 W153S75-S114 WeakPolarHBondContact CB-OG 3.43Å; S75-S114 PolarHBondContact OG-OG 3.31Å; I110-S114 WeakPolarHBondContact O-CB 3.5Å; I110-S114 PolarHBondContact O-N 3.29Å; I110-S114 PolarHBondContact O-OG 3.45Å; S114-F117 PolarHBondContact O-N 3.2Å; S114-F118 WeakPolarHBondContact O-CB 3.26Å; S114-F118 WeakPolarHBondContact O-CD2 3.26Å; S114-F118 PolarHBondContact O-N 2.86Å; S114-W153 WeakPolarHBondContact OG-CZ3 3.36Å
115G96.6Very high95.2Very high7 Ų712.7 Ų12.77%0.0727%0.067CC..Hα-helixtrans-58.5-53.4178.300000111.6L72 S75 G111 F112 F113 F118 I119L72-G115 WeakPolarHBondContact CD1-O 3.35Å; S75-G115 WeakPolarHBondContact OG-CA 3.43Å; S75-G115 PolarHBondContact OG-N 3.22Å; G111-G115 PolarHBondContact O-N 2.88Å; G111-G115 VanDerWaalsContact O-N 3.11Å; F112-G115 PolarHBondContact O-N 3.33Å; F113-G115 PolarHBondContact O-N 3Å; G115-F118 PolarHBondContact O-N 3.45Å; G115-I119 WeakPolarHBondContact O-CG1 3.39Å; G115-I119 PolarHBondContact O-N 3.24Å; G115-I119 VanDerWaalsContact O-N 3.12Å
116I96.7Very high95.1Very high0 Ų014.1 Ų14.10%07%0.072CC..Hα-helixtrans-68.1-37.2178.9-170.750.1000112.7F112 F113 F118 I119 I120 P206 Y244F112-I116 PolarHBondContact O-N 3.44Å; F113-I116 VanDerWaalsContact O-CG2 3.26Å; F113-I116 WeakPolarHBondContact O-CG2 3.47Å; F113-I116 PolarHBondContact O-N 3.09Å; I116-F118 PolarHBondContact O-N 3.32Å; I116-I119 HydrophobicContact CD1-CB 4.33Å; I116-I119 HydrophobicContact CD1-CG2 4.42Å; I116-I119 PolarHBondContact O-N 3Å; I116-I120 HydrophobicContact CG1-CD1 4.2Å; I116-I120 WeakPolarHBondContact O-CG1 3.13Å; I116-I120 PolarHBondContact O-N 3.01Å; I116-P206 HydrophobicContact CD1-CB 3.55Å; I116-P206 HydrophobicContact CD1-CG 3.81Å; I116-P206 HydrophobicContact CG1-CB 3.96Å; I116-P206 HydrophobicContact CG1-CG 3.83Å; I116-Y244 HydrophobicContact CB-CE2 4.08Å; I116-Y244 HydrophobicContact CD1-CD1 3.64Å; I116-Y244 HydrophobicContact CD1-CD2 4.22Å; I116-Y244 HydrophobicContact CD1-CE1 3.3Å; I116-Y244 HydrophobicContact CD1-CE2 3.92Å; I116-Y244 HydrophobicContact CD1-CG 4.1Å; I116-Y244 VanDerWaalsContact CD1-CZ 3.45Å; I116-Y244 HydrophobicContact CG1-CE1 3.91Å; I116-Y244 HydrophobicContact CG1-CE2 4.32Å
117F97.9Very high95Very high21 Ų2116.2 Ų16.29%0.0928%0.079CC..Hα-helixtrans-64.5-39.8176.7-63.9-24.8000112.4F113 S114 I119 I120 L121 T152 V155 A156 L201 L205F113-F117 HydrophobicContact CB-CD2 4.44Å; F113-F117 HydrophobicContact CB-CE2 3.99Å; F113-F117 HydrophobicContact CB-CZ 4.41Å; F113-F117 HydrophobicContact CD1-CZ 4.4Å; F113-F117 WeakPolarHBondContact O-CB 3.37Å; F113-F117 WeakPolarHBondContact O-CD2 3.26Å; F113-F117 WeakPolarHBondContact O-CG 2.98Å; F113-F117 PolarHBondContact O-N 2.93Å; S114-F117 PolarHBondContact O-N 3.2Å; F117-I119 VanDerWaalsContact C-N 3.35Å; F117-I120 HydrophobicContact CD1-CD1 4.33Å; F117-I120 WeakPolarHBondContact O-CB 3.48Å; F117-I120 PolarHBondContact O-N 3.01Å; F117-L121 WeakPolarHBondContact O-CB 3.2Å; F117-L121 WeakPolarHBondContact O-CG 3.44Å; F117-L121 PolarHBondContact O-N 3.08Å; F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 VanDerWaalsContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.14Å; F117-T152 HydrophobicContact CG-CG2 4.3Å; F117-V155 HydrophobicContact CD2-CG1 4.47Å; F117-V155 HydrophobicContact CE2-CG1 3.8Å; F117-V155 HydrophobicContact CZ-CG1 4.31Å; F117-A156 HydrophobicContact CD2-CB 4.38Å; F117-A156 HydrophobicContact CE2-CB 4.47Å; F117-L201 HydrophobicContact CE1-CB 4.38Å; F117-L201 HydrophobicContact CE1-CD2 4.47Å; F117-L201 HydrophobicContact CZ-CD1 4.33Å; F117-L201 HydrophobicContact CZ-CD2 4.48Å; F117-L205 HydrophobicContact CE1-CD2 4.33Å
118F97.3Very high94.7Very high0 Ų016.3 Ų16.30%08%0.079CC..Hα-helixtrans-68.5-32.8174.5-75.7-60.4000112.5Y68 N71 L72 S114 G115 I116 L121 L122 S149 T152 W153Y68-F118 HydrophobicContact CD1-CD1 4.11Å; Y68-F118 HydrophobicContact CD1-CE1 4.25Å; N71-F118 HydrophobicContact CB-CD1 3.82Å; N71-F118 HydrophobicContact CB-CD2 3.78Å; N71-F118 HydrophobicContact CB-CE1 3.49Å; N71-F118 VanDerWaalsContact CB-CE1 3.49Å; N71-F118 HydrophobicContact CB-CE2 3.46Å; N71-F118 VanDerWaalsContact CB-CE2 3.46Å; N71-F118 HydrophobicContact CB-CG 3.99Å; N71-F118 HydrophobicContact CB-CZ 3.32Å; L72-F118 HydrophobicContact CB-CB 4.16Å; L72-F118 HydrophobicContact CD1-CB 4.33Å; S114-F118 WeakPolarHBondContact O-CB 3.26Å; S114-F118 WeakPolarHBondContact O-CD2 3.26Å; S114-F118 PolarHBondContact O-N 2.86Å; G115-F118 PolarHBondContact O-N 3.45Å; I116-F118 PolarHBondContact O-N 3.32Å; F118-L121 HydrophobicContact CD1-CD1 4.03Å; F118-L121 HydrophobicContact CE1-CD1 4.18Å; F118-L121 PolarHBondContact O-N 3.13Å; F118-L122 WeakPolarHBondContact O-CB 3.25Å; F118-L122 VanDerWaalsContact O-CG 3.25Å; F118-L122 WeakPolarHBondContact O-CG 3.18Å; F118-L122 PolarHBondContact O-N 2.83Å; F118-S149 WeakPolarHBondContact CE1-OG 3.15Å; F118-T152 HydrophobicContact CE1-CG2 4.12Å; F118-T152 HydrophobicContact CE2-CG2 4.06Å; F118-T152 HydrophobicContact CZ-CG2 3.84Å; F118-W153 AromaticContact CE2-CE2 3.94Å; F118-W153 HydrophobicContact CE2-CZ2 4.17Å; F118-W153 AromaticContact CE2-NE1 3.91Å; F118-W153 AromaticContact CZ-NE1 3.77Å
119I95.3Very high94.3Very high1 Ų116.9 Ų16.91%0.0059%0.086CC..Hα-helixtrans-65.1-41.3171.4-68.9170.5000111.4L72 G115 I116 F117 L122 T123 I240 M241 Y244L72-I119 HydrophobicContact CD1-CD1 4.38Å; L72-I119 HydrophobicContact CD1-CG1 4.02Å; L72-I119 HydrophobicContact CD2-CG1 4.06Å; G115-I119 WeakPolarHBondContact O-CG1 3.39Å; G115-I119 PolarHBondContact O-N 3.24Å; G115-I119 VanDerWaalsContact O-N 3.12Å; I116-I119 HydrophobicContact CD1-CB 4.33Å; I116-I119 HydrophobicContact CD1-CG2 4.42Å; I116-I119 PolarHBondContact O-N 3Å; F117-I119 VanDerWaalsContact C-N 3.35Å; I119-L122 PolarHBondContact O-N 3.11Å; I119-T123 PolarHBondContact O-N 2.89Å; I119-T123 PolarHBondContact O-OG1 3.36Å; I119-I240 HydrophobicContact CD1-CG2 4.06Å; I119-I240 HydrophobicContact CG1-CG2 3.99Å; I119-I240 HydrophobicContact CG2-CG2 4.48Å; I119-M241 HydrophobicContact CG2-CE 3.49Å; I119-M241 VanDerWaalsContact CG2-CE 3.49Å; I119-M241 HydrophobicContact CG2-SD 3.68Å; I119-Y244 HydrophobicContact CD1-CD2 3.9Å; I119-Y244 HydrophobicContact CD1-CG 4.21Å
120I96.3Very high93.8Very high14 Ų1416.3 Ų16.37%0.0729%0.085CC..Hα-helixtrans-61-48.9172.7-73.6164.2000110.6I116 F117 L122 T123 I124 L205 P206 V209I116-I120 HydrophobicContact CG1-CD1 4.2Å; I116-I120 WeakPolarHBondContact O-CG1 3.13Å; I116-I120 PolarHBondContact O-N 3.01Å; F117-I120 HydrophobicContact CD1-CD1 4.33Å; F117-I120 WeakPolarHBondContact O-CB 3.48Å; F117-I120 PolarHBondContact O-N 3.01Å; I120-L122 VanDerWaalsContact C-N 3.33Å; I120-L122 PolarHBondContact O-N 3.43Å; I120-T123 WeakPolarHBondContact O-CA 3.32Å; I120-T123 WeakPolarHBondContact O-CB 3.28Å; I120-T123 PolarHBondContact O-N 3.28Å; I120-I124 HydrophobicContact CG2-CD1 3.77Å; I120-I124 HydrophobicContact CG2-CG1 4.48Å; I120-I124 WeakPolarHBondContact O-CG1 3.33Å; I120-I124 PolarHBondContact O-N 3.34Å; I120-L205 HydrophobicContact CD1-CD2 3.98Å; I120-L205 HydrophobicContact CD1-CG 3.99Å; I120-P206 HydrophobicContact CD1-CB 3.99Å; I120-P206 HydrophobicContact CG1-CB 3.98Å; I120-V209 HydrophobicContact CG2-CG1 4.22Å; I120-V209 HydrophobicContact CG2-CG2 4.03Å
121L96.1Very high93.4Very high32 Ų3217 Ų1717%0.1689%0.09CC..Hα-helixtrans-62.5-38.7178.9-73.9177.1000112.5Y68 F117 F118 T123 I124 D125 T152Y68-L121 HydrophobicContact CD2-CB 4Å; Y68-L121 HydrophobicContact CE1-CB 4.45Å; Y68-L121 HydrophobicContact CE1-CD1 4.02Å; Y68-L121 HydrophobicContact CE2-CB 3.75Å; Y68-L121 HydrophobicContact CG-CB 4.42Å; F117-L121 WeakPolarHBondContact O-CB 3.2Å; F117-L121 WeakPolarHBondContact O-CG 3.44Å; F117-L121 PolarHBondContact O-N 3.08Å; F118-L121 HydrophobicContact CD1-CD1 4.03Å; F118-L121 HydrophobicContact CE1-CD1 4.18Å; F118-L121 PolarHBondContact O-N 3.13Å; L121-T123 VanDerWaalsContact C-N 3.29Å; L121-T123 PolarHBondContact O-N 3.42Å; L121-I124 PolarHBondContact O-N 3.4Å; L121-D125 WeakPolarHBondContact O-CB 3.14Å; L121-D125 PolarHBondContact O-N 3.47Å; L121-T152 HydrophobicContact CD1-CG2 4.28Å; L121-T152 VanDerWaalsContact CD1-OG1 3.3Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.46Å
122L93.4Very high92.8Very high1 Ų121 Ų211%0.00511%0.108CC..Hα-helixtrans-60.3-40.8171.6-78.3167.5000111.4T65 Y68 L69 L72 F118 I119 I120 D125 R126 I237T65-L122 HydrophobicContact CG2-CD2 3.73Å; Y68-L122 HydrophobicContact CD2-CD2 4.36Å; L69-L122 HydrophobicContact CD2-CD1 3.9Å; L69-L122 HydrophobicContact CD2-CD2 4.24Å; L69-L122 HydrophobicContact CG-CD2 4.13Å; L72-L122 HydrophobicContact CD2-CD1 3.95Å; F118-L122 WeakPolarHBondContact O-CB 3.25Å; F118-L122 VanDerWaalsContact O-CG 3.25Å; F118-L122 WeakPolarHBondContact O-CG 3.18Å; F118-L122 PolarHBondContact O-N 2.83Å; I119-L122 PolarHBondContact O-N 3.11Å; I120-L122 VanDerWaalsContact C-N 3.33Å; I120-L122 PolarHBondContact O-N 3.43Å; L122-D125 PolarHBondContact O-N 3.12Å; L122-R126 WeakPolarHBondContact O-CG 3.38Å; L122-R126 PolarHBondContact O-N 3.38Å; L122-I237 HydrophobicContact CB-CD1 4.34Å; L122-I237 HydrophobicContact CB-CG2 4.34Å; L122-I237 HydrophobicContact CD2-CD1 4.4Å
123T93Very high92.1Very high1 Ų123.2 Ų23.21%0.00613%0.128CC..Hα-helixtrans-67.1-44.6179.4-57.80000111.3I119 I120 L121 R126 Y127 V209 C213 Y214 M241I119-T123 PolarHBondContact O-N 2.89Å; I119-T123 PolarHBondContact O-OG1 3.36Å; I120-T123 WeakPolarHBondContact O-CA 3.32Å; I120-T123 WeakPolarHBondContact O-CB 3.28Å; I120-T123 PolarHBondContact O-N 3.28Å; L121-T123 VanDerWaalsContact C-N 3.29Å; L121-T123 PolarHBondContact O-N 3.42Å; T123-R126 PolarHBondContact O-N 2.9Å; T123-Y127 WeakPolarHBondContact O-CB 3.38Å; T123-Y127 PolarHBondContact O-N 3.44Å; T123-V209 HydrophobicContact CG2-CG1 4.04Å; T123-C213 HydrophobicContact CG2-CB 3.81Å; T123-Y214 HydrophobicContact CG2-CD2 4.49Å; T123-Y214 HydrophobicContact CG2-CE2 3.82Å; T123-M241 HydrophobicContact CG2-CE 4.25Å; T123-M241 WeakPolarHBondContact OG1-CE 3.43Å
124I93.4Very high91.3Very high61 Ų6129.3 Ų29.331%0.31317%0.165SC..Hα-helixtrans-64.7-44.4175.2-64.6168.6000110.9I120 L121 R126 Y127 L128 V209I120-I124 HydrophobicContact CG2-CD1 3.77Å; I120-I124 HydrophobicContact CG2-CG1 4.48Å; I120-I124 WeakPolarHBondContact O-CG1 3.33Å; I120-I124 PolarHBondContact O-N 3.34Å; L121-I124 PolarHBondContact O-N 3.4Å; I124-R126 VanDerWaalsContact C-N 3.3Å; I124-R126 PolarHBondContact O-N 3.37Å; I124-Y127 WeakPolarHBondContact O-CB 3.38Å; I124-Y127 PolarHBondContact O-N 3.46Å; I124-Y127 VanDerWaalsContact O-N 3.16Å; I124-L128 HydrophobicContact CG2-CD1 4.02Å; I124-L128 HydrophobicContact CG2-CG 4.27Å; I124-L128 WeakPolarHBondContact O-CG 3.3Å; I124-L128 PolarHBondContact O-N 3.48Å; I124-V209 HydrophobicContact CG1-CG1 4.14Å
125D91.2Very high90.4Very high4 Ų435.2 Ų35.22%0.02119%0.191CC..Hα-helixtrans-58.6-40.5176.3165.368.1000111.8T65 Y68 L121 L122 A129 R140T65-D125 PolarHBondContact OG1-OD2 2.83Å; Y68-D125 HydrophobicContact CD2-CB 4.28Å; Y68-D125 HydrophobicContact CE2-CB 4.06Å; L121-D125 WeakPolarHBondContact O-CB 3.14Å; L121-D125 PolarHBondContact O-N 3.47Å; L122-D125 PolarHBondContact O-N 3.12Å; D125-A129 WeakPolarHBondContact O-CB 3.42Å; D125-A129 PolarHBondContact O-N 3.42Å; D125-R140 PolarHBondContact O-NE 2.97Å; D125-R140 IonicContact OD1-CZ 3.19Å; D125-R140 IonicContact OD1-NE 2.7Å; D125-R140 PolarHBondContact OD1-NE 3.43Å; D125-R140 IonicContact OD1-NH2 2.86Å; D125-R140 PolarHBondContact OD1-NH2 3.42Å; D125-R140 IonicContact OD2-NH2 3.77Å
126R89.4Confident89.5Confident35 Ų3535.2 Ų35.213%0.13219%0.19CC..Hα-helixtrans-69.2-42.7173-69.2-52.981.7-143-2.4112.7T65 L122 T123 I124 A129 V130 I237T65-R126 PolarHBondContact OG1-NH2 2.85Å; L122-R126 WeakPolarHBondContact O-CG 3.38Å; L122-R126 PolarHBondContact O-N 3.38Å; T123-R126 PolarHBondContact O-N 2.9Å; I124-R126 VanDerWaalsContact C-N 3.3Å; I124-R126 PolarHBondContact O-N 3.37Å; R126-A129 PolarHBondContact O-N 3.04Å; R126-V130 WeakPolarHBondContact O-CG2 3.08Å; R126-V130 PolarHBondContact O-N 3.4Å; R126-V130 VanDerWaalsContact O-N 3.09Å; R126-I237 HydrophobicContact CG-CB 4.08Å; R126-I237 HydrophobicContact CG-CG1 3.47Å; R126-I237 VanDerWaalsContact CG-CG1 3.47Å; R126-I237 HydrophobicContact CG-CG2 4.34Å
127Y90.2Very high88.5Confident48 Ų4842.4 Ų42.419%0.18823%0.228CC..Hα-helixtrans-57-51.9177.5172.9-99.7000111.3T123 I124 A129 V130 V131 H132 C213 I217T123-Y127 WeakPolarHBondContact O-CB 3.38Å; T123-Y127 PolarHBondContact O-N 3.44Å; I124-Y127 WeakPolarHBondContact O-CB 3.38Å; I124-Y127 PolarHBondContact O-N 3.46Å; I124-Y127 VanDerWaalsContact O-N 3.16Å; Y127-A129 VanDerWaalsContact C-N 3.31Å; Y127-A129 PolarHBondContact O-N 3.36Å; Y127-V130 PolarHBondContact O-N 3.5Å; Y127-V130 VanDerWaalsContact O-N 3.12Å; Y127-V131 HydrophobicContact CD2-CB 4.34Å; Y127-V131 HydrophobicContact CD2-CG2 3.71Å; Y127-V131 HydrophobicContact CE2-CB 4.04Å; Y127-V131 HydrophobicContact CE2-CG1 4.25Å; Y127-V131 HydrophobicContact CE2-CG2 3.58Å; Y127-V131 HydrophobicContact CG-CG2 4.46Å; Y127-V131 WeakPolarHBondContact O-CB 3.27Å; Y127-V131 PolarHBondContact O-N 2.79Å; Y127-H132 AromaticContact CE1-CD2 3.69Å; Y127-H132 AromaticContact CE1-NE2 3.8Å; Y127-H132 AromaticContact CZ-NE2 3.98Å; Y127-C213 VanDerWaalsContact CD2-CA 3.48Å; Y127-C213 HydrophobicContact CD2-CB 3.86Å; Y127-C213 VanDerWaalsContact CD2-O 3.3Å; Y127-C213 WeakPolarHBondContact CD2-O 3.41Å; Y127-C213 HydrophobicContact CG-CB 4.08Å; Y127-I217 HydrophobicContact CD2-CG1 4.16Å
128L89.5Confident87.6Confident39 Ų3949.9 Ų49.920%0.20426%0.26CS..Hα-helixtrans-59.5-42.8178.3-68.3175.4000111.5I124 V130 H132 F135I124-L128 HydrophobicContact CG2-CD1 4.02Å; I124-L128 HydrophobicContact CG2-CG 4.27Å; I124-L128 WeakPolarHBondContact O-CG 3.3Å; I124-L128 PolarHBondContact O-N 3.48Å; L128-V130 VanDerWaalsContact C-N 3.26Å; L128-V130 PolarHBondContact O-N 3.19Å; L128-H132 HydrophobicContact CD2-CB 4.44Å; L128-H132 CarbonylContact O-C 3.57Å; L128-H132 WeakPolarHBondContact O-CA 3.25Å; L128-H132 PolarHBondContact O-N 3.12Å; L128-F135 HydrophobicContact CD2-CD1 4.28Å; L128-F135 HydrophobicContact CD2-CE1 4.42Å
129A86.9Confident86.7Confident24 Ų2451.1 Ų51.120%0.19827%0.27CS..Hα-helixtrans-63.8-28.4178.600000114D125 R126 Y127D125-A129 WeakPolarHBondContact O-CB 3.42Å; D125-A129 PolarHBondContact O-N 3.42Å; R126-A129 PolarHBondContact O-N 3.04Å; Y127-A129 VanDerWaalsContact C-N 3.31Å; Y127-A129 PolarHBondContact O-N 3.36Å
130V84.4Confident86.3Confident14 Ų1454.2 Ų54.29%0.08528%0.282CS..Hα-helixtrans-95.1-47.1-176.9172.90000112.1R126 Y127 L128 I217 T220 R230 V234R126-V130 WeakPolarHBondContact O-CG2 3.08Å; R126-V130 PolarHBondContact O-N 3.4Å; R126-V130 VanDerWaalsContact O-N 3.09Å; Y127-V130 PolarHBondContact O-N 3.5Å; Y127-V130 VanDerWaalsContact O-N 3.12Å; L128-V130 VanDerWaalsContact C-N 3.26Å; L128-V130 PolarHBondContact O-N 3.19Å; V130-I217 HydrophobicContact CB-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG1 4.4Å; V130-I217 HydrophobicContact CG1-CG2 4.31Å; V130-T220 HydrophobicContact CG1-CG2 4.11Å; V130-R230 HydrophobicContact CG2-CG 3.87Å; V130-V234 HydrophobicContact CG2-CG2 4.09Å
131V86.8Confident85.9Confident40 Ų4056 Ų5624%0.24229%0.294CS..Hα-helixtrans-89.8-35.8-171.7-176.90000111.5Y127 I217Y127-V131 HydrophobicContact CD2-CB 4.34Å; Y127-V131 HydrophobicContact CD2-CG2 3.71Å; Y127-V131 HydrophobicContact CE2-CB 4.04Å; Y127-V131 HydrophobicContact CE2-CG1 4.25Å; Y127-V131 HydrophobicContact CE2-CG2 3.58Å; Y127-V131 HydrophobicContact CG-CG2 4.46Å; Y127-V131 WeakPolarHBondContact O-CB 3.27Å; Y127-V131 PolarHBondContact O-N 2.79Å; V131-I217 HydrophobicContact CG2-CG1 4.32Å
132H85.3Confident85.6Confident88 Ų8857.2 Ų57.241%0.40730%0.302SS..  trans-121.852.4-175.3-60.7-71.5000111.9Y127 L128 V134 F135 A136Y127-H132 AromaticContact CE1-CD2 3.69Å; Y127-H132 AromaticContact CE1-NE2 3.8Å; Y127-H132 AromaticContact CZ-NE2 3.98Å; L128-H132 HydrophobicContact CD2-CB 4.44Å; L128-H132 CarbonylContact O-C 3.57Å; L128-H132 WeakPolarHBondContact O-CA 3.25Å; L128-H132 PolarHBondContact O-N 3.12Å; H132-V134 VanDerWaalsContact C-N 3.28Å; H132-V134 PolarHBondContact O-N 2.78Å; H132-V134 VanDerWaalsContact O-N 3.15Å; H132-F135 HydrophobicContact CB-CB 4.25Å; H132-F135 PolarHBondContact O-N 2.83Å; H132-F135 VanDerWaalsContact O-N 3.13Å; H132-A136 WeakPolarHBondContact O-CB 3.44Å; H132-A136 PolarHBondContact O-N 3.33Å
133A80.6Confident85.6Confident58 Ų5862.1 Ų62.148%0.47933%0.332SS..Hα-helixtrans-54.5-36.4-171.500000114.7A136 L137A133-A136 WeakPolarHBondContact O-CB 3.41Å; A133-L137 PolarHBondContact O-N 3.38Å
134V78.8Confident85.5Confident128 Ų12867.6 Ų67.678%0.77636%0.356SS*.Hα-helixtrans-69.7-45.7178.9-179.40000111.5H132 A136 L137H132-V134 VanDerWaalsContact C-N 3.28Å; H132-V134 PolarHBondContact O-N 2.78Å; H132-V134 VanDerWaalsContact O-N 3.15Å; V134-A136 VanDerWaalsContact C-N 3.31Å; V134-A136 PolarHBondContact O-N 3.22Å; V134-L137 PolarHBondContact O-N 2.84Å
135F79.1Confident85.5Confident124 Ų12464.7 Ų64.754%0.54434%0.341SS..Hα-helixtrans-64.9-38.7175.4177.9-100.2000111.6L128 H132 L137 K138 A139L128-F135 HydrophobicContact CD2-CD1 4.28Å; L128-F135 HydrophobicContact CD2-CE1 4.42Å; H132-F135 HydrophobicContact CB-CB 4.25Å; H132-F135 PolarHBondContact O-N 2.83Å; H132-F135 VanDerWaalsContact O-N 3.13Å; F135-L137 PolarHBondContact O-N 2.91Å; F135-K138 PolarHBondContact O-N 3Å; F135-K138 VanDerWaalsContact O-N 3.07Å; F135-A139 HydrophobicContact CD1-CB 4.06Å; F135-A139 HydrophobicContact CE1-CB 3.6Å; F135-A139 HydrophobicContact CZ-CB 3.86Å; F135-A139 PolarHBondContact O-N 2.9Å
