A0A096NTD0_PAPAN Loading...

Charged multivesicular body protein 6

AlphaFold DB (Q96FZ7), UniProt , Accession A0A096NTD0, Species PAPAN (Papio anubis, Olive baboon), Gene CHMP6, 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
1M46.2Very low57.7Low248 Ų248164.3 Ų164.3100%1.22283%0.834SS**  0117.80-83.3-75.6-104.600108.8
2G57.8Low59.4Low61 Ų61171.2 Ų171.263%0.62984%0.842SS**  trans93.581.1158.900000117.5L4G2-L4 PolarHBondContact O-N 2.96Å
3N52.1Low61Low149 Ų149163.7 Ų163.780%0.79781%0.812SS**  trans-68.880.5157-78.811.3000109.2F5N3-F5 HydrophobicContact CB-CD2 4.18Å; N3-F5 PolarHBondContact O-N 3.19Å
4L53.6Low62.9Low167 Ų167156.2 Ų156.287%0.87478%0.78SS**  trans-80.569.5170.1-79.8156.9000109.2G2 G6G2-L4 PolarHBondContact O-N 2.96Å; L4-G6 PolarHBondContact O-N 2.97Å
5F59Low64.5Low195 Ų195154.2 Ų154.286%0.85577%0.767SS**  trans-66.867.9159.1-87.9-98000108.8N3 R7N3-F5 HydrophobicContact CB-CD2 4.18Å; N3-F5 PolarHBondContact O-N 3.19Å; F5-R7 PolarHBondContact O-N 3.28Å
6G64.4Low66Low60 Ų60148.9 Ų148.962%0.61974%0.739SS**  trans-68.6110.3164.500000107L4 K8L4-G6 PolarHBondContact O-N 2.97Å; G6-K8 PolarHBondContact O-N 3.49Å
7R59.1Low67.5Low244 Ų244144 Ų14492%0.92172%0.716SS**  trans-35.4113.7160.8-96.3175.3162.3165-5.8107F5 K9F5-R7 PolarHBondContact O-N 3.28Å; R7-K9 PolarHBondContact O-N 3.44Å
8K55.7Low68.9Low203 Ų203140.6 Ų140.688%0.88370%0.697SS**  trans-51.7108.3174.4-79.7-178178.5178.60105.3G6 Q10G6-K8 PolarHBondContact O-N 3.49Å; K8-Q10 PolarHBondContact O-N 3.3Å
9K59.3Low70.1Confident202 Ų202134.9 Ų134.988%0.87867%0.674SS**  trans-50.4110.2170.5-90.9-178.6174178.80104.5R7 S11R7-K9 PolarHBondContact O-N 3.44Å; K9-S11 PolarHBondContact O-N 3.33Å
10Q61.5Low71.3Confident193 Ų193128.9 Ų128.990%0.90264%0.644SS**  trans-49122.3171.3-88.9154.6-61.400106K8 R12K8-Q10 PolarHBondContact O-N 3.3Å; Q10-R12 PolarHBondContact O-N 3.12Å; Q10-R12 VanDerWaalsContact O-N 3.13Å
11S66Low72.5Confident85 Ų85127.4 Ų127.459%0.59464%0.638SS**  trans-55.8124.5-170.5490000108.3K9 V13K9-S11 PolarHBondContact O-N 3.33Å; S11-V13 PolarHBondContact O-N 3.36Å; S11-V13 PolarHBondContact OG-O 2.93Å
12R77.7Confident74.8Confident247 Ų247122 Ų12293%0.93261%0.609SS**SBendtrans-59.1-5.6172.1-179.5172.6159.3100.6-0.5113Q10Q10-R12 PolarHBondContact O-N 3.12Å; Q10-R12 VanDerWaalsContact O-N 3.13Å
13V81.2Confident76.7Confident74 Ų74120.6 Ų120.645%0.44859%0.587SS.*  trans-94.1118178.8-174.60000108.4S11 D17 K18S11-V13 PolarHBondContact O-N 3.36Å; S11-V13 PolarHBondContact OG-O 2.93Å; V13-D17 HydrophobicContact CG1-CB 3.75Å; V13-K18 HydrophobicContact CG1-CG 3.84Å
14T86.7Confident78.8Confident59 Ų59116.8 Ų116.836%0.36256%0.564SS.*  trans-79.4164.6174.866.60000111Q16 D17 K18T14-Q16 VanDerWaalsContact CB-OE1 3.24Å; T14-Q16 PolarHBondContact O-N 3.18Å; T14-Q16 PolarHBondContact OG1-OE1 3.25Å; T14-D17 WeakPolarHBondContact CB-OD2 3.44Å; T14-D17 PolarHBondContact N-OD2 3.48Å; T14-D17 PolarHBondContact O-N 3.22Å; T14-D17 PolarHBondContact OG1-N 3.2Å; T14-D17 PolarHBondContact OG1-OD2 3.12Å; T14-K18 PolarHBondContact O-N 3.12Å
15E87.9Confident80.9Confident126 Ų126113.5 Ų113.559%0.58954%0.544SS*.Hα-helixtrans-63.1-31.2173.1-67.6-55.7128.700111.3K18 A19E15-K18 PolarHBondContact O-N 2.92Å; E15-K18 IonicContact OE1-NZ 2.73Å; E15-K18 PolarHBondContact OE1-NZ 3.36Å; E15-K18 IonicContact OE2-NZ 2.57Å; E15-A19 PolarHBondContact O-N 3.04Å
16Q88.4Confident82.7Confident70 Ų70108.4 Ų108.433%0.32752%0.523SS..Hα-helixtrans-64.8-42.9174.5-60.582.2-1100111.3T14 K18 A19 I20 I91 Q95T14-Q16 VanDerWaalsContact CB-OE1 3.24Å; T14-Q16 PolarHBondContact O-N 3.18Å; T14-Q16 PolarHBondContact OG1-OE1 3.25Å; Q16-K18 VanDerWaalsContact C-N 3.3Å; Q16-K18 PolarHBondContact O-N 2.97Å; Q16-A19 PolarHBondContact O-N 2.99Å; Q16-I20 WeakPolarHBondContact O-CG1 3.36Å; Q16-I20 PolarHBondContact O-N 3.27Å; Q16-I91 HydrophobicContact CB-CG2 4.35Å; Q16-Q95 HydrophobicContact CB-CG 4.37Å; Q16-Q95 HydrophobicContact CG-CG 4.29Å
17D90.4Very high84.2Confident65 Ų65108.1 Ų108.135%0.34850%0.503SS..Hα-helixtrans-61.5-40175.7-65.2-46.6000111.7V13 T14 I20 L21V13-D17 HydrophobicContact CG1-CB 3.75Å; T14-D17 WeakPolarHBondContact CB-OD2 3.44Å; T14-D17 PolarHBondContact N-OD2 3.48Å; T14-D17 PolarHBondContact O-N 3.22Å; T14-D17 PolarHBondContact OG1-N 3.2Å; T14-D17 PolarHBondContact OG1-OD2 3.12Å; D17-I20 PolarHBondContact O-N 3.49Å; D17-L21 WeakPolarHBondContact O-CB 3.5Å; D17-L21 PolarHBondContact O-N 2.94Å
18K92.5Very high86Confident83 Ų8399.5 Ų99.536%0.36148%0.475SS..Hα-helixtrans-63.3-43.4175.6-65.4175.9-172.2167.20111.2V13 T14 E15 Q16 L21 Q22V13-K18 HydrophobicContact CG1-CG 3.84Å; T14-K18 PolarHBondContact O-N 3.12Å; E15-K18 PolarHBondContact O-N 2.92Å; E15-K18 IonicContact OE1-NZ 2.73Å; E15-K18 PolarHBondContact OE1-NZ 3.36Å; E15-K18 IonicContact OE2-NZ 2.57Å; Q16-K18 VanDerWaalsContact C-N 3.3Å; Q16-K18 PolarHBondContact O-N 2.97Å; K18-L21 PolarHBondContact O-N 3.11Å; K18-Q22 WeakPolarHBondContact O-CG 3.44Å; K18-Q22 PolarHBondContact O-N 3.48Å
19A92Very high88Confident33 Ų3395.6 Ų95.627%0.27346%0.458SS..Hα-helixtrans-62.5-46.9176.800000111.6E15 Q16 L21 Q22 L23 I91E15-A19 PolarHBondContact O-N 3.04Å; Q16-A19 PolarHBondContact O-N 2.99Å; A19-L21 VanDerWaalsContact C-N 3.3Å; A19-L21 PolarHBondContact O-N 3.38Å; A19-Q22 PolarHBondContact O-N 3.48Å; A19-L23 WeakPolarHBondContact O-CG 3.35Å; A19-L23 PolarHBondContact O-N 3.18Å; A19-I91 HydrophobicContact CB-CD1 4.41Å
20I94.9Very high89.8Confident14 Ų1487 Ų877%0.07242%0.422CS..Hα-helixtrans-58.3-44.1175.8-70.4169.6000110.7Q16 D17 L23 K24 V88 I91 E92Q16-I20 WeakPolarHBondContact O-CG1 3.36Å; Q16-I20 PolarHBondContact O-N 3.27Å; D17-I20 PolarHBondContact O-N 3.49Å; I20-L23 PolarHBondContact O-N 3.42Å; I20-K24 HydrophobicContact CG2-CD 3.79Å; I20-K24 VanDerWaalsContact CG2-CE 3.46Å; I20-K24 HydrophobicContact CG2-CG 4.38Å; I20-K24 WeakPolarHBondContact O-CB 3.41Å; I20-K24 WeakPolarHBondContact O-CG 3.48Å; I20-K24 PolarHBondContact O-N 3.22Å; I20-V88 HydrophobicContact CG2-CG1 4.22Å; I20-I91 HydrophobicContact CD1-CG2 3.95Å; I20-I91 HydrophobicContact CG1-CB 4.33Å; I20-I91 HydrophobicContact CG1-CG2 3.82Å; I20-E92 HydrophobicContact CD1-CG 3.86Å
21L95.4Very high91.5Very high97 Ų9783.4 Ų83.451%0.50840%0.4SS..Hα-helixtrans-61.5-45.7178.2-179.265000111.6D17 K18 A19 K24 Q25D17-L21 WeakPolarHBondContact O-CB 3.5Å; D17-L21 PolarHBondContact O-N 2.94Å; K18-L21 PolarHBondContact O-N 3.11Å; A19-L21 VanDerWaalsContact C-N 3.3Å; A19-L21 PolarHBondContact O-N 3.38Å; L21-K24 PolarHBondContact O-N 3.48Å; L21-Q25 VanDerWaalsContact O-CG 3.31Å; L21-Q25 WeakPolarHBondContact O-CG 3.48Å; L21-Q25 PolarHBondContact O-N 3.44Å
22Q95.6Very high92.9Very high134 Ų13485.2 Ų85.263%0.62640%0.399SS*.Hα-helixtrans-62-43.7178.2-74.1177.1-10.800111.9K18 A19 Q25 Q26K18-Q22 WeakPolarHBondContact O-CG 3.44Å; K18-Q22 PolarHBondContact O-N 3.48Å; A19-Q22 PolarHBondContact O-N 3.48Å; Q22-Q25 PolarHBondContact O-N 3.5Å; Q22-Q26 PolarHBondContact O-N 2.88Å
23L96.7Very high93.8Very high32 Ų3277.7 Ų77.717%0.16837%0.371CS..Hα-helixtrans-62.6-44.1176.1-69.6171.8000111.7A19 I20 Q26 R27 L84 M87 V88 I91A19-L23 WeakPolarHBondContact O-CG 3.35Å; A19-L23 PolarHBondContact O-N 3.18Å; I20-L23 PolarHBondContact O-N 3.42Å; L23-Q26 PolarHBondContact O-N 3.23Å; L23-R27 WeakPolarHBondContact O-CB 3.48Å; L23-R27 PolarHBondContact O-N 3.04Å; L23-L84 HydrophobicContact CD2-CD2 3.64Å; L23-M87 HydrophobicContact CD1-CB 4.18Å; L23-M87 HydrophobicContact CD2-CE 4.36Å; L23-V88 HydrophobicContact CB-CG2 3.64Å; L23-V88 HydrophobicContact CD1-CG2 3.94Å; L23-V88 HydrophobicContact CG-CG2 4.46Å; L23-I91 HydrophobicContact CD1-CD1 3.45Å; L23-I91 VanDerWaalsContact CD1-CD1 3.45Å
24K96.4Very high94.4Very high70 Ų7076.8 Ų76.830%0.30436%0.362SS..Hα-helixtrans-61.8-44176-74.8175.3-179.9168.60111.4I20 L21 Q26 R27 D28 V88 E92I20-K24 HydrophobicContact CG2-CD 3.79Å; I20-K24 VanDerWaalsContact CG2-CE 3.46Å; I20-K24 HydrophobicContact CG2-CG 4.38Å; I20-K24 WeakPolarHBondContact O-CB 3.41Å; I20-K24 WeakPolarHBondContact O-CG 3.48Å; I20-K24 PolarHBondContact O-N 3.22Å; L21-K24 PolarHBondContact O-N 3.48Å; K24-Q26 VanDerWaalsContact C-N 3.35Å; K24-Q26 PolarHBondContact O-N 2.99Å; K24-R27 WeakPolarHBondContact O-CB 3.49Å; K24-R27 PolarHBondContact O-N 3.06Å; K24-D28 PolarHBondContact O-N 3.15Å; K24-V88 HydrophobicContact CG-CG2 4.42Å; K24-E92 IonicContact NZ-OE1 2.68Å
25Q97.4Very high94.9Very high97 Ų9780.7 Ų80.745%0.45337%0.374SS..Hα-helixtrans-60.7-42.6174.9-73.8178.611.200112.3L21 Q22 D28 K29L21-Q25 VanDerWaalsContact O-CG 3.31Å; L21-Q25 WeakPolarHBondContact O-CG 3.48Å; L21-Q25 PolarHBondContact O-N 3.44Å; Q22-Q25 PolarHBondContact O-N 3.5Å; Q25-D28 PolarHBondContact O-N 3.49Å; Q25-K29 WeakPolarHBondContact O-CG 3.42Å; Q25-K29 PolarHBondContact O-N 2.86Å
26Q96.8Very high95.3Very high89 Ų8982.1 Ų82.142%0.41637%0.374SS..Hα-helixtrans-65.5-42.4177.7-174.860.316.500111.6Q22 L23 K24 D28 K29 L30 L84Q22-Q26 PolarHBondContact O-N 2.88Å; L23-Q26 PolarHBondContact O-N 3.23Å; K24-Q26 VanDerWaalsContact C-N 3.35Å; K24-Q26 PolarHBondContact O-N 2.99Å; Q26-D28 VanDerWaalsContact C-N 3.32Å; Q26-D28 PolarHBondContact O-N 3.26Å; Q26-K29 PolarHBondContact O-N 3.26Å; Q26-L30 WeakPolarHBondContact O-CG 3.44Å; Q26-L30 PolarHBondContact O-N 3.02Å; Q26-L84 HydrophobicContact CB-CD1 4.28Å; Q26-L84 HydrophobicContact CG-CD1 3.93Å; Q26-L84 HydrophobicContact CG-CD2 4.35Å
27R96.6Very high95.5Very high53 Ų5379.2 Ų79.220%0.236%0.361CS..Hα-helixtrans-58.4-45.7174.5-177.8-158.564-165.1-4111.1L23 K24 K29 L30 R31 I81 L84 E85L23-R27 WeakPolarHBondContact O-CB 3.48Å; L23-R27 PolarHBondContact O-N 3.04Å; K24-R27 WeakPolarHBondContact O-CB 3.49Å; K24-R27 PolarHBondContact O-N 3.06Å; R27-K29 VanDerWaalsContact C-N 3.34Å; R27-K29 PolarHBondContact O-N 3.32Å; R27-L30 PolarHBondContact O-N 3.15Å; R27-L30 VanDerWaalsContact O-N 3.17Å; R27-R31 WeakPolarHBondContact O-CG 3.32Å; R27-R31 PolarHBondContact O-N 3.35Å; R27-I81 HydrophobicContact CG-CG2 4.05Å; R27-L84 HydrophobicContact CB-CB 4.33Å; R27-L84 HydrophobicContact CB-CD1 4.04Å; R27-E85 WeakPolarHBondContact CD-OE1 3.42Å; R27-E85 HydrophobicContact CG-CG 4.41Å
28D97.2Very high95.7Very high63 Ų6378 Ų7834%0.33736%0.36SS..Hα-helixtrans-67.1-36.5-178.4-64.2-13000111.6K24 Q25 Q26 R31 Q32K24-D28 PolarHBondContact O-N 3.15Å; Q25-D28 PolarHBondContact O-N 3.49Å; Q26-D28 VanDerWaalsContact C-N 3.32Å; Q26-D28 PolarHBondContact O-N 3.26Å; D28-R31 PolarHBondContact O-N 2.93Å; D28-Q32 WeakPolarHBondContact O-CG 3.45Å; D28-Q32 PolarHBondContact O-N 3.44Å
