A0A077ZMR3_TRITR Loading...

CTD nuclear envelope phosphatase 1

AlphaFold DB , UniProt , Accession A0A077ZMR3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 138 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
1M63.5Low82Confident209 Ų209124.5 Ų124.5100%1.0364%0.636SS**  0-20.40-54.3-44.617200116.2
2P76.5Confident82.7Confident100 Ų100119.8 Ų119.865%0.64962%0.618SS**Hα-helixtrans-75.9-28.4-179.429.2-33.6000114.9L4 Q5 K6P2-L4 PolarHBondContact O-N 3.32Å; P2-Q5 PolarHBondContact O-N 3.1Å; P2-K6 PolarHBondContact O-N 3.35Å
3E76.1Confident83.6Confident151 Ų151121.2 Ų121.271%0.70662%0.617SS**Hα-helixtrans-60.6-42.3-178.8-69.9-64.7124.800113.1Q5 K6 D7E3-Q5 VanDerWaalsContact C-N 3.3Å; E3-Q5 PolarHBondContact O-N 3.41Å; E3-K6 PolarHBondContact O-N 3.31Å; E3-D7 PolarHBondContact O-N 3.32Å
4L82Confident84.3Confident135 Ų135120.5 Ų120.571%0.70762%0.615SS**Hα-helixtrans-65.1-33.8179.8-172.667.3000112.4P2 Q8P2-L4 PolarHBondContact O-N 3.32Å; L4-Q8 PolarHBondContact O-N 3.25Å
5Q81.1Confident85Confident135 Ų135115.8 Ų115.863%0.63160%0.601SS**Hα-helixtrans-73-33.4179.7-171.8177.4-31.400111.8P2 E3 M9P2-Q5 PolarHBondContact O-N 3.1Å; E3-Q5 VanDerWaalsContact C-N 3.3Å; E3-Q5 PolarHBondContact O-N 3.41Å; Q5-M9 VanDerWaalsContact O-CG 3.27Å; Q5-M9 WeakPolarHBondContact O-CG 3.46Å; Q5-M9 PolarHBondContact O-N 3.1Å; Q5-M9 VanDerWaalsContact O-N 3.15Å
6K81.1Confident85.7Confident126 Ų126119.8 Ų119.855%0.54861%0.606SS.*Hα-helixtrans-67.3-47.1177.4-172.6179.9172.7-1710111.3P2 E3 Q8 M9 E10P2-K6 PolarHBondContact O-N 3.35Å; E3-K6 PolarHBondContact O-N 3.31Å; K6-Q8 VanDerWaalsContact C-N 3.29Å; K6-Q8 PolarHBondContact O-N 2.77Å; K6-M9 WeakPolarHBondContact O-CB 3.43Å; K6-M9 PolarHBondContact O-N 3.03Å; K6-M9 VanDerWaalsContact O-N 3.09Å; K6-E10 WeakPolarHBondContact CE-OE1 3.44Å; K6-E10 WeakPolarHBondContact O-CG 3.44Å; K6-E10 PolarHBondContact O-N 3.45Å
7D86.1Confident86.2Confident112 Ų112115.9 Ų115.960%0.59959%0.59SS**Hα-helixtrans-60.6-39.1178.2-164.652.4000111.7E3 M9 E10 G11E3-D7 PolarHBondContact O-N 3.32Å; D7-M9 PolarHBondContact O-N 2.93Å; D7-E10 PolarHBondContact O-N 2.93Å; D7-G11 PolarHBondContact O-N 3.38Å
8Q88.5Confident86.8Confident138 Ų138112.1 Ų112.165%0.64558%0.579SS**Hα-helixtrans-62.6-40.9174.1-169.2-173.6-36.500112.5L4 K6 V12L4-Q8 PolarHBondContact O-N 3.25Å; K6-Q8 VanDerWaalsContact C-N 3.29Å; K6-Q8 PolarHBondContact O-N 2.77Å; Q8-V12 WeakPolarHBondContact O-CG2 3.28Å; Q8-V12 PolarHBondContact O-N 3.49Å
9M85.2Confident87.3Confident130 Ų130112.2 Ų112.264%0.6458%0.579SS**Hα-helixtrans-68.3-40177.6-70.8-70-64.500111.9Q5 K6 D7 V12 F13Q5-M9 VanDerWaalsContact O-CG 3.27Å; Q5-M9 WeakPolarHBondContact O-CG 3.46Å; Q5-M9 PolarHBondContact O-N 3.1Å; Q5-M9 VanDerWaalsContact O-N 3.15Å; K6-M9 WeakPolarHBondContact O-CB 3.43Å; K6-M9 PolarHBondContact O-N 3.03Å; K6-M9 VanDerWaalsContact O-N 3.09Å; D7-M9 PolarHBondContact O-N 2.93Å; M9-V12 PolarHBondContact O-N 3.25Å; M9-F13 WeakPolarHBondContact O-CB 3.46Å; M9-F13 PolarHBondContact O-N 3.13Å
10E90.2Very high87.8Confident93 Ų93110.9 Ų110.944%0.43558%0.576SS.*Hα-helixtrans-63.1-43.1175.6-71.2-177.6-177.100111.3K6 D7 V12 F13 L14K6-E10 WeakPolarHBondContact CE-OE1 3.44Å; K6-E10 WeakPolarHBondContact O-CG 3.44Å; K6-E10 PolarHBondContact O-N 3.45Å; D7-E10 PolarHBondContact O-N 2.93Å; E10-V12 PolarHBondContact O-N 2.97Å; E10-F13 WeakPolarHBondContact O-CB 3.2Å; E10-F13 PolarHBondContact O-N 3.45Å; E10-L14 WeakPolarHBondContact O-CG 3.42Å; E10-L14 PolarHBondContact O-N 3.35Å
11G91.4Very high88.2Confident40 Ų40113.9 Ų113.941%0.41258%0.58SS.*Hα-helixtrans-59.6-43.4175.400000113.3D7 F13 L14 A15D7-G11 PolarHBondContact O-N 3.38Å; G11-F13 VanDerWaalsContact C-N 3.35Å; G11-L14 PolarHBondContact O-N 2.96Å; G11-A15 VanDerWaalsContact O-CB 3.31Å; G11-A15 WeakPolarHBondContact O-CB 3.42Å; G11-A15 PolarHBondContact O-N 3.1Å
12V91.3Very high89.8Confident68 Ų68109.4 Ų109.441%0.41256%0.559SS.*Hα-helixtrans-66.2-38.4176.1176.20000111.3Q8 M9 E10 R16Q8-V12 WeakPolarHBondContact O-CG2 3.28Å; Q8-V12 PolarHBondContact O-N 3.49Å; M9-V12 PolarHBondContact O-N 3.25Å; E10-V12 PolarHBondContact O-N 2.97Å; V12-R16 WeakPolarHBondContact O-CG 3.5Å; V12-R16 PolarHBondContact O-N 3.37Å
13F93.2Very high90.7Very high138 Ų138109.4 Ų109.461%0.60555%0.554SS**Hα-helixtrans-63.9-49.2176.3-177.9-97.1000111.6M9 E10 G11 A15 R16 V17M9-F13 WeakPolarHBondContact O-CB 3.46Å; M9-F13 PolarHBondContact O-N 3.13Å; E10-F13 WeakPolarHBondContact O-CB 3.2Å; E10-F13 PolarHBondContact O-N 3.45Å; G11-F13 VanDerWaalsContact C-N 3.35Å; F13-A15 VanDerWaalsContact C-N 3.33Å; F13-A15 PolarHBondContact O-N 3.08Å; F13-R16 PolarHBondContact O-N 3.06Å; F13-V17 HydrophobicContact CD1-CG2 4.31Å; F13-V17 HydrophobicContact CE1-CG2 3.94Å; F13-V17 HydrophobicContact CZ-CG2 4.06Å; F13-V17 WeakPolarHBondContact O-CG2 3.43Å; F13-V17 PolarHBondContact O-N 3.15Å
14L94.2Very high91.7Very high112 Ų112108 Ų10859%0.58655%0.547SS*.Hα-helixtrans-60.7-41.1176.8-69.9174.5000111.9E10 G11 R16 V17 A18E10-L14 WeakPolarHBondContact O-CG 3.42Å; E10-L14 PolarHBondContact O-N 3.35Å; G11-L14 PolarHBondContact O-N 2.96Å; L14-R16 PolarHBondContact O-N 3.05Å; L14-V17 PolarHBondContact O-N 2.89Å; L14-A18 VanDerWaalsContact O-CB 3.29Å; L14-A18 WeakPolarHBondContact O-CB 3.35Å; L14-A18 PolarHBondContact O-N 3.35Å
15A94.8Very high92.4Very high50 Ų50106.3 Ų106.341%0.41354%0.538SS..Hα-helixtrans-61.7-43.6176.800000112G11 F13 A18 I19G11-A15 VanDerWaalsContact O-CB 3.31Å; G11-A15 WeakPolarHBondContact O-CB 3.42Å; G11-A15 PolarHBondContact O-N 3.1Å; F13-A15 VanDerWaalsContact C-N 3.33Å; F13-A15 PolarHBondContact O-N 3.08Å; A15-A18 PolarHBondContact O-N 3.07Å; A15-I19 WeakPolarHBondContact O-CD1 3.33Å; A15-I19 VanDerWaalsContact O-CG1 3.24Å; A15-I19 WeakPolarHBondContact O-CG1 3.42Å; A15-I19 PolarHBondContact O-N 3.44Å
16R95.3Very high93.1Very high179 Ų179108.3 Ų108.368%0.67554%0.54SS*.Hα-helixtrans-63.3-45.6176.7-74.4178.3177.3-175.20.2111.9V12 F13 L14 I19 V20V12-R16 WeakPolarHBondContact O-CG 3.5Å; V12-R16 PolarHBondContact O-N 3.37Å; F13-R16 PolarHBondContact O-N 3.06Å; L14-R16 PolarHBondContact O-N 3.05Å; R16-I19 PolarHBondContact O-N 2.72Å; R16-V20 WeakPolarHBondContact O-CG2 3.31Å; R16-V20 PolarHBondContact O-N 2.81Å; R16-V20 VanDerWaalsContact O-N 3.12Å