136A77.3Confident85.7Confident7 Ų767.9 Ų67.96%0.05836%0.361CS..Hα-helixtrans-58.5-31.7178.800000113.6H132 A133 V134 K138 R140H132-A136 WeakPolarHBondContact O-CB 3.44Å; H132-A136 PolarHBondContact O-N 3.33Å; A133-A136 WeakPolarHBondContact O-CB 3.41Å; V134-A136 VanDerWaalsContact C-N 3.31Å; V134-A136 PolarHBondContact O-N 3.22Å; A136-K138 VanDerWaalsContact C-N 3.29Å; A136-K138 PolarHBondContact O-N 3.1Å; A136-R140 HydrophobicContact CB-CG 4.3Å; A136-R140 VanDerWaalsContact O-CB 3.23Å; A136-R140 WeakPolarHBondContact O-CB 3.4Å; A136-R140 VanDerWaalsContact O-CG 3.32Å; A136-R140 WeakPolarHBondContact O-CG 3.38Å; A136-R140 PolarHBondContact O-N 2.86Å; A136-R140 VanDerWaalsContact O-N 3.12Å
137L77Confident86.1Confident151 Ų15169.8 Ų69.879%0.79138%0.376SS*.Hα-helixtrans-63.2-35176-75.2161.6000112.5A133 V134 F135A133-L137 PolarHBondContact O-N 3.38Å; V134-L137 PolarHBondContact O-N 2.84Å; F135-L137 PolarHBondContact O-N 2.91Å
138K78.3Confident86.4Confident178 Ų17869.3 Ų69.377%0.77438%0.379SS*.Hα-helixtrans-87.7-36.3-179.3-169.2175.6-179.6178.60112.7F135 A136F135-K138 PolarHBondContact O-N 3Å; F135-K138 VanDerWaalsContact O-N 3.07Å; A136-K138 VanDerWaalsContact C-N 3.29Å; A136-K138 PolarHBondContact O-N 3.1Å
139A78.1Confident86.8Confident25 Ų2567.7 Ų67.721%0.20737%0.37CS..Hα-helixtrans-90-21.5-171.500000114.8F135 T141F135-A139 HydrophobicContact CD1-CB 4.06Å; F135-A139 HydrophobicContact CE1-CB 3.6Å; F135-A139 HydrophobicContact CZ-CB 3.86Å; F135-A139 PolarHBondContact O-N 2.9Å; A139-T141 VanDerWaalsContact C-N 3.33Å; A139-T141 PolarHBondContact O-N 3.47Å
140R86.5Confident87.3Confident66 Ų6670.7 Ų70.725%0.24939%0.386CS..  trans-95.846.7-172.2-60.4173.366.1-110.4-31.7113.4M64 D125 A136M64-R140 HydrophobicContact SD-CB 3.98Å; M64-R140 HydrophobicContact SD-CG 4.13Å; D125-R140 PolarHBondContact O-NE 2.97Å; D125-R140 IonicContact OD1-CZ 3.19Å; D125-R140 IonicContact OD1-NE 2.7Å; D125-R140 PolarHBondContact OD1-NE 3.43Å; D125-R140 IonicContact OD1-NH2 2.86Å; D125-R140 PolarHBondContact OD1-NH2 3.42Å; D125-R140 IonicContact OD2-NH2 3.77Å; A136-R140 HydrophobicContact CB-CG 4.3Å; A136-R140 VanDerWaalsContact O-CB 3.23Å; A136-R140 WeakPolarHBondContact O-CB 3.4Å; A136-R140 VanDerWaalsContact O-CG 3.32Å; A136-R140 WeakPolarHBondContact O-CG 3.38Å; A136-R140 PolarHBondContact O-N 2.86Å; A136-R140 VanDerWaalsContact O-N 3.12Å
141T88.8Confident88Confident52 Ų5274.7 Ų74.732%0.31941%0.406SS..  trans-82.2157.3175.472.60000111.1A139 T143 F144 G145A139-T141 VanDerWaalsContact C-N 3.33Å; A139-T141 PolarHBondContact O-N 3.47Å; T141-T143 VanDerWaalsContact C-N 3.27Å; T141-T143 PolarHBondContact O-N 3.02Å; T141-F144 HydrophobicContact CG2-CD2 4.35Å; T141-F144 PolarHBondContact O-N 3.41Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.46Å; T141-F144 PolarHBondContact OG1-N 3.41Å; T141-G145 PolarHBondContact O-N 2.94Å; T141-G145 VanDerWaalsContact O-N 3.1Å
142V90.6Very high88.5Confident57 Ų5773.5 Ų73.535%0.34540%0.399SS..Hα-helixtrans-61.6-38.7176.1175.20000110.8I67 F144 G145 V146I67-V142 HydrophobicContact CD1-CG1 4.23Å; I67-V142 HydrophobicContact CG1-CG1 4.24Å; V142-F144 PolarHBondContact O-N 3.15Å; V142-G145 CarbonylContact O-C 3.33Å; V142-G145 WeakPolarHBondContact O-CA 3.24Å; V142-G145 PolarHBondContact O-N 3.43Å; V142-G145 VanDerWaalsContact O-N 3.12Å; V142-V146 HydrophobicContact CG1-CG2 4.41Å; V142-V146 WeakPolarHBondContact O-CG2 3.31Å; V142-V146 PolarHBondContact O-N 3.1Å
143T92.1Very high89.1Confident104 Ų10471.5 Ų71.564%0.63839%0.388SS*.Hα-helixtrans-58.4-48.5177.4-46.90000111.9T141 G145 V146 V147T141-T143 VanDerWaalsContact C-N 3.27Å; T141-T143 PolarHBondContact O-N 3.02Å; T143-G145 VanDerWaalsContact C-N 3.3Å; T143-G145 PolarHBondContact O-N 3.34Å; T143-V146 PolarHBondContact O-N 3.4Å; T143-V147 WeakPolarHBondContact O-CG2 3.5Å; T143-V147 PolarHBondContact O-N 3.3Å
144F92.3Very high90Very high116 Ų11672.1 Ų72.151%0.50939%0.385SS..Hα-helixtrans-61.7-40.6175.2-79.3-61000111.5T141 V142 V146 V147 T148T141-F144 HydrophobicContact CG2-CD2 4.35Å; T141-F144 PolarHBondContact O-N 3.41Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.46Å; T141-F144 PolarHBondContact OG1-N 3.41Å; V142-F144 PolarHBondContact O-N 3.15Å; F144-V146 VanDerWaalsContact C-N 3.33Å; F144-V146 PolarHBondContact O-N 3.46Å; F144-V147 PolarHBondContact O-N 3.48Å; F144-T148 WeakPolarHBondContact O-CG2 3.49Å; F144-T148 PolarHBondContact O-N 3.38Å; F144-T148 PolarHBondContact O-OG1 2.96Å
145G93.3Very high90.9Very high0 Ų069.4 Ų69.40%037%0.369CS..Hα-helixtrans-58.4-39.2174.300000114.3T141 V142 T143 T148 S149T141-G145 PolarHBondContact O-N 2.94Å; T141-G145 VanDerWaalsContact O-N 3.1Å; V142-G145 CarbonylContact O-C 3.33Å; V142-G145 WeakPolarHBondContact O-CA 3.24Å; V142-G145 PolarHBondContact O-N 3.43Å; V142-G145 VanDerWaalsContact O-N 3.12Å; T143-G145 VanDerWaalsContact C-N 3.3Å; T143-G145 PolarHBondContact O-N 3.34Å; G145-T148 WeakPolarHBondContact CA-OG1 3.38Å; G145-T148 PolarHBondContact O-OG1 2.64Å; G145-T148 VanDerWaalsContact O-OG1 3.08Å; G145-S149 WeakPolarHBondContact O-CB 3.46Å; G145-S149 PolarHBondContact O-N 3.13Å; G145-S149 VanDerWaalsContact O-N 3.09Å; G145-S149 PolarHBondContact O-OG 3.41Å; G145-S149 VanDerWaalsContact O-OG 3.06Å
146V95.6Very high91.7Very high72 Ų7263.5 Ų63.544%0.43634%0.343SS..Hα-helixtrans-69.2-46.8176.6173.10000110.7V142 T143 F144 T148 S149 V150V142-V146 HydrophobicContact CG1-CG2 4.41Å; V142-V146 WeakPolarHBondContact O-CG2 3.31Å; V142-V146 PolarHBondContact O-N 3.1Å; T143-V146 PolarHBondContact O-N 3.4Å; F144-V146 VanDerWaalsContact C-N 3.33Å; F144-V146 PolarHBondContact O-N 3.46Å; V146-T148 PolarHBondContact O-N 3Å; V146-S149 WeakPolarHBondContact O-CB 3.35Å; V146-S149 PolarHBondContact O-N 2.86Å; V146-V150 WeakPolarHBondContact O-CG2 3.49Å; V146-V150 PolarHBondContact O-N 3.31Å
147V96.5Very high92.7Very high74 Ų7466 Ų6645%0.44836%0.357SS..Hα-helixtrans-61.1-47179.9173.20000111T143 F144 S149 V150 I151T143-V147 WeakPolarHBondContact O-CG2 3.5Å; T143-V147 PolarHBondContact O-N 3.3Å; F144-V147 PolarHBondContact O-N 3.48Å; V147-S149 VanDerWaalsContact C-N 3.32Å; V147-S149 PolarHBondContact O-N 3.43Å; V147-V150 PolarHBondContact O-N 3.39Å; V147-I151 HydrophobicContact CG1-CD1 3.98Å; V147-I151 WeakPolarHBondContact O-CG1 3.34Å; V147-I151 PolarHBondContact O-N 3.19Å
148T96.6Very high93.6Very high39 Ų3965.2 Ų65.224%0.23935%0.348CS..Hα-helixtrans-64.3-36.9177.753.80000112Y68 F144 G145 V146 I151 T152Y68-T148 WeakPolarHBondContact CE1-OG1 3.29Å; Y68-T148 WeakPolarHBondContact OH-CB 3.23Å; Y68-T148 PolarHBondContact OH-OG1 3.49Å; F144-T148 WeakPolarHBondContact O-CG2 3.49Å; F144-T148 PolarHBondContact O-N 3.38Å; F144-T148 PolarHBondContact O-OG1 2.96Å; G145-T148 WeakPolarHBondContact CA-OG1 3.38Å; G145-T148 PolarHBondContact O-OG1 2.64Å; G145-T148 VanDerWaalsContact O-OG1 3.08Å; V146-T148 PolarHBondContact O-N 3Å; T148-I151 PolarHBondContact O-N 2.93Å; T148-T152 WeakPolarHBondContact O-CB 3.32Å; T148-T152 PolarHBondContact O-N 3.32Å; T148-T152 PolarHBondContact O-OG1 2.93Å
149S97.6Very high94.3Very high4 Ų457.4 Ų57.43%0.02832%0.316CS..Hα-helixtrans-61.8-45.5173.1-74.90000112.5N71 F118 G145 V146 V147 I151 T152 W153N71-S149 PolarHBondContact ND2-OG 2.81Å; F118-S149 WeakPolarHBondContact CE1-OG 3.15Å; G145-S149 WeakPolarHBondContact O-CB 3.46Å; G145-S149 PolarHBondContact O-N 3.13Å; G145-S149 VanDerWaalsContact O-N 3.09Å; G145-S149 PolarHBondContact O-OG 3.41Å; G145-S149 VanDerWaalsContact O-OG 3.06Å; V146-S149 WeakPolarHBondContact O-CB 3.35Å; V146-S149 PolarHBondContact O-N 2.86Å; V147-S149 VanDerWaalsContact C-N 3.32Å; V147-S149 PolarHBondContact O-N 3.43Å; S149-I151 PolarHBondContact O-N 3.47Å; S149-T152 WeakPolarHBondContact O-CB 3.35Å; S149-T152 PolarHBondContact O-N 2.95Å; S149-T152 VanDerWaalsContact O-N 3.16Å; S149-W153 PolarHBondContact O-N 2.84Å
150V98.1Very high95.1Very high88 Ų8856.2 Ų56.253%0.53331%0.306SS..Hα-helixtrans-60.3-46.7178.2171.70000110.8V146 V147 T152 W153 V154V146-V150 WeakPolarHBondContact O-CG2 3.49Å; V146-V150 PolarHBondContact O-N 3.31Å; V147-V150 PolarHBondContact O-N 3.39Å; V150-T152 VanDerWaalsContact C-N 3.27Å; V150-T152 PolarHBondContact O-N 3.33Å; V150-W153 PolarHBondContact O-N 2.98Å; V150-V154 WeakPolarHBondContact O-CG2 3.32Å; V150-V154 PolarHBondContact O-N 3.3Å; V150-V154 VanDerWaalsContact O-N 3.07Å
151I98.1Very high95.3Very high98 Ų9856.2 Ų56.250%0.50331%0.311SS..Hα-helixtrans-58.8-43175.9-65.6166.6000110.5V147 T148 S149 W153 V154 V155V147-I151 HydrophobicContact CG1-CD1 3.98Å; V147-I151 WeakPolarHBondContact O-CG1 3.34Å; V147-I151 PolarHBondContact O-N 3.19Å; T148-I151 PolarHBondContact O-N 2.93Å; S149-I151 PolarHBondContact O-N 3.47Å; I151-W153 VanDerWaalsContact C-N 3.35Å; I151-W153 PolarHBondContact O-N 3.39Å; I151-V154 PolarHBondContact O-N 3.3Å; I151-V155 HydrophobicContact CG2-CG2 4.31Å; I151-V155 VanDerWaalsContact O-CG2 3.32Å; I151-V155 WeakPolarHBondContact O-CG2 3.35Å; I151-V155 PolarHBondContact O-N 3.46Å
152T98.1Very high95.3Very high15 Ų1554.9 Ų54.99%0.09230%0.303CS..Hα-helixtrans-62.6-41.2-179.9-58.40000112.2F117 F118 L121 T148 S149 V150 V155 A156F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 VanDerWaalsContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.14Å; F117-T152 HydrophobicContact CG-CG2 4.3Å; F118-T152 HydrophobicContact CE1-CG2 4.12Å; F118-T152 HydrophobicContact CE2-CG2 4.06Å; F118-T152 HydrophobicContact CZ-CG2 3.84Å; L121-T152 HydrophobicContact CD1-CG2 4.28Å; L121-T152 VanDerWaalsContact CD1-OG1 3.3Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.46Å; T148-T152 WeakPolarHBondContact O-CB 3.32Å; T148-T152 PolarHBondContact O-N 3.32Å; T148-T152 PolarHBondContact O-OG1 2.93Å; S149-T152 WeakPolarHBondContact O-CB 3.35Å; S149-T152 PolarHBondContact O-N 2.95Å; S149-T152 VanDerWaalsContact O-N 3.16Å; V150-T152 VanDerWaalsContact C-N 3.27Å; V150-T152 PolarHBondContact O-N 3.33Å; T152-V155 PolarHBondContact O-N 2.67Å; T152-A156 WeakPolarHBondContact O-CB 3.24Å; T152-A156 PolarHBondContact O-N 3.46Å
153W98.3Very high94.9Very high46 Ų4652.2 Ų52.217%0.17429%0.287CS..Hα-helixtrans-61.8-45.5174.1-80.7112.3000112N71 I74 F78 I110 S114 F118 S149 V150 I151 V155 A156 V157N71-W153 PolarHBondContact OD1-NE1 3.27Å; I74-W153 HydrophobicContact CB-CZ2 4.26Å; I74-W153 HydrophobicContact CG2-CH2 3.99Å; I74-W153 HydrophobicContact CG2-CZ2 3.78Å; F78-W153 AromaticContact CD2-CH2 3.54Å; F78-W153 HydrophobicContact CD2-CH2 3.54Å; F78-W153 AromaticContact CD2-CZ3 3.55Å; F78-W153 HydrophobicContact CD2-CZ3 3.55Å; F78-W153 HydrophobicContact CE2-CE3 4.32Å; F78-W153 AromaticContact CE2-CH2 3.43Å; F78-W153 HydrophobicContact CE2-CH2 3.43Å; F78-W153 VanDerWaalsContact CE2-CH2 3.43Å; F78-W153 HydrophobicContact CE2-CZ2 4.36Å; F78-W153 AromaticContact CE2-CZ3 3.42Å; F78-W153 HydrophobicContact CE2-CZ3 3.42Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.42Å; I110-W153 HydrophobicContact CG2-CE3 4.08Å; I110-W153 HydrophobicContact CG2-CZ3 3.6Å; S114-W153 WeakPolarHBondContact OG-CZ3 3.36Å; F118-W153 AromaticContact CE2-CE2 3.94Å; F118-W153 HydrophobicContact CE2-CZ2 4.17Å; F118-W153 AromaticContact CE2-NE1 3.91Å; F118-W153 AromaticContact CZ-NE1 3.77Å; S149-W153 PolarHBondContact O-N 2.84Å; V150-W153 PolarHBondContact O-N 2.98Å; I151-W153 VanDerWaalsContact C-N 3.35Å; I151-W153 PolarHBondContact O-N 3.39Å; W153-V155 VanDerWaalsContact C-N 3.34Å; W153-V155 PolarHBondContact O-N 3.02Å; W153-A156 PolarHBondContact O-N 2.86Å; W153-V157 WeakPolarHBondContact O-CG2 3.34Å; W153-V157 PolarHBondContact O-N 2.91Å
154V98.1Very high94.6Very high71 Ų7149 Ų4943%0.4327%0.266SS..Hα-helixtrans-58.6-47.8176.4172.90000110.3V150 I151 A156 V157 F158V150-V154 WeakPolarHBondContact O-CG2 3.32Å; V150-V154 PolarHBondContact O-N 3.3Å; V150-V154 VanDerWaalsContact O-N 3.07Å; I151-V154 PolarHBondContact O-N 3.3Å; V154-A156 PolarHBondContact O-N 3.31Å; V154-V157 PolarHBondContact O-N 3.46Å; V154-F158 HydrophobicContact CG1-CD2 3.65Å; V154-F158 HydrophobicContact CG1-CE2 3.55Å; V154-F158 VanDerWaalsContact O-CD2 3.22Å; V154-F158 WeakPolarHBondContact O-CD2 3.35Å; V154-F158 PolarHBondContact O-N 2.72Å
155V97.8Very high94.3Very high70 Ų7048.6 Ų48.642%0.42427%0.268SS..Hα-helixtrans-61.4-41.8177.3174.80000111.7F117 I151 T152 W153 V157 F158 A159F117-V155 HydrophobicContact CD2-CG1 4.47Å; F117-V155 HydrophobicContact CE2-CG1 3.8Å; F117-V155 HydrophobicContact CZ-CG1 4.31Å; I151-V155 HydrophobicContact CG2-CG2 4.31Å; I151-V155 VanDerWaalsContact O-CG2 3.32Å; I151-V155 WeakPolarHBondContact O-CG2 3.35Å; I151-V155 PolarHBondContact O-N 3.46Å; T152-V155 PolarHBondContact O-N 2.67Å; W153-V155 VanDerWaalsContact C-N 3.34Å; W153-V155 PolarHBondContact O-N 3.02Å; V155-V157 PolarHBondContact O-N 2.9Å; V155-F158 PolarHBondContact O-N 2.89Å; V155-A159 WeakPolarHBondContact O-CB 3.45Å; V155-A159 PolarHBondContact O-N 3.01Å
156A97.4Very high93.9Very high0 Ų049.7 Ų49.70%027%0.273CS..Hα-helixtrans-63.4-39.9177.200000112.3F113 F117 T152 W153 V154 A159 S160F113-A156 HydrophobicContact CB-CB 4.14Å; F117-A156 HydrophobicContact CD2-CB 4.38Å; F117-A156 HydrophobicContact CE2-CB 4.47Å; T152-A156 WeakPolarHBondContact O-CB 3.24Å; T152-A156 PolarHBondContact O-N 3.46Å; W153-A156 PolarHBondContact O-N 2.86Å; V154-A156 PolarHBondContact O-N 3.31Å; A156-A159 PolarHBondContact O-N 3.43Å; A156-S160 WeakPolarHBondContact O-CB 3.44Å; A156-S160 PolarHBondContact O-N 3.18Å; A156-S160 VanDerWaalsContact O-N 3.12Å; A156-S160 PolarHBondContact O-OG 3.3Å
157V96.7Very high93.1Very high60 Ų6046.3 Ų46.336%0.36425%0.253SS..Hα-helixtrans-62.4-50.3174.1171.30000110.3I110 W153 V154 V155 A159 S160 L161I110-V157 HydrophobicContact CD1-CG2 3.97Å; I110-V157 HydrophobicContact CG1-CG2 4.2Å; W153-V157 WeakPolarHBondContact O-CG2 3.34Å; W153-V157 PolarHBondContact O-N 2.91Å; V154-V157 PolarHBondContact O-N 3.46Å; V155-V157 PolarHBondContact O-N 2.9Å; V157-A159 VanDerWaalsContact C-N 3.35Å; V157-A159 PolarHBondContact O-N 2.96Å; V157-S160 WeakPolarHBondContact O-CA 3.4Å; V157-S160 WeakPolarHBondContact O-CB 3.48Å; V157-S160 PolarHBondContact O-N 3.43Å; V157-L161 PolarHBondContact O-N 2.81Å; V157-L161 VanDerWaalsContact O-N 3.12Å
158F95.9Very high92.1Very high134 Ų13449.4 Ų49.459%0.58826%0.256SS*.Hα-helixtrans-59.8-42.1177.8-83.8-71.3000112.8V154 V155 S160 L161V154-F158 HydrophobicContact CG1-CD2 3.65Å; V154-F158 HydrophobicContact CG1-CE2 3.55Å; V154-F158 VanDerWaalsContact O-CD2 3.22Å; V154-F158 WeakPolarHBondContact O-CD2 3.35Å; V154-F158 PolarHBondContact O-N 2.72Å; V155-F158 PolarHBondContact O-N 2.89Å; F158-S160 PolarHBondContact O-N 3.14Å; F158-L161 HydrophobicContact CD1-CD1 3.63Å; F158-L161 HydrophobicContact CE1-CD1 4.08Å; F158-L161 HydrophobicContact CG-CD1 4.43Å; F158-L161 PolarHBondContact O-N 3.44Å
159A94.6Very high90.6Very high14 Ų1448.5 Ų48.512%0.11625%0.251CS..Hα-helixtrans-62.3-27.217600000112.8F113 V155 A156 V157 K197 L201F113-A159 HydrophobicContact CD1-CB 4.41Å; F113-A159 HydrophobicContact CD2-CB 3.8Å; F113-A159 HydrophobicContact CE2-CB 4.12Å; F113-A159 HydrophobicContact CG-CB 4Å; V155-A159 WeakPolarHBondContact O-CB 3.45Å; V155-A159 PolarHBondContact O-N 3.01Å; A156-A159 PolarHBondContact O-N 3.43Å; V157-A159 VanDerWaalsContact C-N 3.35Å; V157-A159 PolarHBondContact O-N 2.96Å; A159-K197 WeakPolarHBondContact O-CE 3.29Å; A159-K197 PolarHBondContact O-NZ 3.47Å; A159-L201 HydrophobicContact CB-CD1 4.34Å
160S93.6Very high89.2Confident0 Ų052.9 Ų52.90%027%0.271CS..Hα-helixtrans-83.6-26.4-179.6-56.60000113.3F109 I110 A156 V157 F158 G163 I164F109-S160 WeakPolarHBondContact CB-OG 3.27Å; F109-S160 PolarHBondContact O-OG 3.24Å; I110-S160 WeakPolarHBondContact CA-OG 3.37Å; I110-S160 WeakPolarHBondContact CG1-OG 3.26Å; I110-S160 PolarHBondContact N-OG 3.02Å; I110-S160 VanDerWaalsContact N-OG 3.12Å; A156-S160 WeakPolarHBondContact O-CB 3.44Å; A156-S160 PolarHBondContact O-N 3.18Å; A156-S160 VanDerWaalsContact O-N 3.12Å; A156-S160 PolarHBondContact O-OG 3.3Å; V157-S160 WeakPolarHBondContact O-CA 3.4Å; V157-S160 WeakPolarHBondContact O-CB 3.48Å; V157-S160 PolarHBondContact O-N 3.43Å; F158-S160 PolarHBondContact O-N 3.14Å; S160-G163 PolarHBondContact O-N 3.48Å; S160-I164 PolarHBondContact O-N 2.99Å
161L91.4Very high87.5Confident66 Ų6655 Ų5535%0.34627%0.273SS..Hα-helixtrans-51.5-47.3-174.4-72176000114.6V157 F158 G163 I164 I165V157-L161 PolarHBondContact O-N 2.81Å; V157-L161 VanDerWaalsContact O-N 3.12Å; F158-L161 HydrophobicContact CD1-CD1 3.63Å; F158-L161 HydrophobicContact CE1-CD1 4.08Å; F158-L161 HydrophobicContact CG-CD1 4.43Å; F158-L161 PolarHBondContact O-N 3.44Å; L161-G163 VanDerWaalsContact C-N 3.26Å; L161-G163 PolarHBondContact O-N 2.91Å; L161-I164 PolarHBondContact O-N 2.82Å; L161-I164 VanDerWaalsContact O-N 3.08Å; L161-I165 WeakPolarHBondContact O-CG1 3.33Å; L161-I165 PolarHBondContact O-N 2.94Å