29K97.2Very high95.9Very high122 Ų12278 Ų7853%0.5336%0.361SS..Hα-helixtrans-61.7-42.5170.6-73.1174.2-176.9174.60112.1Q25 Q26 R27 Q32 Y33Q25-K29 WeakPolarHBondContact O-CG 3.42Å; Q25-K29 PolarHBondContact O-N 2.86Å; Q26-K29 PolarHBondContact O-N 3.26Å; R27-K29 VanDerWaalsContact C-N 3.34Å; R27-K29 PolarHBondContact O-N 3.32Å; K29-Q32 PolarHBondContact O-N 3.35Å; K29-Y33 PolarHBondContact O-N 3.38Å
30L96.9Very high95.9Very high22 Ų2280.3 Ų80.312%0.11537%0.366CS..Hα-helixtrans-65.1-40.9175.8-70.1-177.8000111.7Q26 R27 Q32 Y33 Q34 T77 Q80 I81 L84Q26-L30 WeakPolarHBondContact O-CG 3.44Å; Q26-L30 PolarHBondContact O-N 3.02Å; R27-L30 PolarHBondContact O-N 3.15Å; R27-L30 VanDerWaalsContact O-N 3.17Å; L30-Q32 VanDerWaalsContact C-N 3.32Å; L30-Q32 PolarHBondContact O-N 2.57Å; L30-Y33 CarbonylContact O-C 3.35Å; L30-Y33 WeakPolarHBondContact O-CB 3.48Å; L30-Y33 PolarHBondContact O-N 3.44Å; L30-Y33 VanDerWaalsContact O-N 3.11Å; L30-Q34 WeakPolarHBondContact O-CB 3.32Å; L30-Q34 PolarHBondContact O-N 3.32Å; L30-T77 HydrophobicContact CB-CG2 4.09Å; L30-T77 HydrophobicContact CD2-CG2 4.27Å; L30-Q80 HydrophobicContact CD1-CB 3.8Å; L30-I81 HydrophobicContact CB-CD1 4.03Å; L30-I81 HydrophobicContact CB-CG1 3.67Å; L30-I81 HydrophobicContact CD1-CG1 4.13Å; L30-L84 HydrophobicContact CD1-CD1 3.57Å
31R97Very high95.9Very high116 Ų11680.9 Ų80.944%0.43837%0.369SS..Hα-helixtrans-60.8-40.6173.9-72.8-179176-159.40.1112.1R27 D28 Y33 Q34 K35 I81 E85R27-R31 WeakPolarHBondContact O-CG 3.32Å; R27-R31 PolarHBondContact O-N 3.35Å; D28-R31 PolarHBondContact O-N 2.93Å; R31-Y33 VanDerWaalsContact C-N 3.34Å; R31-Q34 PolarHBondContact O-N 3.1Å; R31-K35 PolarHBondContact O-N 2.92Å; R31-I81 HydrophobicContact CG-CD1 3.88Å; R31-I81 HydrophobicContact CG-CG1 4.49Å; R31-E85 IonicContact CZ-OE1 3.95Å; R31-E85 IonicContact NE-OE1 3.73Å; R31-E85 IonicContact NH2-OE1 3.66Å; R31-E85 PolarHBondContact NH2-OE1 3.21Å
32Q97Very high95.8Very high124 Ų12482.6 Ų82.658%0.57938%0.375SS*.Hα-helixtrans-64.5-38.3173.4-70.2174.426.800112.3D28 K29 L30 R36D28-Q32 WeakPolarHBondContact O-CG 3.45Å; D28-Q32 PolarHBondContact O-N 3.44Å; K29-Q32 PolarHBondContact O-N 3.35Å; L30-Q32 VanDerWaalsContact C-N 3.32Å; L30-Q32 PolarHBondContact O-N 2.57Å; Q32-R36 WeakPolarHBondContact O-CG 3.33Å; Q32-R36 PolarHBondContact O-N 3.3Å; Q32-R36 VanDerWaalsContact O-N 3.15Å; Q32-R36 PolarHBondContact O-NE 2.89Å
33Y95.6Very high95.7Very high88 Ų8884.3 Ų84.335%0.34538%0.376SS..Hα-helixtrans-64.7-45.9174-179.1-116.7000111.9K29 L30 R31 K35 R36 I37 T77K29-Y33 PolarHBondContact O-N 3.38Å; L30-Y33 CarbonylContact O-C 3.35Å; L30-Y33 WeakPolarHBondContact O-CB 3.48Å; L30-Y33 PolarHBondContact O-N 3.44Å; L30-Y33 VanDerWaalsContact O-N 3.11Å; R31-Y33 VanDerWaalsContact C-N 3.34Å; Y33-K35 VanDerWaalsContact C-N 3.34Å; Y33-K35 PolarHBondContact O-N 3.05Å; Y33-R36 PolarHBondContact O-N 2.91Å; Y33-R36 VanDerWaalsContact O-N 3.15Å; Y33-I37 HydrophobicContact CD1-CD1 3.67Å; Y33-I37 HydrophobicContact CD2-CD1 4.21Å; Y33-I37 HydrophobicContact CD2-CG1 4.4Å; Y33-I37 HydrophobicContact CE1-CD1 3.18Å; Y33-I37 HydrophobicContact CE1-CG1 4.29Å; Y33-I37 HydrophobicContact CE2-CD1 3.78Å; Y33-I37 HydrophobicContact CE2-CG1 4.04Å; Y33-I37 HydrophobicContact CG-CD1 4.17Å; Y33-I37 PolarHBondContact O-N 3.21Å; Y33-T77 HydrophobicContact CD1-CG2 4.17Å
34Q95.1Very high95.5Very high56 Ų5683.3 Ų83.326%0.26237%0.37SS..Hα-helixtrans-55.2-48175.1-167-172.122.500111.2L30 R31 R36 I37 A38 L74 T77L30-Q34 WeakPolarHBondContact O-CB 3.32Å; L30-Q34 PolarHBondContact O-N 3.32Å; R31-Q34 PolarHBondContact O-N 3.1Å; Q34-R36 PolarHBondContact O-N 3.39Å; Q34-I37 PolarHBondContact O-N 3.08Å; Q34-A38 WeakPolarHBondContact O-CB 3.5Å; Q34-A38 PolarHBondContact O-N 3.05Å; Q34-L74 HydrophobicContact CB-CD2 4.28Å; Q34-L74 HydrophobicContact CG-CD2 3.61Å; Q34-T77 HydrophobicContact CB-CG2 4.35Å
35K96.1Very high95.3Very high140 Ų14087 Ų8761%0.60938%0.382SS*.Hα-helixtrans-60.2-41.7177.2-173.6175.8-178.7177.10112.6R31 Y33 A38 Q39R31-K35 PolarHBondContact O-N 2.92Å; Y33-K35 VanDerWaalsContact C-N 3.34Å; Y33-K35 PolarHBondContact O-N 3.05Å; K35-A38 PolarHBondContact O-N 3.06Å; K35-Q39 WeakPolarHBondContact O-CG 3.41Å; K35-Q39 PolarHBondContact O-N 3.46Å; K35-Q39 VanDerWaalsContact O-N 3.12Å
36R95.8Very high95.1Very high156 Ų15684 Ų8459%0.58937%0.374SS*.Hα-helixtrans-64.4-44.9177.7-75.4-177-69.2161.7-2.6111.9Q32 Y33 Q34 Q39 Q40Q32-R36 WeakPolarHBondContact O-CG 3.33Å; Q32-R36 PolarHBondContact O-N 3.3Å; Q32-R36 VanDerWaalsContact O-N 3.15Å; Q32-R36 PolarHBondContact O-NE 2.89Å; Y33-R36 PolarHBondContact O-N 2.91Å; Y33-R36 VanDerWaalsContact O-N 3.15Å; Q34-R36 PolarHBondContact O-N 3.39Å; R36-Q39 PolarHBondContact O-N 2.96Å; R36-Q40 PolarHBondContact O-N 2.92Å; R36-Q40 VanDerWaalsContact O-N 3.08Å
37I94.2Very high95Very high10 Ų1084 Ų845%0.05138%0.376CS..Hα-helixtrans-66.3-42177.9-62.1164.6000110.7Y33 Q34 Q39 Q40 L41 Q70 L74Y33-I37 HydrophobicContact CD1-CD1 3.67Å; Y33-I37 HydrophobicContact CD2-CD1 4.21Å; Y33-I37 HydrophobicContact CD2-CG1 4.4Å; Y33-I37 HydrophobicContact CE1-CD1 3.18Å; Y33-I37 HydrophobicContact CE1-CG1 4.29Å; Y33-I37 HydrophobicContact CE2-CD1 3.78Å; Y33-I37 HydrophobicContact CE2-CG1 4.04Å; Y33-I37 HydrophobicContact CG-CD1 4.17Å; Y33-I37 PolarHBondContact O-N 3.21Å; Q34-I37 PolarHBondContact O-N 3.08Å; I37-Q39 VanDerWaalsContact C-N 3.33Å; I37-Q39 PolarHBondContact O-N 2.73Å; I37-Q40 WeakPolarHBondContact O-CB 3.45Å; I37-Q40 PolarHBondContact O-N 3.2Å; I37-Q40 VanDerWaalsContact O-N 3.1Å; I37-L41 WeakPolarHBondContact O-CB 3.42Å; I37-L41 PolarHBondContact O-N 3.46Å; I37-Q70 HydrophobicContact CG2-CB 4.09Å; I37-L74 HydrophobicContact CB-CD2 3.77Å; I37-L74 HydrophobicContact CB-CG 4.12Å; I37-L74 HydrophobicContact CD1-CD2 4.21Å; I37-L74 HydrophobicContact CG2-CD1 3.86Å; I37-L74 HydrophobicContact CG2-CD2 3.9Å; I37-L74 HydrophobicContact CG2-CG 3.64Å
38A93.9Very high94.8Very high39 Ų3981.7 Ų81.732%0.32237%0.368SS..Hα-helixtrans-57.4-45.6177.900000111.9Q34 K35 Q40 L41 E42Q34-A38 WeakPolarHBondContact O-CB 3.5Å; Q34-A38 PolarHBondContact O-N 3.05Å; K35-A38 PolarHBondContact O-N 3.06Å; A38-Q40 PolarHBondContact O-N 3.33Å; A38-L41 WeakPolarHBondContact O-CB 3.28Å; A38-L41 PolarHBondContact O-N 3.1Å; A38-E42 PolarHBondContact O-N 3.23Å; A38-E42 VanDerWaalsContact O-N 3.1Å
39Q95.3Very high94.7Very high84 Ų8484.2 Ų84.239%0.39337%0.373SS..Hα-helixtrans-62.8-39.7174.8-71.4178.1-200112.7K35 R36 I37 L41 R43K35-Q39 WeakPolarHBondContact O-CG 3.41Å; K35-Q39 PolarHBondContact O-N 3.46Å; K35-Q39 VanDerWaalsContact O-N 3.12Å; R36-Q39 PolarHBondContact O-N 2.96Å; I37-Q39 VanDerWaalsContact C-N 3.33Å; I37-Q39 PolarHBondContact O-N 2.73Å; Q39-L41 VanDerWaalsContact C-N 3.32Å; Q39-R43 WeakPolarHBondContact O-CG 3.39Å; Q39-R43 PolarHBondContact O-N 3.08Å
40Q93.3Very high94.5Very high81 Ų8183.4 Ų83.438%0.37937%0.371SS..Hα-helixtrans-64-40.6175.7-179.7171.9-4.800111.3R36 I37 A38 E42 R43 E44R36-Q40 PolarHBondContact O-N 2.92Å; R36-Q40 VanDerWaalsContact O-N 3.08Å; I37-Q40 WeakPolarHBondContact O-CB 3.45Å; I37-Q40 PolarHBondContact O-N 3.2Å; I37-Q40 VanDerWaalsContact O-N 3.1Å; A38-Q40 PolarHBondContact O-N 3.33Å; Q40-E42 VanDerWaalsContact C-N 3.35Å; Q40-E42 PolarHBondContact O-N 2.84Å; Q40-R43 WeakPolarHBondContact O-CB 3.46Å; Q40-R43 PolarHBondContact O-N 3.1Å; Q40-E44 HydrophobicContact CG-CG 4.35Å; Q40-E44 PolarHBondContact NE2-OE1 2.92Å; Q40-E44 WeakPolarHBondContact O-CG 3.47Å; Q40-E44 PolarHBondContact O-N 3.11Å
41L94.2Very high94.4Very high25 Ų2584 Ų8413%0.13137%0.374CS..Hα-helixtrans-64.8-37.9-179.2-171.4139.7000112.3I37 A38 Q39 E44 R45 K67 Q70 E71 L74I37-L41 WeakPolarHBondContact O-CB 3.42Å; I37-L41 PolarHBondContact O-N 3.46Å; A38-L41 WeakPolarHBondContact O-CB 3.28Å; A38-L41 PolarHBondContact O-N 3.1Å; Q39-L41 VanDerWaalsContact C-N 3.32Å; L41-E44 PolarHBondContact O-N 3.37Å; L41-R45 WeakPolarHBondContact O-CB 3.47Å; L41-R45 PolarHBondContact O-N 3.03Å; L41-K67 HydrophobicContact CD1-CG 4.09Å; L41-K67 HydrophobicContact CG-CG 4.11Å; L41-Q70 HydrophobicContact CD1-CB 4.46Å; L41-E71 HydrophobicContact CD1-CG 3.39Å; L41-L74 HydrophobicContact CD1-CD1 4.25Å
42E93.2Very high94.2Very high134 Ų13483 Ų8363%0.62638%0.377SS*.Hα-helixtrans-61.8-43172.7-71.6178.8168.200112.4A38 Q40 R45 A46A38-E42 PolarHBondContact O-N 3.23Å; A38-E42 VanDerWaalsContact O-N 3.1Å; Q40-E42 VanDerWaalsContact C-N 3.35Å; Q40-E42 PolarHBondContact O-N 2.84Å; E42-R45 WeakPolarHBondContact O-CB 3.42Å; E42-R45 PolarHBondContact O-N 3.45Å; E42-A46 PolarHBondContact O-N 2.74Å
43R93.8Very high94.1Very high170 Ų17087.1 Ų87.164%0.64239%0.387SS*.Hα-helixtrans-64.5-46.2176.2-64.5174.1-166173.84.3111.2Q39 Q40 R45 A46 L47Q39-R43 WeakPolarHBondContact O-CG 3.39Å; Q39-R43 PolarHBondContact O-N 3.08Å; Q40-R43 WeakPolarHBondContact O-CB 3.46Å; Q40-R43 PolarHBondContact O-N 3.1Å; R43-R45 VanDerWaalsContact C-N 3.27Å; R43-R45 PolarHBondContact O-N 2.92Å; R43-A46 PolarHBondContact O-N 2.96Å; R43-A46 VanDerWaalsContact O-N 3.15Å; R43-L47 WeakPolarHBondContact O-CG 3.48Å; R43-L47 PolarHBondContact O-N 3.23Å
44E92.3Very high94.1Very high10 Ų1087.9 Ų87.95%0.04740%0.397CS..Hα-helixtrans-62.7-35.7177.2-69.7-170.9-169.600111.4Q40 L41 L47 A48 L63 K66 Q70Q40-E44 HydrophobicContact CG-CG 4.35Å; Q40-E44 PolarHBondContact NE2-OE1 2.92Å; Q40-E44 WeakPolarHBondContact O-CG 3.47Å; Q40-E44 PolarHBondContact O-N 3.11Å; L41-E44 PolarHBondContact O-N 3.37Å; E44-L47 PolarHBondContact O-N 3.47Å; E44-A48 VanDerWaalsContact O-CB 3.32Å; E44-A48 WeakPolarHBondContact O-CB 3.42Å; E44-A48 PolarHBondContact O-N 3.12Å; E44-L63 HydrophobicContact CB-CD1 4.13Å; E44-L63 HydrophobicContact CB-CG 4.46Å; E44-L63 HydrophobicContact CG-CD1 4.05Å; E44-L63 WeakPolarHBondContact O-CD2 3.31Å; E44-K66 VanDerWaalsContact OE1-CE 3.28Å; E44-K66 WeakPolarHBondContact OE1-CE 3.37Å; E44-K66 IonicContact OE1-NZ 3.35Å; E44-K66 PolarHBondContact OE1-NZ 2.96Å; E44-Q70 PolarHBondContact OE1-NE2 3.39Å; E44-Q70 PolarHBondContact OE2-OE1 3.38Å; E44-Q70 VanDerWaalsContact OE2-OE1 3.08Å
45R92.3Very high94Very high148 Ų14887.7 Ų87.756%0.55841%0.411SS*.Hα-helixtrans-64.7-40.6173.4-167.8-177.1179.6-178.80.1112.2L41 E42 R43 R49L41-R45 WeakPolarHBondContact O-CB 3.47Å; L41-R45 PolarHBondContact O-N 3.03Å; E42-R45 WeakPolarHBondContact O-CB 3.42Å; E42-R45 PolarHBondContact O-N 3.45Å; R43-R45 VanDerWaalsContact C-N 3.27Å; R43-R45 PolarHBondContact O-N 2.92Å; R45-R49 WeakPolarHBondContact O-CG 3.35Å; R45-R49 PolarHBondContact O-N 3.38Å
46A94.1Very high94Very high35 Ų3587.2 Ų87.229%0.28941%0.405SS..Hα-helixtrans-66-45175.600000112E42 R43 A48 R49 Q50E42-A46 PolarHBondContact O-N 2.74Å; R43-A46 PolarHBondContact O-N 2.96Å; R43-A46 VanDerWaalsContact O-N 3.15Å; A46-A48 PolarHBondContact O-N 3.27Å; A46-R49 WeakPolarHBondContact O-CB 3.26Å; A46-R49 PolarHBondContact O-N 3.21Å; A46-Q50 PolarHBondContact O-N 3.45Å
