A0A096MZD7_PAPAN Loading...

Transgelin

AlphaFold DB (G7PP17), UniProt , Accession A0A096MZD7, Species PAPAN (Papio anubis, Olive baboon), Gene TAGLN, Length 201 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
1M41.6Very low66.8Low240 Ų240119.2 Ų119.2100%1.18269%0.688SS**  01030-66.7173.5-176.400107N3M1-N3 PolarHBondContact O-N 3.4Å
2A43.9Very low68.4Low96 Ų96122.8 Ų122.879%0.79368%0.682SS**  trans-89.295.1-179.400000108.4K4A2-K4 PolarHBondContact O-N 2.95Å
3N45.5Very low69.9Low165 Ų165121.9 Ų121.988%0.88267%0.669SS**  trans-63.294.5160-79.7-42.8000106.8M1 G5M1-N3 PolarHBondContact O-N 3.4Å; N3-G5 PolarHBondContact O-N 3.46Å
4K61.2Low71.1Confident177 Ų177117.9 Ų117.977%0.7765%0.65SS**PPolyproline II helixtrans-72.3121.5173.7-137.4175.4-176.2-178.30106.6A2A2-K4 PolarHBondContact O-N 2.95Å
5G61.7Low72Confident58 Ų58113.5 Ų113.560%0.59862%0.623SS**PPolyproline II helixtrans-59167.2176.100000111.9N3 S7N3-G5 PolarHBondContact O-N 3.46Å; G5-S7 PolarHBondContact O-N 3.22Å
6P66.1Low73Confident93 Ų93109.4 Ų109.460%0.60461%0.605SS**PPolyproline II helixtrans-52.3138.1-178.9-21.330.5000111.1Y8P6-Y8 HydrophobicContact CB-CE1 4.37Å; P6-Y8 HydrophobicContact CB-CE2 4.02Å; P6-Y8 WeakPolarHBondContact O-CD2 3.46Å; P6-Y8 WeakPolarHBondContact O-CE2 3.28Å
7S73.3Confident74Confident49 Ų49110.8 Ų110.834%0.34360%0.603SS.*PPolyproline II helixtrans-72.2140171.253.10000109.3G5 R12G5-S7 PolarHBondContact O-N 3.22Å; S7-R12 WeakPolarHBondContact O-CB 3.49Å
8Y82.6Confident74.8Confident168 Ų168106.6 Ų106.666%0.65958%0.58SS**  trans-123.3158.1179.6-61.9-80.1000111.2P6 S11P6-Y8 HydrophobicContact CB-CE1 4.37Å; P6-Y8 HydrophobicContact CB-CE2 4.02Å; P6-Y8 WeakPolarHBondContact O-CD2 3.46Å; P6-Y8 WeakPolarHBondContact O-CE2 3.28Å; Y8-S11 PolarHBondContact O-N 3.29Å
9G88.9Confident75.4Confident49 Ų49105.2 Ų105.251%0.50557%0.569SS.*THydrogen-bonded Turntrans57.1-135.4178.100000113.4S11 R12 E13G9-S11 PolarHBondContact O-N 3.49Å; G9-S11 VanDerWaalsContact O-N 3.14Å; G9-R12 WeakPolarHBondContact O-CB 3.46Å; G9-R12 PolarHBondContact O-N 3.01Å; G9-E13 PolarHBondContact O-N 3.46Å; G9-E13 VanDerWaalsContact O-N 3.16Å
10M85.7Confident76.2Confident135 Ų135108.4 Ų108.467%0.66558%0.577SS**Hα-helixtrans-53.2-35.9-178.7-172.762.9175.800113.4R12 E13 V14M10-R12 VanDerWaalsContact C-N 3.34Å; M10-R12 PolarHBondContact O-N 3.25Å; M10-E13 PolarHBondContact O-N 2.85Å; M10-V14 HydrophobicContact CE-CG2 4.25Å; M10-V14 VanDerWaalsContact O-CG2 3.29Å; M10-V14 WeakPolarHBondContact O-CG2 3.44Å; M10-V14 PolarHBondContact O-N 3.21Å
11S84Confident77Confident81 Ų81109.8 Ų109.857%0.56658%0.578SS**Hα-helixtrans-66.8-35.6179-65.70000112.4Y8 G9 Q15Y8-S11 PolarHBondContact O-N 3.29Å; G9-S11 PolarHBondContact O-N 3.49Å; G9-S11 VanDerWaalsContact O-N 3.14Å; S11-Q15 WeakPolarHBondContact O-CB 3.38Å; S11-Q15 PolarHBondContact O-N 3.28Å; S11-Q15 VanDerWaalsContact O-N 3.08Å
12R86.4Confident79.6Confident163 Ų16399.9 Ų99.962%0.61553%0.528SS*.Hα-helixtrans-71-40.6176.1-169.5177.6170.9-179.5-2.7111.4S7 G9 M10 Q15 S16S7-R12 WeakPolarHBondContact O-CB 3.49Å; G9-R12 WeakPolarHBondContact O-CB 3.46Å; G9-R12 PolarHBondContact O-N 3.01Å; M10-R12 VanDerWaalsContact C-N 3.34Å; M10-R12 PolarHBondContact O-N 3.25Å; R12-Q15 PolarHBondContact O-N 3.11Å; R12-S16 WeakPolarHBondContact O-CB 3.22Å; R12-S16 PolarHBondContact O-N 3.33Å
13E87.8Confident82Confident111 Ų11198.7 Ų98.752%0.51951%0.508SS..Hα-helixtrans-64.1-43177.6-68.9-179.4-169.300111.9G9 M10 S16 K17G9-E13 PolarHBondContact O-N 3.46Å; G9-E13 VanDerWaalsContact O-N 3.16Å; M10-E13 PolarHBondContact O-N 2.85Å; E13-S16 PolarHBondContact O-N 3.22Å; E13-K17 WeakPolarHBondContact O-CG 3.34Å; E13-K17 PolarHBondContact O-N 3.25Å
14V86.6Confident84.3Confident66 Ų6697.8 Ų97.840%0.450%0.499SS..Hα-helixtrans-60.7-48.1173.8170.90000110.5M10 S16 K17 I18M10-V14 HydrophobicContact CE-CG2 4.25Å; M10-V14 VanDerWaalsContact O-CG2 3.29Å; M10-V14 WeakPolarHBondContact O-CG2 3.44Å; M10-V14 PolarHBondContact O-N 3.21Å; V14-S16 PolarHBondContact O-N 3.22Å; V14-K17 PolarHBondContact O-N 3.41Å; V14-I18 HydrophobicContact CG1-CD1 3.92Å; V14-I18 WeakPolarHBondContact O-CG1 3.4Å; V14-I18 PolarHBondContact O-N 3.14Å
15Q85.1Confident85.9Confident52 Ų5297 Ų9724%0.24350%0.497CS..Hα-helixtrans-59.2-46.3177.8-17063.146.200111.4S11 R12 K17 I18 E19 K121S11-Q15 WeakPolarHBondContact O-CB 3.38Å; S11-Q15 PolarHBondContact O-N 3.28Å; S11-Q15 VanDerWaalsContact O-N 3.08Å; R12-Q15 PolarHBondContact O-N 3.11Å; Q15-K17 VanDerWaalsContact C-N 3.32Å; Q15-K17 PolarHBondContact O-N 3.47Å; Q15-I18 WeakPolarHBondContact O-CB 3.27Å; Q15-I18 PolarHBondContact O-N 3.41Å; Q15-I18 VanDerWaalsContact O-N 3.09Å; Q15-E19 HydrophobicContact CG-CG 4.43Å; Q15-E19 VanDerWaalsContact O-CG 3.3Å; Q15-E19 WeakPolarHBondContact O-CG 3.43Å; Q15-E19 PolarHBondContact O-N 3.26Å; Q15-K121 PolarHBondContact NE2-O 3.07Å
16S88Confident87.4Confident47 Ų4795.3 Ų95.333%0.32948%0.475SS..Hα-helixtrans-61.6-38.2177.9-179.60000112.4R12 E13 V14 I18 E19 K20R12-S16 WeakPolarHBondContact O-CB 3.22Å; R12-S16 PolarHBondContact O-N 3.33Å; E13-S16 PolarHBondContact O-N 3.22Å; V14-S16 PolarHBondContact O-N 3.22Å; S16-I18 VanDerWaalsContact C-N 3.34Å; S16-E19 PolarHBondContact O-N 3.26Å; S16-K20 VanDerWaalsContact O-CG 3.3Å; S16-K20 WeakPolarHBondContact O-CG 3.45Å; S16-K20 PolarHBondContact O-N 3.19Å
17K89.8Confident88.8Confident133 Ų13391.3 Ų91.358%0.57845%0.448SS*.Hα-helixtrans-65.9-36.2174.1-74.5176.4-178.3175.30112.4E13 V14 Q15E13-K17 WeakPolarHBondContact O-CG 3.34Å; E13-K17 PolarHBondContact O-N 3.25Å; V14-K17 PolarHBondContact O-N 3.41Å; Q15-K17 VanDerWaalsContact C-N 3.32Å; Q15-K17 PolarHBondContact O-N 3.47Å
18I87.6Confident89.9Confident36 Ų3693 Ų9319%0.18545%0.451CS..Hα-helixtrans-67.1-47.2174.5-69.3167000110V14 Q15 S16 K20 K21 D122V14-I18 HydrophobicContact CG1-CD1 3.92Å; V14-I18 WeakPolarHBondContact O-CG1 3.4Å; V14-I18 PolarHBondContact O-N 3.14Å; Q15-I18 WeakPolarHBondContact O-CB 3.27Å; Q15-I18 PolarHBondContact O-N 3.41Å; Q15-I18 VanDerWaalsContact O-N 3.09Å; S16-I18 VanDerWaalsContact C-N 3.34Å; I18-K20 VanDerWaalsContact C-N 3.27Å; I18-K20 PolarHBondContact O-N 3.35Å; I18-K21 WeakPolarHBondContact O-CB 3.45Å; I18-K21 PolarHBondContact O-N 3.21Å; I18-D122 HydrophobicContact CG2-CB 3.9Å; I18-D122 VanDerWaalsContact CG2-CG 3.42Å; I18-D122 VanDerWaalsContact CG2-OD1 3.25Å; I18-D122 WeakPolarHBondContact CG2-OD1 3.32Å
19E86.9Confident90.5Very high80 Ų8089.2 Ų89.237%0.37444%0.435SS..Hα-helixtrans-60-37.3178.9-69-177.914100112.2Q15 S16 K21 Y22 R49Q15-E19 HydrophobicContact CG-CG 4.43Å; Q15-E19 VanDerWaalsContact O-CG 3.3Å; Q15-E19 WeakPolarHBondContact O-CG 3.43Å; Q15-E19 PolarHBondContact O-N 3.26Å; S16-E19 PolarHBondContact O-N 3.26Å; E19-K21 PolarHBondContact O-N 2.94Å; E19-Y22 WeakPolarHBondContact O-CB 3.17Å; E19-Y22 PolarHBondContact O-N 2.89Å; E19-R49 IonicContact OE1-CZ 2.86Å; E19-R49 IonicContact OE1-NH1 3.62Å; E19-R49 PolarHBondContact OE1-NH1 3.1Å; E19-R49 IonicContact OE1-NH2 3.26Å
20K91.8Very high90.8Very high168 Ų16886.9 Ų86.973%0.7341%0.411SS*.THydrogen-bonded Turntrans-64.3-17.5174.2-77.2177.5-179.4-174.80114.6S16 I18 Y22S16-K20 VanDerWaalsContact O-CG 3.3Å; S16-K20 WeakPolarHBondContact O-CG 3.45Å; S16-K20 PolarHBondContact O-N 3.19Å; I18-K20 VanDerWaalsContact C-N 3.27Å; I18-K20 PolarHBondContact O-N 3.35Å; K20-Y22 VanDerWaalsContact C-N 3.29Å
21K93.4Very high91.3Very high138 Ų13880.7 Ų80.760%0.638%0.381SS*.THydrogen-bonded Turntrans-83.5-9.5174.5-63.5175.9-178.7-177.10112.5I18 E19 A124I18-K21 WeakPolarHBondContact O-CB 3.45Å; I18-K21 PolarHBondContact O-N 3.21Å; E19-K21 PolarHBondContact O-N 2.94Å; K21-A124 HydrophobicContact CB-CB 3.88Å
22Y94.5Very high91.9Very high33 Ų3379.8 Ų79.813%0.12937%0.368CS..  trans-70.9132.3174.4-165.8-94.9000109.2E19 K20 E27 R49 M123 Q127E19-Y22 WeakPolarHBondContact O-CB 3.17Å; E19-Y22 PolarHBondContact O-N 2.89Å; K20-Y22 VanDerWaalsContact C-N 3.29Å; Y22-E27 HydrophobicContact CE1-CB 4.41Å; Y22-E27 VanDerWaalsContact CE1-OE2 3.31Å; Y22-E27 WeakPolarHBondContact CE1-OE2 3.39Å; Y22-E27 VanDerWaalsContact CZ-OE2 3.26Å; Y22-E27 VanDerWaalsContact OH-CD 3.3Å; Y22-E27 WeakPolarHBondContact OH-CG 3.44Å; Y22-E27 PolarHBondContact OH-OE2 2.84Å; Y22-R49 HydrophobicContact CD1-CB 4.49Å; Y22-R49 HydrophobicContact CD2-CG 4.39Å; Y22-R49 HydrophobicContact CE1-CB 3.98Å; Y22-R49 HydrophobicContact CE1-CG 4.37Å; Y22-R49 HydrophobicContact CE2-CB 4.5Å; Y22-R49 HydrophobicContact CE2-CG 4.06Å; Y22-M123 HydrophobicContact CD2-CB 3.82Å; Y22-M123 HydrophobicContact CE2-CB 3.69Å; Y22-Q127 HydrophobicContact CD2-CG 4.41Å; Y22-Q127 VanDerWaalsContact CD2-OE1 3.31Å; Y22-Q127 HydrophobicContact CE2-CG 3.94Å
23D95Very high92.4Very high70 Ų7072 Ų7237%0.37434%0.338SS..  trans-120.4120.8-177-178.8-18.8000109.1E25 L26 E27 Q127D23-E25 WeakPolarHBondContact OD1-CB 3.31Å; D23-E25 PolarHBondContact OD1-N 3.43Å; D23-L26 HydrophobicContact CB-CB 3.62Å; D23-L26 HydrophobicContact CB-CD2 4.32Å; D23-L26 WeakPolarHBondContact O-CB 3.46Å; D23-L26 PolarHBondContact O-N 3.28Å; D23-L26 PolarHBondContact OD1-N 2.99Å; D23-L26 VanDerWaalsContact OD1-N 3.17Å; D23-E27 PolarHBondContact O-N 3.31Å; D23-E27 VanDerWaalsContact O-N 3.08Å; D23-Q127 PolarHBondContact O-NE2 3.35Å
24E94.3Very high92.7Very high147 Ų14766.7 Ų66.769%0.68731%0.314SS*.Hα-helixtrans-72.6-34.9-177.6-65.3-178.4-169.700112.1L26 E27 E28E24-L26 VanDerWaalsContact C-N 3.29Å; E24-L26 PolarHBondContact O-N 3.31Å; E24-E27 WeakPolarHBondContact O-CB 3.46Å; E24-E27 PolarHBondContact O-N 3.15Å; E24-E28 PolarHBondContact O-N 3.11Å; E24-E28 VanDerWaalsContact O-N 3.09Å
25E94.1Very high93.2Very high159 Ų15965.3 Ų65.374%0.74330%0.303SS*.Hα-helixtrans-68-37.2175.9-61.3-176.1171.600110.3D23 E27 E28 R29D23-E25 WeakPolarHBondContact OD1-CB 3.31Å; D23-E25 PolarHBondContact OD1-N 3.43Å; E25-E27 VanDerWaalsContact C-N 3.33Å; E25-E28 PolarHBondContact O-N 2.84Å; E25-R29 PolarHBondContact O-N 3.47Å; E25-R29 VanDerWaalsContact O-N 3.07Å
26L94.3Very high93.7Very high24 Ų2465.8 Ų65.813%0.12631%0.31CS..Hα-helixtrans-62.7-40.4173.2-168.965.6000112.1D23 E24 R29 L30 Q127 M131D23-L26 HydrophobicContact CB-CB 3.62Å; D23-L26 HydrophobicContact CB-CD2 4.32Å; D23-L26 WeakPolarHBondContact O-CB 3.46Å; D23-L26 PolarHBondContact O-N 3.28Å; D23-L26 PolarHBondContact OD1-N 2.99Å; D23-L26 VanDerWaalsContact OD1-N 3.17Å; E24-L26 VanDerWaalsContact C-N 3.29Å; E24-L26 PolarHBondContact O-N 3.31Å; L26-R29 PolarHBondContact O-N 3.4Å; L26-L30 HydrophobicContact CG-CD1 4.22Å; L26-L30 WeakPolarHBondContact O-CB 3.38Å; L26-L30 VanDerWaalsContact O-CG 3.25Å; L26-L30 WeakPolarHBondContact O-CG 3.23Å; L26-L30 PolarHBondContact O-N 3.06Å; L26-Q127 HydrophobicContact CD2-CB 3.72Å; L26-Q127 HydrophobicContact CD2-CG 4.35Å; L26-Q127 HydrophobicContact CG-CB 4.44Å; L26-M131 HydrophobicContact CD1-CE 4.11Å; L26-M131 HydrophobicContact CD1-CG 3.65Å; L26-M131 HydrophobicContact CD1-SD 3.42Å; L26-M131 WeakPolarHBondContact CD1-SD 3.2Å; L26-M131 HydrophobicContact CD2-CG 4.17Å; L26-M131 HydrophobicContact CG-CG 4.21Å; L26-M131 HydrophobicContact CG-SD 4.41Å
27E95.4Very high94Very high8 Ų863.6 Ų63.64%0.03729%0.294CS..Hα-helixtrans-58.5-53.1175.1-176.9-167117.100110.5Y22 D23 E24 E25 R29 L30 V31 G48 R49 F52Y22-E27 HydrophobicContact CE1-CB 4.41Å; Y22-E27 VanDerWaalsContact CE1-OE2 3.31Å; Y22-E27 WeakPolarHBondContact CE1-OE2 3.39Å; Y22-E27 VanDerWaalsContact CZ-OE2 3.26Å; Y22-E27 VanDerWaalsContact OH-CD 3.3Å; Y22-E27 WeakPolarHBondContact OH-CG 3.44Å; Y22-E27 PolarHBondContact OH-OE2 2.84Å; D23-E27 PolarHBondContact O-N 3.31Å; D23-E27 VanDerWaalsContact O-N 3.08Å; E24-E27 WeakPolarHBondContact O-CB 3.46Å; E24-E27 PolarHBondContact O-N 3.15Å; E25-E27 VanDerWaalsContact C-N 3.33Å; E27-R29 VanDerWaalsContact C-N 3.3Å; E27-R29 PolarHBondContact O-N 3.06Å; E27-L30 PolarHBondContact O-N 2.94Å; E27-L30 VanDerWaalsContact O-N 3.12Å; E27-V31 HydrophobicContact CG-CG2 4.42Å; E27-V31 WeakPolarHBondContact O-CG2 3.1Å; E27-V31 PolarHBondContact O-N 3.23Å; E27-G48 WeakPolarHBondContact OE1-CA 2.93Å; E27-G48 PolarHBondContact OE1-N 2.84Å; E27-G48 WeakPolarHBondContact OE2-CA 3.04Å; E27-R49 PolarHBondContact OE2-N 3.39Å; E27-F52 HydrophobicContact CG-CB 4.02Å; E27-F52 HydrophobicContact CG-CD1 4.37Å; E27-F52 HydrophobicContact CG-CD2 3.92Å; E27-F52 HydrophobicContact CG-CE2 4.48Å; E27-F52 HydrophobicContact CG-CG 3.86Å
28E95.2Very high94.1Very high85 Ų8558.6 Ų58.640%0.39728%0.276SS..Hα-helixtrans-58-44.7-179-68.4-167.2158.700111.3E24 E25 L30 V31 E32 R47E24-E28 PolarHBondContact O-N 3.11Å; E24-E28 VanDerWaalsContact O-N 3.09Å; E25-E28 PolarHBondContact O-N 2.84Å; E28-L30 PolarHBondContact O-N 3.03Å; E28-V31 PolarHBondContact O-N 3.44Å; E28-E32 WeakPolarHBondContact O-CG 3.5Å; E28-E32 PolarHBondContact O-N 3.26Å; E28-R47 IonicContact OE1-CZ 2.71Å; E28-R47 IonicContact OE1-NE 3.71Å; E28-R47 IonicContact OE1-NH1 3.91Å; E28-R47 IonicContact OE1-NH2 3.65Å
29R95.4Very high94.3Very high89 Ų8957.8 Ų57.834%0.33628%0.276SS..Hα-helixtrans-60.9-43.5176.1-177.6170.667.6-171.5-2.3112.9E25 L26 E27 E32 W33 W151E25-R29 PolarHBondContact O-N 3.47Å; E25-R29 VanDerWaalsContact O-N 3.07Å; L26-R29 PolarHBondContact O-N 3.4Å; E27-R29 VanDerWaalsContact C-N 3.3Å; E27-R29 PolarHBondContact O-N 3.06Å; R29-E32 PolarHBondContact O-N 2.99Å; R29-W33 WeakPolarHBondContact O-CB 3.29Å; R29-W33 PolarHBondContact O-N 3.19Å; R29-W151 HydrophobicContact CG-CB 3.96Å; R29-W151 HydrophobicContact CG-CD2 4.48Å; R29-W151 HydrophobicContact CG-CG 3.91Å; R29-W151 PolarHBondContact NE-O 3.32Å; R29-W151 PolarHBondContact NH1-O 3.39Å