162P87.9Confident85.9Confident24 Ų2454.9 Ų54.916%0.15627%0.27CS..Hα-helixtrans-59-39.6178.7-23.834.4000112.1I164 I165 F166 F193P162-I164 VanDerWaalsContact C-N 3.32Å; P162-I164 PolarHBondContact O-N 3.38Å; P162-I165 PolarHBondContact O-N 2.76Å; P162-F166 HydrophobicContact CB-CD2 4.4Å; P162-F166 HydrophobicContact CB-CE2 4.29Å; P162-F166 WeakPolarHBondContact O-CD2 3.49Å; P162-F166 PolarHBondContact O-N 3.2Å; P162-F166 VanDerWaalsContact O-N 3.11Å; P162-F193 HydrophobicContact CB-CE1 4.44Å; P162-F193 HydrophobicContact CG-CE1 4.23Å
163G83Confident84.4Confident1 Ų157.3 Ų57.31%0.0130%0.299CS..Hα-helixtrans-63.7-37.4177.400000112.6S160 L161 T167S160-G163 PolarHBondContact O-N 3.48Å; L161-G163 VanDerWaalsContact C-N 3.26Å; L161-G163 PolarHBondContact O-N 2.91Å; G163-T167 VanDerWaalsContact O-CB 3.32Å; G163-T167 WeakPolarHBondContact O-CB 3.44Å; G163-T167 PolarHBondContact O-N 3.16Å; G163-T167 PolarHBondContact O-OG1 3.47Å
164I86.5Confident82.6Confident38 Ų3862.6 Ų62.620%0.19533%0.33CS..Hα-helixtrans-69-44.1178.2-59.7168.3000110.7Q102 S160 L161 P162Q102-I164 HydrophobicContact CB-CG2 4.17Å; S160-I164 PolarHBondContact O-N 2.99Å; L161-I164 PolarHBondContact O-N 2.82Å; L161-I164 VanDerWaalsContact O-N 3.08Å; P162-I164 VanDerWaalsContact C-N 3.32Å; P162-I164 PolarHBondContact O-N 3.38Å
165I86.2Confident80.8Confident106 Ų10663.2 Ų63.254%0.54433%0.328SS..Hα-helixtrans-66.9-42.8-176.2-65.8164.4000111.5L161 P162L161-I165 WeakPolarHBondContact O-CG1 3.33Å; L161-I165 PolarHBondContact O-N 2.94Å; P162-I165 PolarHBondContact O-N 2.76Å
166F83.9Confident79.2Confident23 Ų2365.1 Ų65.110%0.10133%0.328CS..Hα-helixtrans-84.5-8.8-176.9-63.7-58.7000114P162 H181 F182 P183 W190P162-F166 HydrophobicContact CB-CD2 4.4Å; P162-F166 HydrophobicContact CB-CE2 4.29Å; P162-F166 WeakPolarHBondContact O-CD2 3.49Å; P162-F166 PolarHBondContact O-N 3.2Å; P162-F166 VanDerWaalsContact O-N 3.11Å; F166-H181 PolarHBondContact O-N 2.92Å; F166-F182 HydrophobicContact CB-CD1 3.85Å; F166-F182 HydrophobicContact CB-CE1 3.8Å; F166-F182 HydrophobicContact CD1-CD1 4.01Å; F166-F182 AromaticContact CD2-CD1 3.96Å; F166-F182 HydrophobicContact CD2-CD1 3.96Å; F166-F182 AromaticContact CD2-CE1 3.91Å; F166-F182 HydrophobicContact CD2-CE1 3.91Å; F166-F182 AromaticContact CG-CD1 3.66Å; F166-F182 HydrophobicContact CG-CD1 3.66Å; F166-F182 AromaticContact CG-CE1 3.88Å; F166-F182 HydrophobicContact CG-CE1 3.88Å; F166-P183 HydrophobicContact CE1-CG 4.05Å; F166-W190 HydrophobicContact CD2-CE3 4.31Å; F166-W190 HydrophobicContact CE1-CD2 4.26Å; F166-W190 AromaticContact CE2-CD2 3.72Å; F166-W190 HydrophobicContact CE2-CD2 3.72Å; F166-W190 AromaticContact CE2-CE3 3.24Å; F166-W190 HydrophobicContact CE2-CE3 3.24Å; F166-W190 HydrophobicContact CE2-CG 4.42Å; F166-W190 HydrophobicContact CE2-CH2 4.13Å; F166-W190 AromaticContact CE2-CZ3 3.48Å; F166-W190 HydrophobicContact CE2-CZ3 3.48Å; F166-W190 VanDerWaalsContact CE2-CZ3 3.48Å; F166-W190 AromaticContact CZ-CD2 3.42Å; F166-W190 HydrophobicContact CZ-CD2 3.42Å; F166-W190 VanDerWaalsContact CZ-CD2 3.42Å; F166-W190 AromaticContact CZ-CE2 3.65Å; F166-W190 AromaticContact CZ-CE3 3.41Å; F166-W190 HydrophobicContact CZ-CE3 3.41Å; F166-W190 VanDerWaalsContact CZ-CE3 3.41Å; F166-W190 HydrophobicContact CZ-CG 4.06Å; F166-W190 AromaticContact CZ-CH2 3.83Å; F166-W190 HydrophobicContact CZ-CH2 3.83Å; F166-W190 AromaticContact CZ-CZ2 3.85Å; F166-W190 HydrophobicContact CZ-CZ2 3.85Å; F166-W190 AromaticContact CZ-CZ3 3.62Å; F166-W190 HydrophobicContact CZ-CZ3 3.62Å
167T79.8Confident77.8Confident2 Ų266.3 Ų66.31%0.01234%0.335CS..EExtended strand (participates in β ladder)trans-87.4124176.4-60.50000110.7R101 T105 G163R101-T167 HydrophobicContact CG-CG2 3.87Å; T105-T167 HydrophobicContact CG2-CG2 4.39Å; G163-T167 VanDerWaalsContact O-CB 3.32Å; G163-T167 WeakPolarHBondContact O-CB 3.44Å; G163-T167 PolarHBondContact O-N 3.16Å; G163-T167 PolarHBondContact O-OG1 3.47Å
168R73.7Confident76.2Confident139 Ų13964.3 Ų64.353%0.52532%0.324SS..EExtended strand (participates in β ladder)trans-132.4152.3173.3-64.6-165.9179.1-157.31.3110.5N98 S179N98-R168 WeakPolarHBondContact OD1-CA 3.44Å; R168-S179 PolarHBondContact N-O 3.08Å
169S66.8Low74.9Confident19 Ų1959.9 Ų59.913%0.13331%0.31CS..EExtended strand (participates in β ladder)trans-93.9124.5165.8179.80000108.5N98N98-S169 PolarHBondContact OD1-N 2.9Å
170Q66.3Low73.9Confident97 Ų9762 Ų6245%0.45332%0.324SS..EExtended strand (participates in β ladder)trans-136.1157.7173.4-74.6-167.91.900110.2E172 T177Q170-E172 PolarHBondContact O-N 3.37Å; Q170-T177 PolarHBondContact N-O 3.44Å; Q170-T177 PolarHBondContact O-N 3.34Å
171K64.3Low73Confident133 Ų13364.8 Ų64.858%0.57834%0.336SS*.EExtended strand (participates in β ladder)trans-84.3105176-170.7179.3178.7-176.10108.6G173 Y176K171-G173 VanDerWaalsContact CE-O 3.31Å; K171-G173 WeakPolarHBondContact CE-O 3.32Å; K171-Y176 HydrophobicContact CB-CD1 4.08Å; K171-Y176 HydrophobicContact CB-CE1 3.89Å; K171-Y176 HydrophobicContact CG-CE1 4.5Å
172E62.7Low72.6Confident94 Ų9462.8 Ų62.844%0.43933%0.325SS..EExtended strand (participates in β ladder)trans-99.1101.1171.1-73.4176.8164.900108.4Q170 H175 T177 H181Q170-E172 PolarHBondContact O-N 3.37Å; E172-H175 PolarHBondContact N-O 3.14Å; E172-T177 HydrophobicContact CB-CG2 3.95Å; E172-T177 WeakPolarHBondContact CB-OG1 3.44Å; E172-T177 VanDerWaalsContact CG-OG1 3.26Å; E172-T177 WeakPolarHBondContact CG-OG1 3.35Å; E172-T177 WeakPolarHBondContact OE2-CB 3.2Å; E172-T177 PolarHBondContact OE2-OG1 3.43Å; E172-H181 IonicContact OE1-CE1 3.55Å
173G66.9Low72.3Confident67 Ų6764.2 Ų64.269%0.69133%0.334SS*.THydrogen-bonded Turntrans72.1-124.9-176.400000113.1K171K171-G173 VanDerWaalsContact CE-O 3.31Å; K171-G173 WeakPolarHBondContact CE-O 3.32Å
174L61.2Low72.2Confident157 Ų15774.3 Ų74.382%0.82237%0.373SS*.THydrogen-bonded Turntrans-84.1-12.5-178.9-80.2147000113.8
175H60.1Low72.2Confident84 Ų8477.9 Ų77.939%0.38940%0.402SS..EExtended strand (participates in β ladder)trans-123.3149.4-173.3-66-67.8000112.5Q93 E172 T177Q93-H175 PolarHBondContact OE1-ND1 3.41Å; E172-H175 PolarHBondContact N-O 3.14Å; H175-T177 PolarHBondContact O-N 2.94Å
176Y65.2Low72.3Confident110 Ų11077.7 Ų77.743%0.43140%0.399SS..EExtended strand (participates in β ladder)trans-76.5110165.7-73.1-86.8000108.7K171K171-Y176 HydrophobicContact CB-CD1 4.08Å; K171-Y176 HydrophobicContact CB-CE1 3.89Å; K171-Y176 HydrophobicContact CG-CE1 4.5Å
177T66.9Low72.4Confident24 Ų2481.5 Ų81.515%0.14741%0.413CS..EExtended strand (participates in β ladder)trans-97.2160.7174.561.90000109.9Q170 E172 H175Q170-T177 PolarHBondContact N-O 3.44Å; Q170-T177 PolarHBondContact O-N 3.34Å; E172-T177 HydrophobicContact CB-CG2 3.95Å; E172-T177 WeakPolarHBondContact CB-OG1 3.44Å; E172-T177 VanDerWaalsContact CG-OG1 3.26Å; E172-T177 WeakPolarHBondContact CG-OG1 3.35Å; E172-T177 WeakPolarHBondContact OE2-CB 3.2Å; E172-T177 PolarHBondContact OE2-OG1 3.43Å; H175-T177 PolarHBondContact O-N 2.94Å
178C62.5Low72.7Confident18 Ų1885.5 Ų85.512%0.12243%0.432CS..EExtended strand (participates in β ladder)trans-128.293.2-169.5139.40000105.7Y89 R101Y89-C178 HydrophobicContact CE2-CB 4Å; Y89-C178 PolarHBondContact OH-N 2.92Å; R101-C178 PolarHBondContact NE-SG 2.64Å; R101-C178 PolarHBondContact NH2-SG 3.19Å
179S69.2Low73.5Confident42 Ų4284.7 Ų84.729%0.29443%0.432SS..EExtended strand (participates in β ladder)trans-131.2150.2-171.1-65.50000110.7R168 H181R168-S179 PolarHBondContact N-O 3.08Å; S179-H181 PolarHBondContact O-CD2 2.97Å; S179-H181 VanDerWaalsContact O-CD2 3.31Å
180S73.9Confident74.6Confident59 Ų5986.8 Ų86.841%0.41344%0.437SS..EExtended strand (participates in β ladder)trans-79.1121.3170.5-65.30000108.7
181H75.4Confident75.6Confident57 Ų5783.8 Ų83.826%0.26442%0.423SS..  trans-109.1106.5178-68.9-87.6000109.6F166 E172 S179F166-H181 PolarHBondContact O-N 2.92Å; E172-H181 IonicContact OE1-CE1 3.55Å; S179-H181 PolarHBondContact O-CD2 2.97Å; S179-H181 VanDerWaalsContact O-CD2 3.31Å
182F82.3Confident76.9Confident24 Ų2479.3 Ų79.311%0.10541%0.405CS..  trans-86.2148.6173.1-55.6-59.9000110.6F166 Y184 Y187 W190 K191 Q194F166-F182 HydrophobicContact CB-CD1 3.85Å; F166-F182 HydrophobicContact CB-CE1 3.8Å; F166-F182 HydrophobicContact CD1-CD1 4.01Å; F166-F182 AromaticContact CD2-CD1 3.96Å; F166-F182 HydrophobicContact CD2-CD1 3.96Å; F166-F182 AromaticContact CD2-CE1 3.91Å; F166-F182 HydrophobicContact CD2-CE1 3.91Å; F166-F182 AromaticContact CG-CD1 3.66Å; F166-F182 HydrophobicContact CG-CD1 3.66Å; F166-F182 AromaticContact CG-CE1 3.88Å; F166-F182 HydrophobicContact CG-CE1 3.88Å; F182-Y184 PolarHBondContact O-N 3.29Å; F182-Y187 HydrophobicContact CB-CD2 3.89Å; F182-Y187 HydrophobicContact CB-CE2 4.4Å; F182-Y187 HydrophobicContact CD2-CD2 4.31Å; F182-Y187 HydrophobicContact CD2-CE2 4.07Å; F182-W190 HydrophobicContact CB-CB 3.9Å; F182-W190 HydrophobicContact CD1-CB 3.5Å; F182-W190 HydrophobicContact CD1-CG 4.43Å; F182-W190 HydrophobicContact CE1-CB 4.18Å; F182-W190 HydrophobicContact CG-CB 3.75Å; F182-K191 HydrophobicContact CD2-CB 4.07Å; F182-K191 HydrophobicContact CE2-CB 4.01Å; F182-K191 HydrophobicContact CE2-CG 4.32Å; F182-Q194 HydrophobicContact CE1-CB 4.48Å; F182-Q194 HydrophobicContact CZ-CB 4.17Å; F182-Q194 HydrophobicContact CZ-CG 4.42Å
183P81.9Confident78.4Confident54 Ų5479 Ų7935%0.35140%0.403SS..  trans-56.9129.3175.7-21.431.2000111.1F166 S185 Q186 Y187F166-P183 HydrophobicContact CE1-CG 4.05Å; P183-S185 PolarHBondContact O-N 2.69Å; P183-Q186 CarbonylContact O-C 3.57Å; P183-Q186 PolarHBondContact O-N 2.94Å; P183-Y187 WeakPolarHBondContact O-CA 3.42Å; P183-Y187 PolarHBondContact O-N 3.07Å
184Y81.4Confident79.5Confident213 Ų21376.5 Ų76.584%0.83537%0.373SS*.G310 helixtrans-55.5-38.2-176.5-67.2-76.1000113.3F182 Q186 Y187F182-Y184 PolarHBondContact O-N 3.29Å; Y184-Q186 PolarHBondContact O-N 3.15Å; Y184-Y187 PolarHBondContact O-N 3.12Å
185S85.5Confident81Confident113 Ų11369.4 Ų69.479%0.7934%0.336SS*.G310 helixtrans-62.1-24.2179.255.70000114.1P183P183-S185 PolarHBondContact O-N 2.69Å
186Q88.2Confident82.7Confident103 Ų10368.9 Ų68.948%0.48134%0.336SS..G310 helixtrans-134.528.2-176.5-66.6-176.3-23.100111.6P183 Y184 Q188 F189 W190P183-Q186 CarbonylContact O-C 3.57Å; P183-Q186 PolarHBondContact O-N 2.94Å; Y184-Q186 PolarHBondContact O-N 3.15Å; Q186-Q188 PolarHBondContact O-N 3.33Å; Q186-F189 HydrophobicContact CB-CB 4.4Å; Q186-F189 WeakPolarHBondContact O-CB 3.35Å; Q186-F189 PolarHBondContact O-N 3.13Å; Q186-F189 VanDerWaalsContact O-N 3.13Å; Q186-W190 VanDerWaalsContact O-CD1 3.29Å; Q186-W190 PolarHBondContact O-N 3.39Å; Q186-W190 VanDerWaalsContact O-N 3.08Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.13Å
187Y86Confident84.1Confident103 Ų10364.7 Ų64.740%0.40432%0.32SS..Hα-helixtrans-55.7-49.8-170.7177.1-93.5000111.9F182 P183 Y184 F189 W190 K191F182-Y187 HydrophobicContact CB-CD2 3.89Å; F182-Y187 HydrophobicContact CB-CE2 4.4Å; F182-Y187 HydrophobicContact CD2-CD2 4.31Å; F182-Y187 HydrophobicContact CD2-CE2 4.07Å; P183-Y187 WeakPolarHBondContact O-CA 3.42Å; P183-Y187 PolarHBondContact O-N 3.07Å; Y184-Y187 PolarHBondContact O-N 3.12Å; Y187-F189 VanDerWaalsContact C-N 3.34Å; Y187-F189 PolarHBondContact O-N 3.34Å; Y187-W190 PolarHBondContact O-N 3.46Å; Y187-K191 HydrophobicContact CE1-CD 3.9Å; Y187-K191 VanDerWaalsContact O-CB 3.27Å; Y187-K191 WeakPolarHBondContact O-CB 3.19Å; Y187-K191 PolarHBondContact O-N 2.82Å
188Q86.7Confident85.4Confident85 Ų8564 Ų6440%0.39732%0.315SS..Hα-helixtrans-64.8-38.1-179.2-167.1633800112.4Q186 N192Q186-Q188 PolarHBondContact O-N 3.33Å; Q188-N192 PolarHBondContact NE2-OD1 3.12Å; Q188-N192 VanDerWaalsContact O-CB 3.25Å; Q188-N192 WeakPolarHBondContact O-CB 3.41Å; Q188-N192 PolarHBondContact O-N 2.78Å; Q188-N192 PolarHBondContact O-ND2 3.16Å; Q188-N192 PolarHBondContact O-OD1 3.43Å
189F90.1Very high87Confident123 Ų12363.8 Ų63.854%0.53931%0.313SS..Hα-helixtrans-62.3-51.4178.8175.3-94.1000111Q186 Y187 N192 F193Q186-F189 HydrophobicContact CB-CB 4.4Å; Q186-F189 WeakPolarHBondContact O-CB 3.35Å; Q186-F189 PolarHBondContact O-N 3.13Å; Q186-F189 VanDerWaalsContact O-N 3.13Å; Y187-F189 VanDerWaalsContact C-N 3.34Å; Y187-F189 PolarHBondContact O-N 3.34Å; F189-N192 PolarHBondContact O-N 2.97Å; F189-F193 VanDerWaalsContact O-CB 3.26Å; F189-F193 WeakPolarHBondContact O-CB 3.43Å; F189-F193 PolarHBondContact O-N 3.08Å
190W89.6Confident88.3Confident62 Ų6265.9 Ų65.924%0.23532%0.32CS..Hα-helixtrans-69.2-37.1-178.7-72.8108.2000112.8F166 F182 Q186 Y187 F193 Q194F166-W190 HydrophobicContact CD2-CE3 4.31Å; F166-W190 HydrophobicContact CE1-CD2 4.26Å; F166-W190 AromaticContact CE2-CD2 3.72Å; F166-W190 HydrophobicContact CE2-CD2 3.72Å; F166-W190 AromaticContact CE2-CE3 3.24Å; F166-W190 HydrophobicContact CE2-CE3 3.24Å; F166-W190 HydrophobicContact CE2-CG 4.42Å; F166-W190 HydrophobicContact CE2-CH2 4.13Å; F166-W190 AromaticContact CE2-CZ3 3.48Å; F166-W190 HydrophobicContact CE2-CZ3 3.48Å; F166-W190 VanDerWaalsContact CE2-CZ3 3.48Å; F166-W190 AromaticContact CZ-CD2 3.42Å; F166-W190 HydrophobicContact CZ-CD2 3.42Å; F166-W190 VanDerWaalsContact CZ-CD2 3.42Å; F166-W190 AromaticContact CZ-CE2 3.65Å; F166-W190 AromaticContact CZ-CE3 3.41Å; F166-W190 HydrophobicContact CZ-CE3 3.41Å; F166-W190 VanDerWaalsContact CZ-CE3 3.41Å; F166-W190 HydrophobicContact CZ-CG 4.06Å; F166-W190 AromaticContact CZ-CH2 3.83Å; F166-W190 HydrophobicContact CZ-CH2 3.83Å; F166-W190 AromaticContact CZ-CZ2 3.85Å; F166-W190 HydrophobicContact CZ-CZ2 3.85Å; F166-W190 AromaticContact CZ-CZ3 3.62Å; F166-W190 HydrophobicContact CZ-CZ3 3.62Å; F182-W190 HydrophobicContact CB-CB 3.9Å; F182-W190 HydrophobicContact CD1-CB 3.5Å; F182-W190 HydrophobicContact CD1-CG 4.43Å; F182-W190 HydrophobicContact CE1-CB 4.18Å; F182-W190 HydrophobicContact CG-CB 3.75Å; Q186-W190 VanDerWaalsContact O-CD1 3.29Å; Q186-W190 PolarHBondContact O-N 3.39Å; Q186-W190 VanDerWaalsContact O-N 3.08Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.13Å; Y187-W190 PolarHBondContact O-N 3.46Å; W190-F193 HydrophobicContact CE3-CD1 4.16Å; W190-F193 HydrophobicContact CZ3-CD1 4.19Å; W190-F193 HydrophobicContact CZ3-CE1 4.43Å; W190-F193 PolarHBondContact O-N 2.96Å; W190-Q194 WeakPolarHBondContact O-CB 3.25Å; W190-Q194 PolarHBondContact O-N 3.39Å
191K88.2Confident89.3Confident34 Ų3465.2 Ų65.215%0.14831%0.312CS..Hα-helixtrans-59.6-50.5172.5-171.7-175.6177.3-1730110.9F182 Y187 Q194 T195 T259F182-K191 HydrophobicContact CD2-CB 4.07Å; F182-K191 HydrophobicContact CE2-CB 4.01Å; F182-K191 HydrophobicContact CE2-CG 4.32Å; Y187-K191 HydrophobicContact CE1-CD 3.9Å; Y187-K191 VanDerWaalsContact O-CB 3.27Å; Y187-K191 WeakPolarHBondContact O-CB 3.19Å; Y187-K191 PolarHBondContact O-N 2.82Å; K191-Q194 PolarHBondContact O-N 3.27Å; K191-T195 PolarHBondContact O-N 2.98Å; K191-T195 VanDerWaalsContact O-N 3.12Å; K191-T195 PolarHBondContact O-OG1 3.39Å; K191-T259 HydrophobicContact CG-CG2 4.19Å
192N91.7Very high90.2Very high40 Ų4062.5 Ų62.521%0.21430%0.299CS..Hα-helixtrans-62.5-46.1177.7-71.5-6.7000111.7Q188 F189 Q194 T195 L196Q188-N192 PolarHBondContact NE2-OD1 3.12Å; Q188-N192 VanDerWaalsContact O-CB 3.25Å; Q188-N192 WeakPolarHBondContact O-CB 3.41Å; Q188-N192 PolarHBondContact O-N 2.78Å; Q188-N192 PolarHBondContact O-ND2 3.16Å; Q188-N192 PolarHBondContact O-OD1 3.43Å; F189-N192 PolarHBondContact O-N 2.97Å; N192-Q194 PolarHBondContact O-N 2.95Å; N192-T195 PolarHBondContact O-N 3.34Å; N192-L196 VanDerWaalsContact O-CB 3.32Å; N192-L196 WeakPolarHBondContact O-CB 3.48Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.45Å; N192-L196 PolarHBondContact O-N 3.07Å
193F92.9Very high90.8Very high87 Ų8762.8 Ų62.838%0.38230%0.302SS..Hα-helixtrans-58.5-47179.4176.8-98.4000111.6P162 F189 W190 K197P162-F193 HydrophobicContact CB-CE1 4.44Å; P162-F193 HydrophobicContact CG-CE1 4.23Å; F189-F193 VanDerWaalsContact O-CB 3.26Å; F189-F193 WeakPolarHBondContact O-CB 3.43Å; F189-F193 PolarHBondContact O-N 3.08Å; W190-F193 HydrophobicContact CE3-CD1 4.16Å; W190-F193 HydrophobicContact CZ3-CD1 4.19Å; W190-F193 HydrophobicContact CZ3-CE1 4.43Å; W190-F193 PolarHBondContact O-N 2.96Å; F193-K197 WeakPolarHBondContact O-CB 3.3Å; F193-K197 PolarHBondContact O-N 3.32Å
194Q91.1Very high91.4Very high15 Ų1563.8 Ų63.87%0.0731%0.307CS..Hα-helixtrans-64-44.5-179.7-174.869.6-8.300111.7F182 W190 K191 N192 I198F182-Q194 HydrophobicContact CE1-CB 4.48Å; F182-Q194 HydrophobicContact CZ-CB 4.17Å; F182-Q194 HydrophobicContact CZ-CG 4.42Å; W190-Q194 WeakPolarHBondContact O-CB 3.25Å; W190-Q194 PolarHBondContact O-N 3.39Å; K191-Q194 PolarHBondContact O-N 3.27Å; N192-Q194 PolarHBondContact O-N 2.95Å; Q194-I198 HydrophobicContact CG-CD1 4.2Å; Q194-I198 WeakPolarHBondContact O-CG1 3.24Å; Q194-I198 PolarHBondContact O-N 3.04Å; Q194-I198 VanDerWaalsContact O-N 3.12Å
195T92.5Very high92.1Very high8 Ų856.7 Ų56.75%0.04928%0.283CS..Hα-helixtrans-64.1-50.4177.3-66.30000111.8K191 N192 K197 I198 V199 L255 L256 T259K191-T195 PolarHBondContact O-N 2.98Å; K191-T195 VanDerWaalsContact O-N 3.12Å; K191-T195 PolarHBondContact O-OG1 3.39Å; N192-T195 PolarHBondContact O-N 3.34Å; T195-K197 VanDerWaalsContact C-N 3.3Å; T195-K197 PolarHBondContact O-N 2.89Å; T195-I198 PolarHBondContact O-N 3.22Å; T195-V199 HydrophobicContact CG2-CG2 4.3Å; T195-V199 WeakPolarHBondContact O-CG2 3.4Å; T195-V199 PolarHBondContact O-N 2.99Å; T195-L255 HydrophobicContact CG2-CD2 4.44Å; T195-L255 HydrophobicContact CG2-CG 4.07Å; T195-L256 HydrophobicContact CG2-CD1 4.32Å; T195-T259 WeakPolarHBondContact CB-OG1 3.35Å; T195-T259 HydrophobicContact CG2-CG2 4.14Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.35Å; T195-T259 PolarHBondContact OG1-OG1 2.88Å