47L94.4Very high93.8Very high88 Ų8887.2 Ų87.246%0.46141%0.41SS..Hα-helixtrans-62.7-40.4176.3-70.6172.6000112.1R43 E44 R49 Q50 L51 L63R43-L47 WeakPolarHBondContact O-CG 3.48Å; R43-L47 PolarHBondContact O-N 3.23Å; E44-L47 PolarHBondContact O-N 3.47Å; L47-R49 VanDerWaalsContact C-N 3.31Å; L47-R49 PolarHBondContact O-N 3Å; L47-Q50 PolarHBondContact O-N 3.35Å; L47-L51 WeakPolarHBondContact O-CG 3.48Å; L47-L51 PolarHBondContact O-N 2.84Å; L47-L63 HydrophobicContact CB-CD2 3.76Å
48A92.5Very high93.7Very high4 Ų493 Ų933%0.03344%0.437CS..Hα-helixtrans-61.5-40.7175.700000111.7E44 A46 L51 L52 L63 L64E44-A48 VanDerWaalsContact O-CB 3.32Å; E44-A48 WeakPolarHBondContact O-CB 3.42Å; E44-A48 PolarHBondContact O-N 3.12Å; A46-A48 PolarHBondContact O-N 3.27Å; A48-L51 PolarHBondContact O-N 2.89Å; A48-L52 WeakPolarHBondContact O-CG 3.41Å; A48-L52 PolarHBondContact O-N 3.27Å; A48-L52 VanDerWaalsContact O-N 3.12Å; A48-L63 HydrophobicContact CB-CD2 3.92Å; A48-L63 HydrophobicContact CB-CG 4.39Å; A48-L64 HydrophobicContact CB-CD2 4.12Å; A48-L64 HydrophobicContact CB-CG 4.45Å
49R93.7Very high93.7Very high116 Ų11698.4 Ų98.444%0.43845%0.448SS..Hα-helixtrans-64.4-39.8174.9-73-177.1-66.8-116.7-1.7112.4R45 A46 L47 L52 R53R45-R49 WeakPolarHBondContact O-CG 3.35Å; R45-R49 PolarHBondContact O-N 3.38Å; A46-R49 WeakPolarHBondContact O-CB 3.26Å; A46-R49 PolarHBondContact O-N 3.21Å; L47-R49 VanDerWaalsContact C-N 3.31Å; L47-R49 PolarHBondContact O-N 3Å; R49-L52 PolarHBondContact O-N 3.48Å; R49-R53 WeakPolarHBondContact O-CG 3.46Å; R49-R53 PolarHBondContact O-N 2.9Å
50Q94.6Very high93.6Very high106 Ų10694.4 Ų94.450%0.49543%0.43SS..Hα-helixtrans-64.3-48.4175.9-72175.3-11.200111.2A46 L47 L52 R53 D54A46-Q50 PolarHBondContact O-N 3.45Å; L47-Q50 PolarHBondContact O-N 3.35Å; Q50-L52 PolarHBondContact O-N 3.05Å; Q50-R53 WeakPolarHBondContact O-CB 3.49Å; Q50-R53 PolarHBondContact O-N 3.48Å; Q50-D54 PolarHBondContact O-N 2.99Å
51L94.5Very high93.6Very high33 Ų3396.1 Ų96.117%0.17344%0.436CS..Hα-helixtrans-59.7-32.2178.2-72171.8000113.5L47 A48 G55 R56 R59 A60 L63L47-L51 WeakPolarHBondContact O-CG 3.48Å; L47-L51 PolarHBondContact O-N 2.84Å; A48-L51 PolarHBondContact O-N 2.89Å; L51-G55 PolarHBondContact O-N 3.4Å; L51-R56 HydrophobicContact CD2-CB 4.24Å; L51-R56 PolarHBondContact O-N 3.4Å; L51-R59 HydrophobicContact CD1-CB 4.16Å; L51-R59 HydrophobicContact CD2-CB 4.42Å; L51-A60 HydrophobicContact CB-CB 3.98Å; L51-L63 HydrophobicContact CD1-CD2 4.12Å
52L93.1Very high93.6Very high95 Ų95100.5 Ų100.550%0.49746%0.459SS..Hα-helixtrans-69.8-38.6173.7-73.1173.2000112.5A48 R49 Q50 D54 G55 A60A48-L52 WeakPolarHBondContact O-CG 3.41Å; A48-L52 PolarHBondContact O-N 3.27Å; A48-L52 VanDerWaalsContact O-N 3.12Å; R49-L52 PolarHBondContact O-N 3.48Å; Q50-L52 PolarHBondContact O-N 3.05Å; L52-D54 VanDerWaalsContact C-N 3.32Å; L52-G55 PolarHBondContact O-N 2.99Å; L52-A60 HydrophobicContact CD2-CB 3.7Å; L52-A60 HydrophobicContact CG-CB 3.83Å
53R94.4Very high93.6Very high211 Ų21195.4 Ų95.480%0.79644%0.436SS*.Hα-helixtrans-66-36.6174.3-67.9177.5-170.7-175.71111.6R49 Q50 G55R49-R53 WeakPolarHBondContact O-CG 3.46Å; R49-R53 PolarHBondContact O-N 2.9Å; Q50-R53 WeakPolarHBondContact O-CB 3.49Å; Q50-R53 PolarHBondContact O-N 3.48Å; R53-G55 PolarHBondContact O-N 3.31Å
54D95.1Very high93.5Very high104 Ų10491.3 Ų91.356%0.55643%0.426SS*.THydrogen-bonded Turntrans-75.44177.4-59.5-17.3000113.5Q50 L52 R56Q50-D54 PolarHBondContact O-N 2.99Å; L52-D54 VanDerWaalsContact C-N 3.32Å; D54-R56 HydrophobicContact CB-CG 4.33Å; D54-R56 PolarHBondContact O-N 2.81Å
55G93.5Very high93.6Very high53 Ų5397.1 Ų97.155%0.54645%0.451SS..THydrogen-bonded Turntrans72.33.8-178.500000115.1L51 L52 R53 K57L51-G55 PolarHBondContact O-N 3.4Å; L52-G55 PolarHBondContact O-N 2.99Å; R53-G55 PolarHBondContact O-N 3.31Å; G55-K57 VanDerWaalsContact C-N 3.29Å; G55-K57 PolarHBondContact O-N 3.4Å
56R95Very high93.7Very high129 Ų12994.8 Ų94.849%0.48745%0.445SS..  trans-8462.7-176.5-64.9177.2175.2179.8-1.1112.2L51 D54 E58 R59 A60L51-R56 HydrophobicContact CD2-CB 4.24Å; L51-R56 PolarHBondContact O-N 3.4Å; D54-R56 HydrophobicContact CB-CG 4.33Å; D54-R56 PolarHBondContact O-N 2.81Å; R56-E58 PolarHBondContact O-N 3.27Å; R56-R59 HydrophobicContact CB-CB 4.44Å; R56-R59 PolarHBondContact O-N 2.91Å; R56-A60 PolarHBondContact O-N 3.15Å; R56-A60 VanDerWaalsContact O-N 3.12Å
57K92.5Very high93.6Very high157 Ų15795 Ų9568%0.68344%0.44SS*.Hα-helixtrans-55.1-45.8-174.1-67.5-176179.1178.60114.2G55 R59 A60 K61G55-K57 VanDerWaalsContact C-N 3.29Å; G55-K57 PolarHBondContact O-N 3.4Å; K57-R59 PolarHBondContact O-N 3.5Å; K57-A60 WeakPolarHBondContact O-CB 3.4Å; K57-A60 PolarHBondContact O-N 3.15Å; K57-K61 PolarHBondContact O-N 3Å
58E93.2Very high93.7Very high132 Ų13298.6 Ų98.662%0.61745%0.447SS*.Hα-helixtrans-63.8-40.9-178-67.6-51.4124.400112.7R56 K61 L62R56-E58 PolarHBondContact O-N 3.27Å; E58-K61 PolarHBondContact O-N 2.9Å; E58-L62 PolarHBondContact O-N 3.32Å; E58-L62 VanDerWaalsContact O-N 3.12Å
59R93.3Very high93.7Very high151 Ų151104.5 Ų104.557%0.5747%0.47SS*.Hα-helixtrans-66.7-40.4175.9-67.2-174.6179.4176.2-0111.4L51 R56 K57 K61 L62 L63L51-R59 HydrophobicContact CD1-CB 4.16Å; L51-R59 HydrophobicContact CD2-CB 4.42Å; R56-R59 HydrophobicContact CB-CB 4.44Å; R56-R59 PolarHBondContact O-N 2.91Å; K57-R59 PolarHBondContact O-N 3.5Å; R59-K61 VanDerWaalsContact C-N 3.33Å; R59-K61 PolarHBondContact O-N 2.9Å; R59-L62 PolarHBondContact O-N 2.95Å; R59-L63 PolarHBondContact O-N 3.2Å; R59-L63 VanDerWaalsContact O-N 3.11Å
60A93.2Very high93.8Very high0 Ų099.7 Ų99.70%045%0.452CS..Hα-helixtrans-61.3-42174.900000111.7L51 L52 R56 K57 L62 L63 L64L51-A60 HydrophobicContact CB-CB 3.98Å; L52-A60 HydrophobicContact CD2-CB 3.7Å; L52-A60 HydrophobicContact CG-CB 3.83Å; R56-A60 PolarHBondContact O-N 3.15Å; R56-A60 VanDerWaalsContact O-N 3.12Å; K57-A60 WeakPolarHBondContact O-CB 3.4Å; K57-A60 PolarHBondContact O-N 3.15Å; A60-L62 PolarHBondContact O-N 3.41Å; A60-L63 PolarHBondContact O-N 3.05Å; A60-L64 WeakPolarHBondContact O-CG 3.37Å; A60-L64 PolarHBondContact O-N 3.29Å
61K93.2Very high93.8Very high117 Ų11797.7 Ų97.751%0.50944%0.442SS..Hα-helixtrans-61-43.8176.8-174.4178.7-178.4-179.30112.4K57 E58 R59 L63 L64 K65K57-K61 PolarHBondContact O-N 3Å; E58-K61 PolarHBondContact O-N 2.9Å; R59-K61 VanDerWaalsContact C-N 3.33Å; R59-K61 PolarHBondContact O-N 2.9Å; K61-L63 VanDerWaalsContact C-N 3.35Å; K61-L64 PolarHBondContact O-N 3.35Å; K61-K65 WeakPolarHBondContact O-CG 3.47Å; K61-K65 PolarHBondContact O-N 3.47Å
62L93.8Very high93.8Very high118 Ų11899.8 Ų99.862%0.61845%0.452SS*.Hα-helixtrans-61.4-42.9175.5-71174.7000112E58 R59 A60 L64 K65 K66E58-L62 PolarHBondContact O-N 3.32Å; E58-L62 VanDerWaalsContact O-N 3.12Å; R59-L62 PolarHBondContact O-N 2.95Å; A60-L62 PolarHBondContact O-N 3.41Å; L62-L64 PolarHBondContact O-N 2.98Å; L62-K65 WeakPolarHBondContact O-CB 3.49Å; L62-K65 PolarHBondContact O-N 2.94Å; L62-K66 PolarHBondContact O-N 3Å
63L93.3Very high93.8Very high27 Ų2797.1 Ų97.114%0.14144%0.437CS..Hα-helixtrans-65.3-39177.9-171.459.4000112.1E44 L47 A48 L51 R59 A60 K61 K65 K66 K67E44-L63 HydrophobicContact CB-CD1 4.13Å; E44-L63 HydrophobicContact CB-CG 4.46Å; E44-L63 HydrophobicContact CG-CD1 4.05Å; E44-L63 WeakPolarHBondContact O-CD2 3.31Å; L47-L63 HydrophobicContact CB-CD2 3.76Å; A48-L63 HydrophobicContact CB-CD2 3.92Å; A48-L63 HydrophobicContact CB-CG 4.39Å; L51-L63 HydrophobicContact CD1-CD2 4.12Å; R59-L63 PolarHBondContact O-N 3.2Å; R59-L63 VanDerWaalsContact O-N 3.11Å; A60-L63 PolarHBondContact O-N 3.05Å; K61-L63 VanDerWaalsContact C-N 3.35Å; L63-K65 VanDerWaalsContact C-N 3.35Å; L63-K65 PolarHBondContact O-N 2.93Å; L63-K66 HydrophobicContact CD1-CD 4.39Å; L63-K66 WeakPolarHBondContact O-CB 3.46Å; L63-K66 PolarHBondContact O-N 3.11Å; L63-K67 WeakPolarHBondContact O-CB 3.4Å; L63-K67 PolarHBondContact O-N 3.4Å
64L92.4Very high93.9Very high83 Ų8388.3 Ų88.344%0.43541%0.406SS..Hα-helixtrans-65.7-35.2174.7-70173.5000112.8A48 A60 K61 L62 K67 R68A48-L64 HydrophobicContact CB-CD2 4.12Å; A48-L64 HydrophobicContact CB-CG 4.45Å; A60-L64 WeakPolarHBondContact O-CG 3.37Å; A60-L64 PolarHBondContact O-N 3.29Å; K61-L64 PolarHBondContact O-N 3.35Å; L62-L64 PolarHBondContact O-N 2.98Å; L64-K67 HydrophobicContact CD2-CD 4.26Å; L64-K67 WeakPolarHBondContact O-CB 3.39Å; L64-K67 PolarHBondContact O-N 3.42Å; L64-R68 PolarHBondContact O-N 3.34Å
65K94.2Very high93.9Very high132 Ų13287.6 Ų87.657%0.57440%0.402SS*.Hα-helixtrans-63.1-44.5171.8-73.2-179.1176.8-173.90111.4K61 L62 L63 R68 Y69K61-K65 WeakPolarHBondContact O-CG 3.47Å; K61-K65 PolarHBondContact O-N 3.47Å; L62-K65 WeakPolarHBondContact O-CB 3.49Å; L62-K65 PolarHBondContact O-N 2.94Å; L63-K65 VanDerWaalsContact C-N 3.35Å; L63-K65 PolarHBondContact O-N 2.93Å; K65-R68 PolarHBondContact O-N 3.38Å; K65-Y69 PolarHBondContact O-N 3.17Å; K65-Y69 VanDerWaalsContact O-N 3.15Å
66K93.2Very high94Very high100 Ų10092.3 Ų92.344%0.43540%0.403SS..Hα-helixtrans-60.5-45.2175.3-173.4-170.3178.9-157.70111.6E44 L62 L63 R68 Y69 Q70E44-K66 VanDerWaalsContact OE1-CE 3.28Å; E44-K66 WeakPolarHBondContact OE1-CE 3.37Å; E44-K66 IonicContact OE1-NZ 3.35Å; E44-K66 PolarHBondContact OE1-NZ 2.96Å; L62-K66 PolarHBondContact O-N 3Å; L63-K66 HydrophobicContact CD1-CD 4.39Å; L63-K66 WeakPolarHBondContact O-CB 3.46Å; L63-K66 PolarHBondContact O-N 3.11Å; K66-R68 PolarHBondContact O-N 3.08Å; K66-Y69 WeakPolarHBondContact O-CB 3.31Å; K66-Y69 PolarHBondContact O-N 3.32Å; K66-Q70 PolarHBondContact O-N 2.85Å
67K93.5Very high94.1Very high39 Ų3986.4 Ų86.417%0.1738%0.382CS..Hα-helixtrans-55-50.3173.9175.1-176.7172.5-76.30111.5L41 L63 L64 Y69 Q70 E71L41-K67 HydrophobicContact CD1-CG 4.09Å; L41-K67 HydrophobicContact CG-CG 4.11Å; L63-K67 WeakPolarHBondContact O-CB 3.4Å; L63-K67 PolarHBondContact O-N 3.4Å; L64-K67 HydrophobicContact CD2-CD 4.26Å; L64-K67 WeakPolarHBondContact O-CB 3.39Å; L64-K67 PolarHBondContact O-N 3.42Å; K67-Y69 VanDerWaalsContact C-N 3.27Å; K67-Y69 PolarHBondContact O-N 2.68Å; K67-Q70 WeakPolarHBondContact O-CB 3.45Å; K67-Q70 PolarHBondContact O-N 3.19Å; K67-E71 WeakPolarHBondContact CE-OE1 3.48Å; K67-E71 VanDerWaalsContact NZ-CD 3.32Å; K67-E71 IonicContact NZ-OE1 2.68Å; K67-E71 PolarHBondContact NZ-OE1 3.27Å; K67-E71 IonicContact NZ-OE2 3.69Å; K67-E71 PolarHBondContact NZ-OE2 2.89Å; K67-E71 WeakPolarHBondContact O-CG 3.44Å; K67-E71 PolarHBondContact O-N 2.95Å