30L96.4Very high94.2Very high0 Ų059.2 Ų59.20%029%0.292CS..Hα-helixtrans-66.6-38.9178.4-74.4174.7000111.7L26 E27 E28 W33 I34 F52 Q127 L130 M131 F152L26-L30 HydrophobicContact CG-CD1 4.22Å; L26-L30 WeakPolarHBondContact O-CB 3.38Å; L26-L30 VanDerWaalsContact O-CG 3.25Å; L26-L30 WeakPolarHBondContact O-CG 3.23Å; L26-L30 PolarHBondContact O-N 3.06Å; E27-L30 PolarHBondContact O-N 2.94Å; E27-L30 VanDerWaalsContact O-N 3.12Å; E28-L30 PolarHBondContact O-N 3.03Å; L30-W33 HydrophobicContact CD2-CE3 4.11Å; L30-W33 HydrophobicContact CD2-CZ3 4.46Å; L30-W33 PolarHBondContact O-N 2.72Å; L30-I34 WeakPolarHBondContact O-CB 3.24Å; L30-I34 WeakPolarHBondContact O-CD1 3.17Å; L30-I34 WeakPolarHBondContact O-CG1 3.24Å; L30-I34 PolarHBondContact O-N 3.33Å; L30-F52 HydrophobicContact CB-CZ 4.38Å; L30-F52 HydrophobicContact CD1-CZ 4.48Å; L30-Q127 HydrophobicContact CD1-CB 3.92Å; L30-Q127 HydrophobicContact CD1-CG 3.98Å; L30-L130 HydrophobicContact CD1-CB 4.11Å; L30-L130 HydrophobicContact CD1-CD1 4.29Å; L30-L130 HydrophobicContact CD2-CB 3.77Å; L30-M131 HydrophobicContact CD1-CG 4.49Å; L30-M131 HydrophobicContact CD2-CG 4.18Å; L30-M131 HydrophobicContact CD2-SD 3.79Å; L30-M131 HydrophobicContact CG-SD 4.3Å; L30-F152 HydrophobicContact CD2-CE1 4.21Å; L30-F152 HydrophobicContact CD2-CZ 4.49Å
31V96.1Very high93.9Very high5 Ų557.9 Ų57.93%0.0329%0.293CS..Hα-helixtrans-61.2-49.7175.3169.30000110.6E27 E28 W33 I34 I35 R44 P45 F52 W55E27-V31 HydrophobicContact CG-CG2 4.42Å; E27-V31 WeakPolarHBondContact O-CG2 3.1Å; E27-V31 PolarHBondContact O-N 3.23Å; E28-V31 PolarHBondContact O-N 3.44Å; V31-W33 VanDerWaalsContact C-N 3.34Å; V31-W33 PolarHBondContact O-N 3.46Å; V31-I34 PolarHBondContact O-N 3.17Å; V31-I35 HydrophobicContact CG1-CD1 3.79Å; V31-I35 VanDerWaalsContact O-CG1 3.31Å; V31-I35 WeakPolarHBondContact O-CG1 3.33Å; V31-I35 PolarHBondContact O-N 2.97Å; V31-R44 HydrophobicContact CG1-CG 4.13Å; V31-P45 HydrophobicContact CB-CG 4.46Å; V31-P45 HydrophobicContact CG1-CG 3.92Å; V31-P45 HydrophobicContact CG2-CG 3.61Å; V31-F52 HydrophobicContact CG2-CD2 3.62Å; V31-F52 HydrophobicContact CG2-CE2 3.71Å; V31-W55 HydrophobicContact CG2-CZ3 4.13Å
32E95.7Very high93.7Very high61 Ų6151.9 Ų51.929%0.28527%0.268SS..Hα-helixtrans-60.1-44.3177.8-69.1-59.4158.800111.6E28 R29 I34 I35 V36 R44 W151E28-E32 WeakPolarHBondContact O-CG 3.5Å; E28-E32 PolarHBondContact O-N 3.26Å; R29-E32 PolarHBondContact O-N 2.99Å; E32-I34 PolarHBondContact O-N 3.17Å; E32-I35 PolarHBondContact O-N 3.23Å; E32-V36 WeakPolarHBondContact O-CG2 3.17Å; E32-V36 PolarHBondContact O-N 3.25Å; E32-R44 IonicContact OE1-CZ 3.72Å; E32-R44 IonicContact OE1-NH1 2.67Å; E32-R44 PolarHBondContact OE1-NH1 3.25Å; E32-R44 IonicContact OE1-NH2 3Å; E32-R44 PolarHBondContact OE1-NH2 3.34Å; E32-W151 HydrophobicContact CB-CH2 4.28Å
33W96.1Very high93.5Very high0 Ų052.1 Ų52.10%028%0.281CS..Hα-helixtrans-59.7-48.5176.1172.554.3000112.5R29 L30 V31 I35 V36 Q37 L65 L130 L133 Y145 W151 F152R29-W33 WeakPolarHBondContact O-CB 3.29Å; R29-W33 PolarHBondContact O-N 3.19Å; L30-W33 HydrophobicContact CD2-CE3 4.11Å; L30-W33 HydrophobicContact CD2-CZ3 4.46Å; L30-W33 PolarHBondContact O-N 2.72Å; V31-W33 VanDerWaalsContact C-N 3.34Å; V31-W33 PolarHBondContact O-N 3.46Å; W33-I35 VanDerWaalsContact C-N 3.28Å; W33-I35 PolarHBondContact O-N 3.02Å; W33-V36 PolarHBondContact O-N 3.24Å; W33-Q37 WeakPolarHBondContact O-CB 3.46Å; W33-Q37 PolarHBondContact O-N 3.26Å; W33-L65 HydrophobicContact CE3-CD1 4.46Å; W33-L65 HydrophobicContact CH2-CD1 3.96Å; W33-L65 HydrophobicContact CH2-CD2 3.98Å; W33-L65 HydrophobicContact CH2-CG 4.25Å; W33-L65 HydrophobicContact CZ2-CD1 4.04Å; W33-L65 HydrophobicContact CZ3-CD1 4.18Å; W33-L65 HydrophobicContact CZ3-CD2 3.83Å; W33-L65 HydrophobicContact CZ3-CG 4.49Å; W33-L130 HydrophobicContact CZ3-CB 4.48Å; W33-L133 HydrophobicContact CH2-CD2 4.37Å; W33-L133 HydrophobicContact CH2-CG 4.35Å; W33-Y145 AromaticContact CD1-CE2 3.86Å; W33-Y145 HydrophobicContact CZ2-CE2 4.49Å; W33-Y145 AromaticContact NE1-CD2 3.89Å; W33-Y145 AromaticContact NE1-CE2 3.24Å; W33-Y145 AromaticContact NE1-CZ 3.98Å; W33-W151 HydrophobicContact CB-CE3 3.88Å; W33-W151 HydrophobicContact CB-CZ3 4.04Å; W33-W151 HydrophobicContact CG-CE3 4.45Å; W33-F152 HydrophobicContact CB-CE2 4.17Å; W33-F152 HydrophobicContact CB-CZ 3.96Å; W33-F152 AromaticContact CD1-CE2 3.68Å; W33-F152 HydrophobicContact CD2-CE1 4.4Å; W33-F152 AromaticContact CD2-CE2 3.72Å; W33-F152 HydrophobicContact CD2-CE2 3.72Å; W33-F152 AromaticContact CD2-CZ 3.32Å; W33-F152 HydrophobicContact CD2-CZ 3.32Å; W33-F152 AromaticContact CE2-CE2 3.88Å; W33-F152 AromaticContact CE2-CZ 3.82Å; W33-F152 HydrophobicContact CE3-CE1 4.24Å; W33-F152 HydrophobicContact CE3-CE2 4.37Å; W33-F152 AromaticContact CE3-CZ 3.52Å; W33-F152 HydrophobicContact CE3-CZ 3.52Å; W33-F152 AromaticContact CG-CE2 3.58Å; W33-F152 HydrophobicContact CG-CE2 3.58Å; W33-F152 AromaticContact CG-CZ 3.5Å; W33-F152 HydrophobicContact CG-CZ 3.5Å; W33-F152 HydrophobicContact CZ2-CZ 4.4Å; W33-F152 HydrophobicContact CZ3-CZ 4.12Å; W33-F152 AromaticContact NE1-CE2 3.87Å
34I96.1Very high93.5Very high0 Ų055.5 Ų55.50%029%0.288CS..Hα-helixtrans-60.9-39.3-179.1-68.4166.6000111.1L30 V31 E32 C38 V42 W55 L56 I61 L65 L130L30-I34 WeakPolarHBondContact O-CB 3.24Å; L30-I34 WeakPolarHBondContact O-CD1 3.17Å; L30-I34 WeakPolarHBondContact O-CG1 3.24Å; L30-I34 PolarHBondContact O-N 3.33Å; V31-I34 PolarHBondContact O-N 3.17Å; E32-I34 PolarHBondContact O-N 3.17Å; I34-C38 VanDerWaalsContact O-CB 3.24Å; I34-C38 WeakPolarHBondContact O-CB 3.48Å; I34-C38 PolarHBondContact O-N 3.21Å; I34-C38 PolarHBondContact O-SG 3.41Å; I34-V42 HydrophobicContact CG2-CG2 4.45Å; I34-W55 HydrophobicContact CB-CH2 3.84Å; I34-W55 HydrophobicContact CB-CZ3 4.34Å; I34-W55 HydrophobicContact CD1-CH2 4.29Å; I34-W55 HydrophobicContact CD1-CZ3 3.92Å; I34-W55 HydrophobicContact CG2-CH2 3.48Å; I34-W55 VanDerWaalsContact CG2-CH2 3.48Å; I34-W55 HydrophobicContact CG2-CZ2 4.16Å; I34-W55 HydrophobicContact CG2-CZ3 4.17Å; I34-L56 HydrophobicContact CD1-CD2 4.39Å; I34-I61 HydrophobicContact CG2-CG2 3.61Å; I34-L65 HydrophobicContact CD1-CD2 4.4Å; I34-L65 HydrophobicContact CG1-CD1 4.09Å; I34-L65 HydrophobicContact CG1-CD2 3.97Å; I34-L130 HydrophobicContact CD1-CD1 4.29Å
35I95.9Very high93.5Very high36 Ų3649.3 Ų49.319%0.18526%0.261CS..Hα-helixtrans-65.7-47.1177.6-67.7167000110.7V31 E32 W33 Q37 G39 V42 R44 W55V31-I35 HydrophobicContact CG1-CD1 3.79Å; V31-I35 VanDerWaalsContact O-CG1 3.31Å; V31-I35 WeakPolarHBondContact O-CG1 3.33Å; V31-I35 PolarHBondContact O-N 2.97Å; E32-I35 PolarHBondContact O-N 3.23Å; W33-I35 VanDerWaalsContact C-N 3.28Å; W33-I35 PolarHBondContact O-N 3.02Å; I35-Q37 VanDerWaalsContact C-N 3.32Å; I35-Q37 PolarHBondContact O-N 3.03Å; I35-G39 CarbonylContact O-C 3.26Å; I35-G39 VanDerWaalsContact O-CA 3.24Å; I35-G39 WeakPolarHBondContact O-CA 3.36Å; I35-G39 PolarHBondContact O-N 2.99Å; I35-V42 HydrophobicContact CG1-CG2 4.16Å; I35-R44 HydrophobicContact CD1-CB 4.05Å; I35-R44 HydrophobicContact CD1-CG 3.99Å; I35-W55 HydrophobicContact CG1-CH2 4.49Å
36V95.6Very high93.4Very high63 Ų6348 Ų4838%0.38226%0.259SS..Hα-helixtrans-65.8-38179174.10000111.6E32 W33 R146 W151E32-V36 WeakPolarHBondContact O-CG2 3.17Å; E32-V36 PolarHBondContact O-N 3.25Å; W33-V36 PolarHBondContact O-N 3.24Å; V36-R146 HydrophobicContact CG1-CB 4.16Å; V36-W151 HydrophobicContact CG2-CH2 4.25Å
37Q94.6Very high93.2Very high0 Ų056.3 Ų56.30%029%0.289CS..Hα-helixtrans-72.8-44.5-177.3-174.762.742.300112.1W33 I35 L65 S68 L69 H144 R146W33-Q37 WeakPolarHBondContact O-CB 3.46Å; W33-Q37 PolarHBondContact O-N 3.26Å; I35-Q37 VanDerWaalsContact C-N 3.32Å; I35-Q37 PolarHBondContact O-N 3.03Å; Q37-L65 HydrophobicContact CB-CD1 4.02Å; Q37-L65 HydrophobicContact CG-CD1 3.67Å; Q37-S68 WeakPolarHBondContact CG-OG 3.44Å; Q37-S68 PolarHBondContact NE2-O 3.34Å; Q37-S68 PolarHBondContact NE2-OG 3.48Å; Q37-L69 HydrophobicContact CG-CD2 4.42Å; Q37-H144 PolarHBondContact NE2-O 3.45Å; Q37-R146 PolarHBondContact OE1-O 2.91Å
38C92.7Very high92.9Very high29 Ų2957 Ų5720%0.19630%0.299CS..Hα-helixtrans-91.4-19.6-177.8-63.70000114.5I34 V42 L65I34-C38 VanDerWaalsContact O-CB 3.24Å; I34-C38 WeakPolarHBondContact O-CB 3.48Å; I34-C38 PolarHBondContact O-N 3.21Å; I34-C38 PolarHBondContact O-SG 3.41Å; C38-V42 HydrophobicContact CB-CG1 3.51Å; C38-V42 HydrophobicContact CB-CG2 4.21Å; C38-L65 WeakPolarHBondContact SG-CA 3.4Å; C38-L65 PolarHBondContact SG-N 3.37Å
39G90.9Very high92.7Very high18 Ų1857.8 Ų57.819%0.18630%0.298CS..  trans90.9177-171.700000113.9I35 D41 V42I35-G39 CarbonylContact O-C 3.26Å; I35-G39 VanDerWaalsContact O-CA 3.24Å; I35-G39 WeakPolarHBondContact O-CA 3.36Å; I35-G39 PolarHBondContact O-N 2.99Å; G39-D41 PolarHBondContact O-N 3.49Å; G39-V42 WeakPolarHBondContact O-CG2 3.38Å
40P84.6Confident92.5Very high110 Ų11059.2 Ų59.271%0.71431%0.311SS*.G310 helixtrans-67.1-19.1-171.527.5-35.3000114.4V42 G43P40-V42 PolarHBondContact O-N 3.25Å; P40-V42 VanDerWaalsContact O-N 3.1Å; P40-G43 PolarHBondContact O-N 3.34Å; P40-G43 VanDerWaalsContact O-N 3.09Å
41D86.6Confident92.4Very high140 Ų14059.8 Ų59.875%0.74932%0.317SS*.G310 helixtrans-66-12.7-175.6-63.1-19.8000114.5G39 G43G39-D41 PolarHBondContact O-N 3.49Å; D41-G43 VanDerWaalsContact C-N 3.32Å
42V88.5Confident92.4Very high13 Ų1359.5 Ų59.58%0.07932%0.316CS..G310 helixtrans-81.9-12.9175.5-63.50000113I34 I35 C38 G39 P40 W55 I61 K64I34-V42 HydrophobicContact CG2-CG2 4.45Å; I35-V42 HydrophobicContact CG1-CG2 4.16Å; C38-V42 HydrophobicContact CB-CG1 3.51Å; C38-V42 HydrophobicContact CB-CG2 4.21Å; G39-V42 WeakPolarHBondContact O-CG2 3.38Å; P40-V42 PolarHBondContact O-N 3.25Å; P40-V42 VanDerWaalsContact O-N 3.1Å; V42-W55 HydrophobicContact CB-CZ2 4.13Å; V42-W55 HydrophobicContact CG2-CZ2 3.93Å; V42-W55 PolarHBondContact O-NE1 2.85Å; V42-I61 HydrophobicContact CB-CD1 4.33Å; V42-I61 HydrophobicContact CB-CG1 4.48Å; V42-I61 HydrophobicContact CB-CG2 4.36Å; V42-I61 HydrophobicContact CG1-CG1 4.49Å; V42-I61 HydrophobicContact CG1-CG2 4.26Å; V42-K64 HydrophobicContact CG1-CD 3.98Å
43G91Very high92.4Very high38 Ų3857.6 Ų57.639%0.39231%0.307SS..  trans64.8-173.3-173.600000112.9P40 D41 W55P40-G43 PolarHBondContact O-N 3.34Å; P40-G43 VanDerWaalsContact O-N 3.09Å; D41-G43 VanDerWaalsContact C-N 3.32Å; G43-W55 WeakPolarHBondContact O-CZ2 3.47Å
44R93.5Very high92.4Very high140 Ų14062 Ų6253%0.52833%0.334SS..  trans-123.7132.5178.2-171.4173.2-174.8137.34.3109.3V31 E32 I35V31-R44 HydrophobicContact CG1-CG 4.13Å; E32-R44 IonicContact OE1-CZ 3.72Å; E32-R44 IonicContact OE1-NH1 2.67Å; E32-R44 PolarHBondContact OE1-NH1 3.25Å; E32-R44 IonicContact OE1-NH2 3Å; E32-R44 PolarHBondContact OE1-NH2 3.34Å; I35-R44 HydrophobicContact CD1-CB 4.05Å; I35-R44 HydrophobicContact CD1-CG 3.99Å
45P94.6Very high92.4Very high18 Ų1863.4 Ų63.412%0.11734%0.339CS..PPolyproline II helixtrans-70.6159.6177.229.8-34.6000111.9V31 W55V31-P45 HydrophobicContact CB-CG 4.46Å; V31-P45 HydrophobicContact CG1-CG 3.92Å; V31-P45 HydrophobicContact CG2-CG 3.61Å; P45-W55 HydrophobicContact CB-CB 3.76Å; P45-W55 HydrophobicContact CB-CD2 3.94Å; P45-W55 HydrophobicContact CB-CE3 4.13Å; P45-W55 HydrophobicContact CB-CG 3.81Å; P45-W55 HydrophobicContact CG-CD2 3.89Å; P45-W55 HydrophobicContact CG-CE3 3.7Å; P45-W55 HydrophobicContact CG-CG 4.31Å; P45-W55 HydrophobicContact CG-CZ3 4.12Å
46D92.5Very high92.4Very high132 Ų13261.7 Ų61.771%0.70633%0.33SS*.PPolyproline II helixtrans-60.6145.5161.5-65-44.5000109.9G51D46-G51 WeakPolarHBondContact O-CA 3.41Å
47R89.3Confident92.3Very high197 Ų19761.7 Ų61.774%0.74333%0.325SS*.SBendtrans-63.1140-179.6-70.6-172.7174.1-157.3-7.8111.4E28E28-R47 IonicContact OE1-CZ 2.71Å; E28-R47 IonicContact OE1-NE 3.71Å; E28-R47 IonicContact OE1-NH1 3.91Å; E28-R47 IonicContact OE1-NH2 3.65Å
48G89.9Confident92.1Very high24 Ų2463.5 Ų63.525%0.24734%0.335CS..SBendtrans96.5165.7173.700000113.3E27 L50 G51 F52E27-G48 WeakPolarHBondContact OE1-CA 2.93Å; E27-G48 PolarHBondContact OE1-N 2.84Å; E27-G48 WeakPolarHBondContact OE2-CA 3.04Å; G48-L50 VanDerWaalsContact C-N 3.28Å; G48-L50 PolarHBondContact O-N 3.18Å; G48-G51 PolarHBondContact O-N 3.46Å; G48-F52 PolarHBondContact O-N 3.21Å; G48-F52 VanDerWaalsContact O-N 3.07Å
49R90.7Very high92.2Very high100 Ų10062.1 Ų62.138%0.37733%0.325SS..Hα-helixtrans-47-43.4-169.7-172.8-177.874.1177.35.4115.1E19 Y22 E27 Q53 M123E19-R49 IonicContact OE1-CZ 2.86Å; E19-R49 IonicContact OE1-NH1 3.62Å; E19-R49 PolarHBondContact OE1-NH1 3.1Å; E19-R49 IonicContact OE1-NH2 3.26Å; Y22-R49 HydrophobicContact CD1-CB 4.49Å; Y22-R49 HydrophobicContact CD2-CG 4.39Å; Y22-R49 HydrophobicContact CE1-CB 3.98Å; Y22-R49 HydrophobicContact CE1-CG 4.37Å; Y22-R49 HydrophobicContact CE2-CB 4.5Å; Y22-R49 HydrophobicContact CE2-CG 4.06Å; E27-R49 PolarHBondContact OE2-N 3.39Å; R49-Q53 VanDerWaalsContact O-CB 3.31Å; R49-Q53 WeakPolarHBondContact O-CB 3.24Å; R49-Q53 PolarHBondContact O-N 3.09Å; R49-M123 HydrophobicContact CG-CB 4.03Å; R49-M123 HydrophobicContact CG-CG 3.9Å
50L92.4Very high92.3Very high119 Ų11962 Ų6262%0.62332%0.321SS*.Hα-helixtrans-70.6-42.2-176.9-176.864.3000111.7G48 Q53 V54G48-L50 VanDerWaalsContact C-N 3.28Å; G48-L50 PolarHBondContact O-N 3.18Å; L50-Q53 PolarHBondContact O-N 2.82Å; L50-V54 HydrophobicContact CD1-CG2 4.35Å; L50-V54 VanDerWaalsContact O-CG2 3.3Å; L50-V54 WeakPolarHBondContact O-CG2 3.27Å; L50-V54 PolarHBondContact O-N 2.9Å