17V95.5Very high93.9Very high55 Ų55105.3 Ų105.333%0.33353%0.532SS..Hα-helixtrans-60.3-47.4176.2173.10000109.9F13 L14 I19 V20 W21F13-V17 HydrophobicContact CD1-CG2 4.31Å; F13-V17 HydrophobicContact CE1-CG2 3.94Å; F13-V17 HydrophobicContact CZ-CG2 4.06Å; F13-V17 WeakPolarHBondContact O-CG2 3.43Å; F13-V17 PolarHBondContact O-N 3.15Å; L14-V17 PolarHBondContact O-N 2.89Å; V17-I19 VanDerWaalsContact C-N 3.35Å; V17-I19 PolarHBondContact O-N 3.39Å; V17-V20 PolarHBondContact O-N 3.39Å; V17-W21 PolarHBondContact O-N 3.48Å
18A96.6Very high94.4Very high47 Ų47102.8 Ų102.839%0.38853%0.527SS..Hα-helixtrans-59.1-41.7178.100000112.9L14 A15 W21 L22L14-A18 VanDerWaalsContact O-CB 3.29Å; L14-A18 WeakPolarHBondContact O-CB 3.35Å; L14-A18 PolarHBondContact O-N 3.35Å; A15-A18 PolarHBondContact O-N 3.07Å; A18-W21 PolarHBondContact O-N 2.77Å; A18-L22 WeakPolarHBondContact O-CB 3.29Å; A18-L22 VanDerWaalsContact O-CG 3.29Å; A18-L22 WeakPolarHBondContact O-CG 3.45Å; A18-L22 PolarHBondContact O-N 2.77Å
19I96.2Very high94.8Very high114 Ų114105.4 Ų105.459%0.58553%0.531SS*.Hα-helixtrans-62.3-43.7176.5-69.8162.8000111.2A15 R16 V17 L22 L23A15-I19 WeakPolarHBondContact O-CD1 3.33Å; A15-I19 VanDerWaalsContact O-CG1 3.24Å; A15-I19 WeakPolarHBondContact O-CG1 3.42Å; A15-I19 PolarHBondContact O-N 3.44Å; R16-I19 PolarHBondContact O-N 2.72Å; V17-I19 VanDerWaalsContact C-N 3.35Å; V17-I19 PolarHBondContact O-N 3.39Å; I19-L22 PolarHBondContact O-N 3.47Å; I19-L23 WeakPolarHBondContact O-CB 3.27Å; I19-L23 PolarHBondContact O-N 3.28Å
20V96.3Very high95.3Very high85 Ų85104.9 Ų104.952%0.51553%0.525SS..Hα-helixtrans-64.1-44.3177.7174.80000110.8R16 V17 L22 L23 E24R16-V20 WeakPolarHBondContact O-CG2 3.31Å; R16-V20 PolarHBondContact O-N 2.81Å; R16-V20 VanDerWaalsContact O-N 3.12Å; V17-V20 PolarHBondContact O-N 3.39Å; V20-L22 VanDerWaalsContact C-N 3.34Å; V20-L22 PolarHBondContact O-N 3.37Å; V20-L23 WeakPolarHBondContact O-CB 3.39Å; V20-L23 PolarHBondContact O-N 3.41Å; V20-E24 WeakPolarHBondContact O-CG 3.43Å; V20-E24 PolarHBondContact O-N 3.36Å
21W96.6Very high95.6Very high174 Ų174103.8 Ų103.866%0.65953%0.527SS*.Hα-helixtrans-61.8-40.1175.1-84.294.5000112.6V17 A18 L23 E24 L25V17-W21 PolarHBondContact O-N 3.48Å; A18-W21 PolarHBondContact O-N 2.77Å; W21-L23 VanDerWaalsContact C-N 3.35Å; W21-E24 PolarHBondContact O-N 2.73Å; W21-L25 WeakPolarHBondContact O-CB 3.22Å; W21-L25 VanDerWaalsContact O-CG 3.25Å; W21-L25 WeakPolarHBondContact O-CG 3.44Å; W21-L25 PolarHBondContact O-N 3Å
22L96.5Very high95.9Very high115 Ų115108.5 Ų108.560%0.60253%0.533SS*.Hα-helixtrans-65.5-38.1174.9-75172.9000112A18 I19 V20 W26A18-L22 WeakPolarHBondContact O-CB 3.29Å; A18-L22 VanDerWaalsContact O-CG 3.29Å; A18-L22 WeakPolarHBondContact O-CG 3.45Å; A18-L22 PolarHBondContact O-N 2.77Å; I19-L22 PolarHBondContact O-N 3.47Å; V20-L22 VanDerWaalsContact C-N 3.34Å; V20-L22 PolarHBondContact O-N 3.37Å; L22-W26 VanDerWaalsContact O-CB 3.25Å; L22-W26 WeakPolarHBondContact O-CB 3.45Å; L22-W26 PolarHBondContact O-N 3.24Å
23L96.8Very high96.1Very high101 Ų101110.3 Ų110.353%0.52954%0.539SS..Hα-helixtrans-64.5-47.5175.7-175.168.6000111I19 V20 W21 L25 W26 V27I19-L23 WeakPolarHBondContact O-CB 3.27Å; I19-L23 PolarHBondContact O-N 3.28Å; V20-L23 WeakPolarHBondContact O-CB 3.39Å; V20-L23 PolarHBondContact O-N 3.41Å; W21-L23 VanDerWaalsContact C-N 3.35Å; L23-L25 PolarHBondContact O-N 3.19Å; L23-W26 PolarHBondContact O-N 3.31Å; L23-V27 WeakPolarHBondContact O-CB 3.14Å; L23-V27 VanDerWaalsContact O-CG2 3.27Å; L23-V27 WeakPolarHBondContact O-CG2 3.28Å; L23-V27 PolarHBondContact O-N 3.18Å
24E96.2Very high96.2Very high120 Ų120107 Ų10756%0.56153%0.529SS*.Hα-helixtrans-59.6-45.4175.8-75.1-65.5139.300111.8V20 W21 W26 V27 A28V20-E24 WeakPolarHBondContact O-CG 3.43Å; V20-E24 PolarHBondContact O-N 3.36Å; W21-E24 PolarHBondContact O-N 2.73Å; E24-W26 VanDerWaalsContact C-N 3.33Å; E24-W26 PolarHBondContact O-N 3.08Å; E24-V27 PolarHBondContact O-N 3.09Å; E24-A28 VanDerWaalsContact O-CB 3.28Å; E24-A28 WeakPolarHBondContact O-CB 3.41Å; E24-A28 PolarHBondContact O-N 3.47Å
25L96.3Very high96.3Very high101 Ų101107.2 Ų107.253%0.52953%0.526SS..Hα-helixtrans-63.5-39.1175.7-73.3172.3000112W21 L23 R29W21-L25 WeakPolarHBondContact O-CB 3.22Å; W21-L25 VanDerWaalsContact O-CG 3.25Å; W21-L25 WeakPolarHBondContact O-CG 3.44Å; W21-L25 PolarHBondContact O-N 3Å; L23-L25 PolarHBondContact O-N 3.19Å; L25-R29 WeakPolarHBondContact O-CB 3.23Å; L25-R29 VanDerWaalsContact O-CG 3.28Å; L25-R29 WeakPolarHBondContact O-CG 3.42Å; L25-R29 PolarHBondContact O-N 3.45Å
26W97.4Very high96.3Very high177 Ų177109.2 Ų109.267%0.6753%0.526SS*.Hα-helixtrans-68.2-43.5178.1-169.478.4000111.5L22 L23 E24 R29 F30L22-W26 VanDerWaalsContact O-CB 3.25Å; L22-W26 WeakPolarHBondContact O-CB 3.45Å; L22-W26 PolarHBondContact O-N 3.24Å; L23-W26 PolarHBondContact O-N 3.31Å; E24-W26 VanDerWaalsContact C-N 3.33Å; E24-W26 PolarHBondContact O-N 3.08Å; W26-R29 PolarHBondContact O-N 3.31Å; W26-F30 VanDerWaalsContact O-CB 3.28Å; W26-F30 WeakPolarHBondContact O-CB 3.49Å; W26-F30 PolarHBondContact O-N 3.42Å
27V97.1Very high96.3Very high63 Ų63108.1 Ų108.138%0.38253%0.527SS..Hα-helixtrans-61.5-48.3174170.80000110.4L23 E24 R29 F30 C31L23-V27 WeakPolarHBondContact O-CB 3.14Å; L23-V27 VanDerWaalsContact O-CG2 3.27Å; L23-V27 WeakPolarHBondContact O-CG2 3.28Å; L23-V27 PolarHBondContact O-N 3.18Å; E24-V27 PolarHBondContact O-N 3.09Å; V27-R29 VanDerWaalsContact C-N 3.34Å; V27-R29 PolarHBondContact O-N 3.13Å; V27-F30 PolarHBondContact O-N 2.95Å; V27-C31 VanDerWaalsContact O-CB 3.31Å; V27-C31 WeakPolarHBondContact O-CB 3.29Å; V27-C31 PolarHBondContact O-N 3.38Å; V27-C31 PolarHBondContact O-SG 3.04Å
28A96.4Very high96.3Very high58 Ų58108.5 Ų108.548%0.47953%0.529SS..Hα-helixtrans-59.3-43.7178.100000112.1E24 Y32E24-A28 VanDerWaalsContact O-CB 3.28Å; E24-A28 WeakPolarHBondContact O-CB 3.41Å; E24-A28 PolarHBondContact O-N 3.47Å; A28-Y32 WeakPolarHBondContact O-CB 3.42Å; A28-Y32 PolarHBondContact O-N 3.3Å
29R96.3Very high96.3Very high193 Ų193111 Ų11173%0.72853%0.531SS*.Hα-helixtrans-66.2-41.3175.5-72.2-175.685147.16.9112.1L25 W26 V27 Y32 M33L25-R29 WeakPolarHBondContact O-CB 3.23Å; L25-R29 VanDerWaalsContact O-CG 3.28Å; L25-R29 WeakPolarHBondContact O-CG 3.42Å; L25-R29 PolarHBondContact O-N 3.45Å; W26-R29 PolarHBondContact O-N 3.31Å; V27-R29 VanDerWaalsContact C-N 3.34Å; V27-R29 PolarHBondContact O-N 3.13Å; R29-Y32 PolarHBondContact O-N 3.31Å; R29-M33 VanDerWaalsContact O-CG 3.23Å; R29-M33 WeakPolarHBondContact O-CG 3.46Å; R29-M33 PolarHBondContact O-N 3.44Å