68R94.7Very high94.2Very high163 Ų16383.9 Ų83.962%0.61537%0.372SS*.Hα-helixtrans-59-38179.5-178.2176.1170.292.1-3.6112.4L64 K65 K66 E71 Q72L64-R68 PolarHBondContact O-N 3.34Å; K65-R68 PolarHBondContact O-N 3.38Å; K66-R68 PolarHBondContact O-N 3.08Å; R68-E71 PolarHBondContact O-N 3.03Å; R68-Q72 WeakPolarHBondContact O-CG 3.33Å; R68-Q72 PolarHBondContact O-N 3.45Å; R68-Q72 VanDerWaalsContact O-N 3.1Å
69Y94.4Very high94.4Very high129 Ų12982.9 Ų82.951%0.50637%0.372SS..Hα-helixtrans-65.5-40.1174.6176.9-106.3000112.2K65 K66 K67 E71 Q72 L73K65-Y69 PolarHBondContact O-N 3.17Å; K65-Y69 VanDerWaalsContact O-N 3.15Å; K66-Y69 WeakPolarHBondContact O-CB 3.31Å; K66-Y69 PolarHBondContact O-N 3.32Å; K67-Y69 VanDerWaalsContact C-N 3.27Å; K67-Y69 PolarHBondContact O-N 2.68Å; Y69-E71 VanDerWaalsContact C-N 3.35Å; Y69-Q72 PolarHBondContact O-N 3.38Å; Y69-L73 HydrophobicContact CD1-CD1 4.03Å; Y69-L73 HydrophobicContact CE1-CD1 3.52Å; Y69-L73 HydrophobicContact CE1-CG 4.15Å; Y69-L73 WeakPolarHBondContact O-CG 3.4Å; Y69-L73 PolarHBondContact O-N 3.06Å
70Q94.1Very high94.6Very high14 Ų1480.7 Ų80.77%0.06537%0.368CS..Hα-helixtrans-65.6-36.1174.4-70.7171.1-16.400112.7I37 L41 E44 K66 K67 L73 L74I37-Q70 HydrophobicContact CG2-CB 4.09Å; L41-Q70 HydrophobicContact CD1-CB 4.46Å; E44-Q70 PolarHBondContact OE1-NE2 3.39Å; E44-Q70 PolarHBondContact OE2-OE1 3.38Å; E44-Q70 VanDerWaalsContact OE2-OE1 3.08Å; K66-Q70 PolarHBondContact O-N 2.85Å; K67-Q70 WeakPolarHBondContact O-CB 3.45Å; K67-Q70 PolarHBondContact O-N 3.19Å; Q70-L73 WeakPolarHBondContact O-CB 3.41Å; Q70-L73 PolarHBondContact O-N 2.93Å; Q70-L74 PolarHBondContact O-N 3.03Å
71E94.9Very high94.8Very high64 Ų6481.1 Ų81.130%0.29937%0.37SS..Hα-helixtrans-60.6-46.9172.7-68.7173.5153.900110.6L41 K67 R68 Y69 L73 L74 D75L41-E71 HydrophobicContact CD1-CG 3.39Å; K67-E71 WeakPolarHBondContact CE-OE1 3.48Å; K67-E71 VanDerWaalsContact NZ-CD 3.32Å; K67-E71 IonicContact NZ-OE1 2.68Å; K67-E71 PolarHBondContact NZ-OE1 3.27Å; K67-E71 IonicContact NZ-OE2 3.69Å; K67-E71 PolarHBondContact NZ-OE2 2.89Å; K67-E71 WeakPolarHBondContact O-CG 3.44Å; K67-E71 PolarHBondContact O-N 2.95Å; R68-E71 PolarHBondContact O-N 3.03Å; Y69-E71 VanDerWaalsContact C-N 3.35Å; E71-L73 VanDerWaalsContact C-N 3.26Å; E71-L73 PolarHBondContact O-N 3.45Å; E71-L74 WeakPolarHBondContact O-CA 3.43Å; E71-L74 WeakPolarHBondContact O-CB 3.45Å; E71-L74 PolarHBondContact O-N 3.45Å; E71-D75 VanDerWaalsContact O-CG 3.29Å; E71-D75 PolarHBondContact O-N 3.47Å
72Q95.4Very high95Very high78 Ų7878.5 Ų78.536%0.36437%0.366SS..Hα-helixtrans-60.6-34.9175.1-69.1175.5-17.500113R68 Y69 R76R68-Q72 WeakPolarHBondContact O-CG 3.33Å; R68-Q72 PolarHBondContact O-N 3.45Å; R68-Q72 VanDerWaalsContact O-N 3.1Å; Y69-Q72 PolarHBondContact O-N 3.38Å; Q72-R76 VanDerWaalsContact O-CG 3.26Å; Q72-R76 WeakPolarHBondContact O-CG 3.38Å; Q72-R76 PolarHBondContact O-N 3.01Å; Q72-R76 VanDerWaalsContact O-N 3.11Å
73L93.2Very high95.2Very high38 Ų3875.9 Ų75.920%0.19936%0.358CS..Hα-helixtrans-69.1-36.8173.9-71176.6000112.1Y69 Q70 E71 T77Y69-L73 HydrophobicContact CD1-CD1 4.03Å; Y69-L73 HydrophobicContact CE1-CD1 3.52Å; Y69-L73 HydrophobicContact CE1-CG 4.15Å; Y69-L73 WeakPolarHBondContact O-CG 3.4Å; Y69-L73 PolarHBondContact O-N 3.06Å; Q70-L73 WeakPolarHBondContact O-CB 3.41Å; Q70-L73 PolarHBondContact O-N 2.93Å; E71-L73 VanDerWaalsContact C-N 3.26Å; E71-L73 PolarHBondContact O-N 3.45Å; L73-T77 WeakPolarHBondContact O-CB 3.48Å; L73-T77 PolarHBondContact O-N 3.31Å; L73-T77 PolarHBondContact O-OG1 3.31Å
74L95.9Very high95.3Very high26 Ų2675.4 Ų75.414%0.13636%0.355CS..Hα-helixtrans-62.8-48.3173.5-79.3171.8000110.9Q34 I37 L41 Q70 E71 R76 T77 E78Q34-L74 HydrophobicContact CB-CD2 4.28Å; Q34-L74 HydrophobicContact CG-CD2 3.61Å; I37-L74 HydrophobicContact CB-CD2 3.77Å; I37-L74 HydrophobicContact CB-CG 4.12Å; I37-L74 HydrophobicContact CD1-CD2 4.21Å; I37-L74 HydrophobicContact CG2-CD1 3.86Å; I37-L74 HydrophobicContact CG2-CD2 3.9Å; I37-L74 HydrophobicContact CG2-CG 3.64Å; L41-L74 HydrophobicContact CD1-CD1 4.25Å; Q70-L74 PolarHBondContact O-N 3.03Å; E71-L74 WeakPolarHBondContact O-CA 3.43Å; E71-L74 WeakPolarHBondContact O-CB 3.45Å; E71-L74 PolarHBondContact O-N 3.45Å; L74-R76 VanDerWaalsContact C-N 3.31Å; L74-R76 PolarHBondContact O-N 2.85Å; L74-T77 CarbonylContact O-C 3.58Å; L74-T77 WeakPolarHBondContact O-CA 3.38Å; L74-T77 WeakPolarHBondContact O-CB 3.45Å; L74-T77 PolarHBondContact O-N 2.94Å; L74-E78 PolarHBondContact O-N 3.48Å
75D96Very high95.5Very high90 Ų9074 Ų7448%0.48135%0.347SS..Hα-helixtrans-59.4-43178.9-59.5-23.1000111.2E71 T77 E78 N79E71-D75 VanDerWaalsContact O-CG 3.29Å; E71-D75 PolarHBondContact O-N 3.47Å; D75-T77 VanDerWaalsContact C-N 3.34Å; D75-T77 PolarHBondContact O-N 3.29Å; D75-E78 PolarHBondContact O-N 3.41Å; D75-N79 VanDerWaalsContact O-CG 3.29Å; D75-N79 PolarHBondContact O-N 3.01Å; D75-N79 PolarHBondContact O-ND2 3.34Å
76R95.3Very high95.7Very high151 Ų15170 Ų7057%0.5734%0.338SS*.Hα-helixtrans-62.5-41.3174.3-73173.5-175.3-1751.8112.2Q72 L74 E78 N79 Q80Q72-R76 VanDerWaalsContact O-CG 3.26Å; Q72-R76 WeakPolarHBondContact O-CG 3.38Å; Q72-R76 PolarHBondContact O-N 3.01Å; Q72-R76 VanDerWaalsContact O-N 3.11Å; L74-R76 VanDerWaalsContact C-N 3.31Å; L74-R76 PolarHBondContact O-N 2.85Å; R76-E78 VanDerWaalsContact C-N 3.33Å; R76-N79 PolarHBondContact O-N 2.93Å; R76-Q80 VanDerWaalsContact O-CG 3.31Å; R76-Q80 WeakPolarHBondContact O-CG 3.38Å; R76-Q80 PolarHBondContact O-N 2.89Å
77T95.6Very high95.8Very high6 Ų669.1 Ų69.14%0.03734%0.337CS..Hα-helixtrans-65.4-39.9178.3-58.10000110.7L30 Y33 Q34 L73 L74 D75 Q80 I81L30-T77 HydrophobicContact CB-CG2 4.09Å; L30-T77 HydrophobicContact CD2-CG2 4.27Å; Y33-T77 HydrophobicContact CD1-CG2 4.17Å; Q34-T77 HydrophobicContact CB-CG2 4.35Å; L73-T77 WeakPolarHBondContact O-CB 3.48Å; L73-T77 PolarHBondContact O-N 3.31Å; L73-T77 PolarHBondContact O-OG1 3.31Å; L74-T77 CarbonylContact O-C 3.58Å; L74-T77 WeakPolarHBondContact O-CA 3.38Å; L74-T77 WeakPolarHBondContact O-CB 3.45Å; L74-T77 PolarHBondContact O-N 2.94Å; D75-T77 VanDerWaalsContact C-N 3.34Å; D75-T77 PolarHBondContact O-N 3.29Å; T77-Q80 WeakPolarHBondContact O-CB 3.41Å; T77-Q80 PolarHBondContact O-N 3.32Å; T77-I81 HydrophobicContact CG2-CD1 4.11Å; T77-I81 VanDerWaalsContact O-CG1 3.31Å; T77-I81 WeakPolarHBondContact O-CG1 3.46Å; T77-I81 PolarHBondContact O-N 3.03Å
78E96.5Very high95.9Very high103 Ų10367.8 Ų67.848%0.48133%0.332SS..Hα-helixtrans-62.9-47.2175.8-174.8166.9-165.100111.3L74 D75 R76 Q80 I81 S82L74-E78 PolarHBondContact O-N 3.48Å; D75-E78 PolarHBondContact O-N 3.41Å; R76-E78 VanDerWaalsContact C-N 3.33Å; E78-Q80 VanDerWaalsContact C-N 3.27Å; E78-Q80 PolarHBondContact O-N 2.84Å; E78-I81 WeakPolarHBondContact O-CB 3.34Å; E78-I81 PolarHBondContact O-N 3.28Å; E78-S82 PolarHBondContact O-N 3.38Å; E78-S82 PolarHBondContact O-OG 2.9Å
79N97.4Very high95.9Very high112 Ų11266.1 Ų66.160%0.59933%0.331SS*.Hα-helixtrans-57.7-39.6173.6-68.9-30.5000112.4D75 R76 S82 S83D75-N79 VanDerWaalsContact O-CG 3.29Å; D75-N79 PolarHBondContact O-N 3.01Å; D75-N79 PolarHBondContact O-ND2 3.34Å; R76-N79 PolarHBondContact O-N 2.93Å; N79-S82 PolarHBondContact O-N 3.34Å; N79-S83 WeakPolarHBondContact O-CB 3.46Å; N79-S83 PolarHBondContact O-N 3.23Å
80Q96.7Very high96Very high104 Ų10463.3 Ų63.349%0.48633%0.33SS..Hα-helixtrans-66.4-39.1174.9-73.7175.3-23.400112.4L30 R76 T77 E78 S83 L84L30-Q80 HydrophobicContact CD1-CB 3.8Å; R76-Q80 VanDerWaalsContact O-CG 3.31Å; R76-Q80 WeakPolarHBondContact O-CG 3.38Å; R76-Q80 PolarHBondContact O-N 2.89Å; T77-Q80 WeakPolarHBondContact O-CB 3.41Å; T77-Q80 PolarHBondContact O-N 3.32Å; E78-Q80 VanDerWaalsContact C-N 3.27Å; E78-Q80 PolarHBondContact O-N 2.84Å; Q80-S83 PolarHBondContact O-N 2.98Å; Q80-L84 WeakPolarHBondContact O-CG 3.31Å; Q80-L84 PolarHBondContact O-N 3.43Å
81I97.4Very high96Very high10 Ų1064.8 Ų64.85%0.05134%0.338CS..Hα-helixtrans-62-48.6174.9-71.7164.3000110R27 L30 R31 T77 E78 S83 L84 E85R27-I81 HydrophobicContact CG-CG2 4.05Å; L30-I81 HydrophobicContact CB-CD1 4.03Å; L30-I81 HydrophobicContact CB-CG1 3.67Å; L30-I81 HydrophobicContact CD1-CG1 4.13Å; R31-I81 HydrophobicContact CG-CD1 3.88Å; R31-I81 HydrophobicContact CG-CG1 4.49Å; T77-I81 HydrophobicContact CG2-CD1 4.11Å; T77-I81 VanDerWaalsContact O-CG1 3.31Å; T77-I81 WeakPolarHBondContact O-CG1 3.46Å; T77-I81 PolarHBondContact O-N 3.03Å; E78-I81 WeakPolarHBondContact O-CB 3.34Å; E78-I81 PolarHBondContact O-N 3.28Å; I81-S83 VanDerWaalsContact C-N 3.31Å; I81-S83 PolarHBondContact O-N 3.35Å; I81-L84 PolarHBondContact O-N 3.41Å; I81-E85 WeakPolarHBondContact O-CG 3.37Å; I81-E85 PolarHBondContact O-N 2.97Å
82S97.8Very high95.9Very high62 Ų6265.7 Ų65.743%0.43434%0.342SS..Hα-helixtrans-61.1-39.6176.9-57.80000112E78 N79 E85 A86E78-S82 PolarHBondContact O-N 3.38Å; E78-S82 PolarHBondContact O-OG 2.9Å; N79-S82 PolarHBondContact O-N 3.34Å; S82-E85 PolarHBondContact O-N 2.92Å; S82-A86 WeakPolarHBondContact O-CB 3.15Å; S82-A86 PolarHBondContact O-N 3.45Å
83S97Very high95.8Very high62 Ų6267.7 Ų67.743%0.43435%0.35SS..Hα-helixtrans-63.2-41.8174.9179.50000112.5N79 Q80 I81 A86 M87N79-S83 WeakPolarHBondContact O-CB 3.46Å; N79-S83 PolarHBondContact O-N 3.23Å; Q80-S83 PolarHBondContact O-N 2.98Å; I81-S83 VanDerWaalsContact C-N 3.31Å; I81-S83 PolarHBondContact O-N 3.35Å; S83-A86 PolarHBondContact O-N 3.43Å; S83-M87 WeakPolarHBondContact O-CG 3.39Å; S83-M87 PolarHBondContact O-N 3.08Å
84L96.9Very high95.8Very high17 Ų1769 Ų699%0.08936%0.359CS..Hα-helixtrans-63.8-41.1174.8-72.5168.2000111.9L23 Q26 R27 L30 Q80 I81 M87 V88L23-L84 HydrophobicContact CD2-CD2 3.64Å; Q26-L84 HydrophobicContact CB-CD1 4.28Å; Q26-L84 HydrophobicContact CG-CD1 3.93Å; Q26-L84 HydrophobicContact CG-CD2 4.35Å; R27-L84 HydrophobicContact CB-CB 4.33Å; R27-L84 HydrophobicContact CB-CD1 4.04Å; L30-L84 HydrophobicContact CD1-CD1 3.57Å; Q80-L84 WeakPolarHBondContact O-CG 3.31Å; Q80-L84 PolarHBondContact O-N 3.43Å; I81-L84 PolarHBondContact O-N 3.41Å; L84-M87 HydrophobicContact CD2-CE 3.78Å; L84-M87 HydrophobicContact CG-CE 4.34Å; L84-M87 PolarHBondContact O-N 3.21Å; L84-V88 WeakPolarHBondContact O-CG2 3.39Å; L84-V88 PolarHBondContact O-N 2.9Å
85E95.9Very high95.6Very high54 Ų5469.7 Ų69.725%0.25236%0.362SS..Hα-helixtrans-64.8-41.8176.7-71.9174.2177.500111.8R27 R31 I81 S82 V88 Q89R27-E85 WeakPolarHBondContact CD-OE1 3.42Å; R27-E85 HydrophobicContact CG-CG 4.41Å; R31-E85 IonicContact CZ-OE1 3.95Å; R31-E85 IonicContact NE-OE1 3.73Å; R31-E85 IonicContact NH2-OE1 3.66Å; R31-E85 PolarHBondContact NH2-OE1 3.21Å; I81-E85 WeakPolarHBondContact O-CG 3.37Å; I81-E85 PolarHBondContact O-N 2.97Å; S82-E85 PolarHBondContact O-N 2.92Å; E85-V88 PolarHBondContact O-N 3.38Å; E85-Q89 WeakPolarHBondContact O-CG 3.32Å; E85-Q89 PolarHBondContact O-N 2.86Å; E85-Q89 VanDerWaalsContact O-N 3.08Å