196L94.9Very high92.5Very high73 Ų7351.3 Ų51.338%0.38225%0.245SC..Hα-helixtrans-61.2-40.4179.7-70.9174.9000111.3N192 I198 V199 I200 F260N192-L196 VanDerWaalsContact O-CB 3.32Å; N192-L196 WeakPolarHBondContact O-CB 3.48Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.45Å; N192-L196 PolarHBondContact O-N 3.07Å; L196-I198 PolarHBondContact O-N 3.08Å; L196-V199 PolarHBondContact O-N 3.22Å; L196-I200 HydrophobicContact CB-CD1 4.23Å; L196-I200 WeakPolarHBondContact O-CB 3.46Å; L196-I200 WeakPolarHBondContact O-CD1 3.4Å; L196-I200 WeakPolarHBondContact O-CG1 3.29Å; L196-I200 PolarHBondContact O-N 3.34Å; L196-F260 HydrophobicContact CD2-CE2 4.48Å
197K95.3Very high92.8Very high22 Ų2250.4 Ų50.410%0.09624%0.243CC..Hα-helixtrans-57.9-48.8174.8-177.2-15875.6-178.60111.7F113 A159 F193 T195 L201F113-K197 HydrophobicContact CZ-CD 4.5Å; A159-K197 WeakPolarHBondContact O-CE 3.29Å; A159-K197 PolarHBondContact O-NZ 3.47Å; F193-K197 WeakPolarHBondContact O-CB 3.3Å; F193-K197 PolarHBondContact O-N 3.32Å; T195-K197 VanDerWaalsContact C-N 3.3Å; T195-K197 PolarHBondContact O-N 2.89Å; K197-L201 HydrophobicContact CG-CD1 3.87Å; K197-L201 WeakPolarHBondContact O-CB 3.47Å; K197-L201 WeakPolarHBondContact O-CG 3.33Å; K197-L201 PolarHBondContact O-N 3.33Å
198I94.2Very high93.3Very high10 Ų1050.3 Ų50.35%0.05125%0.249CC..Hα-helixtrans-62.8-47.5179.6-67.8165.3000110.3F109 F112 F113 Q194 T195 L196 G202 N252 L255F109-I198 HydrophobicContact CE1-CD1 4.07Å; F112-I198 HydrophobicContact CE1-CG2 4.25Å; F112-I198 HydrophobicContact CZ-CG2 4.32Å; F113-I198 HydrophobicContact CZ-CG1 4.24Å; Q194-I198 HydrophobicContact CG-CD1 4.2Å; Q194-I198 WeakPolarHBondContact O-CG1 3.24Å; Q194-I198 PolarHBondContact O-N 3.04Å; Q194-I198 VanDerWaalsContact O-N 3.12Å; T195-I198 PolarHBondContact O-N 3.22Å; L196-I198 PolarHBondContact O-N 3.08Å; I198-G202 VanDerWaalsContact O-CA 3.28Å; I198-G202 WeakPolarHBondContact O-CA 3.49Å; I198-G202 PolarHBondContact O-N 3.21Å; I198-N252 WeakPolarHBondContact CG2-OD1 3.29Å; I198-N252 PolarHBondContact O-OD1 2.94Å; I198-L255 HydrophobicContact CB-CD2 4.05Å; I198-L255 HydrophobicContact CD1-CD2 3.96Å; I198-L255 HydrophobicContact CG2-CD2 3.79Å
199V95.6Very high93.7Very high13 Ų1347.2 Ų47.28%0.07924%0.236CC..Hα-helixtrans-67.3-43.2-178.7173.90000111.9T195 L196 L203 V204 N252 L256T195-V199 HydrophobicContact CG2-CG2 4.3Å; T195-V199 WeakPolarHBondContact O-CG2 3.4Å; T195-V199 PolarHBondContact O-N 2.99Å; L196-V199 PolarHBondContact O-N 3.22Å; V199-L203 WeakPolarHBondContact O-CA 3.43Å; V199-L203 VanDerWaalsContact O-CB 3.27Å; V199-L203 WeakPolarHBondContact O-CB 3.2Å; V199-L203 PolarHBondContact O-N 3.4Å; V199-V204 HydrophobicContact CG1-CG2 4.27Å; V199-V204 PolarHBondContact O-N 3.13Å; V199-N252 HydrophobicContact CG2-CB 4.43Å; V199-L256 HydrophobicContact CG2-CD1 4.42Å
200I96.6Very high93.7Very high86 Ų8642.8 Ų42.844%0.44122%0.217SC..Iπ-helixtrans-65.8-50.4-179.2-69.6166.5000110.1L196 V204 L205L196-I200 HydrophobicContact CB-CD1 4.23Å; L196-I200 WeakPolarHBondContact O-CB 3.46Å; L196-I200 WeakPolarHBondContact O-CD1 3.4Å; L196-I200 WeakPolarHBondContact O-CG1 3.29Å; L196-I200 PolarHBondContact O-N 3.34Å; I200-V204 PolarHBondContact O-N 3.05Å; I200-L205 VanDerWaalsContact O-CB 3.24Å; I200-L205 WeakPolarHBondContact O-CB 3.36Å; I200-L205 PolarHBondContact O-N 3.19Å
201L96.4Very high93.8Very high44 Ų4443.9 Ų43.923%0.2323%0.231CC..Iπ-helixtrans-77.5-33.5-175.7-61.4178.1000112.9F113 F117 A159 K197 L205 P206F113-L201 HydrophobicContact CD1-CB 4.25Å; F113-L201 HydrophobicContact CD1-CD1 4.31Å; F113-L201 HydrophobicContact CE1-CB 3.99Å; F113-L201 HydrophobicContact CE1-CD1 4.02Å; F117-L201 HydrophobicContact CE1-CB 4.38Å; F117-L201 HydrophobicContact CE1-CD2 4.47Å; F117-L201 HydrophobicContact CZ-CD1 4.33Å; F117-L201 HydrophobicContact CZ-CD2 4.48Å; A159-L201 HydrophobicContact CB-CD1 4.34Å; K197-L201 HydrophobicContact CG-CD1 3.87Å; K197-L201 WeakPolarHBondContact O-CB 3.47Å; K197-L201 WeakPolarHBondContact O-CG 3.33Å; K197-L201 PolarHBondContact O-N 3.33Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L201-P206 WeakPolarHBondContact O-CD 3.24Å
202G92.9Very high94.1Very high0 Ų046.8 Ų46.80%025%0.247CC..Iπ-helixtrans-93-19-175.900000115I198 P206 Y244I198-G202 VanDerWaalsContact O-CA 3.28Å; I198-G202 WeakPolarHBondContact O-CA 3.49Å; I198-G202 PolarHBondContact O-N 3.21Å; G202-P206 WeakPolarHBondContact O-CG 3.39Å; G202-Y244 VanDerWaalsContact O-CE1 3.32Å; G202-Y244 WeakPolarHBondContact O-CE1 3.42Å; G202-Y244 PolarHBondContact O-OH 3.21Å
203L94.5Very high94.1Very high31 Ų3145.2 Ų45.216%0.16224%0.239CC..Iπ-helixtrans-128.6-56.2-178.4-17664.5000112.6V199 P206 L207 F245 A249 N252V199-L203 WeakPolarHBondContact O-CA 3.43Å; V199-L203 VanDerWaalsContact O-CB 3.27Å; V199-L203 WeakPolarHBondContact O-CB 3.2Å; V199-L203 PolarHBondContact O-N 3.4Å; L203-P206 WeakPolarHBondContact O-CD 3.5Å; L203-P206 WeakPolarHBondContact O-CG 3.27Å; L203-L207 WeakPolarHBondContact O-CB 3.44Å; L203-L207 PolarHBondContact O-N 2.9Å; L203-L207 VanDerWaalsContact O-N 3.1Å; L203-F245 HydrophobicContact CD1-CD1 3.8Å; L203-F245 HydrophobicContact CD1-CE1 3.9Å; L203-A249 HydrophobicContact CD1-CB 3.75Å; L203-N252 HydrophobicContact CB-CB 4.26Å; L203-N252 HydrophobicContact CD2-CB 4.02Å
204V96.3Very high93.8Very high75 Ų7542.4 Ų42.446%0.45523%0.226SC..Iπ-helixtrans-68-49.4-172-178.70000111.7V199 I200 L207 L208V199-V204 HydrophobicContact CG1-CG2 4.27Å; V199-V204 PolarHBondContact O-N 3.13Å; I200-V204 PolarHBondContact O-N 3.05Å; V204-L207 PolarHBondContact O-N 3.34Å; V204-L208 WeakPolarHBondContact O-CB 3.33Å; V204-L208 PolarHBondContact O-N 2.9Å
205L96Very high93.7Very high63 Ų6345.2 Ų45.233%0.3325%0.247SC..Hα-helixtrans-59.3-53.7179.3178.866.4000112.7F117 I120 I200 L201 L207 L208 V209F117-L205 HydrophobicContact CE1-CD2 4.33Å; I120-L205 HydrophobicContact CD1-CD2 3.98Å; I120-L205 HydrophobicContact CD1-CG 3.99Å; I200-L205 VanDerWaalsContact O-CB 3.24Å; I200-L205 WeakPolarHBondContact O-CB 3.36Å; I200-L205 PolarHBondContact O-N 3.19Å; L201-L205 HydrophobicContact CD2-CD2 4.25Å; L205-L207 VanDerWaalsContact C-N 3.27Å; L205-L207 PolarHBondContact O-N 3.37Å; L205-L208 PolarHBondContact O-N 2.96Å; L205-V209 WeakPolarHBondContact O-CG2 3.36Å; L205-V209 PolarHBondContact O-N 3.45Å
206P93.6Very high93.5Very high0 Ų045.5 Ų45.50%025%0.252CS..Hα-helixtrans-64-32.6178.224-33.8000112.5I116 I120 L201 G202 L203 V209 M210 M241 F245I116-P206 HydrophobicContact CD1-CB 3.55Å; I116-P206 HydrophobicContact CD1-CG 3.81Å; I116-P206 HydrophobicContact CG1-CB 3.96Å; I116-P206 HydrophobicContact CG1-CG 3.83Å; I120-P206 HydrophobicContact CD1-CB 3.99Å; I120-P206 HydrophobicContact CG1-CB 3.98Å; L201-P206 WeakPolarHBondContact O-CD 3.24Å; G202-P206 WeakPolarHBondContact O-CG 3.39Å; L203-P206 WeakPolarHBondContact O-CD 3.5Å; L203-P206 WeakPolarHBondContact O-CG 3.27Å; P206-V209 PolarHBondContact O-N 2.99Å; P206-M210 VanDerWaalsContact O-CB 3.3Å; P206-M210 WeakPolarHBondContact O-CB 3.46Å; P206-M210 PolarHBondContact O-N 3.27Å; P206-M241 HydrophobicContact CB-SD 4.33Å; P206-F245 HydrophobicContact CB-CE1 4.24Å; P206-F245 HydrophobicContact CB-CZ 3.85Å; P206-F245 HydrophobicContact CG-CE1 4Å; P206-F245 HydrophobicContact CG-CZ 4.11Å
207L94.3Very high93Very high85 Ų8542.2 Ų42.245%0.44524%0.235SC..Hα-helixtrans-67.3-43.2177-173.170.5000111.2L203 V204 L205 M210 V211 F245L203-L207 WeakPolarHBondContact O-CB 3.44Å; L203-L207 PolarHBondContact O-N 2.9Å; L203-L207 VanDerWaalsContact O-N 3.1Å; V204-L207 PolarHBondContact O-N 3.34Å; L205-L207 VanDerWaalsContact C-N 3.27Å; L205-L207 PolarHBondContact O-N 3.37Å; L207-M210 WeakPolarHBondContact O-CB 3.43Å; L207-M210 PolarHBondContact O-N 2.93Å; L207-V211 WeakPolarHBondContact O-CG2 3.22Å; L207-V211 PolarHBondContact O-N 3.49Å; L207-F245 HydrophobicContact CB-CE1 4.35Å; L207-F245 HydrophobicContact CB-CZ 4.07Å; L207-F245 HydrophobicContact CD1-CE2 4.43Å; L207-F245 HydrophobicContact CD1-CZ 4.26Å
208L95.9Very high92.6Very high101 Ų10146 Ų4653%0.52926%0.256SS..Hα-helixtrans-60.1-47.7175-179.764.2000111.3V204 L205 M210 V211 I212V204-L208 WeakPolarHBondContact O-CB 3.33Å; V204-L208 PolarHBondContact O-N 2.9Å; L205-L208 PolarHBondContact O-N 2.96Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.46Å; L208-V211 PolarHBondContact O-N 2.85Å; L208-I212 HydrophobicContact CD1-CD1 3.82Å; L208-I212 HydrophobicContact CD1-CG1 4.36Å; L208-I212 HydrophobicContact CG-CD1 3.88Å; L208-I212 WeakPolarHBondContact O-CG1 3.5Å; L208-I212 PolarHBondContact O-N 3.36Å
209V94.5Very high92.2Very high20 Ų2053.3 Ų53.312%0.12129%0.287CS..Hα-helixtrans-59.2-43.5175.6171.90000110.5I120 T123 I124 L205 P206 I212 C213I120-V209 HydrophobicContact CG2-CG1 4.22Å; I120-V209 HydrophobicContact CG2-CG2 4.03Å; T123-V209 HydrophobicContact CG2-CG1 4.04Å; I124-V209 HydrophobicContact CG1-CG1 4.14Å; L205-V209 WeakPolarHBondContact O-CG2 3.36Å; L205-V209 PolarHBondContact O-N 3.45Å; P206-V209 PolarHBondContact O-N 2.99Å; V209-I212 PolarHBondContact O-N 2.89Å; V209-C213 WeakPolarHBondContact O-CB 3.44Å; V209-C213 PolarHBondContact O-N 2.8Å; V209-C213 PolarHBondContact O-SG 3.09Å; V209-C213 VanDerWaalsContact O-SG 3.39Å
210M90.6Very high91.5Very high29 Ų2954.2 Ų54.214%0.14329%0.293CS..Hα-helixtrans-58.6-52.3177.9-173.8-174.2-172.300111P206 L207 L208 I212 C213 Y214 F238 M241 I242 F245P206-M210 VanDerWaalsContact O-CB 3.3Å; P206-M210 WeakPolarHBondContact O-CB 3.46Å; P206-M210 PolarHBondContact O-N 3.27Å; L207-M210 WeakPolarHBondContact O-CB 3.43Å; L207-M210 PolarHBondContact O-N 2.93Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.46Å; M210-I212 PolarHBondContact O-N 3.44Å; M210-C213 PolarHBondContact O-N 2.94Å; M210-Y214 HydrophobicContact CB-CD2 4.3Å; M210-Y214 HydrophobicContact CG-CD2 3.54Å; M210-Y214 HydrophobicContact CG-CE2 3.95Å; M210-Y214 VanDerWaalsContact O-CB 3.31Å; M210-Y214 WeakPolarHBondContact O-CB 3.5Å; M210-Y214 VanDerWaalsContact O-CD2 3.28Å; M210-Y214 WeakPolarHBondContact O-CD2 3.28Å; M210-Y214 PolarHBondContact O-N 3.33Å; M210-F238 HydrophobicContact CE-CD2 4.01Å; M210-F238 HydrophobicContact CE-CE2 3.52Å; M210-F238 HydrophobicContact CE-CZ 4.33Å; M210-M241 HydrophobicContact CB-CG 4.43Å; M210-M241 HydrophobicContact CE-CG 4.39Å; M210-M241 HydrophobicContact CG-CG 4.16Å; M210-M241 HydrophobicContact SD-CG 3.94Å; M210-I242 HydrophobicContact CE-CD1 4.47Å; M210-I242 HydrophobicContact CE-CG1 3.83Å; M210-F245 HydrophobicContact SD-CD2 4.04Å; M210-F245 HydrophobicContact SD-CE2 3.55Å; M210-F245 VanDerWaalsContact SD-CE2 3.55Å
211V92.8Very high90.6Very high85 Ų8551.2 Ų51.252%0.51528%0.277SS..Hα-helixtrans-59.8-46.2-178.3172.30000111.3L207 L208 S215L207-V211 WeakPolarHBondContact O-CG2 3.22Å; L207-V211 PolarHBondContact O-N 3.49Å; L208-V211 PolarHBondContact O-N 2.85Å; V211-S215 WeakPolarHBondContact O-CB 3.25Å; V211-S215 PolarHBondContact O-N 3.48Å; V211-S215 PolarHBondContact O-OG 3.33Å
212I93.6Very high89.7Confident95 Ų9555.7 Ų55.749%0.48730%0.301SS..Hα-helixtrans-66.9-52.5-178.8-64.8169.3000110.6L208 V209 M210 G216L208-I212 HydrophobicContact CD1-CD1 3.82Å; L208-I212 HydrophobicContact CD1-CG1 4.36Å; L208-I212 HydrophobicContact CG-CD1 3.88Å; L208-I212 WeakPolarHBondContact O-CG1 3.5Å; L208-I212 PolarHBondContact O-N 3.36Å; V209-I212 PolarHBondContact O-N 2.89Å; M210-I212 PolarHBondContact O-N 3.44Å; I212-G216 PolarHBondContact O-N 2.88Å
213C91.5Very high89Confident8 Ų866.4 Ų66.45%0.05434%0.341CS..Hα-helixtrans-67.4-46.1-174.1-71.50000112T123 Y127 V209 M210 G216 I217T123-C213 HydrophobicContact CG2-CB 3.81Å; Y127-C213 VanDerWaalsContact CD2-CA 3.48Å; Y127-C213 HydrophobicContact CD2-CB 3.86Å; Y127-C213 VanDerWaalsContact CD2-O 3.3Å; Y127-C213 WeakPolarHBondContact CD2-O 3.41Å; Y127-C213 HydrophobicContact CG-CB 4.08Å; V209-C213 WeakPolarHBondContact O-CB 3.44Å; V209-C213 PolarHBondContact O-N 2.8Å; V209-C213 PolarHBondContact O-SG 3.09Å; V209-C213 VanDerWaalsContact O-SG 3.39Å; M210-C213 PolarHBondContact O-N 2.94Å; C213-G216 PolarHBondContact O-N 3.31Å; C213-I217 WeakPolarHBondContact O-CB 3.33Å; C213-I217 VanDerWaalsContact O-CG1 3.24Å; C213-I217 WeakPolarHBondContact O-CG1 3.28Å; C213-I217 PolarHBondContact O-N 2.92Å
214Y87.5Confident87.7Confident28 Ų2868 Ų6811%0.1135%0.354CS..Hα-helixtrans-72.2-31.7-177.3-76.2-77000112.8T123 M210 I217 L218 V234 I237 F238T123-Y214 HydrophobicContact CG2-CD2 4.49Å; T123-Y214 HydrophobicContact CG2-CE2 3.82Å; M210-Y214 HydrophobicContact CB-CD2 4.3Å; M210-Y214 HydrophobicContact CG-CD2 3.54Å; M210-Y214 HydrophobicContact CG-CE2 3.95Å; M210-Y214 VanDerWaalsContact O-CB 3.31Å; M210-Y214 WeakPolarHBondContact O-CB 3.5Å; M210-Y214 VanDerWaalsContact O-CD2 3.28Å; M210-Y214 WeakPolarHBondContact O-CD2 3.28Å; M210-Y214 PolarHBondContact O-N 3.33Å; Y214-I217 HydrophobicContact CD1-CD1 4.23Å; Y214-I217 HydrophobicContact CE1-CD1 4.32Å; Y214-I217 PolarHBondContact O-N 2.88Å; Y214-L218 VanDerWaalsContact O-CB 3.23Å; Y214-L218 WeakPolarHBondContact O-CB 3.2Å; Y214-L218 PolarHBondContact O-N 3.04Å; Y214-V234 HydrophobicContact CE1-CG1 4.11Å; Y214-I237 VanDerWaalsContact OH-C 3.25Å; Y214-F238 AromaticContact CD1-CD2 3.67Å; Y214-F238 HydrophobicContact CD1-CD2 3.67Å; Y214-F238 HydrophobicContact CD1-CE2 4.23Å; Y214-F238 HydrophobicContact CD1-CG 4.49Å; Y214-F238 HydrophobicContact CD2-CD2 4.19Å; Y214-F238 HydrophobicContact CE1-CB 3.67Å; Y214-F238 AromaticContact CE1-CD2 3.42Å; Y214-F238 HydrophobicContact CE1-CD2 3.42Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.42Å; Y214-F238 HydrophobicContact CE1-CE2 4.4Å; Y214-F238 AromaticContact CE1-CG 3.95Å; Y214-F238 HydrophobicContact CE1-CG 3.95Å; Y214-F238 AromaticContact CE2-CD2 3.98Å; Y214-F238 HydrophobicContact CE2-CD2 3.98Å; Y214-F238 HydrophobicContact CG-CD2 4.06Å; Y214-F238 HydrophobicContact CG-CE2 4.34Å; Y214-F238 AromaticContact CZ-CD2 3.6Å; Y214-F238 WeakPolarHBondContact OH-CA 3.31Å; Y214-F238 PolarHBondContact OH-N 3.2Å
215S88.6Confident86.1Confident73 Ų7375 Ų7551%0.5137%0.372SS..Hα-helixtrans-58.5-47.5170.4-65.20000111.8V211 L218 K219V211-S215 WeakPolarHBondContact O-CB 3.25Å; V211-S215 PolarHBondContact O-N 3.48Å; V211-S215 PolarHBondContact O-OG 3.33Å; S215-L218 PolarHBondContact O-N 2.71Å; S215-K219 WeakPolarHBondContact O-CB 3.47Å; S215-K219 PolarHBondContact O-N 2.85Å
216G87.5Confident84.2Confident15 Ų1578.7 Ų78.716%0.15539%0.393CS..Hα-helixtrans-68.8-38.9178.100000113.4I212 C213 T220I212-G216 PolarHBondContact O-N 2.88Å; C213-G216 PolarHBondContact O-N 3.31Å; G216-T220 WeakPolarHBondContact O-CB 3.49Å; G216-T220 PolarHBondContact O-N 2.88Å; G216-T220 VanDerWaalsContact O-N 3.09Å; G216-T220 PolarHBondContact O-OG1 2.96Å
217I85.9Confident82.8Confident3 Ų384.3 Ų84.32%0.01542%0.419CS..Hα-helixtrans-60.7-50174.1-70.9164.5000109.9Y127 V130 V131 C213 Y214 K219 T220 L221 V234Y127-I217 HydrophobicContact CD2-CG1 4.16Å; V130-I217 HydrophobicContact CB-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG1 4.4Å; V130-I217 HydrophobicContact CG1-CG2 4.31Å; V131-I217 HydrophobicContact CG2-CG1 4.32Å; C213-I217 WeakPolarHBondContact O-CB 3.33Å; C213-I217 VanDerWaalsContact O-CG1 3.24Å; C213-I217 WeakPolarHBondContact O-CG1 3.28Å; C213-I217 PolarHBondContact O-N 2.92Å; Y214-I217 HydrophobicContact CD1-CD1 4.23Å; Y214-I217 HydrophobicContact CE1-CD1 4.32Å; Y214-I217 PolarHBondContact O-N 2.88Å; I217-K219 PolarHBondContact O-N 3.1Å; I217-T220 PolarHBondContact O-N 2.91Å; I217-T220 VanDerWaalsContact O-N 3.12Å; I217-L221 HydrophobicContact CG2-CD1 3.69Å; I217-L221 HydrophobicContact CG2-CG 4Å; I217-L221 WeakPolarHBondContact O-CB 3.38Å; I217-L221 VanDerWaalsContact O-CG 3.28Å; I217-L221 WeakPolarHBondContact O-CG 3.4Å; I217-L221 PolarHBondContact O-N 3.35Å; I217-V234 HydrophobicContact CG2-CG1 3.76Å; I217-V234 HydrophobicContact CG2-CG2 3.93Å
218L85.1Confident81.4Confident102 Ų10288.5 Ų88.553%0.53443%0.434SS..Hα-helixtrans-60.8-45.5-178.3-173.562.3000111.3Y214 S215 T220 L221 L222Y214-L218 VanDerWaalsContact O-CB 3.23Å; Y214-L218 WeakPolarHBondContact O-CB 3.2Å; Y214-L218 PolarHBondContact O-N 3.04Å; S215-L218 PolarHBondContact O-N 2.71Å; L218-T220 VanDerWaalsContact C-N 3.25Å; L218-T220 PolarHBondContact O-N 3.42Å; L218-L221 PolarHBondContact O-N 3.02Å; L218-L222 HydrophobicContact CD1-CD1 4.47Å; L218-L222 HydrophobicContact CD1-CG 4.39Å; L218-L222 HydrophobicContact CG-CD1 4.11Å; L218-L222 HydrophobicContact CG-CG 4.46Å; L218-L222 WeakPolarHBondContact O-CB 3.11Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.44Å; L218-L222 PolarHBondContact O-N 3.07Å
219K86.3Confident79.8Confident164 Ų16491 Ų9171%0.71344%0.44SS*.Hα-helixtrans-55.6-41.4174.6-173.3176.3-178.4176.10112.1S215 I217 R223S215-K219 WeakPolarHBondContact O-CB 3.47Å; S215-K219 PolarHBondContact O-N 2.85Å; I217-K219 PolarHBondContact O-N 3.1Å; K219-R223 PolarHBondContact O-N 3.45Å
220T81.2Confident78.5Confident32 Ų3292.7 Ų92.720%0.19644%0.444CS..Hα-helixtrans-76.5-32.8-179.2-53.70000112.7V130 G216 I217 L218 C224 R230V130-T220 HydrophobicContact CG1-CG2 4.11Å; G216-T220 WeakPolarHBondContact O-CB 3.49Å; G216-T220 PolarHBondContact O-N 2.88Å; G216-T220 VanDerWaalsContact O-N 3.09Å; G216-T220 PolarHBondContact O-OG1 2.96Å; I217-T220 PolarHBondContact O-N 2.91Å; I217-T220 VanDerWaalsContact O-N 3.12Å; L218-T220 VanDerWaalsContact C-N 3.25Å; L218-T220 PolarHBondContact O-N 3.42Å; T220-C224 PolarHBondContact O-N 3.09Å; T220-R230 PolarHBondContact O-NH2 3.06Å