30F96.7Very high96.3Very high120 Ų120107.6 Ų107.653%0.52652%0.524SS..Hα-helixtrans-63.9-47.3176.9-176.3-98000111.2W26 V27 Y32 M33 V34W26-F30 VanDerWaalsContact O-CB 3.28Å; W26-F30 WeakPolarHBondContact O-CB 3.49Å; W26-F30 PolarHBondContact O-N 3.42Å; V27-F30 PolarHBondContact O-N 2.95Å; F30-Y32 VanDerWaalsContact C-N 3.32Å; F30-Y32 PolarHBondContact O-N 3.05Å; F30-M33 PolarHBondContact O-N 3.19Å; F30-V34 HydrophobicContact CD1-CG2 4.2Å; F30-V34 HydrophobicContact CE1-CG2 3.82Å; F30-V34 HydrophobicContact CZ-CG2 4Å; F30-V34 WeakPolarHBondContact O-CG2 3.46Å; F30-V34 PolarHBondContact O-N 3.47Å
31C97.2Very high96.2Very high70 Ų70109.9 Ų109.947%0.47353%0.527SS..Hα-helixtrans-57.6-43.7174.1-72.20000111.7V27 V34 F35V27-C31 VanDerWaalsContact O-CB 3.31Å; V27-C31 WeakPolarHBondContact O-CB 3.29Å; V27-C31 PolarHBondContact O-N 3.38Å; V27-C31 PolarHBondContact O-SG 3.04Å; C31-V34 PolarHBondContact O-N 2.88Å; C31-F35 VanDerWaalsContact O-CB 3.24Å; C31-F35 WeakPolarHBondContact O-CB 3.32Å; C31-F35 PolarHBondContact O-N 3.44Å
32Y96.3Very high96.2Very high138 Ų138107 Ų10754%0.54152%0.519SS..Hα-helixtrans-62.6-44176.4-177.3-102.7000112.2A28 R29 F30 V34 F35 Q36A28-Y32 WeakPolarHBondContact O-CB 3.42Å; A28-Y32 PolarHBondContact O-N 3.3Å; R29-Y32 PolarHBondContact O-N 3.31Å; F30-Y32 VanDerWaalsContact C-N 3.32Å; F30-Y32 PolarHBondContact O-N 3.05Å; Y32-V34 PolarHBondContact O-N 3.4Å; Y32-F35 PolarHBondContact O-N 2.86Å; Y32-Q36 HydrophobicContact CD1-CG 4.21Å; Y32-Q36 HydrophobicContact CE1-CG 3.87Å; Y32-Q36 HydrophobicContact CE2-CG 4.32Å; Y32-Q36 VanDerWaalsContact CZ-NE2 3.25Å; Y32-Q36 WeakPolarHBondContact O-CB 3.24Å; Y32-Q36 WeakPolarHBondContact O-CG 3.31Å; Y32-Q36 PolarHBondContact O-N 3.39Å; Y32-Q36 PolarHBondContact OH-NE2 3.45Å
33M95.6Very high96.2Very high107 Ų107106.2 Ų106.253%0.52752%0.516SS..Hα-helixtrans-62.7-42.3176.6-70.8-68.4-69.100112.1R29 F30 K37R29-M33 VanDerWaalsContact O-CG 3.23Å; R29-M33 WeakPolarHBondContact O-CG 3.46Å; R29-M33 PolarHBondContact O-N 3.44Å; F30-M33 PolarHBondContact O-N 3.19Å; M33-K37 VanDerWaalsContact O-CG 3.25Å; M33-K37 WeakPolarHBondContact O-CG 3.46Å; M33-K37 PolarHBondContact O-N 3.28Å; M33-K37 VanDerWaalsContact O-N 3.14Å
34V96.4Very high96.1Very high68 Ų68103.2 Ų103.241%0.41251%0.51SS..Hα-helixtrans-64.4-46.8175.5172.20000110.5F30 C31 Y32 Q36 K37 V38F30-V34 HydrophobicContact CD1-CG2 4.2Å; F30-V34 HydrophobicContact CE1-CG2 3.82Å; F30-V34 HydrophobicContact CZ-CG2 4Å; F30-V34 WeakPolarHBondContact O-CG2 3.46Å; F30-V34 PolarHBondContact O-N 3.47Å; C31-V34 PolarHBondContact O-N 2.88Å; Y32-V34 PolarHBondContact O-N 3.4Å; V34-Q36 PolarHBondContact O-N 3.06Å; V34-K37 PolarHBondContact O-N 2.78Å; V34-K37 VanDerWaalsContact O-N 3.15Å; V34-V38 HydrophobicContact CG1-CG2 4.25Å; V34-V38 VanDerWaalsContact O-CG2 3.32Å; V34-V38 WeakPolarHBondContact O-CG2 3.33Å; V34-V38 PolarHBondContact O-N 2.81Å
35F96.7Very high96.1Very high116 Ų116100.9 Ų100.951%0.50950%0.501SS..Hα-helixtrans-58-49.2177.9-175-89.7000111.2C31 Y32 K37 V38 F39C31-F35 VanDerWaalsContact O-CB 3.24Å; C31-F35 WeakPolarHBondContact O-CB 3.32Å; C31-F35 PolarHBondContact O-N 3.44Å; Y32-F35 PolarHBondContact O-N 2.86Å; F35-K37 VanDerWaalsContact C-N 3.27Å; F35-K37 PolarHBondContact O-N 3.41Å; F35-V38 PolarHBondContact O-N 3.09Å; F35-V38 VanDerWaalsContact O-N 3.15Å; F35-F39 AromaticContact CD1-CD2 3.59Å; F35-F39 HydrophobicContact CD1-CD2 3.59Å; F35-F39 AromaticContact CD1-CE2 3.86Å; F35-F39 HydrophobicContact CD1-CE2 3.86Å; F35-F39 HydrophobicContact CD1-CG 4.32Å; F35-F39 AromaticContact CD2-CD2 3.91Å; F35-F39 HydrophobicContact CD2-CD2 3.91Å; F35-F39 AromaticContact CD2-CE2 3.53Å; F35-F39 HydrophobicContact CD2-CE2 3.53Å; F35-F39 HydrophobicContact CE1-CD1 4.42Å; F35-F39 AromaticContact CE1-CD2 3.42Å; F35-F39 HydrophobicContact CE1-CD2 3.42Å; F35-F39 VanDerWaalsContact CE1-CD2 3.42Å; F35-F39 HydrophobicContact CE1-CE1 4.33Å; F35-F39 AromaticContact CE1-CE2 3.37Å; F35-F39 HydrophobicContact CE1-CE2 3.37Å; F35-F39 AromaticContact CE1-CG 3.99Å; F35-F39 HydrophobicContact CE1-CG 3.99Å; F35-F39 AromaticContact CE1-CZ 3.82Å; F35-F39 HydrophobicContact CE1-CZ 3.82Å; F35-F39 AromaticContact CE2-CD2 3.79Å; F35-F39 HydrophobicContact CE2-CD2 3.79Å; F35-F39 AromaticContact CE2-CE2 3.02Å; F35-F39 HydrophobicContact CE2-CE2 3.02Å; F35-F39 AromaticContact CE2-CZ 3.62Å; F35-F39 HydrophobicContact CE2-CZ 3.62Å; F35-F39 AromaticContact CG-CD2 3.85Å; F35-F39 HydrophobicContact CG-CD2 3.85Å; F35-F39 AromaticContact CG-CE2 3.94Å; F35-F39 HydrophobicContact CG-CE2 3.94Å; F35-F39 AromaticContact CZ-CD2 3.55Å; F35-F39 HydrophobicContact CZ-CD2 3.55Å; F35-F39 HydrophobicContact CZ-CE1 4.05Å; F35-F39 AromaticContact CZ-CE2 2.93Å; F35-F39 HydrophobicContact CZ-CE2 2.93Å; F35-F39 HydrophobicContact CZ-CG 4.34Å; F35-F39 AromaticContact CZ-CZ 3.2Å; F35-F39 HydrophobicContact CZ-CZ 3.2Å; F35-F39 VanDerWaalsContact O-CD2 3.29Å; F35-F39 WeakPolarHBondContact O-CD2 3.25Å; F35-F39 PolarHBondContact O-N 3.48Å
36Q94.7Very high96Very high92 Ų92101 Ų10143%0.4350%0.501SS..Hα-helixtrans-56.1-40.7176.2-76.2-170.7-41.200112.7Y32 V34 G40Y32-Q36 HydrophobicContact CD1-CG 4.21Å; Y32-Q36 HydrophobicContact CE1-CG 3.87Å; Y32-Q36 HydrophobicContact CE2-CG 4.32Å; Y32-Q36 VanDerWaalsContact CZ-NE2 3.25Å; Y32-Q36 WeakPolarHBondContact O-CB 3.24Å; Y32-Q36 WeakPolarHBondContact O-CG 3.31Å; Y32-Q36 PolarHBondContact O-N 3.39Å; Y32-Q36 PolarHBondContact OH-NE2 3.45Å; V34-Q36 PolarHBondContact O-N 3.06Å; Q36-G40 PolarHBondContact O-N 3.46Å
37K94.4Very high96Very high157 Ų15799.8 Ų99.868%0.68350%0.503SS*.Hα-helixtrans-68.5-41.4178-70.5-74.5-179.4172.90112.3M33 V34 F35 F41M33-K37 VanDerWaalsContact O-CG 3.25Å; M33-K37 WeakPolarHBondContact O-CG 3.46Å; M33-K37 PolarHBondContact O-N 3.28Å; M33-K37 VanDerWaalsContact O-N 3.14Å; V34-K37 PolarHBondContact O-N 2.78Å; V34-K37 VanDerWaalsContact O-N 3.15Å; F35-K37 VanDerWaalsContact C-N 3.27Å; F35-K37 PolarHBondContact O-N 3.41Å; K37-F41 WeakPolarHBondContact O-CB 3.38Å; K37-F41 PolarHBondContact O-N 3.1Å
38V96.2Very high95.9Very high63 Ų63102.9 Ų102.938%0.38251%0.512SS..Hα-helixtrans-65-46177.3170.50000110.7V34 F35 F41 F42V34-V38 HydrophobicContact CG1-CG2 4.25Å; V34-V38 VanDerWaalsContact O-CG2 3.32Å; V34-V38 WeakPolarHBondContact O-CG2 3.33Å; V34-V38 PolarHBondContact O-N 2.81Å; F35-V38 PolarHBondContact O-N 3.09Å; F35-V38 VanDerWaalsContact O-N 3.15Å; V38-F41 WeakPolarHBondContact O-CB 3.46Å; V38-F41 PolarHBondContact O-N 3.01Å; V38-F42 HydrophobicContact CG1-CD2 3.63Å; V38-F42 HydrophobicContact CG1-CE2 3.38Å; V38-F42 WeakPolarHBondContact O-CD2 3.32Å; V38-F42 PolarHBondContact O-N 3.45Å