86A97.3Very high95.4Very high48 Ų4870 Ų7040%0.39736%0.363SS..Hα-helixtrans-61-45.4173.600000111.6S82 S83 V88 Q89 S90S82-A86 WeakPolarHBondContact O-CB 3.15Å; S82-A86 PolarHBondContact O-N 3.45Å; S83-A86 PolarHBondContact O-N 3.43Å; A86-V88 VanDerWaalsContact C-N 3.32Å; A86-V88 PolarHBondContact O-N 3.4Å; A86-Q89 PolarHBondContact O-N 3.39Å; A86-S90 PolarHBondContact O-N 2.88Å; A86-S90 PolarHBondContact O-OG 3.46Å; A86-S90 VanDerWaalsContact O-OG 3.06Å
87M95.5Very high95.3Very high82 Ų8266.9 Ų66.940%0.40436%0.355SS..Hα-helixtrans-61.8-37.9176.8-76.2-173.9-73.500112.8L23 S83 L84 S90 I91L23-M87 HydrophobicContact CD1-CB 4.18Å; L23-M87 HydrophobicContact CD2-CE 4.36Å; S83-M87 WeakPolarHBondContact O-CG 3.39Å; S83-M87 PolarHBondContact O-N 3.08Å; L84-M87 HydrophobicContact CD2-CE 3.78Å; L84-M87 HydrophobicContact CG-CE 4.34Å; L84-M87 PolarHBondContact O-N 3.21Å; M87-S90 PolarHBondContact O-N 3.37Å; M87-I91 VanDerWaalsContact O-CG1 3.31Å; M87-I91 WeakPolarHBondContact O-CG1 3.36Å; M87-I91 PolarHBondContact O-N 3.39Å
88V95.8Very high95.2Very high11 Ų1170.1 Ų70.17%0.06737%0.37CS..Hα-helixtrans-61.8-47.1174.3169.20000110.7I20 L23 K24 L84 E85 A86 S90 I91 E92I20-V88 HydrophobicContact CG2-CG1 4.22Å; L23-V88 HydrophobicContact CB-CG2 3.64Å; L23-V88 HydrophobicContact CD1-CG2 3.94Å; L23-V88 HydrophobicContact CG-CG2 4.46Å; K24-V88 HydrophobicContact CG-CG2 4.42Å; L84-V88 WeakPolarHBondContact O-CG2 3.39Å; L84-V88 PolarHBondContact O-N 2.9Å; E85-V88 PolarHBondContact O-N 3.38Å; A86-V88 VanDerWaalsContact C-N 3.32Å; A86-V88 PolarHBondContact O-N 3.4Å; V88-S90 VanDerWaalsContact C-N 3.34Å; V88-S90 PolarHBondContact O-N 3.02Å; V88-I91 PolarHBondContact O-N 3.46Å; V88-E92 WeakPolarHBondContact O-CG 3.31Å; V88-E92 PolarHBondContact O-N 3.41Å
89Q95.5Very high95.1Very high127 Ų12771.8 Ų71.859%0.59338%0.376SS*.Hα-helixtrans-62.8-40.9177.5-68.8173.632.400111.8E85 A86 I91 E92 F93E85-Q89 WeakPolarHBondContact O-CG 3.32Å; E85-Q89 PolarHBondContact O-N 2.86Å; E85-Q89 VanDerWaalsContact O-N 3.08Å; A86-Q89 PolarHBondContact O-N 3.39Å; Q89-I91 PolarHBondContact O-N 2.95Å; Q89-E92 PolarHBondContact O-N 3.24Å; Q89-F93 WeakPolarHBondContact O-CB 3.37Å; Q89-F93 PolarHBondContact O-N 3.07Å
90S95.9Very high94.9Very high70 Ų7070.1 Ų70.149%0.4937%0.37SS..Hα-helixtrans-60.1-44.1175.8-60.90000111.6A86 M87 V88 F93 T94A86-S90 PolarHBondContact O-N 2.88Å; A86-S90 PolarHBondContact O-OG 3.46Å; A86-S90 VanDerWaalsContact O-OG 3.06Å; M87-S90 PolarHBondContact O-N 3.37Å; V88-S90 VanDerWaalsContact C-N 3.34Å; V88-S90 PolarHBondContact O-N 3.02Å; S90-F93 PolarHBondContact O-N 3.33Å; S90-T94 WeakPolarHBondContact O-CB 3.31Å; S90-T94 PolarHBondContact O-N 3.21Å; S90-T94 PolarHBondContact O-OG1 2.68Å
91I94Very high94.8Very high45 Ų4570.1 Ų70.123%0.23137%0.371CS..Hα-helixtrans-64.8-42.1177.2-66.3166.1000111.1Q16 A19 I20 L23 M87 V88 Q89 F93 T94 Q95Q16-I91 HydrophobicContact CB-CG2 4.35Å; A19-I91 HydrophobicContact CB-CD1 4.41Å; I20-I91 HydrophobicContact CD1-CG2 3.95Å; I20-I91 HydrophobicContact CG1-CB 4.33Å; I20-I91 HydrophobicContact CG1-CG2 3.82Å; L23-I91 HydrophobicContact CD1-CD1 3.45Å; L23-I91 VanDerWaalsContact CD1-CD1 3.45Å; M87-I91 VanDerWaalsContact O-CG1 3.31Å; M87-I91 WeakPolarHBondContact O-CG1 3.36Å; M87-I91 PolarHBondContact O-N 3.39Å; V88-I91 PolarHBondContact O-N 3.46Å; Q89-I91 PolarHBondContact O-N 2.95Å; I91-F93 VanDerWaalsContact C-N 3.32Å; I91-T94 PolarHBondContact O-N 3.48Å; I91-Q95 WeakPolarHBondContact O-CG 3.37Å; I91-Q95 PolarHBondContact O-N 2.85Å; I91-Q95 VanDerWaalsContact O-N 3.08Å
92E92.2Very high94.7Very high84 Ų8475.4 Ų75.439%0.39340%0.395SS..Hα-helixtrans-63-40176.8-71.8172.8176.500111.2I20 K24 V88 Q89 Q95 I96I20-E92 HydrophobicContact CD1-CG 3.86Å; K24-E92 IonicContact NZ-OE1 2.68Å; V88-E92 WeakPolarHBondContact O-CG 3.31Å; V88-E92 PolarHBondContact O-N 3.41Å; Q89-E92 PolarHBondContact O-N 3.24Å; E92-Q95 WeakPolarHBondContact O-CB 3.36Å; E92-Q95 PolarHBondContact O-N 3.44Å; E92-I96 PolarHBondContact O-N 3.19Å
93F94.3Very high94.5Very high119 Ų11974.6 Ų74.652%0.52240%0.396SS..Hα-helixtrans-67.6-44.8175.5-173.8-107.1000112.3Q89 S90 I91 Q95 I96 E97Q89-F93 WeakPolarHBondContact O-CB 3.37Å; Q89-F93 PolarHBondContact O-N 3.07Å; S90-F93 PolarHBondContact O-N 3.33Å; I91-F93 VanDerWaalsContact C-N 3.32Å; F93-Q95 PolarHBondContact O-N 3.1Å; F93-I96 CarbonylContact O-C 3.59Å; F93-I96 WeakPolarHBondContact O-CA 3.47Å; F93-I96 VanDerWaalsContact O-CB 3.31Å; F93-I96 WeakPolarHBondContact O-CB 3.31Å; F93-I96 PolarHBondContact O-N 3.38Å; F93-E97 HydrophobicContact CD1-CG 3.87Å; F93-E97 HydrophobicContact CE1-CG 3.61Å; F93-E97 WeakPolarHBondContact CE1-OE1 3.49Å; F93-E97 HydrophobicContact CZ-CG 4.09Å; F93-E97 PolarHBondContact O-N 2.88Å
94T93.4Very high94.4Very high65 Ų6576.8 Ų76.840%0.39940%0.403SS..Hα-helixtrans-60.4-30.4175.9-61.30000112.2S90 I91 I96 E97 M98S90-T94 WeakPolarHBondContact O-CB 3.31Å; S90-T94 PolarHBondContact O-N 3.21Å; S90-T94 PolarHBondContact O-OG1 2.68Å; I91-T94 PolarHBondContact O-N 3.48Å; T94-I96 VanDerWaalsContact C-N 3.31Å; T94-I96 PolarHBondContact O-N 3.22Å; T94-E97 WeakPolarHBondContact CA-OE2 3.36Å; T94-E97 PolarHBondContact O-N 2.94Å; T94-E97 PolarHBondContact OG1-OE2 3.25Å; T94-M98 WeakPolarHBondContact O-CB 3.41Å; T94-M98 VanDerWaalsContact O-CG 3.31Å; T94-M98 WeakPolarHBondContact O-CG 3.47Å; T94-M98 PolarHBondContact O-N 2.86Å
95Q91.3Very high94.3Very high42 Ų4281.9 Ų81.920%0.19643%0.426CS..Hα-helixtrans-65.2-34.4170.5-71.3177.943.700113.2Q16 I91 E92 F93 M98 K99Q16-Q95 HydrophobicContact CB-CG 4.37Å; Q16-Q95 HydrophobicContact CG-CG 4.29Å; I91-Q95 WeakPolarHBondContact O-CG 3.37Å; I91-Q95 PolarHBondContact O-N 2.85Å; I91-Q95 VanDerWaalsContact O-N 3.08Å; E92-Q95 WeakPolarHBondContact O-CB 3.36Å; E92-Q95 PolarHBondContact O-N 3.44Å; F93-Q95 PolarHBondContact O-N 3.1Å; Q95-M98 HydrophobicContact CB-CE 4.36Å; Q95-M98 HydrophobicContact CG-CE 4.02Å; Q95-K99 WeakPolarHBondContact O-CG 3.35Å; Q95-K99 PolarHBondContact O-N 3.43Å
96I92.9Very high94.2Very high97 Ų9785.5 Ų85.550%0.49744%0.441SS..Hα-helixtrans-70.5-45.6173.9-59.9169.2000109.4E92 F93 T94 M98 K99 V100E92-I96 PolarHBondContact O-N 3.19Å; F93-I96 CarbonylContact O-C 3.59Å; F93-I96 WeakPolarHBondContact O-CA 3.47Å; F93-I96 VanDerWaalsContact O-CB 3.31Å; F93-I96 WeakPolarHBondContact O-CB 3.31Å; F93-I96 PolarHBondContact O-N 3.38Å; T94-I96 VanDerWaalsContact C-N 3.31Å; T94-I96 PolarHBondContact O-N 3.22Å; I96-M98 VanDerWaalsContact C-N 3.31Å; I96-M98 PolarHBondContact O-N 3.44Å; I96-K99 WeakPolarHBondContact O-CB 3.41Å; I96-K99 PolarHBondContact O-N 3.21Å; I96-K99 VanDerWaalsContact O-N 3.1Å; I96-V100 HydrophobicContact CG2-CG2 4.47Å; I96-V100 WeakPolarHBondContact O-CG2 3.34Å; I96-V100 PolarHBondContact O-N 3.37Å
97E92.8Very high94Very high85 Ų8584.7 Ų84.740%0.39744%0.438SS..Hα-helixtrans-57.3-43.9176.7-65.5178.7124.500111.7F93 T94 K99 V100 M101F93-E97 HydrophobicContact CD1-CG 3.87Å; F93-E97 HydrophobicContact CE1-CG 3.61Å; F93-E97 WeakPolarHBondContact CE1-OE1 3.49Å; F93-E97 HydrophobicContact CZ-CG 4.09Å; F93-E97 PolarHBondContact O-N 2.88Å; T94-E97 WeakPolarHBondContact CA-OE2 3.36Å; T94-E97 PolarHBondContact O-N 2.94Å; T94-E97 PolarHBondContact OG1-OE2 3.25Å; E97-K99 VanDerWaalsContact C-N 3.35Å; E97-K99 PolarHBondContact O-N 3.27Å; E97-V100 PolarHBondContact O-N 2.71Å; E97-M101 WeakPolarHBondContact O-CG 3.37Å; E97-M101 PolarHBondContact O-N 2.84Å
98M93.4Very high94Very high74 Ų7485 Ų8537%0.36544%0.441SS..Hα-helixtrans-58.7-44.4174.9-75.2-171.9-58.800111.9T94 Q95 I96 V100 M101 E102T94-M98 WeakPolarHBondContact O-CB 3.41Å; T94-M98 VanDerWaalsContact O-CG 3.31Å; T94-M98 WeakPolarHBondContact O-CG 3.47Å; T94-M98 PolarHBondContact O-N 2.86Å; Q95-M98 HydrophobicContact CB-CE 4.36Å; Q95-M98 HydrophobicContact CG-CE 4.02Å; I96-M98 VanDerWaalsContact C-N 3.31Å; I96-M98 PolarHBondContact O-N 3.44Å; M98-V100 VanDerWaalsContact C-N 3.33Å; M98-V100 PolarHBondContact O-N 2.88Å; M98-M101 PolarHBondContact O-N 3.45Å; M98-E102 WeakPolarHBondContact O-CG 3.42Å; M98-E102 PolarHBondContact O-N 3.37Å
99K93Very high93.9Very high137 Ų13789.4 Ų89.460%0.59646%0.461SS*.Hα-helixtrans-64.2-37176.6-70.9172.1-176.7174.20112.6Q95 I96 E97 G103Q95-K99 WeakPolarHBondContact O-CG 3.35Å; Q95-K99 PolarHBondContact O-N 3.43Å; I96-K99 WeakPolarHBondContact O-CB 3.41Å; I96-K99 PolarHBondContact O-N 3.21Å; I96-K99 VanDerWaalsContact O-N 3.1Å; E97-K99 VanDerWaalsContact C-N 3.35Å; E97-K99 PolarHBondContact O-N 3.27Å; K99-G103 PolarHBondContact O-N 2.92Å
100V94.5Very high93.7Very high78 Ų7885.6 Ų85.647%0.47345%0.448SS..Hα-helixtrans-64.8-44174.5174.50000110I96 E97 M98 G103 L104I96-V100 HydrophobicContact CG2-CG2 4.47Å; I96-V100 WeakPolarHBondContact O-CG2 3.34Å; I96-V100 PolarHBondContact O-N 3.37Å; E97-V100 PolarHBondContact O-N 2.71Å; M98-V100 VanDerWaalsContact C-N 3.33Å; M98-V100 PolarHBondContact O-N 2.88Å; V100-G103 PolarHBondContact O-N 3.49Å; V100-L104 HydrophobicContact CG1-CD1 4.41Å; V100-L104 WeakPolarHBondContact O-CG 3.44Å; V100-L104 PolarHBondContact O-N 2.93Å
101M94.2Very high93.4Very high103 Ų10386.6 Ų86.651%0.50745%0.447SS..Hα-helixtrans-62.6-43.5176.1-68.9-60.9111.600112.3E97 M98 G103 L104 Q105E97-M101 WeakPolarHBondContact O-CG 3.37Å; E97-M101 PolarHBondContact O-N 2.84Å; M98-M101 PolarHBondContact O-N 3.45Å; M101-G103 VanDerWaalsContact C-N 3.31Å; M101-G103 PolarHBondContact O-N 3.15Å; M101-L104 HydrophobicContact CE-CD1 3.67Å; M101-L104 PolarHBondContact O-N 3.35Å; M101-L104 HydrophobicContact SD-CD1 4.38Å; M101-Q105 WeakPolarHBondContact O-CB 3.49Å; M101-Q105 WeakPolarHBondContact O-CG 3.36Å; M101-Q105 PolarHBondContact O-N 2.91Å
102E94.7Very high93.1Very high122 Ų12287.9 Ų87.957%0.5745%0.454SS*.Hα-helixtrans-58.9-42.3173.9-73.6170.8-174.400111.4M98 Q105 F106M98-E102 WeakPolarHBondContact O-CG 3.42Å; M98-E102 PolarHBondContact O-N 3.37Å; E102-Q105 PolarHBondContact O-N 2.9Å; E102-F106 WeakPolarHBondContact O-CB 3.46Å; E102-F106 PolarHBondContact O-N 3.13Å
103G94.4Very high92.9Very high44 Ų4489.5 Ų89.545%0.45446%0.46SS..Hα-helixtrans-63.1-40.8175.200000113.2K99 V100 M101 G107K99-G103 PolarHBondContact O-N 2.92Å; V100-G103 PolarHBondContact O-N 3.49Å; M101-G103 VanDerWaalsContact C-N 3.31Å; M101-G103 PolarHBondContact O-N 3.15Å; G103-G107 PolarHBondContact O-N 2.98Å