221L76.9Confident77.6Confident23 Ų2394.9 Ų94.912%0.1245%0.454CS..Hα-helixtrans-69.4-41.5174.9-72.7-178.2000111.4I217 L218 R223 C224 R230 V234I217-L221 HydrophobicContact CG2-CD1 3.69Å; I217-L221 HydrophobicContact CG2-CG 4Å; I217-L221 WeakPolarHBondContact O-CB 3.38Å; I217-L221 VanDerWaalsContact O-CG 3.28Å; I217-L221 WeakPolarHBondContact O-CG 3.4Å; I217-L221 PolarHBondContact O-N 3.35Å; L218-L221 PolarHBondContact O-N 3.02Å; L221-R223 VanDerWaalsContact C-N 3.29Å; L221-R223 PolarHBondContact O-N 3.3Å; L221-C224 CarbonylContact O-C 3.52Å; L221-C224 PolarHBondContact O-N 3.28Å; L221-R230 HydrophobicContact CD2-CG 4.2Å; L221-R230 VanDerWaalsContact CD2-NE 3.35Å; L221-V234 HydrophobicContact CD1-CG1 4.44Å
222L79.1Confident76.6Confident138 Ų13896.9 Ų96.972%0.72345%0.452SS*.Hα-helixtrans-64.2-35.2176.4-69.4171.3000111.9L218L218-L222 HydrophobicContact CD1-CD1 4.47Å; L218-L222 HydrophobicContact CD1-CG 4.39Å; L218-L222 HydrophobicContact CG-CD1 4.11Å; L218-L222 HydrophobicContact CG-CG 4.46Å; L218-L222 WeakPolarHBondContact O-CB 3.11Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.44Å; L218-L222 PolarHBondContact O-N 3.07Å
223R77.7Confident75.4Confident225 Ų22594.1 Ų94.185%0.84944%0.444SS*.Hα-helixtrans-76.1-28.8179-166.9174-179.1-177.20.9113.9K219 L221K219-R223 PolarHBondContact O-N 3.45Å; L221-R223 VanDerWaalsContact C-N 3.29Å; L221-R223 PolarHBondContact O-N 3.3Å
224C66.1Low74.7Confident64 Ų6494.5 Ų94.543%0.43245%0.446SS..  trans-126.592.4-176.2-56.90000110.7T220 L221 N226 R230T220-C224 PolarHBondContact O-N 3.09Å; L221-C224 CarbonylContact O-C 3.52Å; L221-C224 PolarHBondContact O-N 3.28Å; C224-N226 VanDerWaalsContact C-N 3.34Å; C224-N226 PolarHBondContact O-N 3.1Å; C224-R230 PolarHBondContact O-NH2 3.23Å
225R62.7Low74.5Confident221 Ų22199.1 Ų99.183%0.83446%0.463SS*.THydrogen-bonded Turntrans-75-8.8-169.6-160.6161.993.6165.64.3115.7
226N56.5Low74.2Confident142 Ų14297.1 Ų97.176%0.75945%0.446SS*.THydrogen-bonded Turntrans-1024.5-156.9-69.5-6.7000117.5C224C224-N226 VanDerWaalsContact C-N 3.34Å; C224-N226 PolarHBondContact O-N 3.1Å
227E65.7Low73.9Confident117 Ų11796.7 Ų96.755%0.54744%0.44SS..  trans-117.683.7-172.7-73.2-64.116100114.5K229 R230 H231E227-K229 PolarHBondContact O-N 3.16Å; E227-K229 VanDerWaalsContact O-N 3.11Å; E227-R230 HydrophobicContact CB-CB 4.11Å; E227-R230 WeakPolarHBondContact O-CB 3.37Å; E227-R230 PolarHBondContact O-N 2.94Å; E227-H231 PolarHBondContact O-CD2 3.47Å
228K64.9Low73.9Confident174 Ų174100.4 Ų100.476%0.75746%0.457SS*.Hα-helixtrans-52.1-33.9179.4-70-179-179.4176.10113.7R230K228-R230 VanDerWaalsContact C-N 3.35Å; K228-R230 PolarHBondContact O-N 3.33Å
229K61.5Low74.2Confident152 Ų15297.4 Ų97.466%0.66144%0.443SS*.Hα-helixtrans-68.7-31.8-179.1-168.6176.6179.2-1790112.7E227E227-K229 PolarHBondContact O-N 3.16Å; E227-K229 VanDerWaalsContact O-N 3.11Å
230R67.5Low74.3Confident56 Ų5689.6 Ų89.621%0.21141%0.409CS..Hα-helixtrans-69.1-42178.6-169.6170.466.6160.94.9111.3V130 T220 L221 C224 E227 K228 R232 A233 V234V130-R230 HydrophobicContact CG2-CG 3.87Å; T220-R230 PolarHBondContact O-NH2 3.06Å; L221-R230 HydrophobicContact CD2-CG 4.2Å; L221-R230 VanDerWaalsContact CD2-NE 3.35Å; C224-R230 PolarHBondContact O-NH2 3.23Å; E227-R230 HydrophobicContact CB-CB 4.11Å; E227-R230 WeakPolarHBondContact O-CB 3.37Å; E227-R230 PolarHBondContact O-N 2.94Å; K228-R230 VanDerWaalsContact C-N 3.35Å; K228-R230 PolarHBondContact O-N 3.33Å; R230-R232 VanDerWaalsContact C-N 3.33Å; R230-R232 PolarHBondContact O-N 3.05Å; R230-A233 PolarHBondContact O-N 3.23Å; R230-V234 WeakPolarHBondContact O-CG2 3.26Å; R230-V234 PolarHBondContact O-N 2.97Å
231H70.4Confident74.7Confident76 Ų7688.1 Ų88.135%0.35240%0.4SS..Hα-helixtrans-60.9-38.3177.4-66.4-78.3000112.9E227 R235E227-H231 PolarHBondContact O-CD2 3.47Å; H231-R235 WeakPolarHBondContact O-CB 3.42Å; H231-R235 PolarHBondContact O-N 2.83Å
232R71.8Confident75.5Confident126 Ų12689.9 Ų89.948%0.47541%0.409SS..Hα-helixtrans-65.1-43.2-179-67-178.2-1731733.1113.1R230 R235 L236 E302R230-R232 VanDerWaalsContact C-N 3.33Å; R230-R232 PolarHBondContact O-N 3.05Å; R232-R235 PolarHBondContact O-N 2.91Å; R232-L236 PolarHBondContact O-N 3.29Å; R232-L236 VanDerWaalsContact O-N 3.15Å; R232-E302 WeakPolarHBondContact CD-OE2 3.49Å; R232-E302 IonicContact CZ-OE1 3.22Å; R232-E302 IonicContact CZ-OE2 2.77Å; R232-E302 IonicContact NE-OE1 3.51Å; R232-E302 IonicContact NE-OE2 3.85Å; R232-E302 IonicContact NH1-OE1 2.64Å; R232-E302 IonicContact NH1-OE2 3.66Å; R232-E302 PolarHBondContact NH1-OE2 3.15Å
233A69.2Low76.2Confident38 Ų3884.4 Ų84.431%0.31438%0.381SS..Hα-helixtrans-70.1-38.7179.900000112.1R230 R235 L236 I237R230-A233 PolarHBondContact O-N 3.23Å; A233-R235 VanDerWaalsContact C-N 3.35Å; A233-L236 PolarHBondContact O-N 2.82Å; A233-I237 PolarHBondContact O-N 3.06Å
234V77.8Confident77Confident15 Ų1574 Ų749%0.09134%0.341CS..Hα-helixtrans-62.3-43.9173.5172.80000110.6V130 Y214 I217 L221 R230 L236 I237 F238V130-V234 HydrophobicContact CG2-CG2 4.09Å; Y214-V234 HydrophobicContact CE1-CG1 4.11Å; I217-V234 HydrophobicContact CG2-CG1 3.76Å; I217-V234 HydrophobicContact CG2-CG2 3.93Å; L221-V234 HydrophobicContact CD1-CG1 4.44Å; R230-V234 WeakPolarHBondContact O-CG2 3.26Å; R230-V234 PolarHBondContact O-N 2.97Å; V234-L236 VanDerWaalsContact C-N 3.34Å; V234-L236 PolarHBondContact O-N 3.46Å; V234-I237 PolarHBondContact O-N 3.47Å; V234-F238 VanDerWaalsContact O-CB 3.25Å; V234-F238 WeakPolarHBondContact O-CB 3.44Å; V234-F238 PolarHBondContact O-N 3.04Å
235R82.1Confident78.4Confident125 Ų12572.1 Ų72.147%0.47233%0.326SS..Hα-helixtrans-57.3-45.6177.1-172.5177.470.2-173.52.6111.9H231 R232 A233 F238 T239H231-R235 WeakPolarHBondContact O-CB 3.42Å; H231-R235 PolarHBondContact O-N 2.83Å; R232-R235 PolarHBondContact O-N 2.91Å; A233-R235 VanDerWaalsContact C-N 3.35Å; R235-F238 PolarHBondContact O-N 3.43Å; R235-T239 PolarHBondContact O-N 3.07Å; R235-T239 PolarHBondContact O-OG1 3Å
236L81.7Confident80Confident31 Ų3166.9 Ų66.916%0.16231%0.314CS..Hα-helixtrans-59.1-52.9179.3-179.465.3000112.1R232 A233 V234 F238 T239 I240 I296 Y297 V300R232-L236 PolarHBondContact O-N 3.29Å; R232-L236 VanDerWaalsContact O-N 3.15Å; A233-L236 PolarHBondContact O-N 2.82Å; V234-L236 VanDerWaalsContact C-N 3.34Å; V234-L236 PolarHBondContact O-N 3.46Å; L236-F238 VanDerWaalsContact C-N 3.31Å; L236-F238 PolarHBondContact O-N 2.83Å; L236-T239 PolarHBondContact O-N 3.27Å; L236-I240 HydrophobicContact CG-CD1 4.26Å; L236-I240 WeakPolarHBondContact O-CG1 3.44Å; L236-I240 PolarHBondContact O-N 3.43Å; L236-I240 VanDerWaalsContact O-N 3.08Å; L236-I296 HydrophobicContact CD1-CG2 3.96Å; L236-Y297 HydrophobicContact CD1-CD1 4.21Å; L236-V300 HydrophobicContact CB-CG1 4.41Å; L236-V300 HydrophobicContact CD1-CB 3.88Å; L236-V300 HydrophobicContact CD1-CG1 3.9Å
237I81.9Confident81.8Confident6 Ų662 Ų623%0.03129%0.286CS..Hα-helixtrans-67.9-34.4-177.3-57.6-48.6000111.4L122 R126 Y214 A233 V234 I240 M241L122-I237 HydrophobicContact CB-CD1 4.34Å; L122-I237 HydrophobicContact CB-CG2 4.34Å; L122-I237 HydrophobicContact CD2-CD1 4.4Å; R126-I237 HydrophobicContact CG-CB 4.08Å; R126-I237 HydrophobicContact CG-CG1 3.47Å; R126-I237 VanDerWaalsContact CG-CG1 3.47Å; R126-I237 HydrophobicContact CG-CG2 4.34Å; Y214-I237 VanDerWaalsContact OH-C 3.25Å; A233-I237 PolarHBondContact O-N 3.06Å; V234-I237 PolarHBondContact O-N 3.47Å; I237-I240 HydrophobicContact CD1-CD1 3.78Å; I237-I240 PolarHBondContact O-N 3.01Å; I237-M241 PolarHBondContact O-N 3.46Å
238F86.7Confident83.3Confident81 Ų8156.8 Ų56.836%0.35526%0.261SS..Hα-helixtrans-63.3-42.7174.4-174-112.9000112.1M210 Y214 V234 R235 L236 M241 I242M210-F238 HydrophobicContact CE-CD2 4.01Å; M210-F238 HydrophobicContact CE-CE2 3.52Å; M210-F238 HydrophobicContact CE-CZ 4.33Å; Y214-F238 AromaticContact CD1-CD2 3.67Å; Y214-F238 HydrophobicContact CD1-CD2 3.67Å; Y214-F238 HydrophobicContact CD1-CE2 4.23Å; Y214-F238 HydrophobicContact CD1-CG 4.49Å; Y214-F238 HydrophobicContact CD2-CD2 4.19Å; Y214-F238 HydrophobicContact CE1-CB 3.67Å; Y214-F238 AromaticContact CE1-CD2 3.42Å; Y214-F238 HydrophobicContact CE1-CD2 3.42Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.42Å; Y214-F238 HydrophobicContact CE1-CE2 4.4Å; Y214-F238 AromaticContact CE1-CG 3.95Å; Y214-F238 HydrophobicContact CE1-CG 3.95Å; Y214-F238 AromaticContact CE2-CD2 3.98Å; Y214-F238 HydrophobicContact CE2-CD2 3.98Å; Y214-F238 HydrophobicContact CG-CD2 4.06Å; Y214-F238 HydrophobicContact CG-CE2 4.34Å; Y214-F238 AromaticContact CZ-CD2 3.6Å; Y214-F238 WeakPolarHBondContact OH-CA 3.31Å; Y214-F238 PolarHBondContact OH-N 3.2Å; V234-F238 VanDerWaalsContact O-CB 3.25Å; V234-F238 WeakPolarHBondContact O-CB 3.44Å; V234-F238 PolarHBondContact O-N 3.04Å; R235-F238 PolarHBondContact O-N 3.43Å; L236-F238 VanDerWaalsContact C-N 3.31Å; L236-F238 PolarHBondContact O-N 2.83Å; F238-M241 PolarHBondContact O-N 3.23Å; F238-I242 HydrophobicContact CD1-CD1 3.68Å; F238-I242 HydrophobicContact CD2-CD1 4.34Å; F238-I242 HydrophobicContact CE1-CD1 3.2Å; F238-I242 HydrophobicContact CE1-CG1 4.36Å; F238-I242 HydrophobicContact CE2-CD1 3.94Å; F238-I242 HydrophobicContact CE2-CG1 4.42Å; F238-I242 HydrophobicContact CG-CD1 4.25Å; F238-I242 HydrophobicContact CZ-CD1 3.37Å; F238-I242 HydrophobicContact CZ-CG1 4.3Å; F238-I242 WeakPolarHBondContact O-CG1 3.25Å; F238-I242 PolarHBondContact O-N 3.46Å
239T90.1Very high84.7Confident39 Ų3949.3 Ų49.324%0.23923%0.232CC..Hα-helixtrans-61.8-45.4174.9-58.40000111.6R235 L236 M241 I242 V243 I296 V300R235-T239 PolarHBondContact O-N 3.07Å; R235-T239 PolarHBondContact O-OG1 3Å; L236-T239 PolarHBondContact O-N 3.27Å; T239-M241 VanDerWaalsContact C-N 3.31Å; T239-M241 PolarHBondContact O-N 3.11Å; T239-I242 PolarHBondContact O-N 2.81Å; T239-V243 HydrophobicContact CG2-CG2 4.17Å; T239-V243 WeakPolarHBondContact O-CB 3.47Å; T239-V243 VanDerWaalsContact O-CG2 3.25Å; T239-V243 WeakPolarHBondContact O-CG2 3.23Å; T239-V243 PolarHBondContact O-N 3.28Å; T239-I296 HydrophobicContact CG2-CG2 4.03Å; T239-V300 HydrophobicContact CG2-CG2 4.24Å
240I89.5Confident86.4Confident1 Ų144.1 Ų44.11%0.00521%0.214CC..Hα-helixtrans-57.2-46.6177-62.3163.9000110.6I119 L236 I237 V243 Y244 I296 Y297I119-I240 HydrophobicContact CD1-CG2 4.06Å; I119-I240 HydrophobicContact CG1-CG2 3.99Å; I119-I240 HydrophobicContact CG2-CG2 4.48Å; L236-I240 HydrophobicContact CG-CD1 4.26Å; L236-I240 WeakPolarHBondContact O-CG1 3.44Å; L236-I240 PolarHBondContact O-N 3.43Å; L236-I240 VanDerWaalsContact O-N 3.08Å; I237-I240 HydrophobicContact CD1-CD1 3.78Å; I237-I240 PolarHBondContact O-N 3.01Å; I240-V243 PolarHBondContact O-N 3Å; I240-Y244 PolarHBondContact O-N 3.37Å; I240-I296 HydrophobicContact CG1-CD1 4.42Å; I240-I296 HydrophobicContact CG1-CG2 3.99Å; I240-Y297 HydrophobicContact CD1-CE1 3.61Å; I240-Y297 HydrophobicContact CG1-CE1 4.13Å
241M89.6Confident87.7Confident0 Ų042.6 Ų42.60%021%0.208CC..Hα-helixtrans-64.6-45.4-179-173.567.777.900112.7I119 T123 P206 M210 I237 F238 T239 Y244 F245I119-M241 HydrophobicContact CG2-CE 3.49Å; I119-M241 VanDerWaalsContact CG2-CE 3.49Å; I119-M241 HydrophobicContact CG2-SD 3.68Å; T123-M241 HydrophobicContact CG2-CE 4.25Å; T123-M241 WeakPolarHBondContact OG1-CE 3.43Å; P206-M241 HydrophobicContact CB-SD 4.33Å; M210-M241 HydrophobicContact CB-CG 4.43Å; M210-M241 HydrophobicContact CE-CG 4.39Å; M210-M241 HydrophobicContact CG-CG 4.16Å; M210-M241 HydrophobicContact SD-CG 3.94Å; I237-M241 PolarHBondContact O-N 3.46Å; F238-M241 PolarHBondContact O-N 3.23Å; T239-M241 VanDerWaalsContact C-N 3.31Å; T239-M241 PolarHBondContact O-N 3.11Å; M241-Y244 WeakPolarHBondContact O-CB 3.41Å; M241-Y244 PolarHBondContact O-N 3.41Å; M241-F245 HydrophobicContact CG-CD2 4.11Å; M241-F245 HydrophobicContact CG-CE2 3.61Å; M241-F245 WeakPolarHBondContact O-CD2 3.32Å; M241-F245 PolarHBondContact O-N 3.09Å; M241-F245 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact SD-CD2 4.46Å; M241-F245 HydrophobicContact SD-CE2 3.67Å; M241-F245 HydrophobicContact SD-CZ 4.05Å
242I93.1Very high88.9Confident61 Ų6139 Ų3931%0.31319%0.192SC..Hα-helixtrans-63.3-45.4177.9-71.7176.4000110.8M210 F238 T239 Y244 F245 L246M210-I242 HydrophobicContact CE-CD1 4.47Å; M210-I242 HydrophobicContact CE-CG1 3.83Å; F238-I242 HydrophobicContact CD1-CD1 3.68Å; F238-I242 HydrophobicContact CD2-CD1 4.34Å; F238-I242 HydrophobicContact CE1-CD1 3.2Å; F238-I242 HydrophobicContact CE1-CG1 4.36Å; F238-I242 HydrophobicContact CE2-CD1 3.94Å; F238-I242 HydrophobicContact CE2-CG1 4.42Å; F238-I242 HydrophobicContact CG-CD1 4.25Å; F238-I242 HydrophobicContact CZ-CD1 3.37Å; F238-I242 HydrophobicContact CZ-CG1 4.3Å; F238-I242 WeakPolarHBondContact O-CG1 3.25Å; F238-I242 PolarHBondContact O-N 3.46Å; T239-I242 PolarHBondContact O-N 2.81Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 2.94Å; I242-F245 PolarHBondContact O-N 3.33Å; I242-F245 VanDerWaalsContact O-N 3.12Å; I242-L246 HydrophobicContact CG2-CD1 3.92Å; I242-L246 HydrophobicContact CG2-CG 4.17Å; I242-L246 WeakPolarHBondContact O-CG 3.31Å; I242-L246 PolarHBondContact O-N 2.89Å
243V94.9Very high90Very high23 Ų2337.2 Ų37.214%0.13919%0.191CC..Hα-helixtrans-62.1-38.9179.71730000110.7T239 I240 F245 L246 F247 I292 I296T239-V243 HydrophobicContact CG2-CG2 4.17Å; T239-V243 WeakPolarHBondContact O-CB 3.47Å; T239-V243 VanDerWaalsContact O-CG2 3.25Å; T239-V243 WeakPolarHBondContact O-CG2 3.23Å; T239-V243 PolarHBondContact O-N 3.28Å; I240-V243 PolarHBondContact O-N 3Å; V243-F245 PolarHBondContact O-N 3.27Å; V243-L246 PolarHBondContact O-N 2.88Å; V243-F247 HydrophobicContact CG1-CD2 3.86Å; V243-F247 HydrophobicContact CG1-CE2 3.83Å; V243-F247 WeakPolarHBondContact O-CD2 3.26Å; V243-F247 PolarHBondContact O-N 3.26Å; V243-F247 VanDerWaalsContact O-N 3.14Å; V243-I292 HydrophobicContact CG1-CG2 3.71Å; V243-I296 HydrophobicContact CB-CD1 3.91Å; V243-I296 HydrophobicContact CG1-CD1 3.97Å; V243-I296 HydrophobicContact CG2-CD1 3.97Å
244Y93.8Very high91.2Very high5 Ų536.1 Ų36.12%0.0218%0.18CC..Hα-helixtrans-55.3-49.8171.9176.4-91.2000111.9I116 I119 G202 I240 M241 I242 L246 F247 W248 H289I116-Y244 HydrophobicContact CB-CE2 4.08Å; I116-Y244 HydrophobicContact CD1-CD1 3.64Å; I116-Y244 HydrophobicContact CD1-CD2 4.22Å; I116-Y244 HydrophobicContact CD1-CE1 3.3Å; I116-Y244 HydrophobicContact CD1-CE2 3.92Å; I116-Y244 HydrophobicContact CD1-CG 4.1Å; I116-Y244 VanDerWaalsContact CD1-CZ 3.45Å; I116-Y244 HydrophobicContact CG1-CE1 3.91Å; I116-Y244 HydrophobicContact CG1-CE2 4.32Å; I119-Y244 HydrophobicContact CD1-CD2 3.9Å; I119-Y244 HydrophobicContact CD1-CG 4.21Å; G202-Y244 VanDerWaalsContact O-CE1 3.32Å; G202-Y244 WeakPolarHBondContact O-CE1 3.42Å; G202-Y244 PolarHBondContact O-OH 3.21Å; I240-Y244 PolarHBondContact O-N 3.37Å; M241-Y244 WeakPolarHBondContact O-CB 3.41Å; M241-Y244 PolarHBondContact O-N 3.41Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 2.94Å; Y244-L246 PolarHBondContact O-N 3.28Å; Y244-F247 PolarHBondContact O-N 3.14Å; Y244-W248 AromaticContact CD2-CD1 3.49Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.49Å; Y244-W248 HydrophobicContact CD2-CG 4.31Å; Y244-W248 HydrophobicContact CE1-CB 4.2Å; Y244-W248 HydrophobicContact CE2-CB 4.23Å; Y244-W248 AromaticContact CE2-CD1 3.32Å; Y244-W248 AromaticContact CE2-CG 3.84Å; Y244-W248 HydrophobicContact CE2-CG 3.84Å; Y244-W248 AromaticContact CE2-NE1 3.9Å; Y244-W248 AromaticContact CZ-CD1 3.96Å; Y244-W248 WeakPolarHBondContact O-CB 3.49Å; Y244-W248 PolarHBondContact O-N 3.29Å; Y244-H289 AromaticContact CD2-CE1 3.83Å; Y244-H289 AromaticContact CD2-NE2 3.9Å
245F94.9Very high91.9Very high26 Ų2636.2 Ų36.211%0.11418%0.18CC..Hα-helixtrans-64.3-39.7178.7-71.3-56.7000113.1L203 P206 L207 M210 M241 I242 V243 F247 A249L203-F245 HydrophobicContact CD1-CD1 3.8Å; L203-F245 HydrophobicContact CD1-CE1 3.9Å; P206-F245 HydrophobicContact CB-CE1 4.24Å; P206-F245 HydrophobicContact CB-CZ 3.85Å; P206-F245 HydrophobicContact CG-CE1 4Å; P206-F245 HydrophobicContact CG-CZ 4.11Å; L207-F245 HydrophobicContact CB-CE1 4.35Å; L207-F245 HydrophobicContact CB-CZ 4.07Å; L207-F245 HydrophobicContact CD1-CE2 4.43Å; L207-F245 HydrophobicContact CD1-CZ 4.26Å; M210-F245 HydrophobicContact SD-CD2 4.04Å; M210-F245 HydrophobicContact SD-CE2 3.55Å; M210-F245 VanDerWaalsContact SD-CE2 3.55Å; M241-F245 HydrophobicContact CG-CD2 4.11Å; M241-F245 HydrophobicContact CG-CE2 3.61Å; M241-F245 WeakPolarHBondContact O-CD2 3.32Å; M241-F245 PolarHBondContact O-N 3.09Å; M241-F245 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact SD-CD2 4.46Å; M241-F245 HydrophobicContact SD-CE2 3.67Å; M241-F245 HydrophobicContact SD-CZ 4.05Å; I242-F245 PolarHBondContact O-N 3.33Å; I242-F245 VanDerWaalsContact O-N 3.12Å; V243-F245 PolarHBondContact O-N 3.27Å; F245-F247 PolarHBondContact O-N 3.47Å; F245-A249 WeakPolarHBondContact O-CA 3.49Å; F245-A249 WeakPolarHBondContact O-CB 3.49Å; F245-A249 PolarHBondContact O-N 2.91Å