51G94.3Very high92.9Very high12 Ų1257.3 Ų57.312%0.12429%0.29CS..Hα-helixtrans-63.6-46.3176.900000111D46 G48 Q53 V54 W55D46-G51 WeakPolarHBondContact O-CA 3.41Å; G48-G51 PolarHBondContact O-N 3.46Å; G51-Q53 VanDerWaalsContact C-N 3.34Å; G51-Q53 PolarHBondContact O-N 3.47Å; G51-V54 PolarHBondContact O-N 3.13Å; G51-W55 WeakPolarHBondContact O-CB 3.31Å; G51-W55 PolarHBondContact O-N 2.95Å
52F95.8Very high93.4Very high0 Ų050.7 Ų50.70%025%0.254CS..Hα-helixtrans-58.6-43.8174.5-170.6-113.6000112.5E27 L30 V31 G48 W55 L56 M123 Q127 L130E27-F52 HydrophobicContact CG-CB 4.02Å; E27-F52 HydrophobicContact CG-CD1 4.37Å; E27-F52 HydrophobicContact CG-CD2 3.92Å; E27-F52 HydrophobicContact CG-CE2 4.48Å; E27-F52 HydrophobicContact CG-CG 3.86Å; L30-F52 HydrophobicContact CB-CZ 4.38Å; L30-F52 HydrophobicContact CD1-CZ 4.48Å; V31-F52 HydrophobicContact CG2-CD2 3.62Å; V31-F52 HydrophobicContact CG2-CE2 3.71Å; G48-F52 PolarHBondContact O-N 3.21Å; G48-F52 VanDerWaalsContact O-N 3.07Å; F52-W55 HydrophobicContact CD2-CE3 4.14Å; F52-W55 HydrophobicContact CD2-CZ3 4.41Å; F52-W55 HydrophobicContact CE2-CE3 4.25Å; F52-W55 HydrophobicContact CE2-CZ3 4.15Å; F52-L56 HydrophobicContact CD1-CD1 4.22Å; F52-L56 HydrophobicContact CD2-CD1 4.39Å; F52-L56 HydrophobicContact CE1-CD1 3.65Å; F52-L56 HydrophobicContact CE2-CD1 3.86Å; F52-L56 HydrophobicContact CZ-CD1 3.45Å; F52-L56 VanDerWaalsContact CZ-CD1 3.45Å; F52-L56 PolarHBondContact O-N 3.15Å; F52-M123 HydrophobicContact CD1-CE 3.75Å; F52-M123 HydrophobicContact CE1-CE 4.29Å; F52-Q127 HydrophobicContact CE1-CG 4.44Å; F52-L130 HydrophobicContact CZ-CD1 3.94Å
53Q95.7Very high93.7Very high21 Ų2150 Ų5010%0.09825%0.25CS..Hα-helixtrans-60.9-53.5175.9-176.1-170-3.300111.7R49 L50 G51 W55 L56 K57 L117 F118 M123R49-Q53 VanDerWaalsContact O-CB 3.31Å; R49-Q53 WeakPolarHBondContact O-CB 3.24Å; R49-Q53 PolarHBondContact O-N 3.09Å; L50-Q53 PolarHBondContact O-N 2.82Å; G51-Q53 VanDerWaalsContact C-N 3.34Å; G51-Q53 PolarHBondContact O-N 3.47Å; Q53-W55 PolarHBondContact O-N 3.4Å; Q53-L56 PolarHBondContact O-N 2.93Å; Q53-K57 VanDerWaalsContact O-CB 3.23Å; Q53-K57 WeakPolarHBondContact O-CB 3.32Å; Q53-K57 PolarHBondContact O-N 2.83Å; Q53-L117 HydrophobicContact CG-CD1 4.35Å; Q53-L117 VanDerWaalsContact CG-O 3.32Å; Q53-L117 WeakPolarHBondContact CG-O 3.41Å; Q53-L117 PolarHBondContact NE2-O 3.34Å; Q53-F118 PolarHBondContact NE2-O 3.32Å; Q53-M123 HydrophobicContact CB-CE 3.77Å; Q53-M123 HydrophobicContact CB-SD 3.88Å; Q53-M123 HydrophobicContact CG-CE 4.22Å; Q53-M123 HydrophobicContact CG-SD 3.75Å
54V95.1Very high93.9Very high93 Ų9351.7 Ų51.756%0.56425%0.247SC*.Hα-helixtrans-58.6-39.4-176.2168.60000111.1L50 G51 K57L50-V54 HydrophobicContact CD1-CG2 4.35Å; L50-V54 VanDerWaalsContact O-CG2 3.3Å; L50-V54 WeakPolarHBondContact O-CG2 3.27Å; L50-V54 PolarHBondContact O-N 2.9Å; G51-V54 PolarHBondContact O-N 3.13Å; V54-K57 PolarHBondContact O-N 3.1Å
55W95.8Very high94Very high29 Ų2945 Ų4511%0.1122%0.222CC..Hα-helixtrans-62.4-42.7178.8-173.757.1000113V31 I34 I35 V42 G43 P45 G51 F52 Q53 I61V31-W55 HydrophobicContact CG2-CZ3 4.13Å; I34-W55 HydrophobicContact CB-CH2 3.84Å; I34-W55 HydrophobicContact CB-CZ3 4.34Å; I34-W55 HydrophobicContact CD1-CH2 4.29Å; I34-W55 HydrophobicContact CD1-CZ3 3.92Å; I34-W55 HydrophobicContact CG2-CH2 3.48Å; I34-W55 VanDerWaalsContact CG2-CH2 3.48Å; I34-W55 HydrophobicContact CG2-CZ2 4.16Å; I34-W55 HydrophobicContact CG2-CZ3 4.17Å; I35-W55 HydrophobicContact CG1-CH2 4.49Å; V42-W55 HydrophobicContact CB-CZ2 4.13Å; V42-W55 HydrophobicContact CG2-CZ2 3.93Å; V42-W55 PolarHBondContact O-NE1 2.85Å; G43-W55 WeakPolarHBondContact O-CZ2 3.47Å; P45-W55 HydrophobicContact CB-CB 3.76Å; P45-W55 HydrophobicContact CB-CD2 3.94Å; P45-W55 HydrophobicContact CB-CE3 4.13Å; P45-W55 HydrophobicContact CB-CG 3.81Å; P45-W55 HydrophobicContact CG-CD2 3.89Å; P45-W55 HydrophobicContact CG-CE3 3.7Å; P45-W55 HydrophobicContact CG-CG 4.31Å; P45-W55 HydrophobicContact CG-CZ3 4.12Å; G51-W55 WeakPolarHBondContact O-CB 3.31Å; G51-W55 PolarHBondContact O-N 2.95Å; F52-W55 HydrophobicContact CD2-CE3 4.14Å; F52-W55 HydrophobicContact CD2-CZ3 4.41Å; F52-W55 HydrophobicContact CE2-CE3 4.25Å; F52-W55 HydrophobicContact CE2-CZ3 4.15Å; Q53-W55 PolarHBondContact O-N 3.4Å; W55-I61 HydrophobicContact CD2-CD1 3.69Å; W55-I61 HydrophobicContact CG-CD1 3.69Å; W55-I61 HydrophobicContact CH2-CG2 4.34Å; W55-I61 HydrophobicContact CZ2-CD1 3.91Å; W55-I61 HydrophobicContact CZ2-CG2 4.17Å; W55-I61 WeakPolarHBondContact O-CD1 3.23Å
56L96Very high94.1Very high0 Ų044.2 Ų44.20%022%0.216CC..Hα-helixtrans-87.6-18.5-179-61.7-179.7000113.9I34 F52 Q53 N58 G59 I61 L62 L117 V126 L130I34-L56 HydrophobicContact CD1-CD2 4.39Å; F52-L56 HydrophobicContact CD1-CD1 4.22Å; F52-L56 HydrophobicContact CD2-CD1 4.39Å; F52-L56 HydrophobicContact CE1-CD1 3.65Å; F52-L56 HydrophobicContact CE2-CD1 3.86Å; F52-L56 HydrophobicContact CZ-CD1 3.45Å; F52-L56 VanDerWaalsContact CZ-CD1 3.45Å; F52-L56 PolarHBondContact O-N 3.15Å; Q53-L56 PolarHBondContact O-N 2.93Å; L56-N58 VanDerWaalsContact C-N 3.28Å; L56-N58 PolarHBondContact O-N 3.43Å; L56-N58 VanDerWaalsContact O-N 3.12Å; L56-G59 PolarHBondContact O-N 2.88Å; L56-I61 HydrophobicContact CD2-CB 4.01Å; L56-I61 HydrophobicContact CD2-CG2 3.77Å; L56-L62 HydrophobicContact CB-CG 4.42Å; L56-L62 HydrophobicContact CD1-CD2 4.27Å; L56-L62 HydrophobicContact CD2-CD2 4.02Å; L56-L62 HydrophobicContact CD2-CG 4.23Å; L56-L117 HydrophobicContact CB-CD1 3.88Å; L56-L117 HydrophobicContact CB-CD2 4.19Å; L56-V126 HydrophobicContact CD1-CG1 4.26Å; L56-L130 HydrophobicContact CD1-CD1 4.15Å
57K94Very high94.2Very high62 Ų6238.4 Ų38.427%0.2719%0.185SC..THydrogen-bonded Turntrans-55.3-34.7-167.8-179.9166.3-179.9159.70115.1Q53 V54 G59 F118Q53-K57 VanDerWaalsContact O-CB 3.23Å; Q53-K57 WeakPolarHBondContact O-CB 3.32Å; Q53-K57 PolarHBondContact O-N 2.83Å; V54-K57 PolarHBondContact O-N 3.1Å; K57-G59 PolarHBondContact O-N 2.6Å; K57-F118 WeakPolarHBondContact CE-O 3.48Å; K57-F118 HydrophobicContact CG-CD2 4.04Å; K57-F118 HydrophobicContact CG-CE2 4.35Å; K57-F118 PolarHBondContact NZ-O 3.39Å
58N91.5Very high94.5Very high39 Ų3930.3 Ų30.321%0.20916%0.159CC..THydrogen-bonded Turntrans-79.7-5.1-179.169.919.3000113.7L56 V60 P84 Q90L56-N58 VanDerWaalsContact C-N 3.28Å; L56-N58 PolarHBondContact O-N 3.43Å; L56-N58 VanDerWaalsContact O-N 3.12Å; N58-V60 PolarHBondContact O-N 3.47Å; N58-V60 WeakPolarHBondContact OD1-CB 3.18Å; N58-V60 PolarHBondContact OD1-N 3.27Å; N58-P84 HydrophobicContact CB-CG 4.45Å; N58-P84 WeakPolarHBondContact O-CG 3.39Å; N58-Q90 HydrophobicContact CB-CG 4.23Å
59G93Very high94.7Very high0 Ų029.2 Ų29.20%015%0.147CC..SBendtrans74.7-7177.600000115.7L56 K57 S63L56-G59 PolarHBondContact O-N 2.88Å; K57-G59 PolarHBondContact O-N 2.6Å; G59-S63 WeakPolarHBondContact O-CB 3.3Å; G59-S63 PolarHBondContact O-N 3.37Å; G59-S63 PolarHBondContact O-OG 3.2Å
60V94.7Very high94.8Very high14 Ų1426.8 Ų26.89%0.08514%0.138CC..Hα-helixtrans-66-45.1-176.3173.10000110.7N58 S63 K64 V79 P80 P84N58-V60 PolarHBondContact O-N 3.47Å; N58-V60 WeakPolarHBondContact OD1-CB 3.18Å; N58-V60 PolarHBondContact OD1-N 3.27Å; V60-S63 WeakPolarHBondContact O-CB 3.5Å; V60-S63 PolarHBondContact O-N 3.33Å; V60-K64 HydrophobicContact CG1-CD 4.43Å; V60-K64 WeakPolarHBondContact O-CG 3.33Å; V60-K64 PolarHBondContact O-N 2.95Å; V60-V79 HydrophobicContact CG1-CG1 3.96Å; V60-P80 HydrophobicContact CG2-CG 4.22Å; V60-P84 HydrophobicContact CG2-CG 4.48Å
61I96.1Very high94.7Very high13 Ų1324 Ų247%0.06713%0.127CC..Hα-helixtrans-68-42.4-178.1-60-174.5000111I34 V42 W55 L56 S63 K64 L65I34-I61 HydrophobicContact CG2-CG2 3.61Å; V42-I61 HydrophobicContact CB-CD1 4.33Å; V42-I61 HydrophobicContact CB-CG1 4.48Å; V42-I61 HydrophobicContact CB-CG2 4.36Å; V42-I61 HydrophobicContact CG1-CG1 4.49Å; V42-I61 HydrophobicContact CG1-CG2 4.26Å; W55-I61 HydrophobicContact CD2-CD1 3.69Å; W55-I61 HydrophobicContact CG-CD1 3.69Å; W55-I61 HydrophobicContact CH2-CG2 4.34Å; W55-I61 HydrophobicContact CZ2-CD1 3.91Å; W55-I61 HydrophobicContact CZ2-CG2 4.17Å; W55-I61 WeakPolarHBondContact O-CD1 3.23Å; L56-I61 HydrophobicContact CD2-CB 4.01Å; L56-I61 HydrophobicContact CD2-CG2 3.77Å; I61-S63 VanDerWaalsContact C-N 3.27Å; I61-S63 PolarHBondContact O-N 3.1Å; I61-K64 PolarHBondContact O-N 2.63Å; I61-L65 WeakPolarHBondContact O-CB 3.48Å; I61-L65 PolarHBondContact O-N 2.96Å
62L96.5Very high94.2Very high0 Ų029.9 Ų29.90%016%0.156CC..Hα-helixtrans-59.2-40.8173.5-66.2177.6000111.8L56 L65 V66 V94 F97 F112 L117 L130L56-L62 HydrophobicContact CB-CG 4.42Å; L56-L62 HydrophobicContact CD1-CD2 4.27Å; L56-L62 HydrophobicContact CD2-CD2 4.02Å; L56-L62 HydrophobicContact CD2-CG 4.23Å; L62-L65 WeakPolarHBondContact O-CB 3.37Å; L62-L65 PolarHBondContact O-N 2.76Å; L62-V66 PolarHBondContact O-N 2.71Å; L62-V94 HydrophobicContact CD1-CG2 4.48Å; L62-F97 HydrophobicContact CB-CB 4.01Å; L62-F97 HydrophobicContact CB-CD1 4.05Å; L62-F97 HydrophobicContact CB-CD2 3.74Å; L62-F97 HydrophobicContact CB-CE2 4.21Å; L62-F97 HydrophobicContact CB-CG 3.63Å; L62-F97 HydrophobicContact CD1-CD1 4Å; L62-F97 HydrophobicContact CD1-CE1 4.34Å; L62-F97 HydrophobicContact CD1-CG 4.39Å; L62-F97 HydrophobicContact CD2-CE1 4.26Å; L62-F97 HydrophobicContact CD2-CE2 4.42Å; L62-F97 HydrophobicContact CD2-CZ 4.18Å; L62-F97 HydrophobicContact CG-CD1 4.44Å; L62-F97 HydrophobicContact CG-CG 4.5Å; L62-F97 WeakPolarHBondContact O-CD2 3.34Å; L62-F112 HydrophobicContact CD1-CZ 4.09Å; L62-L117 HydrophobicContact CD1-CD2 3.5Å; L62-L117 VanDerWaalsContact CD1-CD2 3.5Å; L62-L130 HydrophobicContact CD2-CD2 3.88Å
63S95.6Very high93.7Very high0 Ų034 Ų340%020%0.198CC..Hα-helixtrans-67.3-41.8177.3-550000112.1G59 V60 I61 L65 V66 N67 Q93G59-S63 WeakPolarHBondContact O-CB 3.3Å; G59-S63 PolarHBondContact O-N 3.37Å; G59-S63 PolarHBondContact O-OG 3.2Å; V60-S63 WeakPolarHBondContact O-CB 3.5Å; V60-S63 PolarHBondContact O-N 3.33Å; I61-S63 VanDerWaalsContact C-N 3.27Å; I61-S63 PolarHBondContact O-N 3.1Å; S63-L65 VanDerWaalsContact C-N 3.31Å; S63-V66 WeakPolarHBondContact O-CG1 3.45Å; S63-N67 VanDerWaalsContact O-CB 3.24Å; S63-N67 WeakPolarHBondContact O-CB 3.17Å; S63-N67 PolarHBondContact O-N 2.99Å; S63-N67 PolarHBondContact O-ND2 3.46Å; S63-Q93 PolarHBondContact OG-NE2 3.44Å
64K95.2Very high93.4Very high73 Ų7335.7 Ų35.732%0.31721%0.213SC..Hα-helixtrans-61-42.3172.6-73.1-179177-171.30111.2V42 V60 I61 N67 S68 V79V42-K64 HydrophobicContact CG1-CD 3.98Å; V60-K64 HydrophobicContact CG1-CD 4.43Å; V60-K64 WeakPolarHBondContact O-CG 3.33Å; V60-K64 PolarHBondContact O-N 2.95Å; I61-K64 PolarHBondContact O-N 2.63Å; K64-N67 PolarHBondContact O-N 3.3Å; K64-S68 WeakPolarHBondContact O-CB 3.48Å; K64-S68 PolarHBondContact O-N 3.11Å; K64-V79 HydrophobicContact CG-CG1 4.19Å; K64-V79 HydrophobicContact CG-CG2 4.18Å
65L96.4Very high93.2Very high0 Ų036 Ų360%021%0.206CC..Hα-helixtrans-60.4-56.8179.4179.967.7000111.3W33 I34 Q37 C38 I61 L62 S63 N67 S68 L130 L133W33-L65 HydrophobicContact CE3-CD1 4.46Å; W33-L65 HydrophobicContact CH2-CD1 3.96Å; W33-L65 HydrophobicContact CH2-CD2 3.98Å; W33-L65 HydrophobicContact CH2-CG 4.25Å; W33-L65 HydrophobicContact CZ2-CD1 4.04Å; W33-L65 HydrophobicContact CZ3-CD1 4.18Å; W33-L65 HydrophobicContact CZ3-CD2 3.83Å; W33-L65 HydrophobicContact CZ3-CG 4.49Å; I34-L65 HydrophobicContact CD1-CD2 4.4Å; I34-L65 HydrophobicContact CG1-CD1 4.09Å; I34-L65 HydrophobicContact CG1-CD2 3.97Å; Q37-L65 HydrophobicContact CB-CD1 4.02Å; Q37-L65 HydrophobicContact CG-CD1 3.67Å; C38-L65 WeakPolarHBondContact SG-CA 3.4Å; C38-L65 PolarHBondContact SG-N 3.37Å; I61-L65 WeakPolarHBondContact O-CB 3.48Å; I61-L65 PolarHBondContact O-N 2.96Å; L62-L65 WeakPolarHBondContact O-CB 3.37Å; L62-L65 PolarHBondContact O-N 2.76Å; S63-L65 VanDerWaalsContact C-N 3.31Å; L65-N67 VanDerWaalsContact C-N 3.3Å; L65-N67 PolarHBondContact O-N 3.44Å; L65-S68 PolarHBondContact O-N 2.67Å; L65-S68 PolarHBondContact O-OG 3.05Å; L65-L130 HydrophobicContact CD2-CD2 3.61Å; L65-L133 HydrophobicContact CD2-CD2 4.31Å
66V95.8Very high93Very high0 Ų037.3 Ų37.30%022%0.219CC..Hα-helixtrans-61.9-41.4-179.769.40000111.1L62 S63 S68 L69 Y70 P76 V77 F97 A100L62-V66 PolarHBondContact O-N 2.71Å; S63-V66 WeakPolarHBondContact O-CG1 3.45Å; V66-S68 VanDerWaalsContact C-N 3.28Å; V66-S68 PolarHBondContact O-N 3.4Å; V66-L69 WeakPolarHBondContact O-CB 3.43Å; V66-L69 PolarHBondContact O-N 3.3Å; V66-L69 VanDerWaalsContact O-N 3.1Å; V66-Y70 HydrophobicContact CG2-CE2 4.05Å; V66-Y70 VanDerWaalsContact O-CD2 3.27Å; V66-Y70 WeakPolarHBondContact O-CD2 3.41Å; V66-P76 HydrophobicContact CG1-CG 4.42Å; V66-P76 HydrophobicContact CG2-CG 4.3Å; V66-V77 HydrophobicContact CG1-CG2 3.94Å; V66-F97 HydrophobicContact CB-CD2 3.88Å; V66-F97 HydrophobicContact CB-CE2 4.08Å; V66-F97 HydrophobicContact CG1-CD2 3.91Å; V66-A100 HydrophobicContact CG1-CB 4.04Å; V66-A100 HydrophobicContact CG2-CB 3.76Å
67N95.6Very high92.9Very high10 Ų1037.7 Ų37.75%0.05322%0.221CC..Hα-helixtrans-62.8-32.7178.7-76.6-13000113.8S63 K64 L65 L69 Y70 K75 P76 V77 V79S63-N67 VanDerWaalsContact O-CB 3.24Å; S63-N67 WeakPolarHBondContact O-CB 3.17Å; S63-N67 PolarHBondContact O-N 2.99Å; S63-N67 PolarHBondContact O-ND2 3.46Å; K64-N67 PolarHBondContact O-N 3.3Å; L65-N67 VanDerWaalsContact C-N 3.3Å; L65-N67 PolarHBondContact O-N 3.44Å; N67-L69 PolarHBondContact O-N 3.44Å; N67-Y70 PolarHBondContact O-N 3.31Å; N67-Y70 VanDerWaalsContact O-N 3.11Å; N67-Y70 VanDerWaalsContact O-O 3.12Å; N67-K75 HydrophobicContact CB-CB 4.23Å; N67-K75 HydrophobicContact CB-CD 4.15Å; N67-K75 HydrophobicContact CB-CG 4.02Å; N67-P76 WeakPolarHBondContact OD1-CD 3.29Å; N67-V77 PolarHBondContact ND2-O 3.48Å; N67-V77 PolarHBondContact OD1-N 3.07Å; N67-V77 PolarHBondContact OD1-O 3.34Å; N67-V79 WeakPolarHBondContact ND2-CG2 3.5Å