104L94.6Very high92.3Very high108 Ų10889.1 Ų89.157%0.56546%0.461SS*.Hα-helixtrans-67.8-40.1175.3-71.4176.8000112.1V100 M101 G107 N108V100-L104 HydrophobicContact CG1-CD1 4.41Å; V100-L104 WeakPolarHBondContact O-CG 3.44Å; V100-L104 PolarHBondContact O-N 2.93Å; M101-L104 HydrophobicContact CE-CD1 3.67Å; M101-L104 PolarHBondContact O-N 3.35Å; M101-L104 HydrophobicContact SD-CD1 4.38Å; L104-G107 PolarHBondContact O-N 3.5Å; L104-N108 WeakPolarHBondContact O-CB 3.4Å; L104-N108 PolarHBondContact O-N 3.34Å
105Q94.5Very high91.8Very high124 Ų12491.7 Ų91.758%0.57947%0.468SS*.Hα-helixtrans-61.5-48.2174.7-76.2177.1-13.800110.8M101 E102 G107 N108 E109M101-Q105 WeakPolarHBondContact O-CB 3.49Å; M101-Q105 WeakPolarHBondContact O-CG 3.36Å; M101-Q105 PolarHBondContact O-N 2.91Å; E102-Q105 PolarHBondContact O-N 2.9Å; Q105-G107 VanDerWaalsContact C-N 3.33Å; Q105-G107 PolarHBondContact O-N 3.23Å; Q105-N108 PolarHBondContact O-N 3.42Å; Q105-N108 VanDerWaalsContact O-N 3.15Å; Q105-E109 WeakPolarHBondContact O-CG 3.42Å; Q105-E109 PolarHBondContact O-N 2.82Å
106F94.4Very high91.2Very high131 Ų13196.4 Ų96.458%0.57549%0.49SS*.Hα-helixtrans-59.7-43.8175.4-179-100.8000111.8E102 N108 E109 C110E102-F106 WeakPolarHBondContact O-CB 3.46Å; E102-F106 PolarHBondContact O-N 3.13Å; F106-N108 VanDerWaalsContact C-N 3.34Å; F106-N108 PolarHBondContact O-N 3.44Å; F106-E109 PolarHBondContact O-N 3.04Å; F106-C110 PolarHBondContact O-N 3.2Å; F106-C110 PolarHBondContact O-SG 3.23Å
107G93.9Very high90.4Very high31 Ų3197.1 Ų97.132%0.3250%0.499SS..Hα-helixtrans-59-43.5173.900000112.6G103 L104 Q105 C110 L111G103-G107 PolarHBondContact O-N 2.98Å; L104-G107 PolarHBondContact O-N 3.5Å; Q105-G107 VanDerWaalsContact C-N 3.33Å; Q105-G107 PolarHBondContact O-N 3.23Å; G107-C110 WeakPolarHBondContact O-CB 3.46Å; G107-C110 PolarHBondContact O-N 2.94Å; G107-L111 WeakPolarHBondContact O-CG 3.47Å; G107-L111 PolarHBondContact O-N 2.81Å
108N94.4Very high89.2Confident89 Ų8998.7 Ų98.748%0.47651%0.508SS..Hα-helixtrans-66.4-41176.7-170-91.4000112.2L104 Q105 F106 C110 L111 N112L104-N108 WeakPolarHBondContact O-CB 3.4Å; L104-N108 PolarHBondContact O-N 3.34Å; Q105-N108 PolarHBondContact O-N 3.42Å; Q105-N108 VanDerWaalsContact O-N 3.15Å; F106-N108 VanDerWaalsContact C-N 3.34Å; F106-N108 PolarHBondContact O-N 3.44Å; N108-C110 VanDerWaalsContact C-N 3.33Å; N108-C110 PolarHBondContact O-N 2.91Å; N108-L111 PolarHBondContact O-N 3.49Å; N108-N112 WeakPolarHBondContact O-CB 3.34Å; N108-N112 PolarHBondContact O-N 2.84Å; N108-N112 PolarHBondContact O-ND2 2.86Å; N108-N112 PolarHBondContact OD1-ND2 3.32Å
109E93.2Very high88.1Confident103 Ų10396.3 Ų96.348%0.48150%0.499SS..Hα-helixtrans-60.8-41.8173.2-74.3-179.9-168.700111.9Q105 F106 N112 K113Q105-E109 WeakPolarHBondContact O-CG 3.42Å; Q105-E109 PolarHBondContact O-N 2.82Å; F106-E109 PolarHBondContact O-N 3.04Å; E109-N112 PolarHBondContact O-N 3.47Å; E109-K113 WeakPolarHBondContact O-CG 3.37Å; E109-K113 PolarHBondContact O-N 3.25Å
110C90.9Very high87Confident47 Ų4795.6 Ų95.632%0.31850%0.5SS..Hα-helixtrans-60.8-46.3173.1-76.70000111.5F106 G107 N108 N112 K113 M114F106-C110 PolarHBondContact O-N 3.2Å; F106-C110 PolarHBondContact O-SG 3.23Å; G107-C110 WeakPolarHBondContact O-CB 3.46Å; G107-C110 PolarHBondContact O-N 2.94Å; N108-C110 VanDerWaalsContact C-N 3.33Å; N108-C110 PolarHBondContact O-N 2.91Å; C110-N112 PolarHBondContact O-N 2.9Å; C110-K113 PolarHBondContact O-N 2.8Å; C110-M114 WeakPolarHBondContact O-CG 3.28Å; C110-M114 PolarHBondContact O-N 2.93Å
111L89.6Confident86Confident90 Ų9097.8 Ų97.847%0.47151%0.505SS..Hα-helixtrans-60.8-43.9175.5-71.4172.7000111.8G107 N108 K113 M114 H115G107-L111 WeakPolarHBondContact O-CG 3.47Å; G107-L111 PolarHBondContact O-N 2.81Å; N108-L111 PolarHBondContact O-N 3.49Å; L111-K113 VanDerWaalsContact C-N 3.35Å; L111-K113 PolarHBondContact O-N 3.38Å; L111-M114 WeakPolarHBondContact O-CB 3.46Å; L111-M114 PolarHBondContact O-N 3.19Å; L111-H115 VanDerWaalsContact O-CG 3.28Å; L111-H115 PolarHBondContact O-N 3.45Å
112N89.2Confident85Confident72 Ų7297.1 Ų97.139%0.38550%0.501SS..Hα-helixtrans-62.7-41.1176.8-69.3-27.2000111.6N108 E109 C110 H115 Q116N108-N112 WeakPolarHBondContact O-CB 3.34Å; N108-N112 PolarHBondContact O-N 2.84Å; N108-N112 PolarHBondContact O-ND2 2.86Å; N108-N112 PolarHBondContact OD1-ND2 3.32Å; E109-N112 PolarHBondContact O-N 3.47Å; C110-N112 PolarHBondContact O-N 2.9Å; N112-H115 PolarHBondContact O-N 3.15Å; N112-Q116 VanDerWaalsContact O-CG 3.28Å; N112-Q116 WeakPolarHBondContact O-CG 3.35Å; N112-Q116 PolarHBondContact O-N 2.95Å
113K87.5Confident84.2Confident119 Ų11995.1 Ų95.152%0.51750%0.497SS..Hα-helixtrans-63.8-41173.7-74.1171.3-176167.20111.6E109 C110 L111 H115 Q116 V117E109-K113 WeakPolarHBondContact O-CG 3.37Å; E109-K113 PolarHBondContact O-N 3.25Å; C110-K113 PolarHBondContact O-N 2.8Å; L111-K113 VanDerWaalsContact C-N 3.35Å; L111-K113 PolarHBondContact O-N 3.38Å; K113-H115 VanDerWaalsContact C-N 3.35Å; K113-Q116 WeakPolarHBondContact O-CB 3.49Å; K113-Q116 PolarHBondContact O-N 3.45Å; K113-V117 WeakPolarHBondContact O-CG2 3.37Å; K113-V117 PolarHBondContact O-N 2.85Å
114M80.9Confident83.5Confident111 Ų11197.9 Ų97.955%0.54750%0.498SS..Hα-helixtrans-62.4-42.7174.3-71.3-179.275.700111.5C110 L111 Q116 V117 M118C110-M114 WeakPolarHBondContact O-CG 3.28Å; C110-M114 PolarHBondContact O-N 2.93Å; L111-M114 WeakPolarHBondContact O-CB 3.46Å; L111-M114 PolarHBondContact O-N 3.19Å; M114-Q116 VanDerWaalsContact C-N 3.31Å; M114-Q116 PolarHBondContact O-N 3.23Å; M114-V117 PolarHBondContact O-N 3.33Å; M114-V117 VanDerWaalsContact O-N 3.15Å; M114-M118 PolarHBondContact O-N 3.22Å
115H82.5Confident83Confident118 Ų11898.9 Ų98.955%0.54649%0.494SS..Hα-helixtrans-65.1-32.8174.1-65.8167.9000112.8L111 N112 K113 V117 M118L111-H115 VanDerWaalsContact O-CG 3.28Å; L111-H115 PolarHBondContact O-N 3.45Å; N112-H115 PolarHBondContact O-N 3.15Å; K113-H115 VanDerWaalsContact C-N 3.35Å; H115-V117 VanDerWaalsContact C-N 3.33Å; H115-M118 CarbonylContact O-C 3.52Å
116Q80Confident82.5Confident141 Ų14197.9 Ų97.966%0.65949%0.492SS*.Hα-helixtrans-69.2-31.5172.3-74.9171.20.600112.4N112 K113 M114 S119N112-Q116 VanDerWaalsContact O-CG 3.28Å; N112-Q116 WeakPolarHBondContact O-CG 3.35Å; N112-Q116 PolarHBondContact O-N 2.95Å; K113-Q116 WeakPolarHBondContact O-CB 3.49Å; K113-Q116 PolarHBondContact O-N 3.45Å; M114-Q116 VanDerWaalsContact C-N 3.31Å; M114-Q116 PolarHBondContact O-N 3.23Å; Q116-S119 VanDerWaalsContact O-CB 3.26Å; Q116-S119 WeakPolarHBondContact O-CB 3.22Å
117V75.5Confident82.1Confident113 Ų11395.9 Ų95.969%0.68549%0.487SS*.Hα-helixtrans-75-40174.6173.70000110.7K113 M114 H115 S119K113-V117 WeakPolarHBondContact O-CG2 3.37Å; K113-V117 PolarHBondContact O-N 2.85Å; M114-V117 PolarHBondContact O-N 3.33Å; M114-V117 VanDerWaalsContact O-N 3.15Å; H115-V117 VanDerWaalsContact C-N 3.33Å; V117-S119 PolarHBondContact O-N 2.9Å
118M68.6Low81.9Confident117 Ų11798.5 Ų98.558%0.57649%0.493SS*.THydrogen-bonded Turntrans-76.538.7168.4-62.6179.917400111.6M114 H115M114-M118 PolarHBondContact O-N 3.22Å; H115-M118 CarbonylContact O-C 3.52Å
119S69.1Low81.7Confident25 Ų2599.7 Ų99.718%0.17550%0.496CS..  trans-51157.9-162.560.70000113.2Q116 V117 E121 E122 V123Q116-S119 VanDerWaalsContact O-CB 3.26Å; Q116-S119 WeakPolarHBondContact O-CB 3.22Å; V117-S119 PolarHBondContact O-N 2.9Å; S119-E121 PolarHBondContact O-N 3.41Å; S119-E121 WeakPolarHBondContact OG-CB 3.32Å; S119-E121 PolarHBondContact OG-N 2.9Å; S119-E122 PolarHBondContact O-N 2.88Å; S119-V123 PolarHBondContact O-N 3.28Å
120I70Confident81.6Confident121 Ų12198.3 Ų98.362%0.62149%0.494SS*.Hα-helixtrans-45.9-30.7167.8-67.2165000111.1E122 V123 E124I120-E122 PolarHBondContact O-N 3.08Å; I120-V123 CarbonylContact O-C 3.59Å; I120-V123 PolarHBondContact O-N 2.68Å; I120-E124 HydrophobicContact CG2-CG 3.8Å; I120-E124 VanDerWaalsContact CG2-OE1 3.32Å; I120-E124 WeakPolarHBondContact CG2-OE1 3.28Å; I120-E124 VanDerWaalsContact O-CB 3.28Å; I120-E124 WeakPolarHBondContact O-CB 3.32Å; I120-E124 WeakPolarHBondContact O-CG 3.39Å; I120-E124 PolarHBondContact O-N 2.82Å
121E73.3Confident81.5Confident125 Ų125101.2 Ų101.258%0.58450%0.504SS*.Hα-helixtrans-62.9-36.8175.7-54.9171.4168.100113.1S119 R125S119-E121 PolarHBondContact O-N 3.41Å; S119-E121 WeakPolarHBondContact OG-CB 3.32Å; S119-E121 PolarHBondContact OG-N 2.9Å; E121-R125 VanDerWaalsContact O-CB 3.26Å; E121-R125 WeakPolarHBondContact O-CB 3.26Å; E121-R125 PolarHBondContact O-N 3.36Å
122E73.1Confident81.6Confident89 Ų89103.3 Ų103.342%0.41651%0.511SS..Hα-helixtrans-68.9-40173-69.1-174.4164.600110.5S119 I120 R125 I126S119-E122 PolarHBondContact O-N 2.88Å; I120-E122 PolarHBondContact O-N 3.08Å; E122-R125 PolarHBondContact O-N 2.96Å; E122-I126 WeakPolarHBondContact O-CB 3.28Å; E122-I126 WeakPolarHBondContact O-CD1 3.4Å; E122-I126 WeakPolarHBondContact O-CG1 3.18Å; E122-I126 PolarHBondContact O-N 3.49Å
123V77.6Confident81.5Confident80 Ų80102.6 Ų102.649%0.48552%0.515SS..Hα-helixtrans-65.5-44.1175.9-179.60000111.1S119 I120 I126 L127S119-V123 PolarHBondContact O-N 3.28Å; I120-V123 CarbonylContact O-C 3.59Å; I120-V123 PolarHBondContact O-N 2.68Å; V123-I126 PolarHBondContact O-N 3.45Å; V123-L127 HydrophobicContact CG1-CD1 4.07Å; V123-L127 WeakPolarHBondContact O-CB 3.4Å; V123-L127 WeakPolarHBondContact O-CG 3.4Å; V123-L127 PolarHBondContact O-N 3.17Å
124E81.2Confident81.7Confident102 Ų102100.5 Ų100.548%0.47751%0.512SS..Hα-helixtrans-63.7-45.6174.6-77.5175.417400110.2I120 I126 L127 D128I120-E124 HydrophobicContact CG2-CG 3.8Å; I120-E124 VanDerWaalsContact CG2-OE1 3.32Å; I120-E124 WeakPolarHBondContact CG2-OE1 3.28Å; I120-E124 VanDerWaalsContact O-CB 3.28Å; I120-E124 WeakPolarHBondContact O-CB 3.32Å; I120-E124 WeakPolarHBondContact O-CG 3.39Å; I120-E124 PolarHBondContact O-N 2.82Å; E124-I126 VanDerWaalsContact C-N 3.34Å; E124-I126 PolarHBondContact O-N 3.18Å; E124-L127 CarbonylContact O-C 3.39Å; E124-L127 WeakPolarHBondContact O-CA 3.16Å; E124-L127 PolarHBondContact O-N 3Å; E124-L127 VanDerWaalsContact O-N 3.08Å; E124-D128 WeakPolarHBondContact O-CB 3.46Å; E124-D128 VanDerWaalsContact O-CG 3.24Å; E124-D128 PolarHBondContact O-N 2.92Å
125R83.7Confident82.3Confident129 Ų129100.2 Ų100.249%0.48751%0.509SS..Hα-helixtrans-58.3-45.7174.5-133.7179.4-57.7164.56.8111.8E121 E122 L127 D128 E129E121-R125 VanDerWaalsContact O-CB 3.26Å; E121-R125 WeakPolarHBondContact O-CB 3.26Å; E121-R125 PolarHBondContact O-N 3.36Å; E122-R125 PolarHBondContact O-N 2.96Å; R125-L127 VanDerWaalsContact C-N 3.29Å; R125-L127 PolarHBondContact O-N 2.93Å; R125-D128 PolarHBondContact O-N 3.01Å; R125-E129 VanDerWaalsContact O-CB 3.24Å; R125-E129 WeakPolarHBondContact O-CB 3.27Å; R125-E129 WeakPolarHBondContact O-CG 3.34Å; R125-E129 PolarHBondContact O-N 2.74Å