39F96Very high95.9Very high99 Ų99103.6 Ų103.643%0.43451%0.51SS..Hα-helixtrans-62.8-45.4176.6-87.4-100.8000112F35 F41 F42 D43F35-F39 AromaticContact CD1-CD2 3.59Å; F35-F39 HydrophobicContact CD1-CD2 3.59Å; F35-F39 AromaticContact CD1-CE2 3.86Å; F35-F39 HydrophobicContact CD1-CE2 3.86Å; F35-F39 HydrophobicContact CD1-CG 4.32Å; F35-F39 AromaticContact CD2-CD2 3.91Å; F35-F39 HydrophobicContact CD2-CD2 3.91Å; F35-F39 AromaticContact CD2-CE2 3.53Å; F35-F39 HydrophobicContact CD2-CE2 3.53Å; F35-F39 HydrophobicContact CE1-CD1 4.42Å; F35-F39 AromaticContact CE1-CD2 3.42Å; F35-F39 HydrophobicContact CE1-CD2 3.42Å; F35-F39 VanDerWaalsContact CE1-CD2 3.42Å; F35-F39 HydrophobicContact CE1-CE1 4.33Å; F35-F39 AromaticContact CE1-CE2 3.37Å; F35-F39 HydrophobicContact CE1-CE2 3.37Å; F35-F39 AromaticContact CE1-CG 3.99Å; F35-F39 HydrophobicContact CE1-CG 3.99Å; F35-F39 AromaticContact CE1-CZ 3.82Å; F35-F39 HydrophobicContact CE1-CZ 3.82Å; F35-F39 AromaticContact CE2-CD2 3.79Å; F35-F39 HydrophobicContact CE2-CD2 3.79Å; F35-F39 AromaticContact CE2-CE2 3.02Å; F35-F39 HydrophobicContact CE2-CE2 3.02Å; F35-F39 AromaticContact CE2-CZ 3.62Å; F35-F39 HydrophobicContact CE2-CZ 3.62Å; F35-F39 AromaticContact CG-CD2 3.85Å; F35-F39 HydrophobicContact CG-CD2 3.85Å; F35-F39 AromaticContact CG-CE2 3.94Å; F35-F39 HydrophobicContact CG-CE2 3.94Å; F35-F39 AromaticContact CZ-CD2 3.55Å; F35-F39 HydrophobicContact CZ-CD2 3.55Å; F35-F39 HydrophobicContact CZ-CE1 4.05Å; F35-F39 AromaticContact CZ-CE2 2.93Å; F35-F39 HydrophobicContact CZ-CE2 2.93Å; F35-F39 HydrophobicContact CZ-CG 4.34Å; F35-F39 AromaticContact CZ-CZ 3.2Å; F35-F39 HydrophobicContact CZ-CZ 3.2Å; F35-F39 VanDerWaalsContact O-CD2 3.29Å; F35-F39 WeakPolarHBondContact O-CD2 3.25Å; F35-F39 PolarHBondContact O-N 3.48Å; F39-F41 PolarHBondContact O-N 2.77Å; F39-F42 PolarHBondContact O-N 3.48Å; F39-F42 VanDerWaalsContact O-N 3.08Å; F39-D43 PolarHBondContact O-N 3.06Å
40G95.4Very high95.9Very high42 Ų4298.1 Ų98.143%0.43350%0.5SS..Hα-helixtrans-60.8-33.1174.900000113.3Q36 G44Q36-G40 PolarHBondContact O-N 3.46Å; G40-G44 PolarHBondContact O-N 3.4Å; G40-G44 VanDerWaalsContact O-N 3.16Å
41F95.9Very high95.8Very high134 Ų13498.8 Ų98.859%0.58850%0.5SS*.Hα-helixtrans-68.1-43.7172.6178.8-103.3000112K37 V38 F39 G44 L45K37-F41 WeakPolarHBondContact O-CB 3.38Å; K37-F41 PolarHBondContact O-N 3.1Å; V38-F41 WeakPolarHBondContact O-CB 3.46Å; V38-F41 PolarHBondContact O-N 3.01Å; F39-F41 PolarHBondContact O-N 2.77Å; F41-G44 PolarHBondContact O-N 2.86Å; F41-L45 HydrophobicContact CD1-CD1 3.77Å; F41-L45 HydrophobicContact CD1-CG 4.3Å; F41-L45 HydrophobicContact CE1-CD1 3.26Å; F41-L45 HydrophobicContact CE1-CG 3.96Å; F41-L45 HydrophobicContact CE2-CG 4.47Å; F41-L45 HydrophobicContact CZ-CD1 3.74Å; F41-L45 HydrophobicContact CZ-CD2 4.2Å; F41-L45 HydrophobicContact CZ-CG 4.04Å; F41-L45 WeakPolarHBondContact O-CG 3.28Å; F41-L45 PolarHBondContact O-N 3.43Å
42F96.2Very high95.7Very high112 Ų11298.9 Ų98.949%0.49150%0.496SS..Hα-helixtrans-63.4-41.1175-80-67.8000112.6V38 F39 G44 L45 L46V38-F42 HydrophobicContact CG1-CD2 3.63Å; V38-F42 HydrophobicContact CG1-CE2 3.38Å; V38-F42 WeakPolarHBondContact O-CD2 3.32Å; V38-F42 PolarHBondContact O-N 3.45Å; F39-F42 PolarHBondContact O-N 3.48Å; F39-F42 VanDerWaalsContact O-N 3.08Å; F42-G44 VanDerWaalsContact C-N 3.34Å; F42-G44 PolarHBondContact O-N 2.91Å; F42-L45 HydrophobicContact CD1-CD1 4.45Å; F42-L45 PolarHBondContact O-N 3.19Å; F42-L46 WeakPolarHBondContact O-CB 3.23Å; F42-L46 VanDerWaalsContact O-CG 3.28Å; F42-L46 WeakPolarHBondContact O-CG 3.25Å; F42-L46 PolarHBondContact O-N 2.94Å
43D95.2Very high95.6Very high99 Ų9997.7 Ų97.753%0.52950%0.498SS..Hα-helixtrans-59.3-45.4175.7-70.5-24.2000111F39 L45 L46 E47F39-D43 PolarHBondContact O-N 3.06Å; D43-L45 PolarHBondContact O-N 2.83Å; D43-L46 PolarHBondContact O-N 3.3Å; D43-E47 WeakPolarHBondContact O-CB 3.44Å; D43-E47 PolarHBondContact O-N 2.89Å
44G94.6Very high95.5Very high38 Ų38100.8 Ų100.839%0.39250%0.504SS..Hα-helixtrans-63.9-38.317500000113.4G40 F41 F42 F48G40-G44 PolarHBondContact O-N 3.4Å; G40-G44 VanDerWaalsContact O-N 3.16Å; F41-G44 PolarHBondContact O-N 2.86Å; F42-G44 VanDerWaalsContact C-N 3.34Å; F42-G44 PolarHBondContact O-N 2.91Å; G44-F48 WeakPolarHBondContact O-CB 3.28Å; G44-F48 PolarHBondContact O-N 2.89Å
45L96.2Very high95.3Very high72 Ų72103.7 Ų103.738%0.37751%0.508SS..Hα-helixtrans-65.2-43.6173.4-75.3179.4000112.1F41 F42 D43 F48 V49F41-L45 HydrophobicContact CD1-CD1 3.77Å; F41-L45 HydrophobicContact CD1-CG 4.3Å; F41-L45 HydrophobicContact CE1-CD1 3.26Å; F41-L45 HydrophobicContact CE1-CG 3.96Å; F41-L45 HydrophobicContact CE2-CG 4.47Å; F41-L45 HydrophobicContact CZ-CD1 3.74Å; F41-L45 HydrophobicContact CZ-CD2 4.2Å; F41-L45 HydrophobicContact CZ-CG 4.04Å; F41-L45 WeakPolarHBondContact O-CG 3.28Å; F41-L45 PolarHBondContact O-N 3.43Å; F42-L45 HydrophobicContact CD1-CD1 4.45Å; F42-L45 PolarHBondContact O-N 3.19Å; D43-L45 PolarHBondContact O-N 2.83Å; L45-F48 PolarHBondContact O-N 3.37Å; L45-V49 VanDerWaalsContact O-CG2 3.29Å; L45-V49 WeakPolarHBondContact O-CG2 3.47Å; L45-V49 PolarHBondContact O-N 3.49Å
46L96Very high94.9Very high104 Ų104102.5 Ų102.555%0.54550%0.504SS..Hα-helixtrans-65.1-41178.4-72.3174.9000111.2F42 D43 F48 V49 C50F42-L46 WeakPolarHBondContact O-CB 3.23Å; F42-L46 VanDerWaalsContact O-CG 3.28Å; F42-L46 WeakPolarHBondContact O-CG 3.25Å; F42-L46 PolarHBondContact O-N 2.94Å; D43-L46 PolarHBondContact O-N 3.3Å; L46-F48 VanDerWaalsContact C-N 3.34Å; L46-F48 PolarHBondContact O-N 3.38Å; L46-V49 PolarHBondContact O-N 3.3Å; L46-C50 VanDerWaalsContact O-CB 3.23Å; L46-C50 WeakPolarHBondContact O-CB 3.4Å; L46-C50 PolarHBondContact O-N 3.3Å; L46-C50 PolarHBondContact O-SG 3.06Å
47E96Very high94.7Very high151 Ų151101 Ų10171%0.70651%0.506SS*.Hα-helixtrans-60.4-44.8173.9-173.2175.6-174.200111.3D43 C50 Y51D43-E47 WeakPolarHBondContact O-CB 3.44Å; D43-E47 PolarHBondContact O-N 2.89Å; E47-C50 PolarHBondContact O-N 3.25Å; E47-Y51 WeakPolarHBondContact O-CB 3.28Å; E47-Y51 PolarHBondContact O-N 2.84Å