68S94.6Very high92.8Very high27 Ų2743.3 Ų43.319%0.18925%0.245CC..Hα-helixtrans-68-19.9178.174.70000113.2Q37 K64 L65 V66Q37-S68 WeakPolarHBondContact CG-OG 3.44Å; Q37-S68 PolarHBondContact NE2-O 3.34Å; Q37-S68 PolarHBondContact NE2-OG 3.48Å; K64-S68 WeakPolarHBondContact O-CB 3.48Å; K64-S68 PolarHBondContact O-N 3.11Å; L65-S68 PolarHBondContact O-N 2.67Å; L65-S68 PolarHBondContact O-OG 3.05Å; V66-S68 VanDerWaalsContact C-N 3.28Å; V66-S68 PolarHBondContact O-N 3.4Å
69L93.9Very high92.8Very high2 Ų243.6 Ų43.61%0.0125%0.249CC..THydrogen-bonded Turntrans-82.9-3.4174.9-59.4175.5000112.4Q37 V66 N67 Y104 L133 A137Q37-L69 HydrophobicContact CG-CD2 4.42Å; V66-L69 WeakPolarHBondContact O-CB 3.43Å; V66-L69 PolarHBondContact O-N 3.3Å; V66-L69 VanDerWaalsContact O-N 3.1Å; N67-L69 PolarHBondContact O-N 3.44Å; L69-Y104 HydrophobicContact CB-CE2 3.96Å; L69-Y104 HydrophobicContact CD1-CE1 4.3Å; L69-L133 HydrophobicContact CD1-CD1 3.91Å; L69-L133 HydrophobicContact CD1-CD2 4.11Å; L69-L133 HydrophobicContact CD1-CG 3.86Å; L69-A137 HydrophobicContact CD1-CB 4.18Å; L69-A137 HydrophobicContact CD2-CB 3.7Å
70Y93.1Very high92.5Very high48 Ų4845.6 Ų45.619%0.18826%0.262CS..SBendtrans-113.2151.8176.5-73.8-104.8000110.4V66 N67 S74 P76 Y104V66-Y70 HydrophobicContact CG2-CE2 4.05Å; V66-Y70 VanDerWaalsContact O-CD2 3.27Å; V66-Y70 WeakPolarHBondContact O-CD2 3.41Å; N67-Y70 PolarHBondContact O-N 3.31Å; N67-Y70 VanDerWaalsContact O-N 3.11Å; N67-Y70 VanDerWaalsContact O-O 3.12Å; Y70-S74 WeakPolarHBondContact CD1-O 3.48Å; Y70-P76 HydrophobicContact CD2-CG 3.9Å; Y70-P76 HydrophobicContact CE2-CG 3.73Å; Y70-P76 HydrophobicContact CG-CG 4.38Å; Y70-Y104 HydrophobicContact CD2-CD2 4.4Å; Y70-Y104 AromaticContact CE2-CD2 3.52Å; Y70-Y104 HydrophobicContact CE2-CD2 3.52Å; Y70-Y104 HydrophobicContact CE2-CE2 4.11Å; Y70-Y104 HydrophobicContact CE2-CG 4.45Å; Y70-Y104 AromaticContact CZ-CD2 3.66Å
71P90.5Very high91.8Very high60 Ų6054.1 Ų54.139%0.3930%0.3SS..  trans-54.3155.7166.4-21.526.1000112.8G73 S74 H144P71-G73 PolarHBondContact O-N 2.98Å; P71-S74 VanDerWaalsContact CD-OG 3.31Å; P71-S74 WeakPolarHBondContact CD-OG 3.2Å; P71-S74 PolarHBondContact O-N 2.88Å; P71-S74 PolarHBondContact O-OG 3.43Å; P71-H144 WeakPolarHBondContact CG-NE2 3.25Å
72D84.2Confident91.3Very high137 Ų13759.5 Ų59.573%0.73333%0.329SS*.THydrogen-bonded Turntrans-58.7-27.7-172.9-83.2-43.1000114.9K75D72-K75 WeakPolarHBondContact OD1-CE 3.44Å; D72-K75 IonicContact OD1-NZ 2.72Å; D72-K75 PolarHBondContact OD1-NZ 3.12Å
73G83.6Confident90.7Very high86 Ų8663.7 Ų63.789%0.88736%0.357SS*.THydrogen-bonded Turntrans-90.3-5.9179.800000115.9P71P71-G73 PolarHBondContact O-N 2.98Å
74S89.6Confident90.2Very high57 Ų5764.3 Ų64.340%0.39936%0.361SS..  trans-124.224.3-175.358.50000113.4Y70 P71 P76Y70-S74 WeakPolarHBondContact CD1-O 3.48Å; P71-S74 VanDerWaalsContact CD-OG 3.31Å; P71-S74 WeakPolarHBondContact CD-OG 3.2Å; P71-S74 PolarHBondContact O-N 2.88Å; P71-S74 PolarHBondContact O-OG 3.43Å; S74-P76 WeakPolarHBondContact O-CD 3.36Å
75K91.8Very high89.7Confident99 Ų9965.9 Ų65.943%0.4338%0.381SS..  trans-58.6117.2177.8-68.4-178.7-175.2167.70110.6N67 D72 V77N67-K75 HydrophobicContact CB-CB 4.23Å; N67-K75 HydrophobicContact CB-CD 4.15Å; N67-K75 HydrophobicContact CB-CG 4.02Å; D72-K75 WeakPolarHBondContact OD1-CE 3.44Å; D72-K75 IonicContact OD1-NZ 2.72Å; D72-K75 PolarHBondContact OD1-NZ 3.12Å; K75-V77 PolarHBondContact O-N 2.93Å
76P91.9Very high89.5Confident57 Ų5771.2 Ų71.237%0.3741%0.407SS..SBendtrans-73.6-23.9-173.227.6-36.8000113.9V66 N67 Y70 S74 A100V66-P76 HydrophobicContact CG1-CG 4.42Å; V66-P76 HydrophobicContact CG2-CG 4.3Å; N67-P76 WeakPolarHBondContact OD1-CD 3.29Å; Y70-P76 HydrophobicContact CD2-CG 3.9Å; Y70-P76 HydrophobicContact CE2-CG 3.73Å; Y70-P76 HydrophobicContact CG-CG 4.38Å; S74-P76 WeakPolarHBondContact O-CD 3.36Å; P76-A100 HydrophobicContact CB-CB 3.76Å; P76-A100 HydrophobicContact CG-CB 3.68Å
77V94Very high89.3Confident8 Ų874.9 Ų74.95%0.04843%0.43CS..SBendtrans-120.4134.1-173.1-176.10000111V66 N67 K75 V79 Q96 A100V66-V77 HydrophobicContact CG1-CG2 3.94Å; N67-V77 PolarHBondContact ND2-O 3.48Å; N67-V77 PolarHBondContact OD1-N 3.07Å; N67-V77 PolarHBondContact OD1-O 3.34Å; K75-V77 PolarHBondContact O-N 2.93Å; V77-V79 PolarHBondContact O-N 2.83Å; V77-Q96 HydrophobicContact CG1-CB 3.85Å; V77-Q96 HydrophobicContact CG2-CB 4.26Å; V77-A100 HydrophobicContact CG2-CB 3.66Å
78K91.8Very high89.1Confident179 Ų17979.9 Ų79.978%0.77845%0.451SS*.PPolyproline II helixtrans-78.4122.2171.2-174.8172.9179.81770109.6Q93K78-Q93 PolarHBondContact O-NE2 2.75Å
79V90Very high89Confident46 Ų4683.7 Ų83.728%0.27946%0.464SS..PPolyproline II helixtrans-88.6122.7174-176.20000108.4V60 K64 N67 V77V60-V79 HydrophobicContact CG1-CG1 3.96Å; K64-V79 HydrophobicContact CG-CG1 4.19Å; K64-V79 HydrophobicContact CG-CG2 4.18Å; N67-V79 WeakPolarHBondContact ND2-CG2 3.5Å; V77-V79 PolarHBondContact O-N 2.83Å
80P87.3Confident89Confident42 Ų4285.2 Ų85.227%0.27347%0.471SS..PPolyproline II helixtrans-69.7146.2176.129.2-34.1000110.9V60 N82V60-P80 HydrophobicContact CG2-CG 4.22Å; P80-N82 VanDerWaalsContact C-N 3.32Å; P80-N82 PolarHBondContact O-N 2.9Å
81E81.3Confident89Confident192 Ų19285.5 Ų85.590%0.89748%0.475SS*.SBendtrans-62.2-41.3177.4-67.8178.2176.800111.9
82N85.1Confident89.3Confident126 Ų12687.7 Ų87.767%0.67448%0.48SS*.SBendtrans-107.9139.8177.4-67.1-52.5000110.5P80P80-N82 VanDerWaalsContact C-N 3.32Å; P80-N82 PolarHBondContact O-N 2.9Å
83P83.1Confident89.8Confident88 Ų8881.9 Ų81.957%0.57145%0.449SS*.  trans-54.3132.2174.6-26.534.6000111.6S85P83-S85 PolarHBondContact O-N 3.22Å; P83-S85 VanDerWaalsContact O-N 3.15Å
84P84.9Confident90.4Very high13 Ų1377.9 Ų77.98%0.08441%0.407CS..  trans-64.1119.7-179.220.8-27.6000110.1N58 V60 K89 Q90N58-P84 HydrophobicContact CB-CG 4.45Å; N58-P84 WeakPolarHBondContact O-CG 3.39Å; V60-P84 HydrophobicContact CG2-CG 4.48Å; P84-K89 HydrophobicContact CB-CB 3.64Å; P84-Q90 HydrophobicContact CB-CG 4.07Å; P84-Q90 HydrophobicContact CG-CG 3.92Å; P84-Q90 WeakPolarHBondContact O-CG 3.25Å; P84-Q90 PolarHBondContact O-NE2 3Å
85S86Confident90.7Very high107 Ų10777.2 Ų77.275%0.74841%0.405SS*.  trans-81.9-29.8176.3177.60000112.8P83P83-S85 PolarHBondContact O-N 3.22Å; P83-S85 VanDerWaalsContact O-N 3.15Å
86M91.1Very high91Very high111 Ų11175.7 Ų75.755%0.54740%0.399SS..SBendtrans-81.1132.5-177.3-65.5-66.6-85.700110.6F88 K89 Q90M86-F88 VanDerWaalsContact C-N 3.29Å; M86-F88 HydrophobicContact CB-CD1 3.71Å; M86-F88 HydrophobicContact CB-CE1 3.59Å; M86-F88 HydrophobicContact CB-CZ 4.49Å; M86-F88 HydrophobicContact CE-CD1 4.42Å; M86-F88 HydrophobicContact CE-CE1 4.05Å; M86-F88 HydrophobicContact CG-CE1 4.01Å; M86-F88 PolarHBondContact O-N 3.04Å; M86-K89 HydrophobicContact CB-CB 4.44Å; M86-K89 HydrophobicContact CB-CD 4.48Å; M86-K89 HydrophobicContact CB-CG 4.21Å; M86-K89 WeakPolarHBondContact O-CB 3.5Å; M86-K89 PolarHBondContact O-N 3.47Å; M86-Q90 PolarHBondContact O-N 3.39Å; M86-Q90 VanDerWaalsContact O-N 3.08Å
87V91.8Very high91.2Very high78 Ų7873 Ų7347%0.47338%0.382SS..Hα-helixtrans-52.3-45.5-178.9170.70000112.5K89 Q90 M91 F118V87-K89 VanDerWaalsContact C-N 3.29Å; V87-K89 PolarHBondContact O-N 2.94Å; V87-Q90 PolarHBondContact O-N 3.25Å; V87-M91 HydrophobicContact CG1-CE 3.97Å; V87-M91 HydrophobicContact CG1-CG 4.45Å; V87-M91 HydrophobicContact CG1-SD 4.23Å; V87-M91 WeakPolarHBondContact O-CG 3.42Å; V87-M91 PolarHBondContact O-N 3.32Å; V87-F118 HydrophobicContact CB-CZ 4.09Å; V87-F118 HydrophobicContact CG1-CE1 3.87Å; V87-F118 HydrophobicContact CG1-CE2 3.96Å; V87-F118 HydrophobicContact CG1-CZ 3.37Å; V87-F118 HydrophobicContact CG2-CZ 3.94Å
88F92.3Very high91.4Very high115 Ų11573.3 Ų73.350%0.50438%0.383SS..Hα-helixtrans-62.3-37-179.680.7-93000112.2M86 M91 E92M86-F88 VanDerWaalsContact C-N 3.29Å; M86-F88 HydrophobicContact CB-CD1 3.71Å; M86-F88 HydrophobicContact CB-CE1 3.59Å; M86-F88 HydrophobicContact CB-CZ 4.49Å; M86-F88 HydrophobicContact CE-CD1 4.42Å; M86-F88 HydrophobicContact CE-CE1 4.05Å; M86-F88 HydrophobicContact CG-CE1 4.01Å; M86-F88 PolarHBondContact O-N 3.04Å; F88-M91 PolarHBondContact O-N 2.9Å; F88-E92 VanDerWaalsContact O-CB 3.31Å; F88-E92 WeakPolarHBondContact O-CB 3.35Å; F88-E92 PolarHBondContact O-N 3.25Å
89K92.6Very high91.6Very high107 Ų10771.5 Ų71.547%0.46538%0.375SS..Hα-helixtrans-70.4-38.1177.4-66.6-169175.9-174.90111.8P84 M86 V87 E92 Q93P84-K89 HydrophobicContact CB-CB 3.64Å; M86-K89 HydrophobicContact CB-CB 4.44Å; M86-K89 HydrophobicContact CB-CD 4.48Å; M86-K89 HydrophobicContact CB-CG 4.21Å; M86-K89 WeakPolarHBondContact O-CB 3.5Å; M86-K89 PolarHBondContact O-N 3.47Å; V87-K89 VanDerWaalsContact C-N 3.29Å; V87-K89 PolarHBondContact O-N 2.94Å; K89-E92 PolarHBondContact O-N 3.37Å; K89-Q93 WeakPolarHBondContact O-CB 3.42Å; K89-Q93 PolarHBondContact O-N 3.04Å
90Q93.2Very high91.9Very high33 Ų3369.4 Ų69.415%0.15436%0.362CS..Hα-helixtrans-61.4-47.2173.6-67.4179.24.400110.5N58 P84 M86 V87 Q93 V94 F118N58-Q90 HydrophobicContact CB-CG 4.23Å; P84-Q90 HydrophobicContact CB-CG 4.07Å; P84-Q90 HydrophobicContact CG-CG 3.92Å; P84-Q90 WeakPolarHBondContact O-CG 3.25Å; P84-Q90 PolarHBondContact O-NE2 3Å; M86-Q90 PolarHBondContact O-N 3.39Å; M86-Q90 VanDerWaalsContact O-N 3.08Å; V87-Q90 PolarHBondContact O-N 3.25Å; Q90-Q93 PolarHBondContact O-N 2.83Å; Q90-V94 WeakPolarHBondContact O-CG2 3.34Å; Q90-V94 PolarHBondContact O-N 2.73Å; Q90-V94 VanDerWaalsContact O-N 3.11Å; Q90-F118 HydrophobicContact CB-CD2 4.44Å; Q90-F118 HydrophobicContact CB-CE2 4.05Å; Q90-F118 VanDerWaalsContact OE1-CE2 3.26Å
91M94.1Very high92.4Very high55 Ų5567.4 Ų67.427%0.27135%0.349SS..Hα-helixtrans-63.2-41.6177.6-72.1-172.8172.100112.6V87 F88 V94 A95 T114 F118V87-M91 HydrophobicContact CG1-CE 3.97Å; V87-M91 HydrophobicContact CG1-CG 4.45Å; V87-M91 HydrophobicContact CG1-SD 4.23Å; V87-M91 WeakPolarHBondContact O-CG 3.42Å; V87-M91 PolarHBondContact O-N 3.32Å; F88-M91 PolarHBondContact O-N 2.9Å; M91-V94 PolarHBondContact O-N 3.06Å; M91-A95 PolarHBondContact O-N 3.42Å; M91-T114 HydrophobicContact CB-CG2 3.7Å; M91-T114 HydrophobicContact CG-CG2 3.83Å; M91-T114 WeakPolarHBondContact O-CG2 3.39Å; M91-F118 HydrophobicContact CE-CB 4.19Å; M91-F118 HydrophobicContact CE-CD1 3.27Å; M91-F118 HydrophobicContact CE-CD2 4.15Å; M91-F118 HydrophobicContact CE-CE1 3.62Å; M91-F118 HydrophobicContact CE-CE2 4.4Å; M91-F118 HydrophobicContact CE-CG 3.59Å; M91-F118 HydrophobicContact CE-CZ 4.2Å; M91-F118 HydrophobicContact CG-CD2 3.91Å; M91-F118 HydrophobicContact CG-CE2 4.28Å; M91-F118 HydrophobicContact CG-CG 4.13Å
92E95Very high93.1Very high106 Ų10661.8 Ų61.850%0.49532%0.323SS..Hα-helixtrans-62.8-42.1175.3-174179.4-176.500111.6F88 K89 V94 A95 Q96F88-E92 VanDerWaalsContact O-CB 3.31Å; F88-E92 WeakPolarHBondContact O-CB 3.35Å; F88-E92 PolarHBondContact O-N 3.25Å; K89-E92 PolarHBondContact O-N 3.37Å; E92-V94 VanDerWaalsContact C-N 3.34Å; E92-V94 PolarHBondContact O-N 3.48Å; E92-A95 WeakPolarHBondContact O-CB 3.29Å; E92-A95 PolarHBondContact O-N 2.88Å; E92-A95 VanDerWaalsContact O-N 3.12Å; E92-Q96 WeakPolarHBondContact O-CG 3.41Å; E92-Q96 PolarHBondContact O-N 3.25Å
93Q95.4Very high93.6Very high15 Ų1560.9 Ų60.97%0.0732%0.319CS..Hα-helixtrans-61.2-43.4177.7-165.169.339.600111.9S63 K78 K89 Q90 A95 Q96 F97S63-Q93 PolarHBondContact OG-NE2 3.44Å; K78-Q93 PolarHBondContact O-NE2 2.75Å; K89-Q93 WeakPolarHBondContact O-CB 3.42Å; K89-Q93 PolarHBondContact O-N 3.04Å; Q90-Q93 PolarHBondContact O-N 2.83Å; Q93-A95 VanDerWaalsContact C-N 3.33Å; Q93-Q96 PolarHBondContact O-N 3.29Å; Q93-F97 PolarHBondContact O-N 3.28Å; Q93-F97 VanDerWaalsContact O-N 3.15Å
94V96.6Very high94.1Very high1 Ų157 Ų571%0.00629%0.292CS..Hα-helixtrans-63.6-39.8174.7173.80000111L62 Q90 M91 E92 Q96 F97 L98 F112 T114 L117L62-V94 HydrophobicContact CD1-CG2 4.48Å; Q90-V94 WeakPolarHBondContact O-CG2 3.34Å; Q90-V94 PolarHBondContact O-N 2.73Å; Q90-V94 VanDerWaalsContact O-N 3.11Å; M91-V94 PolarHBondContact O-N 3.06Å; E92-V94 VanDerWaalsContact C-N 3.34Å; E92-V94 PolarHBondContact O-N 3.48Å; V94-Q96 VanDerWaalsContact C-N 3.35Å; V94-Q96 PolarHBondContact O-N 2.89Å; V94-F97 WeakPolarHBondContact O-CB 3.33Å; V94-F97 PolarHBondContact O-N 3.32Å; V94-L98 HydrophobicContact CG1-CD1 4.4Å; V94-L98 WeakPolarHBondContact O-CG 3.44Å; V94-L98 PolarHBondContact O-N 3.48Å; V94-F112 HydrophobicContact CG1-CE2 3.61Å; V94-F112 HydrophobicContact CG1-CZ 3.96Å; V94-T114 HydrophobicContact CB-CG2 4.02Å; V94-T114 HydrophobicContact CG1-CG2 4.02Å; V94-L117 HydrophobicContact CG1-CD2 4.14Å; V94-L117 HydrophobicContact CG2-CD2 3.97Å
95A96.3Very high94.5Very high43 Ų4358.3 Ų58.336%0.35531%0.308SS..Hα-helixtrans-64.5-37.3176.700000112.6M91 E92 Q93 L98 K99M91-A95 PolarHBondContact O-N 3.42Å; E92-A95 WeakPolarHBondContact O-CB 3.29Å; E92-A95 PolarHBondContact O-N 2.88Å; E92-A95 VanDerWaalsContact O-N 3.12Å; Q93-A95 VanDerWaalsContact C-N 3.33Å; A95-L98 PolarHBondContact O-N 3.46Å; A95-K99 PolarHBondContact O-N 3.42Å
96Q96.8Very high94.9Very high68 Ų6853.4 Ų53.432%0.31827%0.274SS..Hα-helixtrans-63.5-41.8174.3-69.5174.813.800111.7V77 E92 Q93 V94 K99 A100V77-Q96 HydrophobicContact CG1-CB 3.85Å; V77-Q96 HydrophobicContact CG2-CB 4.26Å; E92-Q96 WeakPolarHBondContact O-CG 3.41Å; E92-Q96 PolarHBondContact O-N 3.25Å; Q93-Q96 PolarHBondContact O-N 3.29Å; V94-Q96 VanDerWaalsContact C-N 3.35Å; V94-Q96 PolarHBondContact O-N 2.89Å; Q96-K99 PolarHBondContact O-N 3.09Å; Q96-A100 WeakPolarHBondContact O-CB 3.43Å; Q96-A100 PolarHBondContact O-N 3.08Å