126I83.4Confident82.6Confident102 Ų102101.7 Ų101.752%0.52351%0.511SS..Hα-helixtrans-63.6-38.8177.2-69.2164.5000110.1E122 V123 E124 T130E122-I126 WeakPolarHBondContact O-CB 3.28Å; E122-I126 WeakPolarHBondContact O-CD1 3.4Å; E122-I126 WeakPolarHBondContact O-CG1 3.18Å; E122-I126 PolarHBondContact O-N 3.49Å; V123-I126 PolarHBondContact O-N 3.45Å; E124-I126 VanDerWaalsContact C-N 3.34Å; E124-I126 PolarHBondContact O-N 3.18Å; I126-T130 WeakPolarHBondContact O-CB 3.3Å; I126-T130 WeakPolarHBondContact O-CG2 3.5Å; I126-T130 PolarHBondContact O-N 2.82Å; I126-T130 PolarHBondContact O-OG1 3.02Å
127L85.7Confident83Confident90 Ų9099.8 Ų99.847%0.47150%0.502SS..Hα-helixtrans-70.5-32.8176.7-73.8171.8000113.3V123 E124 R125 T130 Q131V123-L127 HydrophobicContact CG1-CD1 4.07Å; V123-L127 WeakPolarHBondContact O-CB 3.4Å; V123-L127 WeakPolarHBondContact O-CG 3.4Å; V123-L127 PolarHBondContact O-N 3.17Å; E124-L127 CarbonylContact O-C 3.39Å; E124-L127 WeakPolarHBondContact O-CA 3.16Å; E124-L127 PolarHBondContact O-N 3Å; E124-L127 VanDerWaalsContact O-N 3.08Å; R125-L127 VanDerWaalsContact C-N 3.29Å; R125-L127 PolarHBondContact O-N 2.93Å; L127-T130 VanDerWaalsContact CA-OG1 3.28Å; L127-T130 WeakPolarHBondContact CA-OG1 3.44Å; L127-T130 PolarHBondContact O-OG1 2.9Å; L127-Q131 VanDerWaalsContact O-CG 3.3Å; L127-Q131 WeakPolarHBondContact O-CG 3.49Å; L127-Q131 PolarHBondContact O-N 3.45Å; L127-Q131 VanDerWaalsContact O-N 3.12Å; L127-Q131 PolarHBondContact O-NE2 2.9Å; L127-Q131 VanDerWaalsContact O-NE2 3.08Å
128D90.5Very high83.7Confident86 Ų86102.2 Ų102.246%0.4650%0.499SS..Hα-helixtrans-77.1-47.4177.4-70.5-15.7000110.1E124 R125 T130 Q131 E132E124-D128 WeakPolarHBondContact O-CB 3.46Å; E124-D128 VanDerWaalsContact O-CG 3.24Å; E124-D128 PolarHBondContact O-N 2.92Å; R125-D128 PolarHBondContact O-N 3.01Å; D128-T130 PolarHBondContact O-N 2.98Å; D128-Q131 CarbonylContact O-C 3.5Å; D128-Q131 WeakPolarHBondContact O-CB 3.38Å; D128-Q131 PolarHBondContact O-N 2.97Å; D128-E132 WeakPolarHBondContact O-CG 3.47Å; D128-E132 PolarHBondContact O-N 3.48Å
129E90.2Very high84.6Confident114 Ų114101.8 Ų101.853%0.53350%0.496SS..Hα-helixtrans-57.4-38.6173.9-74.7173.5-166.400111.4R125 A133R125-E129 VanDerWaalsContact O-CB 3.24Å; R125-E129 WeakPolarHBondContact O-CB 3.27Å; R125-E129 WeakPolarHBondContact O-CG 3.34Å; R125-E129 PolarHBondContact O-N 2.74Å; E129-A133 WeakPolarHBondContact O-CB 3.22Å; E129-A133 PolarHBondContact O-N 3.05Å
130T90.9Very high85.4Confident73 Ų73102.9 Ų102.945%0.44850%0.499SS..Hα-helixtrans-71-33.917549.50000112.9I126 L127 D128 V134I126-T130 WeakPolarHBondContact O-CB 3.3Å; I126-T130 WeakPolarHBondContact O-CG2 3.5Å; I126-T130 PolarHBondContact O-N 2.82Å; I126-T130 PolarHBondContact O-OG1 3.02Å; L127-T130 VanDerWaalsContact CA-OG1 3.28Å; L127-T130 WeakPolarHBondContact CA-OG1 3.44Å; L127-T130 PolarHBondContact O-OG1 2.9Å; D128-T130 PolarHBondContact O-N 2.98Å; T130-V134 VanDerWaalsContact O-CG2 3.27Å; T130-V134 WeakPolarHBondContact O-CG2 3.26Å; T130-V134 PolarHBondContact O-N 3.08Å
131Q89.5Confident86.3Confident109 Ų109101.1 Ų101.151%0.50949%0.491SS..Hα-helixtrans-69.7-46.4173.2-80171.17000111.9L127 D128 A133 V134 E135L127-Q131 VanDerWaalsContact O-CG 3.3Å; L127-Q131 WeakPolarHBondContact O-CG 3.49Å; L127-Q131 PolarHBondContact O-N 3.45Å; L127-Q131 VanDerWaalsContact O-N 3.12Å; L127-Q131 PolarHBondContact O-NE2 2.9Å; L127-Q131 VanDerWaalsContact O-NE2 3.08Å; D128-Q131 CarbonylContact O-C 3.5Å; D128-Q131 WeakPolarHBondContact O-CB 3.38Å; D128-Q131 PolarHBondContact O-N 2.97Å; Q131-A133 VanDerWaalsContact C-N 3.31Å; Q131-A133 PolarHBondContact O-N 3.28Å; Q131-V134 WeakPolarHBondContact O-CB 3.24Å; Q131-V134 PolarHBondContact O-N 3.24Å; Q131-V134 VanDerWaalsContact O-N 3.08Å; Q131-E135 PolarHBondContact O-N 3.12Å
132E90.9Very high87Confident133 Ų133102.4 Ų102.462%0.62150%0.497SS*.Hα-helixtrans-57.7-43175.8-73.3-177.3179.500111.3D128 V134 E135 Y136D128-E132 WeakPolarHBondContact O-CG 3.47Å; D128-E132 PolarHBondContact O-N 3.48Å; E132-V134 VanDerWaalsContact C-N 3.31Å; E132-V134 PolarHBondContact O-N 2.8Å; E132-E135 PolarHBondContact O-N 3.28Å; E132-Y136 VanDerWaalsContact O-CB 3.3Å; E132-Y136 WeakPolarHBondContact O-CB 3.08Å; E132-Y136 PolarHBondContact O-N 2.79Å
133A87.8Confident87.6Confident58 Ų58104.2 Ų104.248%0.47951%0.509SS..Hα-helixtrans-61.1-39.5175.400000112.4E129 Q131 Q137E129-A133 WeakPolarHBondContact O-CB 3.22Å; E129-A133 PolarHBondContact O-N 3.05Å; Q131-A133 VanDerWaalsContact C-N 3.31Å; Q131-A133 PolarHBondContact O-N 3.28Å; A133-Q137 WeakPolarHBondContact O-CB 3.38Å; A133-Q137 PolarHBondContact O-N 3.42Å
134V91.7Very high87.9Confident75 Ų75104 Ų10446%0.45551%0.505SS..Hα-helixtrans-68.5-40.2176.4170.20000111.5T130 Q131 E132 Q137 R138T130-V134 VanDerWaalsContact O-CG2 3.27Å; T130-V134 WeakPolarHBondContact O-CG2 3.26Å; T130-V134 PolarHBondContact O-N 3.08Å; Q131-V134 WeakPolarHBondContact O-CB 3.24Å; Q131-V134 PolarHBondContact O-N 3.24Å; Q131-V134 VanDerWaalsContact O-N 3.08Å; E132-V134 VanDerWaalsContact C-N 3.31Å; E132-V134 PolarHBondContact O-N 2.8Å; V134-Q137 PolarHBondContact O-N 3.39Å; V134-R138 WeakPolarHBondContact O-CG 3.25Å; V134-R138 PolarHBondContact O-N 3.02Å
135E92.4Very high87.9Confident104 Ų104103.4 Ų103.449%0.48652%0.517SS..Hα-helixtrans-68.5-42.9176.9-71.4-175.6174.800112.3Q131 E132 Q137 R138 Q139Q131-E135 PolarHBondContact O-N 3.12Å; E132-E135 PolarHBondContact O-N 3.28Å; E135-Q137 VanDerWaalsContact C-N 3.29Å; E135-Q137 PolarHBondContact O-N 2.74Å; E135-R138 WeakPolarHBondContact O-CB 3.42Å; E135-R138 PolarHBondContact O-N 3.08Å; E135-R138 VanDerWaalsContact O-N 3.13Å; E135-Q139 WeakPolarHBondContact O-CG 3.42Å; E135-Q139 PolarHBondContact O-N 2.81Å
136Y90.3Very high87.6Confident149 Ų149100.6 Ų100.658%0.58453%0.528SS*.Hα-helixtrans-58.6-43.5174.3-179.2-111000111.1E132 R138 Q139 I140E132-Y136 VanDerWaalsContact O-CB 3.3Å; E132-Y136 WeakPolarHBondContact O-CB 3.08Å; E132-Y136 PolarHBondContact O-N 2.79Å; Y136-R138 VanDerWaalsContact C-N 3.34Å; Y136-R138 PolarHBondContact O-N 3.39Å; Y136-Q139 PolarHBondContact O-N 3.22Å; Y136-I140 HydrophobicContact CD1-CD1 3.77Å; Y136-I140 HydrophobicContact CE1-CD1 3.34Å; Y136-I140 HydrophobicContact CE1-CG1 4.28Å; Y136-I140 HydrophobicContact CE2-CD1 4.4Å; Y136-I140 HydrophobicContact CG-CD1 4.47Å; Y136-I140 WeakPolarHBondContact O-CG1 3.21Å; Y136-I140 PolarHBondContact O-N 3.3Å
137Q87.2Confident87.2Confident101 Ų10199.9 Ų99.947%0.47253%0.532SS..Hα-helixtrans-60-44.4174.5-170.861.147.400111.5A133 V134 E135 Q139 I140 D141A133-Q137 WeakPolarHBondContact O-CB 3.38Å; A133-Q137 PolarHBondContact O-N 3.42Å; V134-Q137 PolarHBondContact O-N 3.39Å; E135-Q137 VanDerWaalsContact C-N 3.29Å; E135-Q137 PolarHBondContact O-N 2.74Å; Q137-Q139 VanDerWaalsContact C-N 3.35Å; Q137-Q139 PolarHBondContact O-N 2.88Å; Q137-I140 WeakPolarHBondContact O-CB 3.13Å; Q137-I140 PolarHBondContact O-N 3.45Å; Q137-D141 PolarHBondContact NE2-OD1 2.88Å; Q137-D141 PolarHBondContact O-N 3.29Å
138R91.3Very high87Confident165 Ų16599.7 Ų99.762%0.62353%0.528SS*.Hα-helixtrans-63.1-37.2176-73.2175179.61671.5113.3V134 E135 Y136 D141 E142V134-R138 WeakPolarHBondContact O-CG 3.25Å; V134-R138 PolarHBondContact O-N 3.02Å; E135-R138 WeakPolarHBondContact O-CB 3.42Å; E135-R138 PolarHBondContact O-N 3.08Å; E135-R138 VanDerWaalsContact O-N 3.13Å; Y136-R138 VanDerWaalsContact C-N 3.34Å; Y136-R138 PolarHBondContact O-N 3.39Å; R138-D141 PolarHBondContact O-N 3.04Å; R138-E142 WeakPolarHBondContact O-CB 3.32Å; R138-E142 PolarHBondContact O-N 3.48Å
139Q87.6Confident86.6Confident107 Ų10799.2 Ų99.250%0.553%0.528SS..Hα-helixtrans-67-39.6176.5-72.3174.620.700111.7E135 Y136 Q137 D141 E142 L143E135-Q139 WeakPolarHBondContact O-CG 3.42Å; E135-Q139 PolarHBondContact O-N 2.81Å; Y136-Q139 PolarHBondContact O-N 3.22Å; Q137-Q139 VanDerWaalsContact C-N 3.35Å; Q137-Q139 PolarHBondContact O-N 2.88Å; Q139-D141 VanDerWaalsContact C-N 3.33Å; Q139-E142 PolarHBondContact O-N 2.91Å; Q139-L143 WeakPolarHBondContact O-CB 3.46Å; Q139-L143 WeakPolarHBondContact O-CG 3.46Å; Q139-L143 PolarHBondContact O-N 2.95Å
140I86Confident86.2Confident48 Ų48101.2 Ų101.225%0.24654%0.538CS..Hα-helixtrans-58.2-51.4170.8-70.3167.9000108.9Y136 Q137 E142 L143 L144Y136-I140 HydrophobicContact CD1-CD1 3.77Å; Y136-I140 HydrophobicContact CE1-CD1 3.34Å; Y136-I140 HydrophobicContact CE1-CG1 4.28Å; Y136-I140 HydrophobicContact CE2-CD1 4.4Å; Y136-I140 HydrophobicContact CG-CD1 4.47Å; Y136-I140 WeakPolarHBondContact O-CG1 3.21Å; Y136-I140 PolarHBondContact O-N 3.3Å; Q137-I140 WeakPolarHBondContact O-CB 3.13Å; Q137-I140 PolarHBondContact O-N 3.45Å; I140-E142 VanDerWaalsContact C-N 3.29Å; I140-E142 PolarHBondContact O-N 3.3Å; I140-L143 PolarHBondContact O-N 3.43Å; I140-L144 HydrophobicContact CG2-CD1 3.49Å; I140-L144 VanDerWaalsContact CG2-CD1 3.49Å; I140-L144 HydrophobicContact CG2-CG 4.16Å; I140-L144 WeakPolarHBondContact O-CB 3.3Å; I140-L144 WeakPolarHBondContact O-CG 3.41Å; I140-L144 PolarHBondContact O-N 2.88Å
141D87.9Confident85.8Confident84 Ų84105.6 Ų105.645%0.44955%0.553SS.*Hα-helixtrans-58.7-40.7-179.2-60.8-20.6000111.6Q137 R138 Q139 L144 A145Q137-D141 PolarHBondContact NE2-OD1 2.88Å; Q137-D141 PolarHBondContact O-N 3.29Å; R138-D141 PolarHBondContact O-N 3.04Å; Q139-D141 VanDerWaalsContact C-N 3.33Å; D141-L144 PolarHBondContact O-N 3.32Å; D141-A145 VanDerWaalsContact O-CB 3.25Å; D141-A145 WeakPolarHBondContact O-CB 3.33Å; D141-A145 PolarHBondContact O-N 3.41Å
142E88.7Confident85.6Confident152 Ų152103.7 Ų103.771%0.7155%0.546SS*.Hα-helixtrans-67.9-44.6178.1-174.2177.1-172.400113.2R138 Q139 I140 L144 A145R138-E142 WeakPolarHBondContact O-CB 3.32Å; R138-E142 PolarHBondContact O-N 3.48Å; Q139-E142 PolarHBondContact O-N 2.91Å; I140-E142 VanDerWaalsContact C-N 3.29Å; I140-E142 PolarHBondContact O-N 3.3Å; E142-L144 VanDerWaalsContact C-N 3.27Å; E142-L144 PolarHBondContact O-N 3.45Å; E142-A145 PolarHBondContact O-N 3.13Å
143L85.2Confident85.3Confident127 Ų127102.5 Ų102.567%0.66554%0.54SS*.Hα-helixtrans-62.6-37.7176.1-75.1172.3000111.5Q139 I140 S147Q139-L143 WeakPolarHBondContact O-CB 3.46Å; Q139-L143 WeakPolarHBondContact O-CG 3.46Å; Q139-L143 PolarHBondContact O-N 2.95Å; I140-L143 PolarHBondContact O-N 3.43Å; L143-S147 WeakPolarHBondContact O-CB 3.44Å; L143-S147 PolarHBondContact O-OG 3.23Å