246L96.1Very high92.4Very high110 Ų11032.9 Ų32.958%0.57617%0.171SC*.Hα-helixtrans-59.6-34.7177.5-70.9174.5000112.3I242 V243 Y244 P250I242-L246 HydrophobicContact CG2-CD1 3.92Å; I242-L246 HydrophobicContact CG2-CG 4.17Å; I242-L246 WeakPolarHBondContact O-CG 3.31Å; I242-L246 PolarHBondContact O-N 2.89Å; V243-L246 PolarHBondContact O-N 2.88Å; Y244-L246 PolarHBondContact O-N 3.28Å; L246-P250 WeakPolarHBondContact O-CD 3.24Å; L246-P250 WeakPolarHBondContact O-CG 3.39Å
247F95.8Very high92.9Very high39 Ų3933.7 Ų33.717%0.17118%0.176CC..Hα-helixtrans-89.9-37.9-177.1-78.2-115.9000112.6V243 Y244 F245 L285 T288 H289 I292V243-F247 HydrophobicContact CG1-CD2 3.86Å; V243-F247 HydrophobicContact CG1-CE2 3.83Å; V243-F247 WeakPolarHBondContact O-CD2 3.26Å; V243-F247 PolarHBondContact O-N 3.26Å; V243-F247 VanDerWaalsContact O-N 3.14Å; Y244-F247 PolarHBondContact O-N 3.14Å; F245-F247 PolarHBondContact O-N 3.47Å; F247-L285 HydrophobicContact CD1-CD1 3.93Å; F247-L285 HydrophobicContact CD1-CG 4.24Å; F247-L285 VanDerWaalsContact CD1-O 3.31Å; F247-L285 WeakPolarHBondContact CD1-O 3.26Å; F247-L285 HydrophobicContact CE1-CD1 4.02Å; F247-L285 HydrophobicContact CG-CD1 4.44Å; F247-L285 HydrophobicContact CG-CG 4.48Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.34Å; F247-T288 VanDerWaalsContact CE1-OG1 3.26Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.45Å; F247-H289 HydrophobicContact CB-CB 3.93Å; F247-H289 HydrophobicContact CD1-CB 3.94Å; F247-H289 HydrophobicContact CG-CB 4.16Å; F247-I292 HydrophobicContact CE1-CD1 4.26Å; F247-I292 HydrophobicContact CE1-CG1 3.81Å; F247-I292 HydrophobicContact CZ-CD1 4.16Å; F247-I292 HydrophobicContact CZ-CG1 3.88Å
248W95.9Very high93.3Very high8 Ų834.8 Ų34.83%0.0318%0.182CC..Hα-helixtrans-102.5-27.9-172.5-75.2104000115.1F79 F112 Y244 P250 Y251 N252 G286 H289F79-W248 HydrophobicContact CE2-CH2 4.07Å; F79-W248 HydrophobicContact CE2-CZ2 4.21Å; F79-W248 AromaticContact CZ-CH2 3.93Å; F79-W248 HydrophobicContact CZ-CH2 3.93Å; F79-W248 HydrophobicContact CZ-CZ2 4.05Å; F112-W248 HydrophobicContact CD2-CD2 4.19Å; F112-W248 HydrophobicContact CD2-CE3 4.04Å; F112-W248 AromaticContact CD2-CH2 3.62Å; F112-W248 HydrophobicContact CD2-CH2 3.62Å; F112-W248 AromaticContact CD2-CZ2 3.8Å; F112-W248 HydrophobicContact CD2-CZ2 3.8Å; F112-W248 AromaticContact CD2-CZ3 3.75Å; F112-W248 HydrophobicContact CD2-CZ3 3.75Å; F112-W248 AromaticContact CE2-CD2 3.7Å; F112-W248 HydrophobicContact CE2-CD2 3.7Å; F112-W248 AromaticContact CE2-CE3 3.47Å; F112-W248 HydrophobicContact CE2-CE3 3.47Å; F112-W248 VanDerWaalsContact CE2-CE3 3.47Å; F112-W248 HydrophobicContact CE2-CG 4.39Å; F112-W248 AromaticContact CE2-CH2 3.95Å; F112-W248 HydrophobicContact CE2-CH2 3.95Å; F112-W248 HydrophobicContact CE2-CZ2 4.18Å; F112-W248 AromaticContact CE2-CZ3 3.6Å; F112-W248 HydrophobicContact CE2-CZ3 3.6Å; F112-W248 HydrophobicContact CZ-CE3 4.49Å; Y244-W248 AromaticContact CD2-CD1 3.49Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.49Å; Y244-W248 HydrophobicContact CD2-CG 4.31Å; Y244-W248 HydrophobicContact CE1-CB 4.2Å; Y244-W248 HydrophobicContact CE2-CB 4.23Å; Y244-W248 AromaticContact CE2-CD1 3.32Å; Y244-W248 AromaticContact CE2-CG 3.84Å; Y244-W248 HydrophobicContact CE2-CG 3.84Å; Y244-W248 AromaticContact CE2-NE1 3.9Å; Y244-W248 AromaticContact CZ-CD1 3.96Å; Y244-W248 WeakPolarHBondContact O-CB 3.49Å; Y244-W248 PolarHBondContact O-N 3.29Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; W248-Y251 HydrophobicContact CE3-CD1 4.16Å; W248-Y251 HydrophobicContact CZ3-CD1 4.19Å; W248-Y251 PolarHBondContact O-N 3.09Å; W248-N252 PolarHBondContact O-N 3.43Å; W248-N252 VanDerWaalsContact O-N 3.09Å; W248-N252 PolarHBondContact O-ND2 3.41Å; W248-G286 WeakPolarHBondContact CZ2-O 3.41Å; W248-H289 AromaticContact CD1-CG 3.88Å; W248-H289 AromaticContact NE1-CG 3.51Å; W248-H289 AromaticContact NE1-ND1 3.57Å
249A94.9Very high93.3Very high18 Ų1831.3 Ų31.315%0.14917%0.167CC..Hα-helixtrans-60.3-40.4178.800000112.9L203 F245 Y251 N252 I253L203-A249 HydrophobicContact CD1-CB 3.75Å; F245-A249 WeakPolarHBondContact O-CA 3.49Å; F245-A249 WeakPolarHBondContact O-CB 3.49Å; F245-A249 PolarHBondContact O-N 2.91Å; A249-Y251 VanDerWaalsContact C-N 3.3Å; A249-Y251 PolarHBondContact O-N 3.24Å; A249-N252 PolarHBondContact O-N 3.2Å; A249-I253 VanDerWaalsContact O-CG1 3.26Å; A249-I253 WeakPolarHBondContact O-CG1 3.01Å; A249-I253 PolarHBondContact O-N 3.16Å
250P96.9Very high93.3Very high42 Ų4232.1 Ų32.127%0.27317%0.167SC..Hα-helixtrans-55.5-45.3176.2-26.736000112.5L246 W248 I253 V254 T282 L285L246-P250 WeakPolarHBondContact O-CD 3.24Å; L246-P250 WeakPolarHBondContact O-CG 3.39Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; P250-I253 PolarHBondContact O-N 2.81Å; P250-V254 VanDerWaalsContact O-CG2 3.32Å; P250-V254 WeakPolarHBondContact O-CG2 3.19Å; P250-V254 PolarHBondContact O-N 2.84Å; P250-T282 HydrophobicContact CB-CG2 3.58Å; P250-L285 HydrophobicContact CG-CD2 4.31Å
251Y95.1Very high93.1Very high24 Ų2434.1 Ų34.19%0.09418%0.177CC..Hα-helixtrans-63.8-46177.9174-102.9000112W248 A249 I253 V254 L255 M279 E283W248-Y251 HydrophobicContact CE3-CD1 4.16Å; W248-Y251 HydrophobicContact CZ3-CD1 4.19Å; W248-Y251 PolarHBondContact O-N 3.09Å; A249-Y251 VanDerWaalsContact C-N 3.3Å; A249-Y251 PolarHBondContact O-N 3.24Å; Y251-I253 VanDerWaalsContact C-N 3.3Å; Y251-I253 PolarHBondContact O-N 3.07Å; Y251-V254 PolarHBondContact O-N 3.47Å; Y251-L255 HydrophobicContact CE1-CD2 4.2Å; Y251-L255 VanDerWaalsContact O-CB 3.26Å; Y251-L255 WeakPolarHBondContact O-CB 3.43Å; Y251-L255 PolarHBondContact O-N 2.83Å; Y251-M279 HydrophobicContact CE2-CG 4.3Å; Y251-E283 HydrophobicContact CD2-CB 3.68Å; Y251-E283 HydrophobicContact CD2-CG 4.33Å; Y251-E283 HydrophobicContact CE2-CB 3.71Å; Y251-E283 HydrophobicContact CE2-CG 4.02Å
252N94.9Very high92.8Very high1 Ų141.1 Ų41.11%0.00521%0.209CC..Hα-helixtrans-61.7-38.5179.2-77.5-85.2000112.2I198 V199 L203 W248 A249 L256I198-N252 WeakPolarHBondContact CG2-OD1 3.29Å; I198-N252 PolarHBondContact O-OD1 2.94Å; V199-N252 HydrophobicContact CG2-CB 4.43Å; L203-N252 HydrophobicContact CB-CB 4.26Å; L203-N252 HydrophobicContact CD2-CB 4.02Å; W248-N252 PolarHBondContact O-N 3.43Å; W248-N252 VanDerWaalsContact O-N 3.09Å; W248-N252 PolarHBondContact O-ND2 3.41Å; A249-N252 PolarHBondContact O-N 3.2Å; N252-L256 PolarHBondContact O-N 3.46Å; N252-L256 VanDerWaalsContact O-N 3.11Å
253I94.9Very high92.5Very high88 Ų8846.4 Ų46.445%0.45123%0.23SC..Hα-helixtrans-67.2-47.3176.7-66.5164000110.3A249 P250 Y251 L255 L256 L257A249-I253 VanDerWaalsContact O-CG1 3.26Å; A249-I253 WeakPolarHBondContact O-CG1 3.01Å; A249-I253 PolarHBondContact O-N 3.16Å; P250-I253 PolarHBondContact O-N 2.81Å; Y251-I253 VanDerWaalsContact C-N 3.3Å; Y251-I253 PolarHBondContact O-N 3.07Å; I253-L255 VanDerWaalsContact C-N 3.33Å; I253-L255 PolarHBondContact O-N 3.3Å; I253-L256 WeakPolarHBondContact O-CB 3.49Å; I253-L256 PolarHBondContact O-N 3.07Å; I253-L257 HydrophobicContact CG2-CD1 4.23Å; I253-L257 WeakPolarHBondContact O-CG 3.27Å; I253-L257 PolarHBondContact O-N 3.32Å
254V94.3Very high92Very high16 Ų1650 Ų5010%0.09724%0.244CC..Hα-helixtrans-65-37.9178.7175.70000111.4P250 Y251 L256 L257 N258 A278 M279 T282P250-V254 VanDerWaalsContact O-CG2 3.32Å; P250-V254 WeakPolarHBondContact O-CG2 3.19Å; P250-V254 PolarHBondContact O-N 2.84Å; Y251-V254 PolarHBondContact O-N 3.47Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 3.38Å; V254-L257 PolarHBondContact O-N 3.39Å; V254-N258 VanDerWaalsContact O-CB 3.31Å; V254-N258 WeakPolarHBondContact O-CB 3.49Å; V254-N258 PolarHBondContact O-N 3.46Å; V254-A278 HydrophobicContact CG1-CB 4.11Å; V254-A278 HydrophobicContact CG2-CB 4.19Å; V254-M279 HydrophobicContact CG1-CB 3.87Å; V254-T282 HydrophobicContact CG2-CG2 4.12Å
255L92.6Very high91.4Very high17 Ų1752 Ų529%0.08927%0.266CS..Hα-helixtrans-61-40.2175-177.866.3000111.8T195 I198 Y251 I253 T259T195-L255 HydrophobicContact CG2-CD2 4.44Å; T195-L255 HydrophobicContact CG2-CG 4.07Å; I198-L255 HydrophobicContact CB-CD2 4.05Å; I198-L255 HydrophobicContact CD1-CD2 3.96Å; I198-L255 HydrophobicContact CG2-CD2 3.79Å; Y251-L255 HydrophobicContact CE1-CD2 4.2Å; Y251-L255 VanDerWaalsContact O-CB 3.26Å; Y251-L255 WeakPolarHBondContact O-CB 3.43Å; Y251-L255 PolarHBondContact O-N 2.83Å; I253-L255 VanDerWaalsContact C-N 3.33Å; I253-L255 PolarHBondContact O-N 3.3Å; L255-T259 WeakPolarHBondContact O-CB 3.11Å; L255-T259 PolarHBondContact O-N 3.48Å; L255-T259 PolarHBondContact O-OG1 3.41Å
256L93.4Very high90.8Very high54 Ų5453 Ų5328%0.28327%0.273SS..Hα-helixtrans-64-49.1174.5-169.476.1000110.9T195 V199 N252 I253 V254 N258 T259 F260T195-L256 HydrophobicContact CG2-CD1 4.32Å; V199-L256 HydrophobicContact CG2-CD1 4.42Å; N252-L256 PolarHBondContact O-N 3.46Å; N252-L256 VanDerWaalsContact O-N 3.11Å; I253-L256 WeakPolarHBondContact O-CB 3.49Å; I253-L256 PolarHBondContact O-N 3.07Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 3.38Å; L256-N258 VanDerWaalsContact C-N 3.34Å; L256-N258 PolarHBondContact O-N 3.4Å; L256-T259 PolarHBondContact O-N 3.35Å; L256-F260 HydrophobicContact CD1-CD2 3.72Å; L256-F260 HydrophobicContact CD1-CE2 3.59Å; L256-F260 HydrophobicContact CG-CD2 4.06Å; L256-F260 HydrophobicContact CG-CE2 4.43Å; L256-F260 WeakPolarHBondContact O-CD2 3.44Å; L256-F260 PolarHBondContact O-N 3.26Å
257L92Very high89.8Confident49 Ų4952.5 Ų52.526%0.25727%0.271SS..Hα-helixtrans-59.8-42.7177.6-69.6172.5000112.1I253 V254 T259 F260 Q261 F264 L275I253-L257 HydrophobicContact CG2-CD1 4.23Å; I253-L257 WeakPolarHBondContact O-CG 3.27Å; I253-L257 PolarHBondContact O-N 3.32Å; V254-L257 PolarHBondContact O-N 3.39Å; L257-T259 VanDerWaalsContact C-N 3.32Å; L257-T259 PolarHBondContact O-N 2.96Å; L257-F260 CarbonylContact O-C 3.49Å; L257-F260 PolarHBondContact O-N 3.18Å; L257-Q261 WeakPolarHBondContact O-CA 3.48Å; L257-Q261 PolarHBondContact O-N 2.74Å; L257-Q261 VanDerWaalsContact O-N 3.07Å; L257-F264 HydrophobicContact CD2-CD1 4.48Å; L257-F264 HydrophobicContact CD2-CD2 3.76Å; L257-F264 HydrophobicContact CD2-CE2 3.84Å; L257-F264 HydrophobicContact CD2-CG 4.1Å; L257-F264 HydrophobicContact CD2-CZ 4.24Å; L257-L275 HydrophobicContact CB-CD2 3.98Å
258N89.1Confident89.2Confident29 Ų2955.4 Ų55.416%0.15529%0.288CS..Hα-helixtrans-65.5-35.6177.9-174.645.2000112.3V254 L256V254-N258 VanDerWaalsContact O-CB 3.31Å; V254-N258 WeakPolarHBondContact O-CB 3.49Å; V254-N258 PolarHBondContact O-N 3.46Å; L256-N258 VanDerWaalsContact C-N 3.34Å; L256-N258 PolarHBondContact O-N 3.4Å
259T88.5Confident88.4Confident8 Ų858.5 Ų58.55%0.04931%0.31CS..Hα-helixtrans-73.1-40.6179.2-59.30000111.9K191 T195 L255 L256 L257K191-T259 HydrophobicContact CG-CG2 4.19Å; T195-T259 WeakPolarHBondContact CB-OG1 3.35Å; T195-T259 HydrophobicContact CG2-CG2 4.14Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.35Å; T195-T259 PolarHBondContact OG1-OG1 2.88Å; L255-T259 WeakPolarHBondContact O-CB 3.11Å; L255-T259 PolarHBondContact O-N 3.48Å; L255-T259 PolarHBondContact O-OG1 3.41Å; L256-T259 PolarHBondContact O-N 3.35Å; L257-T259 VanDerWaalsContact C-N 3.32Å; L257-T259 PolarHBondContact O-N 2.96Å
260F89.1Confident87.8Confident56 Ų5661.1 Ų61.125%0.24633%0.327CS..THydrogen-bonded Turntrans-104.333.7-176.6-62-72000112.6L196 L256 L257 E262 F263 F264L196-F260 HydrophobicContact CD2-CE2 4.48Å; L256-F260 HydrophobicContact CD1-CD2 3.72Å; L256-F260 HydrophobicContact CD1-CE2 3.59Å; L256-F260 HydrophobicContact CG-CD2 4.06Å; L256-F260 HydrophobicContact CG-CE2 4.43Å; L256-F260 WeakPolarHBondContact O-CD2 3.44Å; L256-F260 PolarHBondContact O-N 3.26Å; L257-F260 CarbonylContact O-C 3.49Å; L257-F260 PolarHBondContact O-N 3.18Å; F260-E262 PolarHBondContact O-N 2.91Å; F260-F263 HydrophobicContact CB-CB 4.27Å; F260-F263 WeakPolarHBondContact O-CB 3.28Å; F260-F263 PolarHBondContact O-N 3.09Å; F260-F263 VanDerWaalsContact O-N 3.09Å; F260-F264 HydrophobicContact CB-CD2 4.05Å; F260-F264 HydrophobicContact CB-CE2 3.91Å; F260-F264 VanDerWaalsContact O-CD2 3.24Å; F260-F264 WeakPolarHBondContact O-CD2 3.39Å; F260-F264 PolarHBondContact O-N 3.48Å; F260-F264 VanDerWaalsContact O-N 3.16Å
261Q86.1Confident87.2Confident42 Ų4260.6 Ų60.620%0.19633%0.325CS..THydrogen-bonded Turntrans-55.4-36.9-177.663.1178.7-21.100113.4L257 F264 G265 L266L257-Q261 WeakPolarHBondContact O-CA 3.48Å; L257-Q261 PolarHBondContact O-N 2.74Å; L257-Q261 VanDerWaalsContact O-N 3.07Å; Q261-F264 PolarHBondContact O-N 2.99Å; Q261-G265 PolarHBondContact O-N 3.09Å; Q261-G265 VanDerWaalsContact O-N 3.07Å; Q261-L266 HydrophobicContact CB-CB 4.3Å; Q261-L266 PolarHBondContact O-N 3.3Å
262E82.9Confident86.5Confident147 Ų14760.6 Ų60.669%0.68733%0.328SS*.THydrogen-bonded Turntrans-67.1-41.3179.2-70.1172.8-163.400111.3F260 F264 G265F260-E262 PolarHBondContact O-N 2.91Å; E262-F264 VanDerWaalsContact C-N 3.31Å; E262-F264 PolarHBondContact O-N 3.06Å; E262-G265 PolarHBondContact O-N 2.82Å
263F86Confident86Confident173 Ų17362.5 Ų62.576%0.75934%0.338SS*.THydrogen-bonded Turntrans-65-35.6177.9-176.3-96.5000112.2F260F260-F263 HydrophobicContact CB-CB 4.27Å; F260-F263 WeakPolarHBondContact O-CB 3.28Å; F260-F263 PolarHBondContact O-N 3.09Å; F260-F263 VanDerWaalsContact O-N 3.09Å
264F84.9Confident85.5Confident98 Ų9866.6 Ų66.643%0.4335%0.348SS..THydrogen-bonded Turntrans-89.31.5178-67.2-66.6000114.2L257 F260 Q261 E262 L266L257-F264 HydrophobicContact CD2-CD1 4.48Å; L257-F264 HydrophobicContact CD2-CD2 3.76Å; L257-F264 HydrophobicContact CD2-CE2 3.84Å; L257-F264 HydrophobicContact CD2-CG 4.1Å; L257-F264 HydrophobicContact CD2-CZ 4.24Å; F260-F264 HydrophobicContact CB-CD2 4.05Å; F260-F264 HydrophobicContact CB-CE2 3.91Å; F260-F264 VanDerWaalsContact O-CD2 3.24Å; F260-F264 WeakPolarHBondContact O-CD2 3.39Å; F260-F264 PolarHBondContact O-N 3.48Å; F260-F264 VanDerWaalsContact O-N 3.16Å; Q261-F264 PolarHBondContact O-N 2.99Å; E262-F264 VanDerWaalsContact C-N 3.31Å; E262-F264 PolarHBondContact O-N 3.06Å; F264-L266 VanDerWaalsContact C-N 3.32Å; F264-L266 HydrophobicContact CB-CD1 3.98Å; F264-L266 HydrophobicContact CB-CG 4.05Å; F264-L266 PolarHBondContact O-N 3.36Å
265G80.9Confident85.1Confident47 Ų4766.7 Ų66.749%0.48535%0.348SS..THydrogen-bonded Turntrans6728.6-178.100000114.4Q261 E262Q261-G265 PolarHBondContact O-N 3.09Å; Q261-G265 VanDerWaalsContact O-N 3.07Å; E262-G265 PolarHBondContact O-N 2.82Å
266L81.6Confident84.7Confident47 Ų4767.1 Ų67.125%0.24635%0.35CS..  trans-10216.8-177.2-61.7175000113.4Q261 F264 N268 S271 L275Q261-L266 HydrophobicContact CB-CB 4.3Å; Q261-L266 PolarHBondContact O-N 3.3Å; F264-L266 VanDerWaalsContact C-N 3.32Å; F264-L266 HydrophobicContact CB-CD1 3.98Å; F264-L266 HydrophobicContact CB-CG 4.05Å; F264-L266 PolarHBondContact O-N 3.36Å; L266-N268 PolarHBondContact O-N 3.35Å; L266-S271 WeakPolarHBondContact O-CB 3.32Å; L266-L275 HydrophobicContact CB-CD1 3.96Å; L266-L275 HydrophobicContact CD1-CD1 3.94Å; L266-L275 HydrophobicContact CD1-CD2 4.47Å
267N76.3Confident84.3Confident100 Ų10068.4 Ų68.454%0.53536%0.355SS..  trans-75.70.9-175.564.1-21.9000115.2
268N83.1Confident84.2Confident100 Ų10067.8 Ų67.854%0.53536%0.357SS..SBendtrans-75.1143.2175.6-63.9-24.8000111.3L266 S270 S271 S272L266-N268 PolarHBondContact O-N 3.35Å; N268-S270 VanDerWaalsContact C-N 3.28Å; N268-S270 PolarHBondContact O-N 2.84Å; N268-S271 PolarHBondContact O-N 2.8Å; N268-S272 PolarHBondContact O-N 3.02Å
269C79.8Confident84.3Confident73 Ų7368.5 Ų68.549%0.49336%0.36SS..Hα-helixtrans-56.7-36.2-177.9166.20000113.3C20 N273C20-C269 HydrophobicContact CB-CB 4.07Å; C20-C269 WeakPolarHBondContact CB-SG 3.41Å; C20-C269 WeakPolarHBondContact SG-CB 3.07Å; C20-C269 CovalentContact SG-SG 2.06Å; C20-C269 PolarHBondContact SG-SG 3.46Å; C269-N273 VanDerWaalsContact O-CB 3.27Å; C269-N273 WeakPolarHBondContact O-CB 3.35Å; C269-N273 PolarHBondContact O-N 3.48Å
270S82Confident84.2Confident72 Ų7271.2 Ų71.250%0.50337%0.372SS..Hα-helixtrans-62.3-46.4173.3175.20000112.7N268 N273 R274N268-S270 VanDerWaalsContact C-N 3.28Å; N268-S270 PolarHBondContact O-N 2.84Å; S270-N273 PolarHBondContact O-N 3.07Å; S270-R274 WeakPolarHBondContact O-CG 3.3Å; S270-R274 PolarHBondContact O-N 3.14Å; S270-R274 VanDerWaalsContact O-N 3.11Å
271S83.3Confident84.3Confident32 Ų3273.4 Ų73.422%0.22439%0.39CS..Hα-helixtrans-68.3-42.9179.2-610000111.7L266 N268 R274 L275L266-S271 WeakPolarHBondContact O-CB 3.32Å; N268-S271 PolarHBondContact O-N 2.8Å; S271-R274 PolarHBondContact O-N 3.26Å; S271-L275 WeakPolarHBondContact O-CG 3.33Å; S271-L275 PolarHBondContact O-N 2.82Å
272S81.4Confident84.7Confident24 Ų2472.3 Ų72.317%0.16839%0.386CS..Hα-helixtrans-59.9-44.9174.7175.80000111.4N268 R274 L275 D276N268-S272 PolarHBondContact O-N 3.02Å; S272-R274 VanDerWaalsContact C-N 3.35Å; S272-R274 PolarHBondContact O-N 3.33Å; S272-L275 WeakPolarHBondContact O-CB 3.43Å; S272-L275 PolarHBondContact O-N 3.11Å; S272-L275 VanDerWaalsContact O-N 3.13Å; S272-D276 PolarHBondContact O-N 2.85Å; S272-D276 VanDerWaalsContact O-OD2 3.12Å
273N82.8Confident85.2Confident41 Ų4167.3 Ų67.322%0.21936%0.362CS..Hα-helixtrans-63.1-39177.4-167.523.3000112.4C269 S270 D276 Q277C269-N273 VanDerWaalsContact O-CB 3.27Å; C269-N273 WeakPolarHBondContact O-CB 3.35Å; C269-N273 PolarHBondContact O-N 3.48Å; S270-N273 PolarHBondContact O-N 3.07Å; N273-D276 PolarHBondContact O-N 3.46Å; N273-Q277 WeakPolarHBondContact O-CG 3.45Å; N273-Q277 PolarHBondContact O-N 3.14Å; N273-Q277 VanDerWaalsContact O-N 3.1Å