97F97.3Very high95.1Very high0 Ų052.7 Ų52.70%027%0.271CS..Hα-helixtrans-58.8-47.2171.4161.2-98.1000111.9L62 V66 Q93 V94 K99 A100 A101 F112 L130 L133L62-F97 HydrophobicContact CB-CB 4.01Å; L62-F97 HydrophobicContact CB-CD1 4.05Å; L62-F97 HydrophobicContact CB-CD2 3.74Å; L62-F97 HydrophobicContact CB-CE2 4.21Å; L62-F97 HydrophobicContact CB-CG 3.63Å; L62-F97 HydrophobicContact CD1-CD1 4Å; L62-F97 HydrophobicContact CD1-CE1 4.34Å; L62-F97 HydrophobicContact CD1-CG 4.39Å; L62-F97 HydrophobicContact CD2-CE1 4.26Å; L62-F97 HydrophobicContact CD2-CE2 4.42Å; L62-F97 HydrophobicContact CD2-CZ 4.18Å; L62-F97 HydrophobicContact CG-CD1 4.44Å; L62-F97 HydrophobicContact CG-CG 4.5Å; L62-F97 WeakPolarHBondContact O-CD2 3.34Å; V66-F97 HydrophobicContact CB-CD2 3.88Å; V66-F97 HydrophobicContact CB-CE2 4.08Å; V66-F97 HydrophobicContact CG1-CD2 3.91Å; Q93-F97 PolarHBondContact O-N 3.28Å; Q93-F97 VanDerWaalsContact O-N 3.15Å; V94-F97 WeakPolarHBondContact O-CB 3.33Å; V94-F97 PolarHBondContact O-N 3.32Å; F97-K99 VanDerWaalsContact C-N 3.31Å; F97-K99 PolarHBondContact O-N 3.23Å; F97-A100 PolarHBondContact O-N 2.96Å; F97-A101 HydrophobicContact CE2-CB 4.49Å; F97-A101 HydrophobicContact CZ-CB 4.29Å; F97-A101 WeakPolarHBondContact O-CB 3.38Å; F97-A101 PolarHBondContact O-N 3.17Å; F97-F112 HydrophobicContact CD1-CE1 4.33Å; F97-F112 HydrophobicContact CD1-CZ 4.12Å; F97-F112 AromaticContact CE1-CE1 3.73Å; F97-F112 HydrophobicContact CE1-CE1 3.73Å; F97-F112 AromaticContact CE1-CZ 3.98Å; F97-F112 HydrophobicContact CE1-CZ 3.98Å; F97-L130 HydrophobicContact CZ-CD2 4.12Å; F97-L133 HydrophobicContact CE2-CD2 3.92Å; F97-L133 HydrophobicContact CZ-CD2 4.14Å
98L97.4Very high95.1Very high14 Ų1455.8 Ų55.87%0.07328%0.278CS..Hα-helixtrans-59.4-43.4-179.7-73174.2000111.4V94 A95 A101 E102 M111 F112V94-L98 HydrophobicContact CG1-CD1 4.4Å; V94-L98 WeakPolarHBondContact O-CG 3.44Å; V94-L98 PolarHBondContact O-N 3.48Å; A95-L98 PolarHBondContact O-N 3.46Å; L98-A101 PolarHBondContact O-N 3.49Å; L98-E102 PolarHBondContact O-N 3.04Å; L98-M111 HydrophobicContact CB-CE 3.64Å; L98-M111 HydrophobicContact CD2-CE 3.9Å; L98-M111 HydrophobicContact CG-CE 4.33Å; L98-M111 WeakPolarHBondContact O-CE 3.35Å; L98-F112 HydrophobicContact CD1-CD2 4.42Å; L98-F112 HydrophobicContact CD1-CE2 4.16Å; L98-F112 WeakPolarHBondContact CD1-O 3.45Å; L98-F112 HydrophobicContact CD2-CD1 3.92Å; L98-F112 HydrophobicContact CD2-CD2 4.19Å; L98-F112 HydrophobicContact CD2-CE1 3.71Å; L98-F112 HydrophobicContact CD2-CE2 3.96Å; L98-F112 HydrophobicContact CD2-CG 4.15Å; L98-F112 HydrophobicContact CD2-CZ 3.71Å; L98-F112 WeakPolarHBondContact CD2-O 3.4Å; L98-F112 HydrophobicContact CG-CE2 4.29Å; L98-F112 HydrophobicContact CG-CZ 4.22Å
99K96.8Very high95.2Very high141 Ų14155.8 Ų55.861%0.61329%0.288SS*.Hα-helixtrans-60.9-46.6174.9-175.2173.1-179.91800111.8A95 Q96 F97 A101 E102 D103A95-K99 PolarHBondContact O-N 3.42Å; Q96-K99 PolarHBondContact O-N 3.09Å; F97-K99 VanDerWaalsContact C-N 3.31Å; F97-K99 PolarHBondContact O-N 3.23Å; K99-A101 VanDerWaalsContact C-N 3.3Å; K99-A101 PolarHBondContact O-N 2.92Å; K99-E102 WeakPolarHBondContact O-CB 3.38Å; K99-E102 PolarHBondContact O-N 3.37Å; K99-D103 PolarHBondContact O-N 3.36Å
100A96.6Very high95.3Very high2 Ų253.2 Ų53.22%0.01728%0.279CS..Hα-helixtrans-63.8-34.7177.300000112.8V66 P76 V77 Q96 F97 D103 Y104V66-A100 HydrophobicContact CG1-CB 4.04Å; V66-A100 HydrophobicContact CG2-CB 3.76Å; P76-A100 HydrophobicContact CB-CB 3.76Å; P76-A100 HydrophobicContact CG-CB 3.68Å; V77-A100 HydrophobicContact CG2-CB 3.66Å; Q96-A100 WeakPolarHBondContact O-CB 3.43Å; Q96-A100 PolarHBondContact O-N 3.08Å; F97-A100 PolarHBondContact O-N 2.96Å; A100-D103 PolarHBondContact O-N 3.48Å; A100-Y104 WeakPolarHBondContact O-CB 3.42Å; A100-Y104 PolarHBondContact O-N 3.49Å
101A96.4Very high95.4Very high0 Ų053.5 Ų53.50%028%0.281CS..Hα-helixtrans-68.7-39.2175.300000112F97 L98 K99 Y104 G105 V106F97-A101 HydrophobicContact CE2-CB 4.49Å; F97-A101 HydrophobicContact CZ-CB 4.29Å; F97-A101 WeakPolarHBondContact O-CB 3.38Å; F97-A101 PolarHBondContact O-N 3.17Å; L98-A101 PolarHBondContact O-N 3.49Å; K99-A101 VanDerWaalsContact C-N 3.3Å; K99-A101 PolarHBondContact O-N 2.92Å; A101-Y104 PolarHBondContact O-N 3.33Å; A101-G105 PolarHBondContact O-N 3.49Å; A101-V106 HydrophobicContact CB-CB 4.46Å; A101-V106 HydrophobicContact CB-CG2 4.15Å; A101-V106 VanDerWaalsContact O-CB 3.3Å; A101-V106 WeakPolarHBondContact O-CB 3.3Å; A101-V106 WeakPolarHBondContact O-CG2 3.44Å; A101-V106 PolarHBondContact O-N 2.9Å
102E96.3Very high95.5Very high74 Ų7451.1 Ų51.135%0.34627%0.269SS..Hα-helixtrans-60.2-50171.2-174-179.2169.100110.6L98 K99 Y104 G105 K108 M111L98-E102 PolarHBondContact O-N 3.04Å; K99-E102 WeakPolarHBondContact O-CB 3.38Å; K99-E102 PolarHBondContact O-N 3.37Å; E102-Y104 PolarHBondContact O-N 3.07Å; E102-G105 WeakPolarHBondContact O-CA 3.33Å; E102-G105 PolarHBondContact O-N 2.92Å; E102-K108 WeakPolarHBondContact OE1-CE 3.42Å; E102-K108 IonicContact OE1-NZ 3.99Å; E102-K108 PolarHBondContact OE1-NZ 2.97Å; E102-M111 HydrophobicContact CB-CE 4.23Å; E102-M111 HydrophobicContact CB-SD 3.9Å; E102-M111 HydrophobicContact CG-SD 4.36Å
103D95.3Very high95.5Very high108 Ų10852.5 Ų52.558%0.57828%0.276SS*.Hα-helixtrans-62.8-29.6178-67.5-25.3000112K99 A100 G105K99-D103 PolarHBondContact O-N 3.36Å; A100-D103 PolarHBondContact O-N 3.48Å; D103-G105 PolarHBondContact O-N 3.3Å
104Y94Very high95.5Very high6 Ų653.2 Ų53.22%0.02428%0.281CS..Hα-helixtrans-70.7-19.8173-164.4-101.5000112.8L69 Y70 A100 A101 E102 L133 L136 A137 K140L69-Y104 HydrophobicContact CB-CE2 3.96Å; L69-Y104 HydrophobicContact CD1-CE1 4.3Å; Y70-Y104 HydrophobicContact CD2-CD2 4.4Å; Y70-Y104 AromaticContact CE2-CD2 3.52Å; Y70-Y104 HydrophobicContact CE2-CD2 3.52Å; Y70-Y104 HydrophobicContact CE2-CE2 4.11Å; Y70-Y104 HydrophobicContact CE2-CG 4.45Å; Y70-Y104 AromaticContact CZ-CD2 3.66Å; A100-Y104 WeakPolarHBondContact O-CB 3.42Å; A100-Y104 PolarHBondContact O-N 3.49Å; A101-Y104 PolarHBondContact O-N 3.33Å; E102-Y104 PolarHBondContact O-N 3.07Å; Y104-L133 HydrophobicContact CD1-CD1 3.49Å; Y104-L133 VanDerWaalsContact CD1-CD1 3.49Å; Y104-L133 HydrophobicContact CE1-CD1 4.03Å; Y104-L133 HydrophobicContact CG-CD1 4.04Å; Y104-L136 HydrophobicContact CD1-CB 4.15Å; Y104-L136 HydrophobicContact CE1-CB 3.94Å; Y104-A137 HydrophobicContact CE1-CB 4.2Å; Y104-A137 VanDerWaalsContact OH-CA 3.29Å; Y104-A137 WeakPolarHBondContact OH-CA 3.32Å; Y104-A137 WeakPolarHBondContact OH-CB 3.39Å; Y104-K140 VanDerWaalsContact CD2-NZ 3.27Å; Y104-K140 HydrophobicContact CE1-CD 4.12Å; Y104-K140 HydrophobicContact CE2-CD 4.08Å; Y104-K140 WeakPolarHBondContact O-CE 3.13Å; Y104-K140 PolarHBondContact O-NZ 3.42Å
105G93.3Very high95.3Very high40 Ų4055.5 Ų55.541%0.41230%0.295SS..THydrogen-bonded Turntrans115.911.717600000115A101 E102 D103 I107 L136A101-G105 PolarHBondContact O-N 3.49Å; E102-G105 WeakPolarHBondContact O-CA 3.33Å; E102-G105 PolarHBondContact O-N 2.92Å; D103-G105 PolarHBondContact O-N 3.3Å; G105-I107 PolarHBondContact O-N 2.96Å; G105-L136 VanDerWaalsContact O-CD1 3.29Å; G105-L136 WeakPolarHBondContact O-CD1 3.49Å
106V95.1Very high95.3Very high5 Ų554.5 Ų54.53%0.0328%0.283CS..  trans-67.5131.5173.2-179.50000109.1A101 D110 M111 T129 A132 L133 L136A101-V106 HydrophobicContact CB-CB 4.46Å; A101-V106 HydrophobicContact CB-CG2 4.15Å; A101-V106 VanDerWaalsContact O-CB 3.3Å; A101-V106 WeakPolarHBondContact O-CB 3.3Å; A101-V106 WeakPolarHBondContact O-CG2 3.44Å; A101-V106 PolarHBondContact O-N 2.9Å; V106-D110 HydrophobicContact CG1-CB 4.33Å; V106-M111 HydrophobicContact CG1-CG 3.88Å; V106-T129 HydrophobicContact CG1-CG2 4.32Å; V106-A132 HydrophobicContact CG1-CB 4.13Å; V106-L133 HydrophobicContact CG2-CB 4.08Å; V106-L133 HydrophobicContact CG2-CD1 4.01Å; V106-L136 HydrophobicContact CB-CD1 4.36Å; V106-L136 HydrophobicContact CG2-CD1 3.76Å
107I93.9Very high95.2Very high96 Ų9651.2 Ų51.249%0.49227%0.268SS..  trans-74.5138.7-179.3-54.3172.8000108.8G105 T109 D110 M111G105-I107 PolarHBondContact O-N 2.96Å; I107-T109 HydrophobicContact CG2-CG2 4.42Å; I107-T109 WeakPolarHBondContact CG2-OG1 3.09Å; I107-T109 PolarHBondContact O-N 3.48Å; I107-D110 PolarHBondContact O-N 2.71Å; I107-M111 PolarHBondContact O-N 3.19Å
108K93.8Very high95Very high142 Ų14252.3 Ų52.362%0.61727%0.273SS*.G310 helixtrans-53.3-30.9-179.4-66.4-175.9176.9-175.80114.5E102 D110 M111E102-K108 WeakPolarHBondContact OE1-CE 3.42Å; E102-K108 IonicContact OE1-NZ 3.99Å; E102-K108 PolarHBondContact OE1-NZ 2.97Å; K108-D110 PolarHBondContact O-N 2.82Å; K108-M111 HydrophobicContact CG-SD 4.49Å; K108-M111 PolarHBondContact O-N 3.15Å
109T93.6Very high94.7Very high116 Ų11656.6 Ų56.671%0.71229%0.293SS*.G310 helixtrans-65.8-27.2177.5550000113I107I107-T109 HydrophobicContact CG2-CG2 4.42Å; I107-T109 WeakPolarHBondContact CG2-OG1 3.09Å; I107-T109 PolarHBondContact O-N 3.48Å
110D93.6Very high94.5Very high52 Ų5250.7 Ų50.728%0.27827%0.271SS..G310 helixtrans-94.8-4.6-179.9-63.3-19.3000111.9V106 I107 K108 T129 A132V106-D110 HydrophobicContact CG1-CB 4.33Å; I107-D110 PolarHBondContact O-N 2.71Å; K108-D110 PolarHBondContact O-N 2.82Å; D110-T129 VanDerWaalsContact O-CA 3.27Å; D110-T129 WeakPolarHBondContact O-CA 3.22Å; D110-T129 WeakPolarHBondContact O-CB 3.46Å; D110-T129 PolarHBondContact O-N 3.05Å; D110-T129 PolarHBondContact O-OG1 2.99Å; D110-A132 HydrophobicContact CB-CB 4.1Å
111M95.4Very high94.2Very high39 Ų3954 Ų5419%0.19229%0.286CS..PPolyproline II helixtrans-83.6134.2-179.8-68.6-178.464.200111.9L98 E102 V106 I107 K108 T129L98-M111 HydrophobicContact CB-CE 3.64Å; L98-M111 HydrophobicContact CD2-CE 3.9Å; L98-M111 HydrophobicContact CG-CE 4.33Å; L98-M111 WeakPolarHBondContact O-CE 3.35Å; E102-M111 HydrophobicContact CB-CE 4.23Å; E102-M111 HydrophobicContact CB-SD 3.9Å; E102-M111 HydrophobicContact CG-SD 4.36Å; V106-M111 HydrophobicContact CG1-CG 3.88Å; I107-M111 PolarHBondContact O-N 3.19Å; K108-M111 HydrophobicContact CG-SD 4.49Å; K108-M111 PolarHBondContact O-N 3.15Å; M111-T129 WeakPolarHBondContact CA-OG1 3.41Å
112F96.8Very high94Very high5 Ų555.2 Ų55.22%0.02229%0.292CS..PPolyproline II helixtrans-79.9163168.472.6-96.1000111.5L62 V94 F97 L98 D116 L117 A125 V126 T129L62-F112 HydrophobicContact CD1-CZ 4.09Å; V94-F112 HydrophobicContact CG1-CE2 3.61Å; V94-F112 HydrophobicContact CG1-CZ 3.96Å; F97-F112 HydrophobicContact CD1-CE1 4.33Å; F97-F112 HydrophobicContact CD1-CZ 4.12Å; F97-F112 AromaticContact CE1-CE1 3.73Å; F97-F112 HydrophobicContact CE1-CE1 3.73Å; F97-F112 AromaticContact CE1-CZ 3.98Å; F97-F112 HydrophobicContact CE1-CZ 3.98Å; L98-F112 HydrophobicContact CD1-CD2 4.42Å; L98-F112 HydrophobicContact CD1-CE2 4.16Å; L98-F112 WeakPolarHBondContact CD1-O 3.45Å; L98-F112 HydrophobicContact CD2-CD1 3.92Å; L98-F112 HydrophobicContact CD2-CD2 4.19Å; L98-F112 HydrophobicContact CD2-CE1 3.71Å; L98-F112 HydrophobicContact CD2-CE2 3.96Å; L98-F112 HydrophobicContact CD2-CG 4.15Å; L98-F112 HydrophobicContact CD2-CZ 3.71Å; L98-F112 WeakPolarHBondContact CD2-O 3.4Å; L98-F112 HydrophobicContact CG-CE2 4.29Å; L98-F112 HydrophobicContact CG-CZ 4.22Å; F112-D116 HydrophobicContact CB-CB 4.27Å; F112-L117 HydrophobicContact CD2-CB 4.23Å; F112-L117 HydrophobicContact CE2-CB 3.83Å; F112-L117 HydrophobicContact CE2-CD2 4.14Å; F112-L117 HydrophobicContact CZ-CD2 4.15Å; F112-A125 HydrophobicContact CB-CB 3.68Å; F112-V126 HydrophobicContact CB-CG2 4.22Å; F112-V126 HydrophobicContact CD1-CB 4.23Å; F112-V126 HydrophobicContact CD1-CG1 4.32Å; F112-V126 HydrophobicContact CD1-CG2 4.04Å; F112-V126 HydrophobicContact CD2-CG2 4.05Å; F112-V126 HydrophobicContact CE1-CG1 4.15Å; F112-V126 HydrophobicContact CE1-CG2 4.42Å; F112-V126 HydrophobicContact CE2-CG2 4.45Å; F112-V126 HydrophobicContact CG-CG2 3.87Å; F112-T129 HydrophobicContact CD1-CG2 3.98Å; F112-T129 VanDerWaalsContact CD1-OG1 3.31Å; F112-T129 WeakPolarHBondContact CD1-OG1 2.69Å; F112-T129 HydrophobicContact CE1-CG2 4.24Å; F112-T129 PolarHBondContact N-OG1 3.29Å
113Q95.4Very high93.9Very high135 Ų13552 Ų5263%0.63128%0.277SS*.PPolyproline II helixtrans-98.8151.4171.3-54.7-170.4-67.900110.7V115 D116Q113-V115 HydrophobicContact CB-CG2 4.22Å; Q113-V115 PolarHBondContact O-N 3.28Å; Q113-D116 WeakPolarHBondContact CB-OD2 3.47Å; Q113-D116 PolarHBondContact N-OD2 3.17Å; Q113-D116 VanDerWaalsContact O-CB 3.25Å; Q113-D116 WeakPolarHBondContact O-CB 3.36Å; Q113-D116 PolarHBondContact O-N 3.34Å
114T95Very high93.9Very high31 Ų3147 Ų4719%0.1925%0.251CS..Hα-helixtrans-50.1-35-177.6-48.80000114.3M91 V94 D116 F118M91-T114 HydrophobicContact CB-CG2 3.7Å; M91-T114 HydrophobicContact CG-CG2 3.83Å; M91-T114 WeakPolarHBondContact O-CG2 3.39Å; V94-T114 HydrophobicContact CB-CG2 4.02Å; V94-T114 HydrophobicContact CG1-CG2 4.02Å; T114-D116 VanDerWaalsContact C-N 3.31Å; T114-D116 PolarHBondContact O-N 3.28Å; T114-F118 WeakPolarHBondContact O-CB 3.43Å; T114-F118 PolarHBondContact O-N 3Å
115V92.9Very high94Very high48 Ų4847 Ų4729%0.29125%0.252SS..Hα-helixtrans-68.3-27.8177.6-61.20000113.6Q113 L117 E119 K121Q113-V115 HydrophobicContact CB-CG2 4.22Å; Q113-V115 PolarHBondContact O-N 3.28Å; V115-L117 VanDerWaalsContact C-N 3.33Å; V115-L117 PolarHBondContact O-N 3.02Å; V115-E119 WeakPolarHBondContact O-CB 3.46Å; V115-E119 PolarHBondContact O-N 3.42Å; V115-K121 HydrophobicContact CG2-CD 4.44Å