48F95.8Very high94.3Very high127 Ų12799.1 Ų99.156%0.55750%0.495SS*.Hα-helixtrans-63-45176.7-177.5-105.8000112.6G44 L45 L46 Y51 L52G44-F48 WeakPolarHBondContact O-CB 3.28Å; G44-F48 PolarHBondContact O-N 2.89Å; L45-F48 PolarHBondContact O-N 3.37Å; L46-F48 VanDerWaalsContact C-N 3.34Å; L46-F48 PolarHBondContact O-N 3.38Å; F48-Y51 WeakPolarHBondContact O-CB 3.43Å; F48-Y51 PolarHBondContact O-N 3.2Å; F48-L52 HydrophobicContact CD1-CD1 4.17Å; F48-L52 HydrophobicContact CE1-CD1 3.63Å; F48-L52 HydrophobicContact CE1-CG 4.31Å; F48-L52 HydrophobicContact CZ-CD1 4Å; F48-L52 HydrophobicContact CZ-CD2 4.46Å; F48-L52 HydrophobicContact CZ-CG 4.35Å; F48-L52 WeakPolarHBondContact O-CG 3.41Å; F48-L52 PolarHBondContact O-N 3.45Å
49V96.2Very high93.7Very high74 Ų74100.4 Ų100.445%0.44850%0.496SS..Hα-helixtrans-63.4-45.1176.4171.50000110.9L45 L46 Y51 L52 L53L45-V49 VanDerWaalsContact O-CG2 3.29Å; L45-V49 WeakPolarHBondContact O-CG2 3.47Å; L45-V49 PolarHBondContact O-N 3.49Å; L46-V49 PolarHBondContact O-N 3.3Å; V49-Y51 VanDerWaalsContact C-N 3.28Å; V49-Y51 PolarHBondContact O-N 2.81Å; V49-L52 PolarHBondContact O-N 3.08Å; V49-L53 HydrophobicContact CG1-CD1 4.1Å; V49-L53 HydrophobicContact CG1-CG 4.43Å; V49-L53 WeakPolarHBondContact O-CG 3.4Å; V49-L53 PolarHBondContact O-N 3.36Å
50C95.7Very high93.1Very high78 Ų78100.2 Ų100.253%0.52750%0.503SS..Hα-helixtrans-58.8-39.1174.3-79.30000112.1L46 E47 L53 R54L46-C50 VanDerWaalsContact O-CB 3.23Å; L46-C50 WeakPolarHBondContact O-CB 3.4Å; L46-C50 PolarHBondContact O-N 3.3Å; L46-C50 PolarHBondContact O-SG 3.06Å; E47-C50 PolarHBondContact O-N 3.25Å; C50-L53 PolarHBondContact O-N 2.88Å; C50-R54 WeakPolarHBondContact O-CB 3.47Å; C50-R54 PolarHBondContact O-N 3.15Å
51Y95.3Very high92.4Very high133 Ų133103.8 Ų103.852%0.52251%0.511SS..Hα-helixtrans-62.6-44.2175.2175.3-99.3000112.2E47 F48 V49 R54 R55E47-Y51 WeakPolarHBondContact O-CB 3.28Å; E47-Y51 PolarHBondContact O-N 2.84Å; F48-Y51 WeakPolarHBondContact O-CB 3.43Å; F48-Y51 PolarHBondContact O-N 3.2Å; V49-Y51 VanDerWaalsContact C-N 3.28Å; V49-Y51 PolarHBondContact O-N 2.81Å; Y51-R54 PolarHBondContact O-N 2.91Å; Y51-R55 WeakPolarHBondContact O-CB 3.44Å; Y51-R55 PolarHBondContact O-N 3.15Å
52L94.5Very high91.5Very high72 Ų72105.1 Ų105.138%0.37752%0.519SS..Hα-helixtrans-64.4-46.3175.9-66.5179.7000111.8F48 V49 R54 R55 E56F48-L52 HydrophobicContact CD1-CD1 4.17Å; F48-L52 HydrophobicContact CE1-CD1 3.63Å; F48-L52 HydrophobicContact CE1-CG 4.31Å; F48-L52 HydrophobicContact CZ-CD1 4Å; F48-L52 HydrophobicContact CZ-CD2 4.46Å; F48-L52 HydrophobicContact CZ-CG 4.35Å; F48-L52 WeakPolarHBondContact O-CG 3.41Å; F48-L52 PolarHBondContact O-N 3.45Å; V49-L52 PolarHBondContact O-N 3.08Å; L52-R54 VanDerWaalsContact C-N 3.33Å; L52-R54 PolarHBondContact O-N 3.26Å; L52-R55 VanDerWaalsContact O-CB 3.31Å; L52-R55 WeakPolarHBondContact O-CB 3.27Å; L52-R55 PolarHBondContact O-N 2.94Å; L52-R55 VanDerWaalsContact O-N 3.1Å; L52-E56 PolarHBondContact O-N 2.94Å
53L94.8Very high90.4Very high114 Ų114106.8 Ų106.860%0.59753%0.528SS*.Hα-helixtrans-60.8-42.8176.6-71.9174.9000111.7V49 C50 R55 E56 A57V49-L53 HydrophobicContact CG1-CD1 4.1Å; V49-L53 HydrophobicContact CG1-CG 4.43Å; V49-L53 WeakPolarHBondContact O-CG 3.4Å; V49-L53 PolarHBondContact O-N 3.36Å; C50-L53 PolarHBondContact O-N 2.88Å; L53-R55 VanDerWaalsContact C-N 3.27Å; L53-R55 PolarHBondContact O-N 3.48Å; L53-E56 PolarHBondContact O-N 3.16Å; L53-A57 VanDerWaalsContact O-CB 3.27Å; L53-A57 WeakPolarHBondContact O-CB 3.25Å; L53-A57 PolarHBondContact O-N 2.86Å
54R93.9Very high88.9Confident172 Ų172108.8 Ų108.865%0.64953%0.534SS*.Hα-helixtrans-63.2-35.5175.6-171.1173.8-173.7176.72.1111.6C50 Y51 L52 R58C50-R54 WeakPolarHBondContact O-CB 3.47Å; C50-R54 PolarHBondContact O-N 3.15Å; Y51-R54 PolarHBondContact O-N 2.91Å; L52-R54 VanDerWaalsContact C-N 3.33Å; L52-R54 PolarHBondContact O-N 3.26Å; R54-R58 WeakPolarHBondContact O-CG 3.42Å; R54-R58 PolarHBondContact O-N 2.98Å; R54-R58 VanDerWaalsContact O-N 3.09Å
55R91.3Very high87.7Confident129 Ų129112.7 Ų112.749%0.48755%0.55SS.*Hα-helixtrans-63.4-47.6175.1-175.2-178.8-176.4-176.40.1111.2Y51 L52 L53 K59Y51-R55 WeakPolarHBondContact O-CB 3.44Å; Y51-R55 PolarHBondContact O-N 3.15Å; L52-R55 VanDerWaalsContact O-CB 3.31Å; L52-R55 WeakPolarHBondContact O-CB 3.27Å; L52-R55 PolarHBondContact O-N 2.94Å; L52-R55 VanDerWaalsContact O-N 3.1Å; L53-R55 VanDerWaalsContact C-N 3.27Å; L53-R55 PolarHBondContact O-N 3.48Å; R55-K59 PolarHBondContact O-N 3.25Å
56E89.4Confident86.5Confident91 Ų91115.1 Ų115.143%0.42556%0.562SS.*Hα-helixtrans-70.5-39.7178.8-61.6-4913100112L52 L53 R58 K59 V60L52-E56 PolarHBondContact O-N 2.94Å; L53-E56 PolarHBondContact O-N 3.16Å; E56-R58 VanDerWaalsContact C-N 3.29Å; E56-R58 PolarHBondContact O-N 3.46Å; E56-K59 WeakPolarHBondContact O-CB 3.29Å; E56-K59 PolarHBondContact O-N 3.27Å; E56-K59 IonicContact OE1-NZ 2.86Å; E56-K59 PolarHBondContact OE1-NZ 3.38Å; E56-K59 WeakPolarHBondContact OE2-CD 3.35Å; E56-K59 IonicContact OE2-NZ 2.77Å; E56-K59 PolarHBondContact OE2-NZ 3.2Å; E56-V60 PolarHBondContact O-N 2.9Å
57A89.2Confident85.4Confident59 Ų59121.4 Ų121.449%0.48858%0.579SS.*Hα-helixtrans-58.6-38.7175.700000112.5L53 K59 V60 L61L53-A57 VanDerWaalsContact O-CB 3.27Å; L53-A57 WeakPolarHBondContact O-CB 3.25Å; L53-A57 PolarHBondContact O-N 2.86Å; A57-K59 VanDerWaalsContact C-N 3.34Å; A57-K59 PolarHBondContact O-N 3Å; A57-V60 PolarHBondContact O-N 2.84Å; A57-L61 WeakPolarHBondContact O-CB 3.5Å; A57-L61 PolarHBondContact O-N 3.38Å
58R86.5Confident84.1Confident119 Ų119123.1 Ų123.145%0.44958%0.58SS.*Hα-helixtrans-62.1-40.7174.4-78.5-171.1-65.9-137.10.3112.4R54 E56 L61 Q62R54-R58 WeakPolarHBondContact O-CG 3.42Å; R54-R58 PolarHBondContact O-N 2.98Å; R54-R58 VanDerWaalsContact O-N 3.09Å; E56-R58 VanDerWaalsContact C-N 3.29Å; E56-R58 PolarHBondContact O-N 3.46Å; R58-L61 PolarHBondContact O-N 3.21Å; R58-Q62 WeakPolarHBondContact O-CG 3.37Å; R58-Q62 PolarHBondContact O-N 2.86Å
59K84.7Confident83Confident89 Ų89123 Ų12339%0.38759%0.59SS.*Hα-helixtrans-63.6-43.9176.2-64179.7-168.2157.60110.8R55 E56 A57 Q62 H63R55-K59 PolarHBondContact O-N 3.25Å; E56-K59 WeakPolarHBondContact O-CB 3.29Å; E56-K59 PolarHBondContact O-N 3.27Å; E56-K59 IonicContact OE1-NZ 2.86Å; E56-K59 PolarHBondContact OE1-NZ 3.38Å; E56-K59 WeakPolarHBondContact OE2-CD 3.35Å; E56-K59 IonicContact OE2-NZ 2.77Å; E56-K59 PolarHBondContact OE2-NZ 3.2Å; A57-K59 VanDerWaalsContact C-N 3.34Å; A57-K59 PolarHBondContact O-N 3Å; K59-Q62 PolarHBondContact O-N 3.33Å; K59-H63 PolarHBondContact O-N 2.99Å; K59-H63 VanDerWaalsContact O-N 3.09Å; K59-H63 PolarHBondContact O-ND1 3.41Å