274R86Confident85.5Confident173 Ų17359.8 Ų59.865%0.65333%0.331SS*.Hα-helixtrans-65.6-39173.2-70.1177.6-171.3-166.21.5112.1S270 S271 S272 Q277 A278S270-R274 WeakPolarHBondContact O-CG 3.3Å; S270-R274 PolarHBondContact O-N 3.14Å; S270-R274 VanDerWaalsContact O-N 3.11Å; S271-R274 PolarHBondContact O-N 3.26Å; S272-R274 VanDerWaalsContact C-N 3.35Å; S272-R274 PolarHBondContact O-N 3.33Å; R274-Q277 PolarHBondContact O-N 3.43Å; R274-A278 WeakPolarHBondContact O-CB 3.28Å; R274-A278 PolarHBondContact O-N 3.25Å
275L86.1Confident85.9Confident18 Ų1858.2 Ų58.29%0.09433%0.326CS..Hα-helixtrans-64.4-41.1175.8-80.4171.2000111.8L257 L266 S271 S272 A278 M279L257-L275 HydrophobicContact CB-CD2 3.98Å; L266-L275 HydrophobicContact CB-CD1 3.96Å; L266-L275 HydrophobicContact CD1-CD1 3.94Å; L266-L275 HydrophobicContact CD1-CD2 4.47Å; S271-L275 WeakPolarHBondContact O-CG 3.33Å; S271-L275 PolarHBondContact O-N 2.82Å; S272-L275 WeakPolarHBondContact O-CB 3.43Å; S272-L275 PolarHBondContact O-N 3.11Å; S272-L275 VanDerWaalsContact O-N 3.13Å; L275-A278 PolarHBondContact O-N 3.46Å; L275-M279 WeakPolarHBondContact O-CB 3.5Å; L275-M279 PolarHBondContact O-N 3.22Å
276D83.3Confident86.6Confident26 Ų2656 Ų5614%0.13930%0.303CS..Hα-helixtrans-64.9-40.4176.3-69-52.2000112.3K22 S272 N273 M279 Q280K22-D276 WeakPolarHBondContact CE-OD2 3.38Å; K22-D276 VanDerWaalsContact NZ-CG 3.34Å; K22-D276 IonicContact NZ-OD1 3.86Å; K22-D276 IonicContact NZ-OD2 3.69Å; K22-D276 PolarHBondContact NZ-OD2 3.02Å; S272-D276 PolarHBondContact O-N 2.85Å; S272-D276 VanDerWaalsContact O-OD2 3.12Å; N273-D276 PolarHBondContact O-N 3.46Å; D276-M279 PolarHBondContact O-N 3.33Å; D276-Q280 PolarHBondContact O-N 2.69Å
277Q85.5Confident87Confident81 Ų8154 Ų5438%0.37929%0.293SS..Hα-helixtrans-60.7-47.7172.6-71.81749.100111.1V25 N273 R274 M279 Q280 V281V25-Q277 HydrophobicContact CB-CG 4.36Å; V25-Q277 HydrophobicContact CG1-CG 3.9Å; V25-Q277 HydrophobicContact CG2-CG 3.47Å; V25-Q277 VanDerWaalsContact CG2-CG 3.47Å; N273-Q277 WeakPolarHBondContact O-CG 3.45Å; N273-Q277 PolarHBondContact O-N 3.14Å; N273-Q277 VanDerWaalsContact O-N 3.1Å; R274-Q277 PolarHBondContact O-N 3.43Å; Q277-M279 VanDerWaalsContact C-N 3.27Å; Q277-M279 PolarHBondContact O-N 2.94Å; Q277-Q280 PolarHBondContact O-N 3.24Å; Q277-V281 WeakPolarHBondContact O-CG2 3.28Å; Q277-V281 PolarHBondContact O-N 3.42Å
278A90.3Very high87.9Confident36 Ų3650.2 Ų50.230%0.29827%0.274SS..Hα-helixtrans-60.6-39.6176.500000111.3V254 R274 L275 V281 T282V254-A278 HydrophobicContact CG1-CB 4.11Å; V254-A278 HydrophobicContact CG2-CB 4.19Å; R274-A278 WeakPolarHBondContact O-CB 3.28Å; R274-A278 PolarHBondContact O-N 3.25Å; L275-A278 PolarHBondContact O-N 3.46Å; A278-V281 PolarHBondContact O-N 3.45Å; A278-T282 VanDerWaalsContact O-CB 3.32Å; A278-T282 WeakPolarHBondContact O-CB 3.17Å; A278-T282 VanDerWaalsContact O-CG2 3.26Å; A278-T282 WeakPolarHBondContact O-CG2 3.33Å; A278-T282 PolarHBondContact O-N 3.01Å; A278-T282 PolarHBondContact O-OG1 2.89Å
279M89.7Confident88.4Confident44 Ų4445.9 Ų45.922%0.21725%0.25CC..Hα-helixtrans-63.7-47.3178.4-171.3170.163.200110.6Y251 V254 L275 D276 Q277 V281 T282 E283Y251-M279 HydrophobicContact CE2-CG 4.3Å; V254-M279 HydrophobicContact CG1-CB 3.87Å; L275-M279 WeakPolarHBondContact O-CB 3.5Å; L275-M279 PolarHBondContact O-N 3.22Å; D276-M279 PolarHBondContact O-N 3.33Å; Q277-M279 VanDerWaalsContact C-N 3.27Å; Q277-M279 PolarHBondContact O-N 2.94Å; M279-V281 PolarHBondContact O-N 2.67Å; M279-T282 PolarHBondContact O-N 2.93Å; M279-T282 PolarHBondContact O-OG1 3.28Å; M279-E283 WeakPolarHBondContact O-CB 3.31Å; M279-E283 PolarHBondContact O-N 2.78Å
280Q88Confident89Confident66 Ų6642.5 Ų42.531%0.30823%0.227SC..Hα-helixtrans-61.2-44.7177.7-172.965.255.300112.2D276 Q277 T284D276-Q280 PolarHBondContact O-N 2.69Å; Q277-Q280 PolarHBondContact O-N 3.24Å; Q280-T284 VanDerWaalsContact O-CB 3.31Å; Q280-T284 WeakPolarHBondContact O-CB 3.48Å; Q280-T284 PolarHBondContact O-N 2.87Å; Q280-T284 PolarHBondContact O-OG1 3.31Å
281V91.3Very high89.5Confident102 Ų10239.7 Ų39.762%0.61821%0.207SC*.Hα-helixtrans-67-46.4-179.5171.80000111Q277 A278 M279 T284 L285Q277-V281 WeakPolarHBondContact O-CG2 3.28Å; Q277-V281 PolarHBondContact O-N 3.42Å; A278-V281 PolarHBondContact O-N 3.45Å; M279-V281 PolarHBondContact O-N 2.67Å; V281-T284 WeakPolarHBondContact O-CB 3.5Å; V281-T284 PolarHBondContact O-N 3.38Å; V281-L285 PolarHBondContact O-N 3.44Å
282T94.3Very high90Very high18 Ų1839.8 Ų39.811%0.1121%0.205CC..Hα-helixtrans-71-34.2-178.955.20000112.7P250 V254 A278 M279 L285 G286P250-T282 HydrophobicContact CB-CG2 3.58Å; V254-T282 HydrophobicContact CG2-CG2 4.12Å; A278-T282 VanDerWaalsContact O-CB 3.32Å; A278-T282 WeakPolarHBondContact O-CB 3.17Å; A278-T282 VanDerWaalsContact O-CG2 3.26Å; A278-T282 WeakPolarHBondContact O-CG2 3.33Å; A278-T282 PolarHBondContact O-N 3.01Å; A278-T282 PolarHBondContact O-OG1 2.89Å; M279-T282 PolarHBondContact O-N 2.93Å; M279-T282 PolarHBondContact O-OG1 3.28Å; T282-L285 WeakPolarHBondContact O-CB 3.26Å; T282-L285 PolarHBondContact O-N 3.01Å; T282-G286 PolarHBondContact O-N 3.32Å
283E92.1Very high90.4Very high42 Ų4238.7 Ų38.720%0.19620%0.197CC..Hα-helixtrans-63.5-45.1171-176.2174.3-159.500110.8Y251 M279 L285 G286 M287Y251-E283 HydrophobicContact CD2-CB 3.68Å; Y251-E283 HydrophobicContact CD2-CG 4.33Å; Y251-E283 HydrophobicContact CE2-CB 3.71Å; Y251-E283 HydrophobicContact CE2-CG 4.02Å; M279-E283 WeakPolarHBondContact O-CB 3.31Å; M279-E283 PolarHBondContact O-N 2.78Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 2.85Å; E283-G286 CarbonylContact O-C 3.47Å; E283-G286 WeakPolarHBondContact O-CA 3.32Å; E283-G286 PolarHBondContact O-N 3.19Å; E283-G286 VanDerWaalsContact O-N 3.14Å; E283-M287 HydrophobicContact CG-CE 4.14Å; E283-M287 WeakPolarHBondContact O-CG 3.46Å; E283-M287 PolarHBondContact O-N 3.13Å
284T92Very high90.7Very high15 Ų1537.4 Ų37.49%0.09219%0.191CC..Hα-helixtrans-59.8-43.6176.5-60.30000111.2L33 L36 Y37 Q280 V281 M287 T288L33-T284 HydrophobicContact CD2-CG2 3.57Å; L33-T284 VanDerWaalsContact CD2-OG1 3.28Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.44Å; L36-T284 HydrophobicContact CD2-CG2 3.53Å; Y37-T284 HydrophobicContact CE1-CG2 3.92Å; Y37-T284 PolarHBondContact OH-OG1 3.03Å; Q280-T284 VanDerWaalsContact O-CB 3.31Å; Q280-T284 WeakPolarHBondContact O-CB 3.48Å; Q280-T284 PolarHBondContact O-N 2.87Å; Q280-T284 PolarHBondContact O-OG1 3.31Å; V281-T284 WeakPolarHBondContact O-CB 3.5Å; V281-T284 PolarHBondContact O-N 3.38Å; T284-M287 PolarHBondContact O-N 3.4Å; T284-T288 VanDerWaalsContact O-CG2 3.28Å; T284-T288 WeakPolarHBondContact O-CG2 3.22Å; T284-T288 PolarHBondContact O-N 2.93Å; T284-T288 VanDerWaalsContact O-N 3.14Å
285L94.8Very high90.9Very high65 Ų6532.8 Ų32.834%0.3418%0.179SC..Hα-helixtrans-57.5-50.8172.8-179.665.2000110.6F247 P250 V281 T282 E283 M287 T288F247-L285 HydrophobicContact CD1-CD1 3.93Å; F247-L285 HydrophobicContact CD1-CG 4.24Å; F247-L285 VanDerWaalsContact CD1-O 3.31Å; F247-L285 WeakPolarHBondContact CD1-O 3.26Å; F247-L285 HydrophobicContact CE1-CD1 4.02Å; F247-L285 HydrophobicContact CG-CD1 4.44Å; F247-L285 HydrophobicContact CG-CG 4.48Å; P250-L285 HydrophobicContact CG-CD2 4.31Å; V281-L285 PolarHBondContact O-N 3.44Å; T282-L285 WeakPolarHBondContact O-CB 3.26Å; T282-L285 PolarHBondContact O-N 3.01Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 2.85Å; L285-M287 VanDerWaalsContact C-N 3.31Å; L285-M287 PolarHBondContact O-N 3.36Å; L285-T288 PolarHBondContact O-N 2.98Å; L285-T288 VanDerWaalsContact O-N 3.07Å; L285-T288 PolarHBondContact O-OG1 2.9Å
286G94.3Very high91Very high0 Ų032.4 Ų32.40%018%0.177CC..Hα-helixtrans-55-43.2175.300000112.9W248 T282 E283 T288 H289W248-G286 WeakPolarHBondContact CZ2-O 3.41Å; T282-G286 PolarHBondContact O-N 3.32Å; E283-G286 CarbonylContact O-C 3.47Å; E283-G286 WeakPolarHBondContact O-CA 3.32Å; E283-G286 PolarHBondContact O-N 3.19Å; E283-G286 VanDerWaalsContact O-N 3.14Å; G286-T288 VanDerWaalsContact C-N 3.28Å; G286-T288 PolarHBondContact O-N 3.44Å; G286-H289 WeakPolarHBondContact O-CB 3.46Å; G286-H289 PolarHBondContact O-N 3.01Å; G286-H289 VanDerWaalsContact O-N 3.07Å
287M91.6Very high91.1Very high5 Ų531.6 Ų31.63%0.02517%0.172CC..Hα-helixtrans-60.6-35.8177.4-69-155.2-174.700112.7Y37 F79 W86 Y108 E283 T284 L285 H289 C290Y37-M287 HydrophobicContact CE1-CB 4.2Å; Y37-M287 HydrophobicContact CE1-SD 3.85Å; Y37-M287 HydrophobicContact CE2-SD 4.06Å; Y37-M287 VanDerWaalsContact CZ-SD 3.53Å; Y37-M287 PolarHBondContact OH-SD 2.64Å; F79-M287 HydrophobicContact CE1-CB 4.1Å; F79-M287 HydrophobicContact CE1-CG 4.1Å; F79-M287 HydrophobicContact CZ-CB 4.4Å; F79-M287 HydrophobicContact CZ-CG 4Å; W86-M287 HydrophobicContact CG-CE 4.38Å; Y108-M287 HydrophobicContact CE2-CE 3.98Å; E283-M287 HydrophobicContact CG-CE 4.14Å; E283-M287 WeakPolarHBondContact O-CG 3.46Å; E283-M287 PolarHBondContact O-N 3.13Å; T284-M287 PolarHBondContact O-N 3.4Å; L285-M287 VanDerWaalsContact C-N 3.31Å; L285-M287 PolarHBondContact O-N 3.36Å; M287-H289 PolarHBondContact O-N 2.74Å; M287-C290 PolarHBondContact O-SG 2.82Å
288T94.1Very high90.9Very high22 Ų2229.3 Ų29.314%0.13517%0.167CC..Hα-helixtrans-67.8-18.6178.569.30000113.4V40 F247 T284 L285 G286 C290 C291V40-T288 HydrophobicContact CG2-CG2 3.74Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.34Å; F247-T288 VanDerWaalsContact CE1-OG1 3.26Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.45Å; T284-T288 VanDerWaalsContact O-CG2 3.28Å; T284-T288 WeakPolarHBondContact O-CG2 3.22Å; T284-T288 PolarHBondContact O-N 2.93Å; T284-T288 VanDerWaalsContact O-N 3.14Å; L285-T288 PolarHBondContact O-N 2.98Å; L285-T288 VanDerWaalsContact O-N 3.07Å; L285-T288 PolarHBondContact O-OG1 2.9Å; G286-T288 VanDerWaalsContact C-N 3.28Å; G286-T288 PolarHBondContact O-N 3.44Å; T288-C290 PolarHBondContact O-N 3.45Å; T288-C290 VanDerWaalsContact O-N 3.16Å; T288-C291 PolarHBondContact O-N 3.29Å; T288-C291 PolarHBondContact O-SG 2.92Å
289H94.6Very high90.3Very high8 Ų835.6 Ų35.64%0.03719%0.188CC..G310 helixtrans-55.6-34.9-179.8176.3-95000113.4Y244 F247 W248 G286 M287 C291 I292Y244-H289 AromaticContact CD2-CE1 3.83Å; Y244-H289 AromaticContact CD2-NE2 3.9Å; F247-H289 HydrophobicContact CB-CB 3.93Å; F247-H289 HydrophobicContact CD1-CB 3.94Å; F247-H289 HydrophobicContact CG-CB 4.16Å; W248-H289 AromaticContact CD1-CG 3.88Å; W248-H289 AromaticContact NE1-CG 3.51Å; W248-H289 AromaticContact NE1-ND1 3.57Å; G286-H289 WeakPolarHBondContact O-CB 3.46Å; G286-H289 PolarHBondContact O-N 3.01Å; G286-H289 VanDerWaalsContact O-N 3.07Å; M287-H289 PolarHBondContact O-N 2.74Å; H289-C291 PolarHBondContact O-N 3.39Å; H289-C291 VanDerWaalsContact O-N 3.09Å; H289-I292 WeakPolarHBondContact O-CB 3.31Å; H289-I292 PolarHBondContact O-N 3.41Å
290C91.8Very high89.7Confident3 Ų335.1 Ų35.12%0.0219%0.187CC..G310 helixtrans-61.5-20.1-175.464.50000114.3N48 D76 F79 L80 M287 T288N48-C290 PolarHBondContact ND2-O 3.18Å; D76-C290 HydrophobicContact CB-CB 4.36Å; F79-C290 HydrophobicContact CD1-CB 3.98Å; L80-C290 WeakPolarHBondContact CD2-SG 3.24Å; L80-C290 HydrophobicContact CG-CB 4.21Å; M287-C290 PolarHBondContact O-SG 2.82Å; T288-C290 PolarHBondContact O-N 3.45Å; T288-C290 VanDerWaalsContact O-N 3.16Å
291C92.3Very high89Confident12 Ų1232.4 Ų32.48%0.08118%0.177CC..G310 helixtrans-95.9-7.2174.872.60000113.9F43 G44 T288 H289F43-C291 HydrophobicContact CB-CB 4.43Å; G44-C291 VanDerWaalsContact CA-CB 3.47Å; T288-C291 PolarHBondContact O-N 3.29Å; T288-C291 PolarHBondContact O-SG 2.92Å; H289-C291 PolarHBondContact O-N 3.39Å; H289-C291 VanDerWaalsContact O-N 3.09Å
292I93.4Very high88.1Confident35 Ų3531 Ų3118%0.17916%0.163CC..Hα-helixtrans-82.4-29.9-175.2-53.7-59.8000112.1V243 F247 H289 I295 I296V243-I292 HydrophobicContact CG1-CG2 3.71Å; F247-I292 HydrophobicContact CE1-CD1 4.26Å; F247-I292 HydrophobicContact CE1-CG1 3.81Å; F247-I292 HydrophobicContact CZ-CD1 4.16Å; F247-I292 HydrophobicContact CZ-CG1 3.88Å; H289-I292 WeakPolarHBondContact O-CB 3.31Å; H289-I292 PolarHBondContact O-N 3.41Å; I292-I295 HydrophobicContact CD1-CD1 4.22Å; I292-I295 WeakPolarHBondContact O-CA 3.41Å; I292-I295 VanDerWaalsContact O-CB 3.31Å; I292-I295 WeakPolarHBondContact O-CB 3.26Å; I292-I295 PolarHBondContact O-N 2.93Å; I292-I296 HydrophobicContact CG2-CD1 4Å; I292-I296 HydrophobicContact CG2-CG1 4.02Å; I292-I296 WeakPolarHBondContact O-CG1 3.36Å; I292-I296 PolarHBondContact O-N 3.18Å
293N90.1Very high87.1Confident0 Ų036.3 Ų36.30%019%0.185CC..Hα-helixtrans-55.2-50.6-179.6-78-30.9000113.4D76 I295 I296 Y297D76-N293 PolarHBondContact OD2-ND2 2.69Å; N293-I295 VanDerWaalsContact C-N 3.28Å; N293-I295 PolarHBondContact O-N 3.4Å; N293-I296 PolarHBondContact O-N 3.01Å; N293-Y297 HydrophobicContact CB-CE2 4.38Å; N293-Y297 WeakPolarHBondContact O-CD1 3.37Å; N293-Y297 WeakPolarHBondContact O-CD2 3.33Å; N293-Y297 VanDerWaalsContact O-CG 3.23Å; N293-Y297 PolarHBondContact O-N 3.35Å
294P89.7Confident86.1Confident14 Ų1435.2 Ų35.29%0.09118%0.18CC..Hα-helixtrans-58.3-37.3173.7-25.534.4000113.8G47 N48 V51 Y297 A298G47-P294 VanDerWaalsContact C-CG 3.42Å; N48-P294 WeakPolarHBondContact OD1-CG 3.38Å; V51-P294 HydrophobicContact CG2-CB 4.05Å; V51-P294 HydrophobicContact CG2-CG 4.14Å; P294-Y297 PolarHBondContact O-N 2.58Å; P294-A298 PolarHBondContact O-N 3.33Å
295I89.6Confident85.4Confident76 Ų7640.8 Ų40.839%0.3920%0.199SC..Hα-helixtrans-62.9-48177.5-62.6175.8000109.5I292 N293 Y297 A298 F299I292-I295 HydrophobicContact CD1-CD1 4.22Å; I292-I295 WeakPolarHBondContact O-CA 3.41Å; I292-I295 VanDerWaalsContact O-CB 3.31Å; I292-I295 WeakPolarHBondContact O-CB 3.26Å; I292-I295 PolarHBondContact O-N 2.93Å; N293-I295 VanDerWaalsContact C-N 3.28Å; N293-I295 PolarHBondContact O-N 3.4Å; I295-Y297 VanDerWaalsContact C-N 3.25Å; I295-Y297 PolarHBondContact O-N 2.93Å; I295-A298 PolarHBondContact O-N 3.48Å; I295-A298 VanDerWaalsContact O-N 3.15Å; I295-F299 HydrophobicContact CG2-CD2 3.64Å; I295-F299 HydrophobicContact CG2-CE2 3.75Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.4Å; I295-F299 PolarHBondContact O-N 3.01Å
296I88.6Confident84.7Confident10 Ų1042.1 Ų42.15%0.05121%0.206CC..Hα-helixtrans-56.2-43.1175.2-64.2169.5000110.4L236 T239 I240 V243 I292 N293 A298 F299 V300L236-I296 HydrophobicContact CD1-CG2 3.96Å; T239-I296 HydrophobicContact CG2-CG2 4.03Å; I240-I296 HydrophobicContact CG1-CD1 4.42Å; I240-I296 HydrophobicContact CG1-CG2 3.99Å; V243-I296 HydrophobicContact CB-CD1 3.91Å; V243-I296 HydrophobicContact CG1-CD1 3.97Å; V243-I296 HydrophobicContact CG2-CD1 3.97Å; I292-I296 HydrophobicContact CG2-CD1 4Å; I292-I296 HydrophobicContact CG2-CG1 4.02Å; I292-I296 WeakPolarHBondContact O-CG1 3.36Å; I292-I296 PolarHBondContact O-N 3.18Å; N293-I296 PolarHBondContact O-N 3.01Å; I296-A298 PolarHBondContact O-N 2.86Å; I296-F299 PolarHBondContact O-N 3.29Å; I296-V300 HydrophobicContact CG2-CB 4.27Å; I296-V300 HydrophobicContact CG2-CG2 4.09Å; I296-V300 WeakPolarHBondContact O-CA 3.29Å; I296-V300 VanDerWaalsContact O-CB 3.25Å; I296-V300 WeakPolarHBondContact O-CB 3.39Å; I296-V300 PolarHBondContact O-N 3.45Å
297Y85.1Confident83.9Confident10 Ų1046 Ų464%0.03922%0.222CC..Hα-helixtrans-66.2-37.7-179.9-55.7-21.4000112.7V51 L69 L72 L236 I240 N293 P294 I295 G301V51-Y297 HydrophobicContact CG1-CD2 4.21Å; V51-Y297 HydrophobicContact CG1-CE2 4.08Å; V51-Y297 HydrophobicContact CG2-CD2 3.73Å; V51-Y297 HydrophobicContact CG2-CE2 4.18Å; L69-Y297 HydrophobicContact CD2-CE1 4.2Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.38Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.34Å; L236-Y297 HydrophobicContact CD1-CD1 4.21Å; I240-Y297 HydrophobicContact CD1-CE1 3.61Å; I240-Y297 HydrophobicContact CG1-CE1 4.13Å; N293-Y297 HydrophobicContact CB-CE2 4.38Å; N293-Y297 WeakPolarHBondContact O-CD1 3.37Å; N293-Y297 WeakPolarHBondContact O-CD2 3.33Å; N293-Y297 VanDerWaalsContact O-CG 3.23Å; N293-Y297 PolarHBondContact O-N 3.35Å; P294-Y297 PolarHBondContact O-N 2.58Å; I295-Y297 VanDerWaalsContact C-N 3.25Å; I295-Y297 PolarHBondContact O-N 2.93Å; Y297-G301 WeakPolarHBondContact O-CA 3.4Å; Y297-G301 PolarHBondContact O-N 3.42Å; Y297-G301 VanDerWaalsContact O-N 3.07Å
298A81.9Confident83.2Confident33 Ų3347.5 Ų47.527%0.27323%0.229SC..Hα-helixtrans-66.8-41.2177.700000112.8P294 I295 I296P294-A298 PolarHBondContact O-N 3.33Å; I295-A298 PolarHBondContact O-N 3.48Å; I295-A298 VanDerWaalsContact O-N 3.15Å; I296-A298 PolarHBondContact O-N 2.86Å
299F78Confident82.5Confident168 Ų16850.7 Ų50.774%0.73725%0.245SC*.Hα-helixtrans-89.8-40.4-175.5-72-72.9000113.8I295 I296I295-F299 HydrophobicContact CG2-CD2 3.64Å; I295-F299 HydrophobicContact CG2-CE2 3.75Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.4Å; I295-F299 PolarHBondContact O-N 3.01Å; I296-F299 PolarHBondContact O-N 3.29Å
300V75.5Confident81.7Confident33 Ų3353.9 Ų53.920%0.227%0.265CS..Hα-helixtrans-95.8-29-174.5-172.40000111.6L236 T239 I296 E302L236-V300 HydrophobicContact CB-CG1 4.41Å; L236-V300 HydrophobicContact CD1-CB 3.88Å; L236-V300 HydrophobicContact CD1-CG1 3.9Å; T239-V300 HydrophobicContact CG2-CG2 4.24Å; I296-V300 HydrophobicContact CG2-CB 4.27Å; I296-V300 HydrophobicContact CG2-CG2 4.09Å; I296-V300 WeakPolarHBondContact O-CA 3.29Å; I296-V300 VanDerWaalsContact O-CB 3.25Å; I296-V300 WeakPolarHBondContact O-CB 3.39Å; I296-V300 PolarHBondContact O-N 3.45Å; V300-E302 PolarHBondContact O-N 3.45Å