116D94.8Very high94.2Very high22 Ų2245 Ų4512%0.11823%0.232CC..Hα-helixtrans-65.3-40.5-179.4-60.5-30.7000110.9F112 Q113 T114 G120 K121 D122F112-D116 HydrophobicContact CB-CB 4.27Å; Q113-D116 WeakPolarHBondContact CB-OD2 3.47Å; Q113-D116 PolarHBondContact N-OD2 3.17Å; Q113-D116 VanDerWaalsContact O-CB 3.25Å; Q113-D116 WeakPolarHBondContact O-CB 3.36Å; Q113-D116 PolarHBondContact O-N 3.34Å; T114-D116 VanDerWaalsContact C-N 3.31Å; T114-D116 PolarHBondContact O-N 3.28Å; D116-G120 CarbonylContact O-C 3.4Å; D116-G120 VanDerWaalsContact O-C 3.26Å; D116-G120 WeakPolarHBondContact O-CA 3.31Å; D116-G120 PolarHBondContact O-N 2.82Å; D116-G120 VanDerWaalsContact O-N 3.16Å; D116-K121 PolarHBondContact O-N 3.39Å; D116-D122 HydrophobicContact CB-CB 4.13Å
117L95.5Very high94.3Very high0 Ų044.9 Ų44.90%023%0.231CC..Hα-helixtrans-82.1-48.6173.9176.259.7000112.1Q53 L56 L62 V94 F112 V115 E119 G120 M123 V126Q53-L117 HydrophobicContact CG-CD1 4.35Å; Q53-L117 VanDerWaalsContact CG-O 3.32Å; Q53-L117 WeakPolarHBondContact CG-O 3.41Å; Q53-L117 PolarHBondContact NE2-O 3.34Å; L56-L117 HydrophobicContact CB-CD1 3.88Å; L56-L117 HydrophobicContact CB-CD2 4.19Å; L62-L117 HydrophobicContact CD1-CD2 3.5Å; L62-L117 VanDerWaalsContact CD1-CD2 3.5Å; V94-L117 HydrophobicContact CG1-CD2 4.14Å; V94-L117 HydrophobicContact CG2-CD2 3.97Å; F112-L117 HydrophobicContact CD2-CB 4.23Å; F112-L117 HydrophobicContact CE2-CB 3.83Å; F112-L117 HydrophobicContact CE2-CD2 4.14Å; F112-L117 HydrophobicContact CZ-CD2 4.15Å; V115-L117 VanDerWaalsContact C-N 3.33Å; V115-L117 PolarHBondContact O-N 3.02Å; L117-E119 PolarHBondContact O-N 3.39Å; L117-G120 PolarHBondContact O-N 3.27Å; L117-M123 HydrophobicContact CD1-CE 4.03Å; L117-M123 HydrophobicContact CD1-SD 4.09Å; L117-V126 HydrophobicContact CB-CG2 3.93Å; L117-V126 HydrophobicContact CD1-CG1 4.46Å; L117-V126 HydrophobicContact CD1-CG2 4.31Å
118F93.4Very high94.4Very high22 Ų2244.7 Ų44.710%0.09622%0.224CC..Hα-helixtrans-66.5-44.7-170.9-172.7-86.3000112.7Q53 K57 V87 Q90 M91 T114Q53-F118 PolarHBondContact NE2-O 3.32Å; K57-F118 WeakPolarHBondContact CE-O 3.48Å; K57-F118 HydrophobicContact CG-CD2 4.04Å; K57-F118 HydrophobicContact CG-CE2 4.35Å; K57-F118 PolarHBondContact NZ-O 3.39Å; V87-F118 HydrophobicContact CB-CZ 4.09Å; V87-F118 HydrophobicContact CG1-CE1 3.87Å; V87-F118 HydrophobicContact CG1-CE2 3.96Å; V87-F118 HydrophobicContact CG1-CZ 3.37Å; V87-F118 HydrophobicContact CG2-CZ 3.94Å; Q90-F118 HydrophobicContact CB-CD2 4.44Å; Q90-F118 HydrophobicContact CB-CE2 4.05Å; Q90-F118 VanDerWaalsContact OE1-CE2 3.26Å; M91-F118 HydrophobicContact CE-CB 4.19Å; M91-F118 HydrophobicContact CE-CD1 3.27Å; M91-F118 HydrophobicContact CE-CD2 4.15Å; M91-F118 HydrophobicContact CE-CE1 3.62Å; M91-F118 HydrophobicContact CE-CE2 4.4Å; M91-F118 HydrophobicContact CE-CG 3.59Å; M91-F118 HydrophobicContact CE-CZ 4.2Å; M91-F118 HydrophobicContact CG-CD2 3.91Å; M91-F118 HydrophobicContact CG-CE2 4.28Å; M91-F118 HydrophobicContact CG-CG 4.13Å; T114-F118 WeakPolarHBondContact O-CB 3.43Å; T114-F118 PolarHBondContact O-N 3Å
119E91.5Very high94.5Very high105 Ų10537.9 Ų37.949%0.49120%0.195SC..SBendtrans-94.8-10.5176.8-59.3-172.3157.800112.4V115 L117 K121V115-E119 WeakPolarHBondContact O-CB 3.46Å; V115-E119 PolarHBondContact O-N 3.42Å; L117-E119 PolarHBondContact O-N 3.39Å; E119-K121 HydrophobicContact CB-CG 4.29Å; E119-K121 WeakPolarHBondContact OE2-CE 3.34Å; E119-K121 IonicContact OE2-NZ 2.64Å; E119-K121 PolarHBondContact OE2-NZ 2.96Å
120G91.2Very high94.7Very high16 Ų1632.4 Ų32.417%0.16516%0.161CC..  trans76.926177.800000113.5D116 L117D116-G120 CarbonylContact O-C 3.4Å; D116-G120 VanDerWaalsContact O-C 3.26Å; D116-G120 WeakPolarHBondContact O-CA 3.31Å; D116-G120 PolarHBondContact O-N 2.82Å; D116-G120 VanDerWaalsContact O-N 3.16Å; L117-G120 PolarHBondContact O-N 3.27Å
121K90.1Very high94.9Very high73 Ų7331.4 Ų31.432%0.31716%0.155SC..SBendtrans-68.8-41.4-176.5-72-179.2178.7147.20113.3Q15 V115 D116 E119Q15-K121 PolarHBondContact NE2-O 3.07Å; V115-K121 HydrophobicContact CG2-CD 4.44Å; D116-K121 PolarHBondContact O-N 3.39Å; E119-K121 HydrophobicContact CB-CG 4.29Å; E119-K121 WeakPolarHBondContact OE2-CE 3.34Å; E119-K121 IonicContact OE2-NZ 2.64Å; E119-K121 PolarHBondContact OE2-NZ 2.96Å
122D93.7Very high94.9Very high24 Ų2429.9 Ų29.913%0.12815%0.148CC..  trans-140.477.6178.7-171.2-5.3000110.3I18 D116 A124 A125 R128I18-D122 HydrophobicContact CG2-CB 3.9Å; I18-D122 VanDerWaalsContact CG2-CG 3.42Å; I18-D122 VanDerWaalsContact CG2-OD1 3.25Å; I18-D122 WeakPolarHBondContact CG2-OD1 3.32Å; D116-D122 HydrophobicContact CB-CB 4.13Å; D122-A124 PolarHBondContact O-N 2.94Å; D122-A124 WeakPolarHBondContact OD1-CA 3.27Å; D122-A124 WeakPolarHBondContact OD1-CB 3.31Å; D122-A124 PolarHBondContact OD1-N 2.85Å; D122-A124 VanDerWaalsContact OD1-N 3.14Å; D122-A125 HydrophobicContact CB-CB 4.07Å; D122-A125 WeakPolarHBondContact O-CB 3.23Å; D122-A125 PolarHBondContact O-N 2.99Å; D122-A125 VanDerWaalsContact O-N 3.17Å; D122-A125 PolarHBondContact OD1-N 3.07Å; D122-A125 WeakPolarHBondContact OD2-CB 3.36Å; D122-R128 IonicContact OD2-NH2 2.79Å; D122-R128 PolarHBondContact OD2-NH2 2.95Å
123M94.8Very high94.8Very high6 Ų629.6 Ų29.63%0.0315%0.147CC..Hα-helixtrans-66.1-22.5174.4-69.6-57.1-59.900112.7Y22 R49 F52 Q53 L117 A125 V126 Q127Y22-M123 HydrophobicContact CD2-CB 3.82Å; Y22-M123 HydrophobicContact CE2-CB 3.69Å; R49-M123 HydrophobicContact CG-CB 4.03Å; R49-M123 HydrophobicContact CG-CG 3.9Å; F52-M123 HydrophobicContact CD1-CE 3.75Å; F52-M123 HydrophobicContact CE1-CE 4.29Å; Q53-M123 HydrophobicContact CB-CE 3.77Å; Q53-M123 HydrophobicContact CB-SD 3.88Å; Q53-M123 HydrophobicContact CG-CE 4.22Å; Q53-M123 HydrophobicContact CG-SD 3.75Å; L117-M123 HydrophobicContact CD1-CE 4.03Å; L117-M123 HydrophobicContact CD1-SD 4.09Å; M123-A125 VanDerWaalsContact C-N 3.32Å; M123-V126 HydrophobicContact CE-CB 4.42Å; M123-V126 HydrophobicContact CE-CG2 4.4Å; M123-V126 WeakPolarHBondContact O-CB 3.35Å; M123-V126 PolarHBondContact O-N 3.24Å; M123-V126 HydrophobicContact SD-CG2 4.22Å; M123-Q127 PolarHBondContact O-N 3.15Å; M123-Q127 VanDerWaalsContact O-N 3.12Å
124A95.1Very high94.8Very high4 Ų423.2 Ų23.23%0.03312%0.117CC..Hα-helixtrans-69-32.8174.200000111K21 D122 V126 Q127 R128K21-A124 HydrophobicContact CB-CB 3.88Å; D122-A124 PolarHBondContact O-N 2.94Å; D122-A124 WeakPolarHBondContact OD1-CA 3.27Å; D122-A124 WeakPolarHBondContact OD1-CB 3.31Å; D122-A124 PolarHBondContact OD1-N 2.85Å; D122-A124 VanDerWaalsContact OD1-N 3.14Å; A124-V126 VanDerWaalsContact C-N 3.33Å; A124-Q127 PolarHBondContact O-N 3.19Å; A124-R128 VanDerWaalsContact C-NH1 3.25Å; A124-R128 WeakPolarHBondContact O-CG 3.38Å; A124-R128 PolarHBondContact O-N 2.46Å; A124-R128 PolarHBondContact O-NH1 2.77Å
125A95.8Very high94.8Very high5 Ų522.3 Ų22.34%0.04111%0.112CC..Hα-helixtrans-61.5-42.2170.600000111.8F112 D122 M123 Q127 R128 T129F112-A125 HydrophobicContact CB-CB 3.68Å; D122-A125 HydrophobicContact CB-CB 4.07Å; D122-A125 WeakPolarHBondContact O-CB 3.23Å; D122-A125 PolarHBondContact O-N 2.99Å; D122-A125 VanDerWaalsContact O-N 3.17Å; D122-A125 PolarHBondContact OD1-N 3.07Å; D122-A125 WeakPolarHBondContact OD2-CB 3.36Å; M123-A125 VanDerWaalsContact C-N 3.32Å; A125-Q127 VanDerWaalsContact C-N 3.34Å; A125-Q127 PolarHBondContact O-N 3.03Å; A125-R128 VanDerWaalsContact CA-CZ 3.45Å; A125-R128 VanDerWaalsContact CA-NH2 3.3Å; A125-R128 VanDerWaalsContact CB-NH2 3.34Å; A125-R128 PolarHBondContact O-N 3.4Å; A125-T129 PolarHBondContact O-N 3.29Å; A125-T129 PolarHBondContact O-OG1 3Å
126V96.8Very high94.9Very high0 Ų021.2 Ų21.20%011%0.105CC..Hα-helixtrans-59.4-46.4176.6-176.40000110.7L56 F112 L117 M123 A124 R128 T129 L130L56-V126 HydrophobicContact CD1-CG1 4.26Å; F112-V126 HydrophobicContact CB-CG2 4.22Å; F112-V126 HydrophobicContact CD1-CB 4.23Å; F112-V126 HydrophobicContact CD1-CG1 4.32Å; F112-V126 HydrophobicContact CD1-CG2 4.04Å; F112-V126 HydrophobicContact CD2-CG2 4.05Å; F112-V126 HydrophobicContact CE1-CG1 4.15Å; F112-V126 HydrophobicContact CE1-CG2 4.42Å; F112-V126 HydrophobicContact CE2-CG2 4.45Å; F112-V126 HydrophobicContact CG-CG2 3.87Å; L117-V126 HydrophobicContact CB-CG2 3.93Å; L117-V126 HydrophobicContact CD1-CG1 4.46Å; L117-V126 HydrophobicContact CD1-CG2 4.31Å; M123-V126 HydrophobicContact CE-CB 4.42Å; M123-V126 HydrophobicContact CE-CG2 4.4Å; M123-V126 WeakPolarHBondContact O-CB 3.35Å; M123-V126 PolarHBondContact O-N 3.24Å; M123-V126 HydrophobicContact SD-CG2 4.22Å; A124-V126 VanDerWaalsContact C-N 3.33Å; V126-R128 PolarHBondContact O-N 3.3Å; V126-T129 PolarHBondContact O-N 3.34Å; V126-L130 HydrophobicContact CG1-CD1 4.13Å; V126-L130 WeakPolarHBondContact O-CG 3.49Å; V126-L130 PolarHBondContact O-N 2.88Å
127Q96.6Very high94.8Very high1 Ų120.2 Ų20.21%0.00510%0.099CC..Hα-helixtrans-59.7-44.4175.2-67-176.5-48.300112Y22 D23 L26 L30 F52 M123 A124 A125 T129 L130 M131Y22-Q127 HydrophobicContact CD2-CG 4.41Å; Y22-Q127 VanDerWaalsContact CD2-OE1 3.31Å; Y22-Q127 HydrophobicContact CE2-CG 3.94Å; D23-Q127 PolarHBondContact O-NE2 3.35Å; L26-Q127 HydrophobicContact CD2-CB 3.72Å; L26-Q127 HydrophobicContact CD2-CG 4.35Å; L26-Q127 HydrophobicContact CG-CB 4.44Å; L30-Q127 HydrophobicContact CD1-CB 3.92Å; L30-Q127 HydrophobicContact CD1-CG 3.98Å; F52-Q127 HydrophobicContact CE1-CG 4.44Å; M123-Q127 PolarHBondContact O-N 3.15Å; M123-Q127 VanDerWaalsContact O-N 3.12Å; A124-Q127 PolarHBondContact O-N 3.19Å; A125-Q127 VanDerWaalsContact C-N 3.34Å; A125-Q127 PolarHBondContact O-N 3.03Å; Q127-T129 PolarHBondContact O-N 3.12Å; Q127-L130 PolarHBondContact O-N 3.26Å; Q127-M131 WeakPolarHBondContact O-CB 3.38Å; Q127-M131 VanDerWaalsContact O-CG 3.29Å; Q127-M131 WeakPolarHBondContact O-CG 3.31Å; Q127-M131 PolarHBondContact O-N 2.98Å
128R96.1Very high94.7Very high92 Ų9220.5 Ų20.535%0.34710%0.101SC..Hα-helixtrans-60.4-45.5177.5-72.6-172.1-55.7-87.15.9112.3D122 A124 A125 V126 L130 M131 A132D122-R128 IonicContact OD2-NH2 2.79Å; D122-R128 PolarHBondContact OD2-NH2 2.95Å; A124-R128 VanDerWaalsContact C-NH1 3.25Å; A124-R128 WeakPolarHBondContact O-CG 3.38Å; A124-R128 PolarHBondContact O-N 2.46Å; A124-R128 PolarHBondContact O-NH1 2.77Å; A125-R128 VanDerWaalsContact CA-CZ 3.45Å; A125-R128 VanDerWaalsContact CA-NH2 3.3Å; A125-R128 VanDerWaalsContact CB-NH2 3.34Å; A125-R128 PolarHBondContact O-N 3.4Å; V126-R128 PolarHBondContact O-N 3.3Å; R128-L130 PolarHBondContact O-N 3.36Å; R128-M131 PolarHBondContact O-N 3.39Å; R128-A132 WeakPolarHBondContact O-CB 3.44Å; R128-A132 PolarHBondContact O-N 3.46Å
129T97.4Very high94.6Very high0 Ų020.2 Ų20.20%010%0.101CC..Hα-helixtrans-62.3-44.2178.5-51.90000111.6V106 D110 M111 F112 A125 V126 Q127 A132 L133V106-T129 HydrophobicContact CG1-CG2 4.32Å; D110-T129 VanDerWaalsContact O-CA 3.27Å; D110-T129 WeakPolarHBondContact O-CA 3.22Å; D110-T129 WeakPolarHBondContact O-CB 3.46Å; D110-T129 PolarHBondContact O-N 3.05Å; D110-T129 PolarHBondContact O-OG1 2.99Å; M111-T129 WeakPolarHBondContact CA-OG1 3.41Å; F112-T129 HydrophobicContact CD1-CG2 3.98Å; F112-T129 VanDerWaalsContact CD1-OG1 3.31Å; F112-T129 WeakPolarHBondContact CD1-OG1 2.69Å; F112-T129 HydrophobicContact CE1-CG2 4.24Å; F112-T129 PolarHBondContact N-OG1 3.29Å; A125-T129 PolarHBondContact O-N 3.29Å; A125-T129 PolarHBondContact O-OG1 3Å; V126-T129 PolarHBondContact O-N 3.34Å; Q127-T129 PolarHBondContact O-N 3.12Å; T129-A132 PolarHBondContact O-N 3.42Å; T129-L133 WeakPolarHBondContact O-CB 3.42Å; T129-L133 PolarHBondContact O-N 3.2Å
130L97.3Very high94.5Very high0 Ų019.3 Ų19.30%010%0.096CC..Hα-helixtrans-66-39.9178.8-68.5173.9000111.8L30 W33 I34 F52 L56 L62 L65 F97 V126 Q127 R128 L133 G134L30-L130 HydrophobicContact CD1-CB 4.11Å; L30-L130 HydrophobicContact CD1-CD1 4.29Å; L30-L130 HydrophobicContact CD2-CB 3.77Å; W33-L130 HydrophobicContact CZ3-CB 4.48Å; I34-L130 HydrophobicContact CD1-CD1 4.29Å; F52-L130 HydrophobicContact CZ-CD1 3.94Å; L56-L130 HydrophobicContact CD1-CD1 4.15Å; L62-L130 HydrophobicContact CD2-CD2 3.88Å; L65-L130 HydrophobicContact CD2-CD2 3.61Å; F97-L130 HydrophobicContact CZ-CD2 4.12Å; V126-L130 HydrophobicContact CG1-CD1 4.13Å; V126-L130 WeakPolarHBondContact O-CG 3.49Å; V126-L130 PolarHBondContact O-N 2.88Å; Q127-L130 PolarHBondContact O-N 3.26Å; R128-L130 PolarHBondContact O-N 3.36Å; L130-L133 PolarHBondContact O-N 2.91Å; L130-G134 PolarHBondContact O-N 3.18Å
131M96.3Very high94.1Very high31 Ų3125 Ų2515%0.15312%0.122CC..Hα-helixtrans-62.3-42.3173-76.6-59.7-59.700112.6L26 L30 Q127 R128 L133 S135 F152L26-M131 HydrophobicContact CD1-CE 4.11Å; L26-M131 HydrophobicContact CD1-CG 3.65Å; L26-M131 HydrophobicContact CD1-SD 3.42Å; L26-M131 WeakPolarHBondContact CD1-SD 3.2Å; L26-M131 HydrophobicContact CD2-CG 4.17Å; L26-M131 HydrophobicContact CG-CG 4.21Å; L26-M131 HydrophobicContact CG-SD 4.41Å; L30-M131 HydrophobicContact CD1-CG 4.49Å; L30-M131 HydrophobicContact CD2-CG 4.18Å; L30-M131 HydrophobicContact CD2-SD 3.79Å; L30-M131 HydrophobicContact CG-SD 4.3Å; Q127-M131 WeakPolarHBondContact O-CB 3.38Å; Q127-M131 VanDerWaalsContact O-CG 3.29Å; Q127-M131 WeakPolarHBondContact O-CG 3.31Å; Q127-M131 PolarHBondContact O-N 2.98Å; R128-M131 PolarHBondContact O-N 3.39Å; M131-L133 VanDerWaalsContact C-N 3.34Å; M131-S135 VanDerWaalsContact O-CB 3.3Å; M131-S135 WeakPolarHBondContact O-CB 3.3Å; M131-S135 PolarHBondContact O-N 3.03Å; M131-S135 PolarHBondContact O-OG 3.49Å; M131-F152 HydrophobicContact CE-CD1 3.79Å; M131-F152 HydrophobicContact CE-CE1 4.17Å; M131-F152 HydrophobicContact SD-CD1 3.93Å; M131-F152 HydrophobicContact SD-CE1 3.66Å