60V83.4Confident82.1Confident96 Ų96127 Ų12758%0.58261%0.608SS**Hα-helixtrans-64.3-42.7178.6176.70000111.3E56 A57 Q62 H63 Q64E56-V60 PolarHBondContact O-N 2.9Å; A57-V60 PolarHBondContact O-N 2.84Å; V60-Q62 VanDerWaalsContact C-N 3.34Å; V60-Q62 PolarHBondContact O-N 3.49Å; V60-H63 PolarHBondContact O-N 2.82Å; V60-Q64 PolarHBondContact O-N 2.77Å
61L79.9Confident81.1Confident117 Ų117129.9 Ų129.961%0.61362%0.617SS**Hα-helixtrans-62.3-41.1178.1-174.665.2000111.9A57 R58 H63 Q64A57-L61 WeakPolarHBondContact O-CB 3.5Å; A57-L61 PolarHBondContact O-N 3.38Å; R58-L61 PolarHBondContact O-N 3.21Å; L61-H63 VanDerWaalsContact C-N 3.31Å; L61-H63 PolarHBondContact O-N 2.93Å; L61-Q64 WeakPolarHBondContact O-CB 3.48Å; L61-Q64 PolarHBondContact O-N 3.14Å
62Q77Confident80.2Confident161 Ų161129.1 Ų129.175%0.75263%0.629SS**Hα-helixtrans-67.8-29.9176.2-72.1174.2-15.800113.1R58 K59 V60 Q64R58-Q62 WeakPolarHBondContact O-CG 3.37Å; R58-Q62 PolarHBondContact O-N 2.86Å; K59-Q62 PolarHBondContact O-N 3.33Å; V60-Q62 VanDerWaalsContact C-N 3.34Å; V60-Q62 PolarHBondContact O-N 3.49Å; Q62-Q64 PolarHBondContact O-N 3.18Å
63H72.5Confident79.3Confident147 Ų147130.5 Ų130.568%0.68164%0.636SS**THydrogen-bonded Turntrans-78.4-0.8174.2-77.583.7000113.6K59 V60 L61 V65K59-H63 PolarHBondContact O-N 2.99Å; K59-H63 VanDerWaalsContact O-N 3.09Å; K59-H63 PolarHBondContact O-ND1 3.41Å; V60-H63 PolarHBondContact O-N 2.82Å; L61-H63 VanDerWaalsContact C-N 3.31Å; L61-H63 PolarHBondContact O-N 2.93Å; H63-V65 WeakPolarHBondContact O-CG2 3.24Å; H63-V65 PolarHBondContact O-N 3.41Å
64Q64.3Low78.5Confident142 Ų142128.4 Ų128.466%0.66463%0.631SS**  trans-67.883.7163-66.3-164.64.200107.9V60 L61 Q62 I66V60-Q64 PolarHBondContact O-N 2.77Å; L61-Q64 WeakPolarHBondContact O-CB 3.48Å; L61-Q64 PolarHBondContact O-N 3.14Å; Q62-Q64 PolarHBondContact O-N 3.18Å; Q64-I66 PolarHBondContact O-N 3.38Å; Q64-I66 VanDerWaalsContact O-N 3.08Å
65V68.6Low77.8Confident120 Ų120125.4 Ų125.473%0.72763%0.634SS**  trans-54.5117169-154.80000105H63 R67H63-V65 WeakPolarHBondContact O-CG2 3.24Å; H63-V65 PolarHBondContact O-N 3.41Å; V65-R67 VanDerWaalsContact C-N 3.3Å; V65-R67 PolarHBondContact O-N 2.83Å
66I72Confident77.4Confident122 Ų122123.6 Ų123.663%0.62664%0.636SS**  trans-51.7103.7171.1-65.8168.8000105.4Q64 Y68Q64-I66 PolarHBondContact O-N 3.38Å; Q64-I66 VanDerWaalsContact O-N 3.08Å; I66-Y68 VanDerWaalsContact C-N 3.33Å; I66-Y68 HydrophobicContact CB-CE2 4.44Å; I66-Y68 HydrophobicContact CG2-CD1 4.4Å; I66-Y68 HydrophobicContact CG2-CD2 4.47Å; I66-Y68 HydrophobicContact CG2-CE1 4.08Å; I66-Y68 HydrophobicContact CG2-CE2 4.16Å; I66-Y68 WeakPolarHBondContact O-CD2 3.31Å; I66-Y68 PolarHBondContact O-N 2.84Å
67R72Confident77Confident236 Ų236120.9 Ų120.989%0.89163%0.628SS**  trans-73.999.2174.9-64.4-162.9-164.3-167.56.5105.1V65 V69V65-R67 VanDerWaalsContact C-N 3.3Å; V65-R67 PolarHBondContact O-N 2.83Å; R67-V69 PolarHBondContact O-N 3.4Å
68Y68.5Low76.7Confident187 Ų187121.9 Ų121.973%0.73363%0.625SS**  trans-60.2130.8164.1-63.6-79.8000106.9I66 D70I66-Y68 VanDerWaalsContact C-N 3.33Å; I66-Y68 HydrophobicContact CB-CE2 4.44Å; I66-Y68 HydrophobicContact CG2-CD1 4.4Å; I66-Y68 HydrophobicContact CG2-CD2 4.47Å; I66-Y68 HydrophobicContact CG2-CE1 4.08Å; I66-Y68 HydrophobicContact CG2-CE2 4.16Å; I66-Y68 WeakPolarHBondContact O-CD2 3.31Å; I66-Y68 PolarHBondContact O-N 2.84Å; Y68-D70 PolarHBondContact O-N 3.45Å
69V74.1Confident76.6Confident125 Ų125122.6 Ų122.676%0.75863%0.633SS**  trans-58.1133.6170.2-179.90000106.6R67 I71R67-V69 PolarHBondContact O-N 3.4Å; V69-I71 VanDerWaalsContact C-N 3.33Å; V69-I71 WeakPolarHBondContact O-CG1 3.14Å; V69-I71 PolarHBondContact O-N 2.95Å
70D76.3Confident76.5Confident157 Ų157126.9 Ų126.984%0.8465%0.647SS**  trans-60.998.7174.8-64.7-53.7000108.2Y68 P72Y68-D70 PolarHBondContact O-N 3.45Å; D70-P72 WeakPolarHBondContact O-CD 3.29Å
71I75Confident76.4Confident140 Ų140124.9 Ų124.972%0.71863%0.633SS**PPolyproline II helixtrans-72.3121.4176.1-56.3170.9000105.7V69 L73V69-I71 VanDerWaalsContact C-N 3.33Å; V69-I71 WeakPolarHBondContact O-CG1 3.14Å; V69-I71 PolarHBondContact O-N 2.95Å; I71-L73 PolarHBondContact O-N 2.98Å; I71-L73 VanDerWaalsContact O-N 3.1Å
72P75.5Confident76.5Confident117 Ų117124 Ų12476%0.7663%0.632SS**PPolyproline II helixtrans-61120.9176.525.2-32.5000108.5D70D70-P72 WeakPolarHBondContact O-CD 3.29Å
73L75.3Confident77Confident101 Ų101122.6 Ų122.653%0.52963%0.628SS.*PPolyproline II helixtrans-59.4150173-78109.6000109.8I71 D78 L81I71-L73 PolarHBondContact O-N 2.98Å; I71-L73 VanDerWaalsContact O-N 3.1Å; L73-D78 HydrophobicContact CB-CB 4.38Å; L73-L81 HydrophobicContact CD2-CD1 3.69Å
74S79.5Confident77.4Confident70 Ų70120.5 Ų120.549%0.4962%0.622SS.*PPolyproline II helixtrans-59.2138.3171.370.10000108.9V76 S77 D78S74-V76 PolarHBondContact O-N 3.44Å; S74-S77 PolarHBondContact N-OG 3.47Å; S74-S77 PolarHBondContact O-N 2.92Å; S74-S77 PolarHBondContact O-OG 3.2Å; S74-S77 PolarHBondContact OG-OG 2.94Å; S74-S77 VanDerWaalsContact OG-OG 3.05Å; S74-D78 PolarHBondContact O-N 2.88Å; S74-D78 VanDerWaalsContact O-N 3.15Å
75P78.8Confident78.1Confident109 Ų109126.1 Ų126.171%0.70864%0.637SS**Hα-helixtrans-58.2-29.9-170.420.8-33.1000112.8Q79P75-Q79 PolarHBondContact O-N 3.12Å; P75-Q79 VanDerWaalsContact O-N 3.1Å
76V83.4Confident78.8Confident90 Ų90129.9 Ų129.955%0.54564%0.638SS.*Hα-helixtrans-66.7-41.9175.9-178.40000111.9S74 R80S74-V76 PolarHBondContact O-N 3.44Å; V76-R80 WeakPolarHBondContact O-CG 3.49Å; V76-R80 PolarHBondContact O-N 3.38Å
77S79.4Confident79.1Confident35 Ų35130.7 Ų130.725%0.24564%0.637CS.*Hα-helixtrans-69.8-38.2178.964.20000111.9S74 R80 L81S74-S77 PolarHBondContact N-OG 3.47Å; S74-S77 PolarHBondContact O-N 2.92Å; S74-S77 PolarHBondContact O-OG 3.2Å; S74-S77 PolarHBondContact OG-OG 2.94Å; S74-S77 VanDerWaalsContact OG-OG 3.05Å; S77-R80 PolarHBondContact O-N 2.84Å; S77-L81 VanDerWaalsContact O-CG 3.28Å; S77-L81 WeakPolarHBondContact O-CG 3.48Å; S77-L81 PolarHBondContact O-N 3.21Å
78D83.1Confident79.5Confident79 Ų79125.4 Ų125.442%0.42263%0.625SS.*Hα-helixtrans-66.2-40.7177.8-168.644.9000112.6L73 S74 R80 L81 T82L73-D78 HydrophobicContact CB-CB 4.38Å; S74-D78 PolarHBondContact O-N 2.88Å; S74-D78 VanDerWaalsContact O-N 3.15Å; D78-R80 PolarHBondContact O-N 2.95Å; D78-L81 PolarHBondContact O-N 2.88Å; D78-T82 PolarHBondContact O-N 3.49Å; D78-T82 PolarHBondContact O-OG1 3.18Å