301G73.8Confident81.1Confident9 Ų954.9 Ų54.99%0.09327%0.269CS..  trans-89.385.4-175.700000113.8Y297 K303 F304 R305Y297-G301 WeakPolarHBondContact O-CA 3.4Å; Y297-G301 PolarHBondContact O-N 3.42Å; Y297-G301 VanDerWaalsContact O-N 3.07Å; G301-K303 PolarHBondContact O-N 3.1Å; G301-K303 VanDerWaalsContact O-N 3.13Å; G301-F304 WeakPolarHBondContact O-CA 3.28Å; G301-F304 WeakPolarHBondContact O-CB 3.25Å; G301-F304 PolarHBondContact O-N 2.9Å; G301-R305 PolarHBondContact O-N 3.13Å
302E73.4Confident80.5Confident72 Ų7258.5 Ų58.534%0.33628%0.284SS..Hα-helixtrans-51.1-41177.7-69.6174.1-168.700113.6R232 V300 N306R232-E302 WeakPolarHBondContact CD-OE2 3.49Å; R232-E302 IonicContact CZ-OE1 3.22Å; R232-E302 IonicContact CZ-OE2 2.77Å; R232-E302 IonicContact NE-OE1 3.51Å; R232-E302 IonicContact NE-OE2 3.85Å; R232-E302 IonicContact NH1-OE1 2.64Å; R232-E302 IonicContact NH1-OE2 3.66Å; R232-E302 PolarHBondContact NH1-OE2 3.15Å; V300-E302 PolarHBondContact O-N 3.45Å; E302-N306 PolarHBondContact O-N 2.92Å; E302-N306 VanDerWaalsContact O-N 3.14Å
303K71.6Confident79.7Confident130 Ų13063 Ų6357%0.56530%0.304SS*.Hα-helixtrans-64.8-43.1176.6-69.9-173.9179.8-178.70111.8G301 N306 Y307G301-K303 PolarHBondContact O-N 3.1Å; G301-K303 VanDerWaalsContact O-N 3.13Å; K303-N306 PolarHBondContact O-N 2.94Å; K303-Y307 HydrophobicContact CB-CE2 4.42Å; K303-Y307 WeakPolarHBondContact O-CD2 3.37Å; K303-Y307 PolarHBondContact O-N 3.28Å; K303-Y307 VanDerWaalsContact O-N 3.08Å
304F71.8Confident78.9Confident20 Ų2069.7 Ų69.79%0.08833%0.333CS..Hα-helixtrans-65.3-42.8-179.3-174.8-95.6000110.4V51 I54 G301 N306 Y307 L308V51-F304 HydrophobicContact CB-CE2 4.38Å; V51-F304 HydrophobicContact CB-CZ 4.4Å; V51-F304 HydrophobicContact CG1-CE2 4.47Å; V51-F304 HydrophobicContact CG2-CE2 3.97Å; V51-F304 HydrophobicContact CG2-CZ 3.63Å; I54-F304 HydrophobicContact CB-CE2 4.09Å; I54-F304 HydrophobicContact CD1-CD2 4.48Å; I54-F304 HydrophobicContact CD1-CE1 4.25Å; I54-F304 HydrophobicContact CD1-CE2 3.72Å; I54-F304 HydrophobicContact CD1-CZ 3.58Å; I54-F304 HydrophobicContact CG2-CD2 4.11Å; I54-F304 HydrophobicContact CG2-CE2 3.92Å; G301-F304 WeakPolarHBondContact O-CA 3.28Å; G301-F304 WeakPolarHBondContact O-CB 3.25Å; G301-F304 PolarHBondContact O-N 2.9Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 3.39Å; F304-Y307 PolarHBondContact O-N 3.11Å; F304-Y307 VanDerWaalsContact O-N 3.16Å; F304-L308 HydrophobicContact CD1-CD1 4.41Å; F304-L308 HydrophobicContact CE1-CD1 3.79Å; F304-L308 WeakPolarHBondContact O-CB 3.04Å; F304-L308 PolarHBondContact O-N 3.26Å
305R77.8Confident77.9Confident132 Ų13273.1 Ų73.150%0.49835%0.348SS..Hα-helixtrans-56.6-43.9173.6-169.1177.769.7-174.83.3112.7G301 L308 L309G301-R305 PolarHBondContact O-N 3.13Å; R305-L308 WeakPolarHBondContact O-CB 3.35Å; R305-L308 PolarHBondContact O-N 2.91Å; R305-L309 WeakPolarHBondContact O-CG 3.27Å; R305-L309 PolarHBondContact O-N 3.09Å
306N79.4Confident76.8Confident92 Ų9272.5 Ų72.549%0.49234%0.344SS..Hα-helixtrans-64.9-41.1177-71.5-2.6000112.1E302 K303 F304 L308 L309 V310E302-N306 PolarHBondContact O-N 2.92Å; E302-N306 VanDerWaalsContact O-N 3.14Å; K303-N306 PolarHBondContact O-N 2.94Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 3.39Å; N306-L308 VanDerWaalsContact C-N 3.33Å; N306-L309 PolarHBondContact O-N 3.4Å; N306-V310 WeakPolarHBondContact O-CG2 3.48Å; N306-V310 PolarHBondContact O-N 3.22Å
307Y77.7Confident75.5Confident82 Ų8274.1 Ų74.132%0.32236%0.359SS..Hα-helixtrans-66.2-37.1174.7-72.4-61.5000112.6I54 C58 K59 K303 F304 V310 F311I54-Y307 HydrophobicContact CG2-CG 4.3Å; C58-Y307 HydrophobicContact CB-CD1 3.69Å; C58-Y307 HydrophobicContact CB-CE1 4.27Å; C58-Y307 HydrophobicContact CB-CG 4.25Å; K59-Y307 HydrophobicContact CD-CD2 4.23Å; K59-Y307 HydrophobicContact CD-CE2 4.05Å; K59-Y307 HydrophobicContact CG-CD2 3.91Å; K59-Y307 HydrophobicContact CG-CE1 4.38Å; K59-Y307 HydrophobicContact CG-CE2 3.56Å; K59-Y307 HydrophobicContact CG-CG 4.49Å; K303-Y307 HydrophobicContact CB-CE2 4.42Å; K303-Y307 WeakPolarHBondContact O-CD2 3.37Å; K303-Y307 PolarHBondContact O-N 3.28Å; K303-Y307 VanDerWaalsContact O-N 3.08Å; F304-Y307 PolarHBondContact O-N 3.11Å; F304-Y307 VanDerWaalsContact O-N 3.16Å; Y307-V310 PolarHBondContact O-N 2.99Å; Y307-F311 VanDerWaalsContact O-CB 3.27Å; Y307-F311 WeakPolarHBondContact O-CB 3.31Å; Y307-F311 PolarHBondContact O-N 3.18Å
308L77.5Confident74.1Confident36 Ų3681 Ų8119%0.18839%0.39CS..Hα-helixtrans-61.3-50.3174.9-170147.5000109.3L50 I54 F304 R305 N306 V310 F311 F312L50-L308 HydrophobicContact CD2-CD1 3.75Å; L50-L308 HydrophobicContact CD2-CG 4.31Å; I54-L308 HydrophobicContact CD1-CB 4.09Å; I54-L308 HydrophobicContact CD1-CG 4.43Å; F304-L308 HydrophobicContact CD1-CD1 4.41Å; F304-L308 HydrophobicContact CE1-CD1 3.79Å; F304-L308 WeakPolarHBondContact O-CB 3.04Å; F304-L308 PolarHBondContact O-N 3.26Å; R305-L308 WeakPolarHBondContact O-CB 3.35Å; R305-L308 PolarHBondContact O-N 2.91Å; N306-L308 VanDerWaalsContact C-N 3.33Å; L308-V310 PolarHBondContact O-N 3.33Å; L308-F311 WeakPolarHBondContact O-CB 3.27Å; L308-F311 PolarHBondContact O-N 3.1Å; L308-F311 VanDerWaalsContact O-N 3.1Å; L308-F312 HydrophobicContact CD1-CE2 4.42Å; L308-F312 HydrophobicContact CD2-CD2 3.4Å; L308-F312 VanDerWaalsContact CD2-CD2 3.4Å; L308-F312 HydrophobicContact CD2-CE2 3.34Å; L308-F312 HydrophobicContact CG-CD2 3.83Å; L308-F312 HydrophobicContact CG-CE2 3.68Å; L308-F312 VanDerWaalsContact O-CD2 3.25Å; L308-F312 WeakPolarHBondContact O-CD2 3.31Å; L308-F312 PolarHBondContact O-N 2.98Å
309L78.3Confident72.8Confident89 Ų8989 Ų8947%0.46641%0.413SS..Hα-helixtrans-55.6-46.7174.8-71.7170.8000112.8R305 N306 F311 F312 Q313R305-L309 WeakPolarHBondContact O-CG 3.27Å; R305-L309 PolarHBondContact O-N 3.09Å; N306-L309 PolarHBondContact O-N 3.4Å; L309-F311 VanDerWaalsContact C-N 3.33Å; L309-F311 PolarHBondContact O-N 2.92Å; L309-F312 PolarHBondContact O-N 3.39Å; L309-Q313 WeakPolarHBondContact O-CB 3.13Å; L309-Q313 VanDerWaalsContact O-CG 3.28Å; L309-Q313 WeakPolarHBondContact O-CG 3.31Å; L309-Q313 PolarHBondContact O-N 3.31Å
310V79.4Confident71.6Confident75 Ų7588 Ų8846%0.45541%0.408SS..Hα-helixtrans-63.5-39.3177171.80000111.6N306 Y307 L308 Q313 K314N306-V310 WeakPolarHBondContact O-CG2 3.48Å; N306-V310 PolarHBondContact O-N 3.22Å; Y307-V310 PolarHBondContact O-N 2.99Å; L308-V310 PolarHBondContact O-N 3.33Å; V310-Q313 PolarHBondContact O-N 3.07Å; V310-K314 VanDerWaalsContact O-CB 3.23Å; V310-K314 WeakPolarHBondContact O-CB 3.26Å; V310-K314 PolarHBondContact O-N 3.25Å
311F77.4Confident70.1Confident25 Ų2589.9 Ų89.911%0.1142%0.422CS..Hα-helixtrans-64.2-46.9176.7-178.8-93000111.2L50 L53 Y307 L308 L309 Q313 K314 H315L50-F311 HydrophobicContact CD1-CD1 3.79Å; L50-F311 HydrophobicContact CD1-CE1 3.66Å; L50-F311 HydrophobicContact CD1-CZ 4.35Å; L53-F311 HydrophobicContact CD1-CZ 4.35Å; Y307-F311 VanDerWaalsContact O-CB 3.27Å; Y307-F311 WeakPolarHBondContact O-CB 3.31Å; Y307-F311 PolarHBondContact O-N 3.18Å; L308-F311 WeakPolarHBondContact O-CB 3.27Å; L308-F311 PolarHBondContact O-N 3.1Å; L308-F311 VanDerWaalsContact O-N 3.1Å; L309-F311 VanDerWaalsContact C-N 3.33Å; L309-F311 PolarHBondContact O-N 2.92Å; F311-Q313 PolarHBondContact O-N 3.47Å; F311-K314 PolarHBondContact O-N 3.4Å; F311-H315 AromaticContact CD2-CD2 3.68Å; F311-H315 AromaticContact CE2-CD2 3.7Å; F311-H315 HydrophobicContact CZ-CB 4.48Å; F311-H315 WeakPolarHBondContact O-CB 3.28Å; F311-H315 PolarHBondContact O-N 3.49Å
312F80.2Confident68.8Low87 Ų8798.6 Ų98.638%0.38246%0.457SS..Iπ-helixtrans-59.8-45.6174.7-87.5-88.4000111.2L50 L308 L309 K314 I316 A317L50-F312 HydrophobicContact CD2-CE2 4.39Å; L308-F312 HydrophobicContact CD1-CE2 4.42Å; L308-F312 HydrophobicContact CD2-CD2 3.4Å; L308-F312 VanDerWaalsContact CD2-CD2 3.4Å; L308-F312 HydrophobicContact CD2-CE2 3.34Å; L308-F312 HydrophobicContact CG-CD2 3.83Å; L308-F312 HydrophobicContact CG-CE2 3.68Å; L308-F312 VanDerWaalsContact O-CD2 3.25Å; L308-F312 WeakPolarHBondContact O-CD2 3.31Å; L308-F312 PolarHBondContact O-N 2.98Å; L309-F312 PolarHBondContact O-N 3.39Å; F312-K314 PolarHBondContact O-N 3.18Å; F312-I316 HydrophobicContact CD1-CB 4.11Å; F312-I316 HydrophobicContact CD1-CD1 3.23Å; F312-I316 HydrophobicContact CD1-CG1 4.22Å; F312-I316 HydrophobicContact CD1-CG2 4.22Å; F312-I316 HydrophobicContact CE1-CD1 3.3Å; F312-I316 HydrophobicContact CG-CD1 3.92Å; F312-I316 HydrophobicContact CZ-CD1 4.04Å; F312-I316 CarbonylContact O-C 3.6Å; F312-I316 WeakPolarHBondContact O-CA 3.43Å; F312-I316 WeakPolarHBondContact O-CB 3.34Å; F312-I316 PolarHBondContact O-N 3.43Å; F312-A317 PolarHBondContact O-N 2.9Å
313Q77.3Confident67.5Low130 Ų130100.5 Ų100.561%0.60748%0.478SS*.Iπ-helixtrans-62.1-44.3176.8-73.7171.7-9.100112.5L309 V310 F311 A317 K318L309-Q313 WeakPolarHBondContact O-CB 3.13Å; L309-Q313 VanDerWaalsContact O-CG 3.28Å; L309-Q313 WeakPolarHBondContact O-CG 3.31Å; L309-Q313 PolarHBondContact O-N 3.31Å; V310-Q313 PolarHBondContact O-N 3.07Å; F311-Q313 PolarHBondContact O-N 3.47Å; Q313-A317 WeakPolarHBondContact O-CB 3.2Å; Q313-K318 PolarHBondContact O-N 2.93Å
314K72.1Confident66Low140 Ų14098.2 Ų98.261%0.60948%0.477SS*.Iπ-helixtrans-76-37.2-174.1-170.1177.4179.7-176.50113.6V310 F311 F312 K318V310-K314 VanDerWaalsContact O-CB 3.23Å; V310-K314 WeakPolarHBondContact O-CB 3.26Å; V310-K314 PolarHBondContact O-N 3.25Å; F311-K314 PolarHBondContact O-N 3.4Å; F312-K314 PolarHBondContact O-N 3.18Å; K314-K318 VanDerWaalsContact O-CB 3.29Å; K314-K318 WeakPolarHBondContact O-CB 3.14Å
315H70.1Confident64.1Low87 Ų87102.9 Ų102.940%0.40351%0.512SS..Iπ-helixtrans-110.3-31.9-170.9-70.7-79.8000114.2F311 R319F311-H315 AromaticContact CD2-CD2 3.68Å; F311-H315 AromaticContact CE2-CD2 3.7Å; F311-H315 HydrophobicContact CZ-CB 4.48Å; F311-H315 WeakPolarHBondContact O-CB 3.28Å; F311-H315 PolarHBondContact O-N 3.49Å; H315-R319 WeakPolarHBondContact O-CB 3.42Å
316I66.8Low62.5Low62 Ų62103.6 Ų103.632%0.31852%0.524SS..Iπ-helixtrans-99.5-54.4-174.9-64.5168.2000109.1F312 K318 R319 F320F312-I316 HydrophobicContact CD1-CB 4.11Å; F312-I316 HydrophobicContact CD1-CD1 3.23Å; F312-I316 HydrophobicContact CD1-CG1 4.22Å; F312-I316 HydrophobicContact CD1-CG2 4.22Å; F312-I316 HydrophobicContact CE1-CD1 3.3Å; F312-I316 HydrophobicContact CG-CD1 3.92Å; F312-I316 HydrophobicContact CZ-CD1 4.04Å; F312-I316 CarbonylContact O-C 3.6Å; F312-I316 WeakPolarHBondContact O-CA 3.43Å; F312-I316 WeakPolarHBondContact O-CB 3.34Å; F312-I316 PolarHBondContact O-N 3.43Å; I316-K318 VanDerWaalsContact C-N 3.3Å; I316-K318 PolarHBondContact O-N 3.46Å; I316-R319 PolarHBondContact O-N 3.23Å; I316-F320 HydrophobicContact CG2-CD2 3.64Å; I316-F320 HydrophobicContact CG2-CE2 3.83Å; I316-F320 WeakPolarHBondContact O-CD2 3.36Å; I316-F320 PolarHBondContact O-N 2.79Å
317A60.9Low60.5Low44 Ų44108.2 Ų108.236%0.36454%0.54SS..Iπ-helixtrans-62-37.1176.800000111.9F312 Q313 R319 F320 C321F312-A317 PolarHBondContact O-N 2.9Å; Q313-A317 WeakPolarHBondContact O-CB 3.2Å; A317-R319 PolarHBondContact O-N 2.06Å; A317-F320 PolarHBondContact O-N 3.38Å; A317-C321 WeakPolarHBondContact O-CA 3.4Å; A317-C321 WeakPolarHBondContact O-CB 3.34Å; A317-C321 PolarHBondContact O-N 3.12Å; A317-C321 PolarHBondContact O-SG 3.18Å
318K55.1Low58.8Low156 Ų156113.3 Ų113.368%0.67857%0.567SS**Hα-helixtrans-70.5-26.2175.2-151.1174.4-175.1177.60114Q313 K314 I316 K322Q313-K318 PolarHBondContact O-N 2.93Å; K314-K318 VanDerWaalsContact O-CB 3.29Å; K314-K318 WeakPolarHBondContact O-CB 3.14Å; I316-K318 VanDerWaalsContact C-N 3.3Å; I316-K318 PolarHBondContact O-N 3.46Å; K318-K322 PolarHBondContact O-N 3.23Å
319R54.3Low56.8Low200 Ų200119.2 Ų119.276%0.75559%0.594SS**Hα-helixtrans-79.3-41.7172.2-95.2-177.8168.9179.4-3.5111.6H315 I316 A317 K322H315-R319 WeakPolarHBondContact O-CB 3.42Å; I316-R319 PolarHBondContact O-N 3.23Å; A317-R319 PolarHBondContact O-N 2.06Å; R319-K322 WeakPolarHBondContact O-CB 3.24Å; R319-K322 PolarHBondContact O-N 3.19Å
320F52.5Low54.8Low147 Ų147122.8 Ų122.865%0.64561%0.608SS**Hα-helixtrans-73-35.8176.7-83.3-81.5000112.6I316 A317 K322 C323 C324I316-F320 HydrophobicContact CG2-CD2 3.64Å; I316-F320 HydrophobicContact CG2-CE2 3.83Å; I316-F320 WeakPolarHBondContact O-CD2 3.36Å; I316-F320 PolarHBondContact O-N 2.79Å; A317-F320 PolarHBondContact O-N 3.38Å; F320-K322 VanDerWaalsContact C-N 3.26Å; F320-K322 PolarHBondContact O-N 3.36Å; F320-C323 CarbonylContact O-C 3.58Å; F320-C323 WeakPolarHBondContact O-CA 3.4Å; F320-C323 WeakPolarHBondContact O-CB 3.4Å; F320-C323 PolarHBondContact O-N 2.89Å; F320-C324 PolarHBondContact O-N 3.43Å
321C45.9Very low52.6Low73 Ų73123.7 Ų123.749%0.49362%0.623SS.*THydrogen-bonded Turntrans-68.1-21.2169.3-81.20000113.1A317 C324A317-C321 WeakPolarHBondContact O-CA 3.4Å; A317-C321 WeakPolarHBondContact O-CB 3.34Å; A317-C321 PolarHBondContact O-N 3.12Å; A317-C321 PolarHBondContact O-SG 3.18Å; C321-C324 CarbonylContact O-C 3.56Å; C321-C324 PolarHBondContact O-N 3.23Å; C321-C324 VanDerWaalsContact O-O 3.06Å
322K45.3Very low50.7Low191 Ų191128.6 Ų128.683%0.8366%0.657SS**THydrogen-bonded Turntrans-71.2-21.3167.5-103.4-171.8174.7-168.70112.8K318 R319 F320K318-K322 PolarHBondContact O-N 3.23Å; R319-K322 WeakPolarHBondContact O-CB 3.24Å; R319-K322 PolarHBondContact O-N 3.19Å; F320-K322 VanDerWaalsContact C-N 3.26Å; F320-K322 PolarHBondContact O-N 3.36Å
323C45.4Very low48.6Very low113 Ų113133.3 Ų133.376%0.76468%0.681SS**SBendtrans-92.3-7.3172.3-770000113.6F320F320-C323 CarbonylContact O-C 3.58Å; F320-C323 WeakPolarHBondContact O-CA 3.4Å; F320-C323 WeakPolarHBondContact O-CB 3.4Å; F320-C323 PolarHBondContact O-N 2.89Å
324C40.3Very low46.8Very low81 Ų81139.1 Ų139.155%0.54770%0.697SS.*  trans-119.394.7174.3-73.30000110.1F320 C321 I326F320-C324 PolarHBondContact O-N 3.43Å; C321-C324 CarbonylContact O-C 3.56Å; C321-C324 PolarHBondContact O-N 3.23Å; C321-C324 VanDerWaalsContact O-O 3.06Å; C324-I326 PolarHBondContact O-N 3.5Å
325S33.4Very low45Very low118 Ų118137.3 Ų137.383%0.82571%0.708SS**THydrogen-bonded Turntrans-71.636.2175.362.70000113.9
326I43.7Very low43.4Very low148 Ų148138 Ų13876%0.75972%0.722SS**THydrogen-bonded Turntrans-118.7-13.7-176.1-68.4-178.7000112.7C324C324-I326 PolarHBondContact O-N 3.5Å
327F36.6Very low42.1Very low189 Ų189140.3 Ų140.383%0.82975%0.745SS**SBendtrans-110.225.4-179.3-113.6-83.5000114.7Q329F327-Q329 PolarHBondContact O-N 3.31Å
328Q41.6Very low40.9Very low188 Ų188144.3 Ų144.388%0.87976%0.764SS**  trans-99.865.3172.2-158.4170.4-10.300109.2
329Q36.6Very low40.1Very low161 Ų161146.3 Ų146.375%0.75277%0.769SS**  trans-133.1106.8163.6-150.3159.35.300110.4F327F327-Q329 PolarHBondContact O-N 3.31Å
330E35.1Very low39Very low164 Ų164143.1 Ų143.177%0.76677%0.771SS**  trans63.397.5150.7-67.3169.2-161.300118.9
331A33.8Very low38.3Very low94 Ų94145.8 Ų145.878%0.77778%0.777SS**PPolyproline II helixtrans-81.2122.4141.900000107.8
332P38Very low37.6Very low127 Ų127147.8 Ų147.883%0.82579%0.792SS**PPolyproline II helixtrans-73132.9168.5-10.226.3000109.2
333E35.4Very low37.3Very low187 Ų187144.4 Ų144.487%0.87479%0.787SS**PPolyproline II helixtrans-59.5149-179.5-64.3177.1146.400112.4A335E333-A335 PolarHBondContact O-N 3.4Å
334R39.1Very low36.6Very low252 Ų252142.2 Ų142.295%0.95178%0.784SS**  trans-60.6106.8168.3-78.1174.4171.1167.4-4.2109.5
335A34.9Very low36.3Very low101 Ų101147.2 Ų147.284%0.83580%0.799SS**  trans-81117.3157.700000109.2E333E333-A335 PolarHBondContact O-N 3.4Å
336S37.5Very low36.3Very low101 Ų101151 Ų15171%0.70680%0.804SS**  trans-70.1153.7168.245.10000112.4
337S39.2Very low35.9Very low112 Ų112152.4 Ų152.478%0.78381%0.807SS**  trans72.7138.716680.40000114.4
338V34.9Very low35.9Very low127 Ų127151.5 Ų151.577%0.7781%0.81SS**  cis-152.9151.937.51670000109
339Y38.1Very low35.6Very low199 Ų199147.6 Ų147.678%0.7880%0.803SS**  trans-64.9123.8172-161.3-94.8000111.8
340T32.3Very low35.6Very low132 Ų132146.9 Ų146.981%0.8181%0.809SS**  trans-146.9109.2152.7-22.90000110.8
341R37.3Very low35.9Very low204 Ų204142.5 Ų142.577%0.7781%0.808SS**  trans-94119.2165.6-173.3-179.7-174.8171.5-0.2106.5
342S31.4Very low36Very low114 Ų114149.7 Ų149.780%0.79783%0.832SS**  trans-136.6110.5163.1-178.50000108.4
343T38.5Very low35.9Very low120 Ų120150.9 Ų150.974%0.73683%0.832SS**  trans-129.8128.3163.419.40000103.5
344G31.8Very low35.9Very low67 Ų67148.9 Ų148.969%0.69183%0.83SS**  trans-68.9165.8-169.500000115.1
345E33Very low35.7Very low187 Ų187143.2 Ų143.287%0.87482%0.823SS**  trans64.7111.3149.7-62.9176.8165.500118.7
346Q33Very low35.8Very low197 Ų197145.7 Ų145.792%0.92182%0.823SS**  -172.2141.3100.6-101.4173.2-19.300112.1
347E36Very low35.7Very low178 Ų178148.5 Ų148.583%0.83283%0.83SS**  trans-56.2155.6174.5-61.2168.9139.200113.1
348I35.6Very low35.4Very low170 Ų170150.9 Ų150.987%0.87283%0.833SS**  -171.9118127.7-88.6149.4000108.7
349S35.6Very low35.5Very low106 Ų106152.6 Ų152.674%0.74184%0.838SS**  trans-58.4145.1164.3-49.30000112.1
350V37.5Very low35.3Very low146 Ų146149.1 Ų149.189%0.88584%0.842SS**  -166.5119.1120.91780000107.1
351G40.6Very low35.5Very low71 Ų71150.5 Ų150.573%0.73285%0.845SS**  trans-115.1127158.600000108.5
352L36.3Very low35.4Very low246 Ų246145.6 Ų145.6100%1.28885%0.852SS**  trans-159.90140.7-117150.3000108.4

Retrieved 352 of 352 residues in 401.8 ms (Link to these results)