132A95.8Very high93.9Very high7 Ų724.7 Ų24.76%0.05812%0.124CC..Hα-helixtrans-63.8-41.5176.400000111.4V106 D110 R128 T129 L136V106-A132 HydrophobicContact CG1-CB 4.13Å; D110-A132 HydrophobicContact CB-CB 4.1Å; R128-A132 WeakPolarHBondContact O-CB 3.44Å; R128-A132 PolarHBondContact O-N 3.46Å; T129-A132 PolarHBondContact O-N 3.42Å; A132-L136 WeakPolarHBondContact O-CG 3.18Å; A132-L136 PolarHBondContact O-N 3.42Å
133L96.3Very high93.6Very high0 Ų026.9 Ų26.90%015%0.152CC..Hα-helixtrans-63.1-49.5176.1-177.564.3000111.8W33 L65 L69 F97 Y104 V106 T129 L130 M131 S135 L136 A137W33-L133 HydrophobicContact CH2-CD2 4.37Å; W33-L133 HydrophobicContact CH2-CG 4.35Å; L65-L133 HydrophobicContact CD2-CD2 4.31Å; L69-L133 HydrophobicContact CD1-CD1 3.91Å; L69-L133 HydrophobicContact CD1-CD2 4.11Å; L69-L133 HydrophobicContact CD1-CG 3.86Å; F97-L133 HydrophobicContact CE2-CD2 3.92Å; F97-L133 HydrophobicContact CZ-CD2 4.14Å; Y104-L133 HydrophobicContact CD1-CD1 3.49Å; Y104-L133 VanDerWaalsContact CD1-CD1 3.49Å; Y104-L133 HydrophobicContact CE1-CD1 4.03Å; Y104-L133 HydrophobicContact CG-CD1 4.04Å; V106-L133 HydrophobicContact CG2-CB 4.08Å; V106-L133 HydrophobicContact CG2-CD1 4.01Å; T129-L133 WeakPolarHBondContact O-CB 3.42Å; T129-L133 PolarHBondContact O-N 3.2Å; L130-L133 PolarHBondContact O-N 2.91Å; M131-L133 VanDerWaalsContact C-N 3.34Å; L133-S135 PolarHBondContact O-N 2.57Å; L133-L136 WeakPolarHBondContact O-CB 3.34Å; L133-L136 PolarHBondContact O-N 2.94Å; L133-A137 PolarHBondContact O-N 3.28Å
134G95.4Very high93.4Very high0 Ų029.2 Ų29.20%016%0.163CC..Hα-helixtrans-62.3-41.4177.700000112.6L130 L136 A137 V138L130-G134 PolarHBondContact O-N 3.18Å; G134-L136 VanDerWaalsContact C-N 3.32Å; G134-L136 PolarHBondContact O-N 3.45Å; G134-A137 PolarHBondContact O-N 3.45Å; G134-A137 VanDerWaalsContact O-N 3.15Å; G134-V138 WeakPolarHBondContact O-CG2 3.07Å; G134-V138 PolarHBondContact O-N 2.89Å
135S94.7Very high93.4Very high12 Ų1230.7 Ų30.78%0.08417%0.168CC..Hα-helixtrans-59.9-41.9174.6-59.40000112M131 L133 T139 M153M131-S135 VanDerWaalsContact O-CB 3.3Å; M131-S135 WeakPolarHBondContact O-CB 3.3Å; M131-S135 PolarHBondContact O-N 3.03Å; M131-S135 PolarHBondContact O-OG 3.49Å; L133-S135 PolarHBondContact O-N 2.57Å; S135-T139 WeakPolarHBondContact O-CB 3.31Å; S135-T139 PolarHBondContact O-N 3.06Å; S135-T139 VanDerWaalsContact O-N 3.1Å; S135-T139 PolarHBondContact O-OG1 3.12Å; S135-M153 VanDerWaalsContact CB-O 3.23Å; S135-M153 WeakPolarHBondContact CB-O 3.3Å
136L93.5Very high93.2Very high26 Ų2637.2 Ų37.214%0.13619%0.191CC..Hα-helixtrans-65.7-41.4174.6-74.6165.5000112Y104 G105 V106 A132 L133 G134 T139 K140 K155Y104-L136 HydrophobicContact CD1-CB 4.15Å; Y104-L136 HydrophobicContact CE1-CB 3.94Å; G105-L136 VanDerWaalsContact O-CD1 3.29Å; G105-L136 WeakPolarHBondContact O-CD1 3.49Å; V106-L136 HydrophobicContact CB-CD1 4.36Å; V106-L136 HydrophobicContact CG2-CD1 3.76Å; A132-L136 WeakPolarHBondContact O-CG 3.18Å; A132-L136 PolarHBondContact O-N 3.42Å; L133-L136 WeakPolarHBondContact O-CB 3.34Å; L133-L136 PolarHBondContact O-N 2.94Å; G134-L136 VanDerWaalsContact C-N 3.32Å; G134-L136 PolarHBondContact O-N 3.45Å; L136-T139 WeakPolarHBondContact O-CB 3.39Å; L136-T139 PolarHBondContact O-N 2.78Å; L136-T139 VanDerWaalsContact O-N 3.13Å; L136-K140 PolarHBondContact O-N 3.01Å; L136-K155 HydrophobicContact CD2-CD 3.97Å; L136-K155 HydrophobicContact CG-CD 4.37Å
137A93.4Very high92.9Very high0 Ų038.8 Ų38.80%021%0.207CC..Hα-helixtrans-62.1-46.4179.300000112.4L69 Y104 L133 G134 T139 K140 N141 Y145L69-A137 HydrophobicContact CD1-CB 4.18Å; L69-A137 HydrophobicContact CD2-CB 3.7Å; Y104-A137 HydrophobicContact CE1-CB 4.2Å; Y104-A137 VanDerWaalsContact OH-CA 3.29Å; Y104-A137 WeakPolarHBondContact OH-CA 3.32Å; Y104-A137 WeakPolarHBondContact OH-CB 3.39Å; L133-A137 PolarHBondContact O-N 3.28Å; G134-A137 PolarHBondContact O-N 3.45Å; G134-A137 VanDerWaalsContact O-N 3.15Å; A137-T139 PolarHBondContact O-N 3.11Å; A137-K140 PolarHBondContact O-N 3.39Å; A137-N141 PolarHBondContact O-N 3.3Å; A137-Y145 HydrophobicContact CB-CD2 3.79Å
138V94.1Very high92.6Very high7 Ų741.8 Ų41.84%0.04222%0.223CC..Hα-helixtrans-63.5-31.7174.6178.20000111.7G134 Y145 P149 F152 K154G134-V138 WeakPolarHBondContact O-CG2 3.07Å; G134-V138 PolarHBondContact O-N 2.89Å; V138-Y145 HydrophobicContact CG2-CD1 3.95Å; V138-Y145 HydrophobicContact CG2-CD2 3.73Å; V138-Y145 HydrophobicContact CG2-CE1 3.66Å; V138-Y145 HydrophobicContact CG2-CE2 3.4Å; V138-Y145 VanDerWaalsContact CG2-CE2 3.4Å; V138-Y145 HydrophobicContact CG2-CG 3.99Å; V138-P149 HydrophobicContact CG1-CB 3.97Å; V138-F152 HydrophobicContact CG2-CB 4.05Å; V138-F152 HydrophobicContact CG2-CD2 3.95Å; V138-F152 HydrophobicContact CG2-CG 4.38Å; V138-K154 HydrophobicContact CG1-CD 4.25Å; V138-K154 HydrophobicContact CG1-CG 3.66Å
139T91.3Very high92.3Very high16 Ų1640.3 Ų40.310%0.09823%0.226CC..Hα-helixtrans-75.4-39.1-179.7-56.20000112.4S135 L136 A137 N141 K155 Q157S135-T139 WeakPolarHBondContact O-CB 3.31Å; S135-T139 PolarHBondContact O-N 3.06Å; S135-T139 VanDerWaalsContact O-N 3.1Å; S135-T139 PolarHBondContact O-OG1 3.12Å; L136-T139 WeakPolarHBondContact O-CB 3.39Å; L136-T139 PolarHBondContact O-N 2.78Å; L136-T139 VanDerWaalsContact O-N 3.13Å; A137-T139 PolarHBondContact O-N 3.11Å; T139-N141 VanDerWaalsContact C-N 3.28Å; T139-N141 PolarHBondContact O-N 3.12Å; T139-K155 HydrophobicContact CG2-CB 4.15Å; T139-K155 WeakPolarHBondContact CG2-O 3.48Å; T139-K155 PolarHBondContact OG1-N 2.94Å; T139-Q157 HydrophobicContact CG2-CG 3.52Å; T139-Q157 PolarHBondContact O-NE2 3.43Å
140K88.1Confident91.9Very high86 Ų8646.8 Ų46.837%0.37426%0.26SS..Hα-helixtrans-64.3-32.8179.5-77.9-174.5-178.2176.20112.8Y104 L136 A137 D142Y104-K140 VanDerWaalsContact CD2-NZ 3.27Å; Y104-K140 HydrophobicContact CE1-CD 4.12Å; Y104-K140 HydrophobicContact CE2-CD 4.08Å; Y104-K140 WeakPolarHBondContact O-CE 3.13Å; Y104-K140 PolarHBondContact O-NZ 3.42Å; L136-K140 PolarHBondContact O-N 3.01Å; A137-K140 PolarHBondContact O-N 3.39Å; K140-D142 PolarHBondContact O-N 2.99Å; K140-D142 VanDerWaalsContact O-N 3.17Å
141N83.4Confident91.7Very high135 Ų13549.8 Ų49.872%0.72227%0.272SS*.  trans50.838.9177.2-164.450.3000113.3A137 T139 G143A137-N141 PolarHBondContact O-N 3.3Å; T139-N141 VanDerWaalsContact C-N 3.28Å; T139-N141 PolarHBondContact O-N 3.12Å; N141-G143 VanDerWaalsContact C-N 3.28Å; N141-G143 PolarHBondContact O-N 3.23Å
142D86.7Confident91.5Very high67 Ų6748.8 Ų48.836%0.35827%0.266SS..SBendtrans-85.13.5-177.758.321.9000113.5K140 H144K140-D142 PolarHBondContact O-N 2.99Å; K140-D142 VanDerWaalsContact O-N 3.17Å; D142-H144 PolarHBondContact O-CE1 3.08Å; D142-H144 PolarHBondContact O-ND1 3.48Å; D142-H144 VanDerWaalsContact O-ND1 3.14Å; D142-H144 WeakPolarHBondContact OD1-CB 3.19Å; D142-H144 IonicContact OD1-CG 3.7Å; D142-H144 PolarHBondContact OD1-N 2.91Å; D142-H144 IonicContact OD1-ND1 3.17Å; D142-H144 PolarHBondContact OD1-ND1 2.88Å; D142-H144 VanDerWaalsContact OD1-ND1 3.17Å
143G87.4Confident91.1Very high69 Ų6956 Ų5671%0.71130%0.301SS*.SBendtrans84.5-0.6-179.900000115.6N141N141-G143 VanDerWaalsContact C-N 3.28Å; N141-G143 PolarHBondContact O-N 3.23Å
144H91.1Very high90.6Very high55 Ų5562.9 Ų62.926%0.25533%0.331SS..  trans-93.8-18.3-178.9-58.484.3000113.5Q37 P71 D142Q37-H144 PolarHBondContact NE2-O 3.45Å; P71-H144 WeakPolarHBondContact CG-NE2 3.25Å; D142-H144 PolarHBondContact O-CE1 3.08Å; D142-H144 PolarHBondContact O-ND1 3.48Å; D142-H144 VanDerWaalsContact O-ND1 3.14Å; D142-H144 WeakPolarHBondContact OD1-CB 3.19Å; D142-H144 IonicContact OD1-CG 3.7Å; D142-H144 PolarHBondContact OD1-N 2.91Å; D142-H144 IonicContact OD1-ND1 3.17Å; D142-H144 PolarHBondContact OD1-ND1 2.88Å; D142-H144 VanDerWaalsContact OD1-ND1 3.17Å
145Y93Very high90Very high35 Ų3566.4 Ų66.414%0.13735%0.346CS..  trans-68.1137.5172.2178.8-92.2000111.4W33 A137 V138 G147 D148 P149 F152W33-Y145 AromaticContact CD1-CE2 3.86Å; W33-Y145 HydrophobicContact CZ2-CE2 4.49Å; W33-Y145 AromaticContact NE1-CD2 3.89Å; W33-Y145 AromaticContact NE1-CE2 3.24Å; W33-Y145 AromaticContact NE1-CZ 3.98Å; A137-Y145 HydrophobicContact CB-CD2 3.79Å; V138-Y145 HydrophobicContact CG2-CD1 3.95Å; V138-Y145 HydrophobicContact CG2-CD2 3.73Å; V138-Y145 HydrophobicContact CG2-CE1 3.66Å; V138-Y145 HydrophobicContact CG2-CE2 3.4Å; V138-Y145 VanDerWaalsContact CG2-CE2 3.4Å; V138-Y145 HydrophobicContact CG2-CG 3.99Å; Y145-G147 WeakPolarHBondContact CE1-O 3.34Å; Y145-D148 PolarHBondContact OH-O 2.86Å; Y145-P149 HydrophobicContact CE1-CG 4.47Å; Y145-F152 AromaticContact CE2-CD2 3.88Å; Y145-F152 HydrophobicContact CE2-CD2 3.88Å; Y145-F152 AromaticContact CE2-CE2 3.85Å; Y145-F152 HydrophobicContact CE2-CE2 3.85Å; Y145-F152 AromaticContact CZ-CD2 3.91Å; Y145-F152 WeakPolarHBondContact OH-CD2 3.47Å; Y145-F152 VanDerWaalsContact OH-CE2 3.23Å; Y145-F152 WeakPolarHBondContact OH-CE2 3.39Å
146R92.1Very high89.3Confident143 Ų14371 Ų7154%0.5439%0.385SS..  trans-131.1144.2178.1-54.4176.4-178.7177.7-1.2109.4V36 Q37V36-R146 HydrophobicContact CG1-CB 4.16Å; Q37-R146 PolarHBondContact OE1-O 2.91Å
147G90.8Very high88.4Confident32 Ų3276.1 Ų76.133%0.3341%0.408SS..SBendtrans109.8-175.8-17700000112.7Y145 P149Y145-G147 WeakPolarHBondContact CE1-O 3.34Å; G147-P149 WeakPolarHBondContact O-CD 3.42Å
148D90.8Very high87.8Confident64 Ų6483.3 Ų83.334%0.34244%0.442SS..  trans-74.6121.1-179.4-172.4-15.2000109.7Y145 N150 W151Y145-D148 PolarHBondContact OH-O 2.86Å; D148-N150 PolarHBondContact O-N 3.22Å; D148-N150 VanDerWaalsContact OD1-CB 3.27Å; D148-N150 WeakPolarHBondContact OD1-CB 3.44Å; D148-N150 VanDerWaalsContact OD1-CG 3.29Å; D148-N150 PolarHBondContact OD1-N 3.04Å; D148-N150 PolarHBondContact OD1-ND2 3.36Å; D148-N150 VanDerWaalsContact OD1-ND2 3.11Å; D148-W151 HydrophobicContact CB-CD2 3.82Å; D148-W151 HydrophobicContact CB-CE3 4.29Å; D148-W151 HydrophobicContact CB-CG 4.14Å; D148-W151 HydrophobicContact CB-CZ2 4.03Å; D148-W151 WeakPolarHBondContact O-CB 3.3Å; D148-W151 PolarHBondContact O-N 2.95Å
149P89.2Confident87Confident61 Ų6190.1 Ų90.140%0.39647%0.473SS..G310 helixtrans-59-24.4174.7-25.136.4000113.9V138 Y145 G147 W151 F152V138-P149 HydrophobicContact CG1-CB 3.97Å; Y145-P149 HydrophobicContact CE1-CG 4.47Å; G147-P149 WeakPolarHBondContact O-CD 3.42Å; P149-W151 PolarHBondContact O-N 3.14Å; P149-F152 PolarHBondContact O-N 2.96Å
150N90.4Very high86.4Confident136 Ų13696.4 Ų96.473%0.72750%0.499SS*.G310 helixtrans-70.1-13.6-179.1-60.8-36.4000113.3D148 F152D148-N150 PolarHBondContact O-N 3.22Å; D148-N150 VanDerWaalsContact OD1-CB 3.27Å; D148-N150 WeakPolarHBondContact OD1-CB 3.44Å; D148-N150 VanDerWaalsContact OD1-CG 3.29Å; D148-N150 PolarHBondContact OD1-N 3.04Å; D148-N150 PolarHBondContact OD1-ND2 3.36Å; D148-N150 VanDerWaalsContact OD1-ND2 3.11Å; N150-F152 PolarHBondContact O-N 2.94Å
151W91.3Very high86.1Confident63 Ų63101.1 Ų101.124%0.23951%0.514CS..G310 helixtrans-66.9-22.7173.7-66.5-18.6000113.1R29 E32 W33 V36 D148 P149R29-W151 HydrophobicContact CG-CB 3.96Å; R29-W151 HydrophobicContact CG-CD2 4.48Å; R29-W151 HydrophobicContact CG-CG 3.91Å; R29-W151 PolarHBondContact NE-O 3.32Å; R29-W151 PolarHBondContact NH1-O 3.39Å; E32-W151 HydrophobicContact CB-CH2 4.28Å; W33-W151 HydrophobicContact CB-CE3 3.88Å; W33-W151 HydrophobicContact CB-CZ3 4.04Å; W33-W151 HydrophobicContact CG-CE3 4.45Å; V36-W151 HydrophobicContact CG2-CH2 4.25Å; D148-W151 HydrophobicContact CB-CD2 3.82Å; D148-W151 HydrophobicContact CB-CE3 4.29Å; D148-W151 HydrophobicContact CB-CG 4.14Å; D148-W151 HydrophobicContact CB-CZ2 4.03Å; D148-W151 WeakPolarHBondContact O-CB 3.3Å; D148-W151 PolarHBondContact O-N 2.95Å; P149-W151 PolarHBondContact O-N 3.14Å
152F93.5Very high86.1Confident10 Ų10103.6 Ų103.64%0.04452%0.521CS..SBendtrans-127.1155.7-178.5-55.1-80.1000111.8L30 W33 M131 V138 Y145 P149 N150L30-F152 HydrophobicContact CD2-CE1 4.21Å; L30-F152 HydrophobicContact CD2-CZ 4.49Å; W33-F152 HydrophobicContact CB-CE2 4.17Å; W33-F152 HydrophobicContact CB-CZ 3.96Å; W33-F152 AromaticContact CD1-CE2 3.68Å; W33-F152 HydrophobicContact CD2-CE1 4.4Å; W33-F152 AromaticContact CD2-CE2 3.72Å; W33-F152 HydrophobicContact CD2-CE2 3.72Å; W33-F152 AromaticContact CD2-CZ 3.32Å; W33-F152 HydrophobicContact CD2-CZ 3.32Å; W33-F152 AromaticContact CE2-CE2 3.88Å; W33-F152 AromaticContact CE2-CZ 3.82Å; W33-F152 HydrophobicContact CE3-CE1 4.24Å; W33-F152 HydrophobicContact CE3-CE2 4.37Å; W33-F152 AromaticContact CE3-CZ 3.52Å; W33-F152 HydrophobicContact CE3-CZ 3.52Å; W33-F152 AromaticContact CG-CE2 3.58Å; W33-F152 HydrophobicContact CG-CE2 3.58Å; W33-F152 AromaticContact CG-CZ 3.5Å; W33-F152 HydrophobicContact CG-CZ 3.5Å; W33-F152 HydrophobicContact CZ2-CZ 4.4Å; W33-F152 HydrophobicContact CZ3-CZ 4.12Å; W33-F152 AromaticContact NE1-CE2 3.87Å; M131-F152 HydrophobicContact CE-CD1 3.79Å; M131-F152 HydrophobicContact CE-CE1 4.17Å; M131-F152 HydrophobicContact SD-CD1 3.93Å; M131-F152 HydrophobicContact SD-CE1 3.66Å; V138-F152 HydrophobicContact CG2-CB 4.05Å; V138-F152 HydrophobicContact CG2-CD2 3.95Å; V138-F152 HydrophobicContact CG2-CG 4.38Å; Y145-F152 AromaticContact CE2-CD2 3.88Å; Y145-F152 HydrophobicContact CE2-CD2 3.88Å; Y145-F152 AromaticContact CE2-CE2 3.85Å; Y145-F152 HydrophobicContact CE2-CE2 3.85Å; Y145-F152 AromaticContact CZ-CD2 3.91Å; Y145-F152 WeakPolarHBondContact OH-CD2 3.47Å; Y145-F152 VanDerWaalsContact OH-CE2 3.23Å; Y145-F152 WeakPolarHBondContact OH-CE2 3.39Å; P149-F152 PolarHBondContact O-N 2.96Å; N150-F152 PolarHBondContact O-N 2.94Å