79Q85.3Confident80Confident134 Ų134123.2 Ų123.263%0.62663%0.625SS**Hα-helixtrans-60.6-44.6173.8-173.5-177.7-5.300111.7P75 L81 T82 I83P75-Q79 PolarHBondContact O-N 3.12Å; P75-Q79 VanDerWaalsContact O-N 3.1Å; Q79-L81 VanDerWaalsContact C-N 3.35Å; Q79-L81 PolarHBondContact O-N 3.37Å; Q79-T82 PolarHBondContact O-N 3.35Å; Q79-I83 WeakPolarHBondContact O-CG1 3.39Å; Q79-I83 PolarHBondContact O-N 2.87Å
80R82.9Confident80.1Confident180 Ų180123.2 Ų123.268%0.67963%0.626SS**Hα-helixtrans-62.6-42.4176.5-71.6-175.8-176.5-132.72.8111.5V76 S77 D78 T82 I83 L84V76-R80 WeakPolarHBondContact O-CG 3.49Å; V76-R80 PolarHBondContact O-N 3.38Å; S77-R80 PolarHBondContact O-N 2.84Å; D78-R80 PolarHBondContact O-N 2.95Å; R80-T82 VanDerWaalsContact C-N 3.32Å; R80-T82 PolarHBondContact O-N 3.32Å; R80-I83 PolarHBondContact O-N 3.37Å; R80-L84 WeakPolarHBondContact O-CG 3.48Å; R80-L84 PolarHBondContact O-N 3.37Å
81L80.5Confident79.8Confident54 Ų54121.8 Ų121.828%0.28362%0.617SS.*Hα-helixtrans-66.7-32.2179.1-72.9170.1000113L73 S77 D78 Q79 I83 L84 K87L73-L81 HydrophobicContact CD2-CD1 3.69Å; S77-L81 VanDerWaalsContact O-CG 3.28Å; S77-L81 WeakPolarHBondContact O-CG 3.48Å; S77-L81 PolarHBondContact O-N 3.21Å; D78-L81 PolarHBondContact O-N 2.88Å; Q79-L81 VanDerWaalsContact C-N 3.35Å; Q79-L81 PolarHBondContact O-N 3.37Å; L81-I83 VanDerWaalsContact C-N 3.32Å; L81-L84 PolarHBondContact O-N 3.02Å; L81-K87 WeakPolarHBondContact O-CE 3.27Å
82T83.1Confident79.8Confident99 Ų99120.2 Ų120.261%0.60761%0.61SS**Hα-helixtrans-67.7-33.4177.8-60.70000112.1D78 Q79 R80D78-T82 PolarHBondContact O-N 3.49Å; D78-T82 PolarHBondContact O-OG1 3.18Å; Q79-T82 PolarHBondContact O-N 3.35Å; R80-T82 VanDerWaalsContact C-N 3.32Å; R80-T82 PolarHBondContact O-N 3.32Å
83I87.5Confident79.5Confident130 Ų130120 Ų12067%0.66760%0.602SS**Hα-helixtrans-73.1-31.2177.3-60.6163.9000111.2Q79 R80 L81 R85Q79-I83 WeakPolarHBondContact O-CG1 3.39Å; Q79-I83 PolarHBondContact O-N 2.87Å; R80-I83 PolarHBondContact O-N 3.37Å; L81-I83 VanDerWaalsContact C-N 3.32Å; I83-R85 PolarHBondContact O-N 2.95Å
84L79.5Confident79.2Confident104 Ų104121.7 Ų121.755%0.54561%0.612SS.*  trans-77.1111.4-179.7-65.2175.1000111.2R80 L81 R86R80-L84 WeakPolarHBondContact O-CG 3.48Å; R80-L84 PolarHBondContact O-N 3.37Å; L81-L84 PolarHBondContact O-N 3.02Å; L84-R86 PolarHBondContact O-N 3.48Å; L84-R86 VanDerWaalsContact O-N 3.13Å
85R80.7Confident78.5Confident259 Ų259125.2 Ų125.298%0.97762%0.62SS**SBendtrans-57.9-24.9177.9-95.2-171.5170.2-170.4-1.9114.8I83I83-R85 PolarHBondContact O-N 2.95Å
86R81.7Confident77.5Confident199 Ų199124 Ų12475%0.75161%0.611SS**  trans-130.6115.4-178.3-166.2-172.8-68.7-172.4-2.7109.6L84 I88L84-R86 PolarHBondContact O-N 3.48Å; L84-R86 VanDerWaalsContact O-N 3.13Å; R86-I88 HydrophobicContact CG-CD1 4.29Å; R86-I88 HydrophobicContact CG-CG1 3.91Å; R86-I88 PolarHBondContact O-N 3.25Å
87K79.4Confident76.4Confident139 Ų139126.7 Ų126.760%0.60462%0.622SS**  trans-95.689.3179.6-58.5179.2-177.2-1730108.7L81L81-K87 WeakPolarHBondContact O-CE 3.27Å
88I80.3Confident75.4Confident125 Ų125130.8 Ų130.864%0.64164%0.639SS**  trans-97.4110.5171.6-55.1178.9000107R86 V90R86-I88 HydrophobicContact CG-CD1 4.29Å; R86-I88 HydrophobicContact CG-CG1 3.91Å; R86-I88 PolarHBondContact O-N 3.25Å; I88-V90 HydrophobicContact CG2-CG2 3.99Å
89L79Confident74Confident141 Ų141132.6 Ų132.674%0.73865%0.645SS**  trans-100.7111.8168.5179.567.6000107.6L91L89-L91 HydrophobicContact CD2-CD1 4.04Å; L89-L91 HydrophobicContact CD2-CD2 4.46Å; L89-L91 HydrophobicContact CD2-CG 4.04Å; L89-L91 HydrophobicContact CG-CD1 4.5Å; L89-L91 HydrophobicContact CG-CG 4.13Å
90V75.2Confident72.4Confident126 Ų126130.9 Ų130.976%0.76465%0.648SS**  trans-94.4108.2168.2-1760000106.2I88I88-V90 HydrophobicContact CG2-CG2 3.99Å
91L71.4Confident71.1Confident126 Ų126130.6 Ų130.666%0.6665%0.654SS**  trans-82.8111.7172.5-79.3149.1000107.5L89 L93L89-L91 HydrophobicContact CD2-CD1 4.04Å; L89-L91 HydrophobicContact CD2-CD2 4.46Å; L89-L91 HydrophobicContact CD2-CG 4.04Å; L89-L91 HydrophobicContact CG-CD1 4.5Å; L89-L91 HydrophobicContact CG-CG 4.13Å; L91-L93 PolarHBondContact O-N 3.01Å
92D74.9Confident69.8Low107 Ų107132 Ų13257%0.57266%0.659SS**  trans-80.5111.1166.3-172.19.3000108.3D94D92-D94 PolarHBondContact OD1-N 3.42Å
93L69.7Low68.3Low113 Ų113133.5 Ų133.559%0.59266%0.663SS**  trans-96.7-11.6-178-70.1172.8000112.2L91 E95 T96L91-L93 PolarHBondContact O-N 3.01Å; L93-E95 VanDerWaalsContact C-N 3.32Å; L93-E95 PolarHBondContact O-N 3.07Å; L93-T96 PolarHBondContact O-N 3.49Å; L93-T96 PolarHBondContact O-OG1 3.37Å
94D67.6Low66.6Low137 Ų137130.9 Ų130.973%0.73367%0.668SS**THydrogen-bonded Turntrans-67.4-31.8-167.2-70.6-12.1000112.2D92D92-D94 PolarHBondContact OD1-N 3.42Å
95E64.5Low64.9Low143 Ų143131.1 Ų131.167%0.66867%0.669SS**THydrogen-bonded Turntrans-82.1-19-179.6-60-162.8165.600113.9L93L93-E95 VanDerWaalsContact C-N 3.32Å; L93-E95 PolarHBondContact O-N 3.07Å
96T59.1Low63Low83 Ų83125.3 Ų125.351%0.50966%0.662SS.*THydrogen-bonded Turntrans-94.9-20.2-173.364.60000114.2L93 I98L93-T96 PolarHBondContact O-N 3.49Å; L93-T96 PolarHBondContact O-OG1 3.37Å; T96-I98 VanDerWaalsContact C-N 3.28Å; T96-I98 PolarHBondContact O-N 2.93Å
97L59.6Low61.1Low148 Ų148124.9 Ų124.978%0.77566%0.66SS**THydrogen-bonded Turntrans-66.7-29.7-178.7-164.481.1000112.4
98I59.2Low59.6Low120 Ų120123.7 Ų123.762%0.61567%0.667SS**THydrogen-bonded Turntrans-100.3-6.9-177.455.2166.8000114.5T96T96-I98 VanDerWaalsContact C-N 3.28Å; T96-I98 PolarHBondContact O-N 2.93Å
99H53.3Low57.9Low117 Ų117126.8 Ų126.854%0.54268%0.681SS.*THydrogen-bonded Turntrans-105.5-22.9-174.8-76.9-1.4000114.8H101 H102H99-H101 VanDerWaalsContact C-N 3.34Å; H99-H101 PolarHBondContact O-N 2.95Å; H99-H102 PolarHBondContact O-N 3.44Å
100S52.4Low56.4Low99 Ų99126.3 Ų126.369%0.69268%0.684SS**THydrogen-bonded Turntrans-73-24.4174.963.10000113.7H102S100-H102 VanDerWaalsContact C-N 3.32Å; S100-H102 PolarHBondContact O-N 3.09Å
101H54.8Low55.1Low174 Ų174128.9 Ų128.981%0.80669%0.685SS**THydrogen-bonded Turntrans-76.4-15.1178.3-164.4-83.9000113.4H99H99-H101 VanDerWaalsContact C-N 3.34Å; H99-H101 PolarHBondContact O-N 2.95Å
102H52.1Low54.3Low82 Ų82129.9 Ų129.938%0.3870%0.698SS.*THydrogen-bonded Turntrans-108.8-11.7-177.9-153.673.5000115.1H99 S100 G104 I105 R107H99-H102 PolarHBondContact O-N 3.44Å; S100-H102 VanDerWaalsContact C-N 3.32Å; S100-H102 PolarHBondContact O-N 3.09Å; H102-G104 PolarHBondContact O-N 2.87Å; H102-G104 VanDerWaalsContact O-N 3.13Å; H102-I105 PolarHBondContact O-N 3.19Å; H102-R107 PolarHBondContact NE2-NH2 3.4Å