153M87.6Confident86.1Confident159 Ų159106.1 Ų106.178%0.78353%0.529SS*.PPolyproline II helixtrans-89.2128.6175.7-63.9-179-176.400109.5S135 K155S135-M153 VanDerWaalsContact CB-O 3.23Å; S135-M153 WeakPolarHBondContact CB-O 3.3Å; M153-K155 PolarHBondContact O-N 3.17Å
154K85.4Confident86.2Confident145 Ų145106.7 Ų106.763%0.6352%0.519SS*.PPolyproline II helixtrans-67.3123.6170.4-77.5-179178.2-178.20109.5V138V138-K154 HydrophobicContact CG1-CD 4.25Å; V138-K154 HydrophobicContact CG1-CG 3.66Å
155K82.9Confident86.2Confident73 Ų73109.8 Ų109.832%0.31753%0.534SS..PPolyproline II helixtrans-75.7146.8172.6-62.8-169177-173.90109.2L136 T139 M153 Q157L136-K155 HydrophobicContact CD2-CD 3.97Å; L136-K155 HydrophobicContact CG-CD 4.37Å; T139-K155 HydrophobicContact CG2-CB 4.15Å; T139-K155 WeakPolarHBondContact CG2-O 3.48Å; T139-K155 PolarHBondContact OG1-N 2.94Å; M153-K155 PolarHBondContact O-N 3.17Å; K155-Q157 PolarHBondContact O-N 3.04Å
156A79Confident85.9Confident108 Ų108111.5 Ų111.589%0.89355%0.551SS**PPolyproline II helixtrans-65.6130.817300000109.7
157Q75.9Confident85.7Confident134 Ų134109.5 Ų109.563%0.62655%0.547SS*.PPolyproline II helixtrans-99.4138.3172.8-70.2-172.6-28.100110T139 K155 H159T139-Q157 HydrophobicContact CG2-CG 3.52Å; T139-Q157 PolarHBondContact O-NE2 3.43Å; K155-Q157 PolarHBondContact O-N 3.04Å; Q157-H159 PolarHBondContact O-N 3.16Å
158E78.9Confident85.6Confident152 Ų152111.9 Ų111.971%0.7155%0.552SS**PPolyproline II helixtrans-68.7117.3171-172.2-173.6177.500109K160E158-K160 HydrophobicContact CG-CG 3.89Å; E158-K160 PolarHBondContact O-N 2.84Å; E158-K160 WeakPolarHBondContact OE1-CE 3.25Å; E158-K160 WeakPolarHBondContact OE1-CG 3.43Å; E158-K160 WeakPolarHBondContact OE2-CE 3.38Å; E158-K160 IonicContact OE2-NZ 3.51Å
159H77.3Confident85.4Confident150 Ų150112.4 Ų112.469%0.69455%0.553SS**  trans-89.878.7174.3-172.6-77.6000109.8Q157 R161Q157-H159 PolarHBondContact O-N 3.16Å; H159-R161 PolarHBondContact O-N 3.26Å
160K78.9Confident85.3Confident148 Ų148115.3 Ų115.364%0.64356%0.561SS**  trans-63.7117173.9-68.3-172.8-176.5179.40109.2E158E158-K160 HydrophobicContact CG-CG 3.89Å; E158-K160 PolarHBondContact O-N 2.84Å; E158-K160 WeakPolarHBondContact OE1-CE 3.25Å; E158-K160 WeakPolarHBondContact OE1-CG 3.43Å; E158-K160 WeakPolarHBondContact OE2-CE 3.38Å; E158-K160 IonicContact OE2-NZ 3.51Å
161R81.4Confident85Confident185 Ų185110.9 Ų110.970%0.69855%0.547SS*.  trans-90.5115.2175-65.6-179.1-177.5176.90.8107.9H159 F163H159-R161 PolarHBondContact O-N 3.26Å; R161-F163 HydrophobicContact CB-CE2 4.11Å; R161-F163 HydrophobicContact CB-CZ 4.07Å
162E84.4Confident84.6Confident187 Ų187114.4 Ų114.487%0.87457%0.565SS**PPolyproline II helixtrans-86.2121.7169.4-63.9-173.9171.700108
163F87.4Confident83.9Confident119 Ų119121.3 Ų121.352%0.52260%0.596SS.*PPolyproline II helixtrans-97.1142.2172.9-62.1-77.7000108.3R161 Q167 L168R161-F163 HydrophobicContact CB-CE2 4.11Å; R161-F163 HydrophobicContact CB-CZ 4.07Å; F163-Q167 HydrophobicContact CB-CB 4.34Å; F163-L168 HydrophobicContact CB-CD2 3.73Å; F163-L168 HydrophobicContact CB-CG 3.81Å; F163-L168 HydrophobicContact CD2-CD2 4.23Å; F163-L168 HydrophobicContact CG-CD2 4.25Å
164T89.8Confident83.4Confident81 Ų81119 Ų11950%0.49759%0.591SS.*PPolyproline II helixtrans-66.7153.7173.966.70000110S166 Q167 L168T164-S166 PolarHBondContact O-N 2.92Å; T164-Q167 VanDerWaalsContact N-OE1 3.09Å; T164-Q167 WeakPolarHBondContact O-CB 3.45Å; T164-Q167 PolarHBondContact O-N 2.8Å; T164-Q167 WeakPolarHBondContact OG1-CB 3.4Å; T164-Q167 VanDerWaalsContact OG1-CG 3.28Å; T164-Q167 WeakPolarHBondContact OG1-CG 3.29Å; T164-Q167 PolarHBondContact OG1-N 3.49Å; T164-Q167 PolarHBondContact OG1-OE1 3.01Å; T164-L168 PolarHBondContact O-N 2.92Å
165E89.2Confident82.7Confident120 Ų120118.8 Ų118.856%0.56160%0.596SS**Hα-helixtrans-55.4-38.4176.4-175.859.8-150.300111.2Q167 L168 Q169E165-Q167 PolarHBondContact O-N 3.43Å; E165-L168 PolarHBondContact O-N 3.35Å; E165-Q169 HydrophobicContact CG-CG 4.43Å; E165-Q169 VanDerWaalsContact O-CG 3.22Å; E165-Q169 WeakPolarHBondContact O-CG 2.93Å; E165-Q169 PolarHBondContact O-N 3.32Å; E165-Q169 PolarHBondContact OE1-NE2 3.49Å
166S88.1Confident82.1Confident71 Ų71117.3 Ų117.350%0.49760%0.601SS.*Hα-helixtrans-60.2-45.6174.5-162.20000112.3T164 L168 Q169 E170T164-S166 PolarHBondContact O-N 2.92Å; S166-L168 VanDerWaalsContact C-N 3.34Å; S166-L168 PolarHBondContact O-N 3.46Å; S166-Q169 PolarHBondContact O-N 2.79Å; S166-E170 WeakPolarHBondContact O-CB 3.41Å; S166-E170 WeakPolarHBondContact O-CG 3.37Å; S166-E170 PolarHBondContact O-N 2.94Å; S166-E170 PolarHBondContact OG-OE1 2.79Å
167Q86.4Confident81.3Confident101 Ų101119 Ų11947%0.47259%0.594SS.*Hα-helixtrans-63.9-38.8177.3-76.6172.5-27.100112F163 T164 E165 G171F163-Q167 HydrophobicContact CB-CB 4.34Å; T164-Q167 VanDerWaalsContact N-OE1 3.09Å; T164-Q167 WeakPolarHBondContact O-CB 3.45Å; T164-Q167 PolarHBondContact O-N 2.8Å; T164-Q167 WeakPolarHBondContact OG1-CB 3.4Å; T164-Q167 VanDerWaalsContact OG1-CG 3.28Å; T164-Q167 WeakPolarHBondContact OG1-CG 3.29Å; T164-Q167 PolarHBondContact OG1-N 3.49Å; T164-Q167 PolarHBondContact OG1-OE1 3.01Å; E165-Q167 PolarHBondContact O-N 3.43Å; Q167-G171 PolarHBondContact O-N 2.97Å
168L88.7Confident80.7Confident82 Ų82122.2 Ų122.243%0.42961%0.609SS.*Hα-helixtrans-65.9-40.2175.1-68.4175.6000111.7F163 T164 E165 S166 G171 K172F163-L168 HydrophobicContact CB-CD2 3.73Å; F163-L168 HydrophobicContact CB-CG 3.81Å; F163-L168 HydrophobicContact CD2-CD2 4.23Å; F163-L168 HydrophobicContact CG-CD2 4.25Å; T164-L168 PolarHBondContact O-N 2.92Å; E165-L168 PolarHBondContact O-N 3.35Å; S166-L168 VanDerWaalsContact C-N 3.34Å; S166-L168 PolarHBondContact O-N 3.46Å; L168-G171 PolarHBondContact O-N 3.25Å; L168-K172 PolarHBondContact O-N 2.98Å
169Q87.5Confident79.8Confident76 Ų76122.6 Ų122.636%0.35561%0.613SS.*Hα-helixtrans-67.6-46.2176.4-68.1-69.7-11.800111.9E165 S166 G171 K172 H173E165-Q169 HydrophobicContact CG-CG 4.43Å; E165-Q169 VanDerWaalsContact O-CG 3.22Å; E165-Q169 WeakPolarHBondContact O-CG 2.93Å; E165-Q169 PolarHBondContact O-N 3.32Å; E165-Q169 PolarHBondContact OE1-NE2 3.49Å; S166-Q169 PolarHBondContact O-N 2.79Å; Q169-G171 PolarHBondContact O-N 2.82Å; Q169-K172 VanDerWaalsContact CD-NZ 3.29Å; Q169-K172 WeakPolarHBondContact O-CB 3.39Å; Q169-K172 PolarHBondContact O-N 2.99Å; Q169-H173 PolarHBondContact O-CD2 2.98Å; Q169-H173 VanDerWaalsContact O-CD2 3.22Å
170E86.1Confident78.9Confident121 Ų121118.4 Ų118.457%0.56561%0.61SS**Hα-helixtrans-57.4-39.5174.2-75.3169.4-154.600111.4S166 K172 H173S166-E170 WeakPolarHBondContact O-CB 3.41Å; S166-E170 WeakPolarHBondContact O-CG 3.37Å; S166-E170 PolarHBondContact O-N 2.94Å; S166-E170 PolarHBondContact OG-OE1 2.79Å; E170-K172 VanDerWaalsContact C-N 3.28Å; E170-K172 PolarHBondContact O-N 3.42Å; E170-H173 PolarHBondContact O-N 3.42Å; E170-H173 VanDerWaalsContact O-N 3.15Å
171G85Confident78Confident43 Ų43114.7 Ų114.744%0.44360%0.6SS.*Hα-helixtrans-60.2-31.3175.600000114.4Q167 L168 Q169 H173 V174Q167-G171 PolarHBondContact O-N 2.97Å; L168-G171 PolarHBondContact O-N 3.25Å; Q169-G171 PolarHBondContact O-N 2.82Å; G171-H173 PolarHBondContact O-N 2.85Å; G171-V174 PolarHBondContact O-N 3.09Å
172K83.1Confident76.9Confident138 Ų138112.5 Ų112.560%0.660%0.602SS**Hα-helixtrans-65-24.4177.6-66.4173.9-171.41690112.8L168 Q169 E170L168-K172 PolarHBondContact O-N 2.98Å; Q169-K172 VanDerWaalsContact CD-NZ 3.29Å; Q169-K172 WeakPolarHBondContact O-CB 3.39Å; Q169-K172 PolarHBondContact O-N 2.99Å; E170-K172 VanDerWaalsContact C-N 3.28Å; E170-K172 PolarHBondContact O-N 3.42Å
173H79.5Confident75.6Confident154 Ų154114.9 Ų114.971%0.71360%0.603SS**THydrogen-bonded Turntrans-91.6-5.4-179.4-58.4-66.2000113.1Q169 E170 G171 I175Q169-H173 PolarHBondContact O-CD2 2.98Å; Q169-H173 VanDerWaalsContact O-CD2 3.22Å; E170-H173 PolarHBondContact O-N 3.42Å; E170-H173 VanDerWaalsContact O-N 3.15Å; G171-H173 PolarHBondContact O-N 2.85Å; H173-I175 PolarHBondContact O-N 2.98Å
174V76.9Confident74.2Confident111 Ų111112.5 Ų112.567%0.67361%0.612SS**  trans-85103.1177.5-177.90000109.6G171 G176G171-V174 PolarHBondContact O-N 3.09Å; V174-G176 PolarHBondContact O-N 3.36Å
175I70.5Confident72.7Confident141 Ų141112.2 Ų112.272%0.72362%0.618SS**  trans-74.5115.8173.3-57.9174.9000108.6H173 M179H173-I175 PolarHBondContact O-N 2.98Å; I175-M179 HydrophobicContact CG2-CB 3.83Å; I175-M179 HydrophobicContact CG2-CG 4.43Å
176G69.4Low71.5Confident41 Ų41110.8 Ų110.842%0.42362%0.622SS.*  trans-62.2143.5178.100000112.5V174 Q178 M179V174-G176 PolarHBondContact O-N 3.36Å; G176-Q178 PolarHBondContact O-N 3.43Å; G176-M179 WeakPolarHBondContact O-CB 3.42Å; G176-M179 PolarHBondContact O-N 3.2Å
177L63.8Low70Confident144 Ų144115.3 Ų115.375%0.75464%0.635SS**G310 helixtrans-56.4-23.1-178.6-79.1159.1000114.2M179 T181L177-M179 VanDerWaalsContact C-N 3.28Å; L177-M179 PolarHBondContact O-N 3.41Å; L177-T181 HydrophobicContact CD2-CG2 3.88Å
178Q62.2Low68.5Low202 Ų202114.8 Ų114.894%0.94465%0.647SS**G310 helixtrans-72.1-16.3175.7-73.2-171.9-21.800114.1G176 G180G176-Q178 PolarHBondContact O-N 3.43Å; Q178-G180 PolarHBondContact O-N 2.86Å
179M61.2Low67.1Low159 Ų159114.5 Ų114.578%0.78366%0.664SS**G310 helixtrans-81.912.8177-63.8-68.9-90.300112.9I175 G176 L177I175-M179 HydrophobicContact CG2-CB 3.83Å; I175-M179 HydrophobicContact CG2-CG 4.43Å; G176-M179 WeakPolarHBondContact O-CB 3.42Å; G176-M179 PolarHBondContact O-N 3.2Å; L177-M179 VanDerWaalsContact C-N 3.28Å; L177-M179 PolarHBondContact O-N 3.41Å
180G57.6Low65.7Low62 Ų62118.2 Ų118.264%0.63968%0.684SS**  trans80.3106.2-17900000111.2Q178Q178-G180 PolarHBondContact O-N 2.86Å
181T58.9Low64.6Low71 Ų71116.9 Ų116.944%0.43668%0.684SS.*  trans-87.7123.4169178.40000109.8L177 R183L177-T181 HydrophobicContact CD2-CG2 3.88Å; T181-R183 PolarHBondContact O-N 3.08Å; T181-R183 WeakPolarHBondContact OG1-CB 3.07Å; T181-R183 PolarHBondContact OG1-N 3.35Å
182N59.3Low63.6Low139 Ų139117.5 Ų117.574%0.74369%0.69SS**THydrogen-bonded Turntrans-75.7-4.917157.7-12.8000112.8G184 A185N182-G184 PolarHBondContact O-N 2.98Å; N182-A185 PolarHBondContact O-N 2.64Å
183R57.5Low62.5Low236 Ų236123 Ų12389%0.89171%0.709SS**THydrogen-bonded Turntrans-66.5-20179.2-77.8-171.9-174.8166.12.5114.1T181T181-R183 PolarHBondContact O-N 3.08Å; T181-R183 WeakPolarHBondContact OG1-CB 3.07Å; T181-R183 PolarHBondContact OG1-N 3.35Å
184G57Low61.7Low70 Ų70119.4 Ų119.472%0.72271%0.713SS**SBendtrans-103-11.2174.700000114.6N182 S186N182-G184 PolarHBondContact O-N 2.98Å; G184-S186 PolarHBondContact O-N 2.91Å
185A58.3Low61.1Low75 Ų75122.9 Ų122.962%0.6271%0.714SS**  trans-91.576-178.400000109.7N182 Q187N182-A185 PolarHBondContact O-N 2.64Å; A185-Q187 PolarHBondContact O-N 3.41Å
186S64.5Low60.9Low90 Ų90121.5 Ų121.563%0.62972%0.715SS**  trans-65130.8169.777.10000108.8G184 A188G184-S186 PolarHBondContact O-N 2.91Å; S186-A188 PolarHBondContact O-N 3.37Å
187Q56.9Low60.7Low166 Ų166131 Ų13178%0.77674%0.737SS**  trans-64.91.5174.6-159.4-179.520.800113.1A185 G189 M190A185-Q187 PolarHBondContact O-N 3.41Å; Q187-G189 PolarHBondContact O-N 3.16Å; Q187-M190 HydrophobicContact CG-CB 4.39Å; Q187-M190 PolarHBondContact O-N 2.97Å
188A54.1Low60.9Low89 Ų89132.4 Ų132.474%0.73674%0.74SS**THydrogen-bonded Turntrans-63.1109.5174.900000109.7S186S186-A188 PolarHBondContact O-N 3.37Å
189G59.6Low61Low76 Ų76130.4 Ų130.478%0.78474%0.735SS**THydrogen-bonded Turntrans103-6.8177.700000115.8Q187 T191Q187-G189 PolarHBondContact O-N 3.16Å; G189-T191 PolarHBondContact O-N 3.46Å; G189-T191 VanDerWaalsContact O-N 3.11Å
190M57.9Low60.7Low154 Ų154130.2 Ų130.276%0.75974%0.735SS**  trans-74.7102.7169.8-73.8-170.277.600109.6Q187 G192Q187-M190 HydrophobicContact CG-CB 4.39Å; Q187-M190 PolarHBondContact O-N 2.97Å; M190-G192 PolarHBondContact O-N 3.14Å
191T62.5Low60.5Low94 Ų94136 Ų13658%0.57777%0.766SS**PPolyproline II helixtrans-66.7121.5171.652.70000109.3G189G189-T191 PolarHBondContact O-N 3.46Å; G189-T191 VanDerWaalsContact O-N 3.11Å
192G64.6Low60.6Low55 Ų55139.3 Ų139.357%0.56778%0.782SS**PPolyproline II helixtrans-54.6152176.600000112.8M190 G194M190-G192 PolarHBondContact O-N 3.14Å; G192-G194 PolarHBondContact O-N 3.39Å
193Y60.4Low60.7Low254 Ų254139.3 Ų139.3100%0.99679%0.785SS**THydrogen-bonded Turntrans-51.2126.8175.6-78.3-83.2000110.3
194G63.4Low60.9Low78 Ų78133.9 Ų133.980%0.80478%0.779SS**THydrogen-bonded Turntrans104.77.9176.400000116.4G192 P196G192-G194 PolarHBondContact O-N 3.39Å; G194-P196 WeakPolarHBondContact O-CD 3.08Å
195R64.3Low61.1Low185 Ų185137.7 Ų137.770%0.69878%0.782SS**PPolyproline II helixtrans-73.2122.1175.2-133.6-178.9-169.4-145.53.8111.1
196P66.4Low61.3Low112 Ų112141.6 Ų141.673%0.72779%0.792SS**PPolyproline II helixtrans-70147.6179.126.6-32.1000111.5G194 Q198G194-P196 WeakPolarHBondContact O-CD 3.08Å; P196-Q198 PolarHBondContact O-N 3.4Å
197R65.1Low61Low239 Ų239145.1 Ų145.190%0.90280%0.803SS**PPolyproline II helixtrans-64.4126.9177.7-71.1-173.7-165.4174.84.9109.7I199R197-I199 PolarHBondContact O-N 3.35Å
198Q66.9Low61.3Low175 Ų175143.6 Ų143.682%0.81881%0.805SS**  trans-73.3111.2170.4-72.2-175-30.800108.8P196P196-Q198 PolarHBondContact O-N 3.4Å
199I64.6Low61.9Low160 Ų160147.8 Ų147.882%0.82181%0.81SS**  trans-95.3115.9169.1-52.6176.5000105.7R197R197-I199 PolarHBondContact O-N 3.35Å
200I55.3Low62.1Low155 Ų155153.8 Ų153.880%0.79581%0.812SS**  trans-91.1121.9176.8-58.7170.4000106.6
201S53.6Low62.5Low184 Ų184153.7 Ų153.7100%1.28782%0.817SS**  trans-81.10172.6740000111.4

Retrieved 201 of 201 residues in 41.8 ms (Link to these results)

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