103D52Low53.3Low131 Ų131128 Ų12870%0.70171%0.705SS**THydrogen-bonded Turntrans-83.520.1-178.1-79.6-13.8000114.8
104G53.5Low52.6Low75 Ų75127.7 Ų127.777%0.77371%0.708SS**THydrogen-bonded Turntrans-75.9-7.615900000113.4H102H102-G104 PolarHBondContact O-N 2.87Å; H102-G104 VanDerWaalsContact O-N 3.13Å
105I41.9Very low51.5Low110 Ų110126.4 Ų126.456%0.56471%0.707SS**SBendtrans-127.198.6-174.7-57.6174.7000109.6H102 R107H102-I105 PolarHBondContact O-N 3.19Å; I105-R107 PolarHBondContact O-N 3.35Å
106V42.3Very low51.1Low136 Ų136124 Ų12482%0.82470%0.704SS**  trans-20.197.9159.4-177.40000112
107R41.3Very low50.9Low190 Ų190127.8 Ų127.872%0.71772%0.721SS**  trans-98.1117.6160.8-71.7-173.4-175.3-102.83.8107.7H102 I105H102-R107 PolarHBondContact NE2-NH2 3.4Å; I105-R107 PolarHBondContact O-N 3.35Å
108P47.9Very low50.5Low115 Ų115128 Ų12875%0.74772%0.716SS**  trans-61.9144.6176.826.1-31.3000109.4V110P108-V110 PolarHBondContact O-N 3.15Å
109M44.5Very low49.8Very low190 Ų190128.2 Ų128.294%0.93672%0.717SS**  trans-28126.8178.8-75.7-179.417800113.6
110V48.4Very low49.2Very low130 Ų130129.6 Ų129.679%0.78873%0.727SS**  trans-51.2139.7167.3-1670000109.1P108P108-V110 PolarHBondContact O-N 3.15Å
111K46.2Very low48.6Very low181 Ų181134.7 Ų134.779%0.78773%0.731SS**  trans-40.2142.1-174-81.9171.8171172.90114G113K111-G113 PolarHBondContact O-N 3.45Å
112P54.3Low48.1Very low146 Ų146131.6 Ų131.695%0.94874%0.736SS**THydrogen-bonded Turntrans-74.366.4-175.532.7-37000112.6
113G54.7Low47.2Very low68 Ų68129.6 Ų129.670%0.70174%0.737SS**THydrogen-bonded Turntrans-147-12.5-179.200000115.7K111K111-G113 PolarHBondContact O-N 3.45Å
114T54.4Low47.3Very low107 Ų107129.9 Ų129.966%0.65675%0.746SS**SBendtrans-91.7122.2171.922.50000109.8
115P45.7Very low47Very low109 Ų109133.7 Ų133.771%0.70874%0.744SS**PPolyproline II helixtrans-64.8128.9178.226-31.8000109.4D117P115-D117 PolarHBondContact O-N 3.2Å
116P55.5Low47.2Very low94 Ų94135 Ų13561%0.6175%0.751SS**PPolyproline II helixtrans-70.7125.8176.826-31.3000110.2F118 I119P116-F118 PolarHBondContact O-N 2.95Å; P116-F118 VanDerWaalsContact O-N 3.07Å; P116-I119 HydrophobicContact CG-CG1 4.27Å
117D54Low47.5Very low162 Ų162136.4 Ų136.487%0.86675%0.753SS**SBendtrans-63-14.4-177.6-79.2-25.1000114P115P115-D117 PolarHBondContact O-N 3.2Å
118F53.1Low47.7Very low153 Ų153134.7 Ų134.767%0.67175%0.753SS**  trans-156.6124.917051.8-83.6000111P116 L120P116-F118 PolarHBondContact O-N 2.95Å; P116-F118 VanDerWaalsContact O-N 3.07Å; F118-L120 HydrophobicContact CD2-CD1 3.82Å; F118-L120 HydrophobicContact CD2-CG 3.98Å; F118-L120 HydrophobicContact CE2-CD1 3.63Å; F118-L120 HydrophobicContact CE2-CG 4.31Å; F118-L120 PolarHBondContact O-N 3.29Å
119I44Very low47.8Very low123 Ų123133.4 Ų133.463%0.63175%0.747SS**  trans-86.598.4170.6-56.3172.6000107.1P116 R121P116-I119 HydrophobicContact CG-CG1 4.27Å; I119-R121 VanDerWaalsContact C-N 3.33Å; I119-R121 HydrophobicContact CG2-CG 3.76Å; I119-R121 PolarHBondContact O-N 3.29Å
120L40.7Very low47.7Very low147 Ų147131.4 Ų131.477%0.7774%0.74SS**  trans-69.191166.8-87.3155.1000108.9F118 A122F118-L120 HydrophobicContact CD2-CD1 3.82Å; F118-L120 HydrophobicContact CD2-CG 3.98Å; F118-L120 HydrophobicContact CE2-CD1 3.63Å; F118-L120 HydrophobicContact CE2-CG 4.31Å; F118-L120 PolarHBondContact O-N 3.29Å; L120-A122 PolarHBondContact O-N 3.36Å
121R40.2Very low47.7Very low205 Ų205130.1 Ų130.177%0.77473%0.732SS**  trans-75.692.5168.9-67-171.5-176.7-168.80.7108.8I119 G123I119-R121 VanDerWaalsContact C-N 3.33Å; I119-R121 HydrophobicContact CG2-CG 3.76Å; I119-R121 PolarHBondContact O-N 3.29Å; R121-G123 VanDerWaalsContact C-N 3.35Å; R121-G123 PolarHBondContact O-N 3.43Å; R121-G123 VanDerWaalsContact O-N 3.08Å
122A42.6Very low47.4Very low110 Ų110132.5 Ų132.591%0.90974%0.736SS**  trans-74.287.4167.200000109.3L120L120-A122 PolarHBondContact O-N 3.36Å
123G33.9Very low46.8Very low39 Ų39133 Ų13340%0.40273%0.731SS.*SBendtrans-169.814117400000110.5R121 Q125R121-G123 VanDerWaalsContact C-N 3.35Å; R121-G123 PolarHBondContact O-N 3.43Å; R121-G123 VanDerWaalsContact O-N 3.08Å; G123-Q125 PolarHBondContact O-N 3.28Å
124P54.3Low46.3Very low137 Ų137136 Ų13689%0.8974%0.735SS**SBendtrans-77.748.1-166.434.3-36.8000113.1
125Q47.8Very low46.2Very low156 Ų156136 Ų13673%0.72975%0.745SS**  trans-113.210.1-178.3-67.5-176500113.8G123 L127 Q128G123-Q125 PolarHBondContact O-N 3.28Å; Q125-L127 PolarHBondContact O-N 3.26Å; Q125-L127 VanDerWaalsContact O-N 3.1Å; Q125-Q128 PolarHBondContact O-N 3.26Å
126I46Very low46.2Very low137 Ų137135.3 Ų135.370%0.70374%0.741SS**THydrogen-bonded Turntrans-68.7-2.6173.3-67178.4000112.5
127L47.8Very low45.3Very low165 Ų165138.9 Ų138.986%0.86475%0.754SS**THydrogen-bonded Turntrans-83.4-2.4173.3-151.275.1000114.6Q125Q125-L127 PolarHBondContact O-N 3.26Å; Q125-L127 VanDerWaalsContact O-N 3.1Å
128Q46.1Very low45.2Very low155 Ų155140.5 Ų140.572%0.72477%0.773SS**SBendtrans-116-2.5-172.7-118162.12.100116.5Q125Q125-Q128 PolarHBondContact O-N 3.26Å
129S49.4Very low44.8Very low88 Ų88139.9 Ų139.962%0.61578%0.778SS**SBendtrans-87.4-8.9176.756.50000115.1
130D43.3Very low44.9Very low147 Ų147140.7 Ų140.779%0.78679%0.786SS**THydrogen-bonded Turntrans-92.79.5-176.2-73.4-1.2000114.4
131T48.2Very low45.1Very low103 Ų103140.4 Ų140.463%0.63279%0.787SS**THydrogen-bonded Turntrans-106.69.7-178.5-33.40000115
132W40.5Very low45.4Very low231 Ų231136.6 Ų136.688%0.87579%0.788SS**  trans-122.951.6173.9-58.7107.3000112.6
133L41.1Very low45.6Very low158 Ų158138.3 Ų138.383%0.82778%0.78SS**  trans-121.7137.2150.6-75.2171.9000107.7
134V44.9Very low46.4Very low131 Ų131144.9 Ų144.979%0.79481%0.805SS**  trans9478.5168-161.90000115.9P136V134-P136 HydrophobicContact CG1-CG 4Å
135A50.8Low45.8Very low105 Ų105145.4 Ų145.487%0.86880%0.799SS**  trans-116.8100.8136.400000107.7
136P45.8Very low45.6Very low95 Ų95144.6 Ų144.662%0.61781%0.805SS**  trans-86.4148.8166.631.4-20.4000108.3V134V134-P136 HydrophobicContact CG1-CG 4Å
137L37.2Very low45.6Very low169 Ų169145.3 Ų145.389%0.88581%0.813SS**  trans165.3151.1147.6-91159.6000110.7
138P52.6Low45.4Very low196 Ų196143.5 Ų143.5100%1.27381%0.809SS**  -86.40-96.938.4-26.3000114.9

Retrieved 138 of 138 residues in 136 ms (Link to these results)