144L83.5Confident85.2Confident77 Ų77104.5 Ų104.540%0.40354%0.543SS..Hα-helixtrans-75.2-35.7179.3-66.9177.2000112.2I140 D141 E142 G146 S147 F148I140-L144 HydrophobicContact CG2-CD1 3.49Å; I140-L144 VanDerWaalsContact CG2-CD1 3.49Å; I140-L144 HydrophobicContact CG2-CG 4.16Å; I140-L144 WeakPolarHBondContact O-CB 3.3Å; I140-L144 WeakPolarHBondContact O-CG 3.41Å; I140-L144 PolarHBondContact O-N 2.88Å; D141-L144 PolarHBondContact O-N 3.32Å; E142-L144 VanDerWaalsContact C-N 3.27Å; E142-L144 PolarHBondContact O-N 3.45Å; L144-G146 PolarHBondContact O-N 3.29Å; L144-S147 PolarHBondContact O-N 2.97Å; L144-F148 HydrophobicContact CB-CE2 3.87Å; L144-F148 HydrophobicContact CD2-CE2 3.5Å; L144-F148 VanDerWaalsContact CD2-CE2 3.5Å; L144-F148 HydrophobicContact CD2-CZ 3.53Å; L144-F148 HydrophobicContact CG-CE2 4.17Å; L144-F148 WeakPolarHBondContact O-CD2 3.45Å
145A81.8Confident84.9Confident88 Ų88103.1 Ų103.173%0.72754%0.54SS*.THydrogen-bonded Turntrans-59.8-17-173.700000115.7D141 E142D141-A145 VanDerWaalsContact O-CB 3.25Å; D141-A145 WeakPolarHBondContact O-CB 3.33Å; D141-A145 PolarHBondContact O-N 3.41Å; E142-A145 PolarHBondContact O-N 3.13Å
146G76.2Confident84.7Confident71 Ų71101.8 Ų101.873%0.73254%0.535SS*.THydrogen-bonded Turntrans-127.2-0.9178.600000115.7L144L144-G146 PolarHBondContact O-N 3.29Å
147S76.2Confident84.5Confident86 Ų8699.9 Ų99.960%0.60154%0.535SS*.THydrogen-bonded Turntrans-91.9-19.4-172.9-66.50000114L143 L144L143-S147 WeakPolarHBondContact O-CB 3.44Å; L143-S147 PolarHBondContact O-OG 3.23Å; L144-S147 PolarHBondContact O-N 2.97Å
148F80.2Confident84.6Confident86 Ų86101.9 Ų101.938%0.37754%0.544SS..  trans-89.3132.3-177.6-63.5-62.7000111.4L144 D152 E153 I156L144-F148 HydrophobicContact CB-CE2 3.87Å; L144-F148 HydrophobicContact CD2-CE2 3.5Å; L144-F148 VanDerWaalsContact CD2-CE2 3.5Å; L144-F148 HydrophobicContact CD2-CZ 3.53Å; L144-F148 HydrophobicContact CG-CE2 4.17Å; L144-F148 WeakPolarHBondContact O-CD2 3.45Å; F148-D152 HydrophobicContact CB-CB 4.11Å; F148-D152 HydrophobicContact CD1-CB 3.81Å; F148-D152 HydrophobicContact CG-CB 4.41Å; F148-E153 HydrophobicContact CB-CG 4.06Å; F148-I156 HydrophobicContact CD1-CD1 3.93Å; F148-I156 HydrophobicContact CE1-CD1 3.75Å; F148-I156 HydrophobicContact CE2-CD1 4.39Å; F148-I156 HydrophobicContact CG-CD1 4.34Å; F148-I156 HydrophobicContact CZ-CD1 3.98Å
149T82.7Confident84.4Confident76 Ų76100.6 Ų100.647%0.46655%0.545SS..  trans-78.5164.4164.967.20000109.7E151 D152 E153T149-E151 PolarHBondContact O-N 3.01Å; T149-D152 WeakPolarHBondContact CB-OD2 3.3Å; T149-D152 PolarHBondContact N-OD2 3.29Å; T149-D152 WeakPolarHBondContact O-CB 3.31Å; T149-D152 PolarHBondContact O-N 2.71Å; T149-D152 VanDerWaalsContact OG1-CG 3.26Å; T149-D152 PolarHBondContact OG1-N 3.46Å; T149-D152 PolarHBondContact OG1-OD2 3.33Å; T149-E153 PolarHBondContact O-N 2.91Å
150Q82.1Confident84.3Confident157 Ų157100.3 Ų100.373%0.73455%0.547SS*.Hα-helixtrans-56.8-34.7175.2-74.4-175.6-30.100112.4D152 E153 D154Q150-D152 VanDerWaalsContact C-N 3.32Å; Q150-D152 PolarHBondContact O-N 3.42Å; Q150-E153 PolarHBondContact O-N 2.83Å; Q150-D154 PolarHBondContact O-N 3.35Å; Q150-D154 VanDerWaalsContact O-N 3.09Å
151E82.9Confident84.3Confident164 Ų164101.2 Ų101.277%0.76656%0.557SS**Hα-helixtrans-66-34.6176.5-64.8-179173.500112T149 A155T149-E151 PolarHBondContact O-N 3.01Å; E151-A155 PolarHBondContact O-N 2.86Å; E151-A155 VanDerWaalsContact O-N 3.17Å
152D85.4Confident84.1Confident69 Ų6999.5 Ų99.537%0.36956%0.555SS.*Hα-helixtrans-72.1-41.2176.1-57.2-54.7000111.6F148 T149 Q150 D154 A155 I156F148-D152 HydrophobicContact CB-CB 4.11Å; F148-D152 HydrophobicContact CD1-CB 3.81Å; F148-D152 HydrophobicContact CG-CB 4.41Å; T149-D152 WeakPolarHBondContact CB-OD2 3.3Å; T149-D152 PolarHBondContact N-OD2 3.29Å; T149-D152 WeakPolarHBondContact O-CB 3.31Å; T149-D152 PolarHBondContact O-N 2.71Å; T149-D152 VanDerWaalsContact OG1-CG 3.26Å; T149-D152 PolarHBondContact OG1-N 3.46Å; T149-D152 PolarHBondContact OG1-OD2 3.33Å; Q150-D152 VanDerWaalsContact C-N 3.32Å; Q150-D152 PolarHBondContact O-N 3.42Å; D152-D154 VanDerWaalsContact C-N 3.34Å; D152-D154 PolarHBondContact O-N 3.24Å; D152-A155 PolarHBondContact O-N 2.86Å; D152-I156 WeakPolarHBondContact O-CD1 3.49Å; D152-I156 VanDerWaalsContact O-CG1 3.22Å; D152-I156 WeakPolarHBondContact O-CG1 3.37Å; D152-I156 PolarHBondContact O-N 2.91Å
153E83.8Confident83.8Confident108 Ų10896.7 Ų96.751%0.50554%0.543SS..Hα-helixtrans-60.8-43.7176.4-70.2-173.3165.600111.5F148 T149 Q150 I156 L157F148-E153 HydrophobicContact CB-CG 4.06Å; T149-E153 PolarHBondContact O-N 2.91Å; Q150-E153 PolarHBondContact O-N 2.83Å; E153-I156 PolarHBondContact O-N 3.35Å; E153-L157 WeakPolarHBondContact O-CB 3.31Å; E153-L157 VanDerWaalsContact O-CG 3.31Å; E153-L157 WeakPolarHBondContact O-CG 3.33Å; E153-L157 PolarHBondContact O-N 3.39Å
154D85.4Confident83.6Confident100 Ų10093.8 Ų93.854%0.53553%0.531SS..Hα-helixtrans-63.4-44177.5-73.4-23.6000111.4Q150 D152 I156 L157 E158Q150-D154 PolarHBondContact O-N 3.35Å; Q150-D154 VanDerWaalsContact O-N 3.09Å; D152-D154 VanDerWaalsContact C-N 3.34Å; D152-D154 PolarHBondContact O-N 3.24Å; D154-I156 PolarHBondContact O-N 2.69Å; D154-L157 PolarHBondContact O-N 2.94Å; D154-E158 WeakPolarHBondContact O-CG 3.17Å; D154-E158 PolarHBondContact O-N 3.44Å
155A86.5Confident83.2Confident47 Ų4796.7 Ų96.739%0.38854%0.542SS..Hα-helixtrans-62.7-41.1175.800000112.5E151 D152 E158 E159E151-A155 PolarHBondContact O-N 2.86Å; E151-A155 VanDerWaalsContact O-N 3.17Å; D152-A155 PolarHBondContact O-N 2.86Å; A155-E158 PolarHBondContact O-N 3.45Å; A155-E159 PolarHBondContact O-N 3.29Å
156I87.5Confident82.6Confident75 Ų7599.4 Ų99.439%0.38554%0.54SS..Hα-helixtrans-64-42.4175.7-69.3162.5000111F148 D152 E153 D154 E158 E159 L160F148-I156 HydrophobicContact CD1-CD1 3.93Å; F148-I156 HydrophobicContact CE1-CD1 3.75Å; F148-I156 HydrophobicContact CE2-CD1 4.39Å; F148-I156 HydrophobicContact CG-CD1 4.34Å; F148-I156 HydrophobicContact CZ-CD1 3.98Å; D152-I156 WeakPolarHBondContact O-CD1 3.49Å; D152-I156 VanDerWaalsContact O-CG1 3.22Å; D152-I156 WeakPolarHBondContact O-CG1 3.37Å; D152-I156 PolarHBondContact O-N 2.91Å; E153-I156 PolarHBondContact O-N 3.35Å; D154-I156 PolarHBondContact O-N 2.69Å; I156-E158 VanDerWaalsContact C-N 3.34Å; I156-E159 PolarHBondContact O-N 2.71Å; I156-L160 VanDerWaalsContact O-CB 3.3Å; I156-L160 WeakPolarHBondContact O-CB 3.36Å; I156-L160 PolarHBondContact O-N 3.21Å
157L87.1Confident81.9Confident110 Ų110102.9 Ų102.958%0.57654%0.537SS*.Hα-helixtrans-64-39.4176.4-73.5172.3000111.7E153 D154 S161E153-L157 WeakPolarHBondContact O-CB 3.31Å; E153-L157 VanDerWaalsContact O-CG 3.31Å; E153-L157 WeakPolarHBondContact O-CG 3.33Å; E153-L157 PolarHBondContact O-N 3.39Å; D154-L157 PolarHBondContact O-N 2.94Å; L157-S161 VanDerWaalsContact O-CB 3.31Å; L157-S161 WeakPolarHBondContact O-CB 3.44Å; L157-S161 PolarHBondContact O-N 3.34Å
158E88Confident80.9Confident142 Ų142103.1 Ų103.166%0.66453%0.531SS*.Hα-helixtrans-62.7-49.3173.6-75.5-173.9178.400111.6D154 A155 I156 L160 S161 A162D154-E158 WeakPolarHBondContact O-CG 3.17Å; D154-E158 PolarHBondContact O-N 3.44Å; A155-E158 PolarHBondContact O-N 3.45Å; I156-E158 VanDerWaalsContact C-N 3.34Å; E158-L160 PolarHBondContact O-N 2.91Å; E158-S161 PolarHBondContact O-N 2.94Å; E158-S161 PolarHBondContact O-OG 3.46Å; E158-A162 PolarHBondContact O-N 3.41Å
159E87.5Confident79.8Confident138 Ų138107 Ų10765%0.64555%0.55SS**Hα-helixtrans-59.8-44.7176.6-74.9-170.8-179.400112.2A155 I156 S161 A162 I163A155-E159 PolarHBondContact O-N 3.29Å; I156-E159 PolarHBondContact O-N 2.71Å; E159-S161 VanDerWaalsContact C-N 3.33Å; E159-S161 PolarHBondContact O-N 2.89Å; E159-A162 PolarHBondContact O-N 2.94Å; E159-I163 WeakPolarHBondContact O-CG1 3.36Å; E159-I163 PolarHBondContact O-N 3.31Å
160L85.7Confident78.3Confident102 Ų102109.7 Ų109.753%0.53456%0.561SS.*Hα-helixtrans-63.2-39.2176.6-174.1140.5000111.6I156 E158 T164I156-L160 VanDerWaalsContact O-CB 3.3Å; I156-L160 WeakPolarHBondContact O-CB 3.36Å; I156-L160 PolarHBondContact O-N 3.21Å; E158-L160 PolarHBondContact O-N 2.91Å; L160-T164 WeakPolarHBondContact O-CB 3.34Å; L160-T164 PolarHBondContact O-N 3.49Å; L160-T164 PolarHBondContact O-OG1 3.06Å
161S85.4Confident77.1Confident67 Ų67107.5 Ų107.547%0.46956%0.561SS.*Hα-helixtrans-64.4-39.6175.879.70000112.1L157 E158 E159 T164 Q165L157-S161 VanDerWaalsContact O-CB 3.31Å; L157-S161 WeakPolarHBondContact O-CB 3.44Å; L157-S161 PolarHBondContact O-N 3.34Å; E158-S161 PolarHBondContact O-N 2.94Å; E158-S161 PolarHBondContact O-OG 3.46Å; E159-S161 VanDerWaalsContact C-N 3.33Å; E159-S161 PolarHBondContact O-N 2.89Å; S161-T164 PolarHBondContact O-N 3.09Å; S161-Q165 WeakPolarHBondContact O-CB 3.46Å; S161-Q165 PolarHBondContact O-N 3.29Å
162A84.9Confident75.8Confident48 Ų48108.6 Ų108.640%0.39757%0.566SS.*Hα-helixtrans-64.5-47.3177.200000111.6E158 E159 T164 Q165 E166E158-A162 PolarHBondContact O-N 3.41Å; E159-A162 PolarHBondContact O-N 2.94Å; A162-T164 VanDerWaalsContact C-N 3.33Å; A162-T164 PolarHBondContact O-N 3.36Å; A162-Q165 PolarHBondContact O-N 2.99Å; A162-E166 WeakPolarHBondContact O-CG 3.46Å; A162-E166 PolarHBondContact O-N 2.96Å
163I81.3Confident74.2Confident92 Ų92111.1 Ų111.147%0.47258%0.583SS.*Hα-helixtrans-62.6-41.3176.4-64.5169.5000110.8E159 Q165 E166 Q167E159-I163 WeakPolarHBondContact O-CG1 3.36Å; E159-I163 PolarHBondContact O-N 3.31Å; I163-Q165 VanDerWaalsContact C-N 3.35Å; I163-E166 PolarHBondContact O-N 3.43Å; I163-Q167 WeakPolarHBondContact O-CG 3.46Å; I163-Q167 PolarHBondContact O-N 2.66Å
164T81.1Confident73.1Confident66 Ų66111.1 Ų111.141%0.40559%0.593SS.*Hα-helixtrans-65.3-40.7177.7-520000110.6L160 S161 A162 Q167 I168L160-T164 WeakPolarHBondContact O-CB 3.34Å; L160-T164 PolarHBondContact O-N 3.49Å; L160-T164 PolarHBondContact O-OG1 3.06Å; S161-T164 PolarHBondContact O-N 3.09Å; A162-T164 VanDerWaalsContact C-N 3.33Å; A162-T164 PolarHBondContact O-N 3.36Å; T164-Q167 CarbonylContact O-C 3.6Å; T164-Q167 PolarHBondContact O-N 3.48Å; T164-I168 HydrophobicContact CG2-CD1 3.96Å; T164-I168 HydrophobicContact CG2-CG1 4.44Å; T164-I168 WeakPolarHBondContact O-CD1 3.22Å; T164-I168 WeakPolarHBondContact O-CG1 3.43Å; T164-I168 PolarHBondContact O-N 3.41Å
165Q75.8Confident71.7Confident138 Ų138112.2 Ų112.265%0.64561%0.608SS**Hα-helixtrans-65.4-37.9176.2-163.174.123.800112.1S161 A162 I163 I168S161-Q165 WeakPolarHBondContact O-CB 3.46Å; S161-Q165 PolarHBondContact O-N 3.29Å; A162-Q165 PolarHBondContact O-N 2.99Å; I163-Q165 VanDerWaalsContact C-N 3.35Å; Q165-I168 PolarHBondContact O-N 3.4Å
166E70Confident70.2Confident146 Ų146117.9 Ų117.968%0.68263%0.627SS**Hα-helixtrans-65.4-39.7172.6-75.3-180-179.500112A162 I163 I168 E169A162-E166 WeakPolarHBondContact O-CG 3.46Å; A162-E166 PolarHBondContact O-N 2.96Å; I163-E166 PolarHBondContact O-N 3.43Å; E166-I168 VanDerWaalsContact C-N 3.34Å; E166-E169 PolarHBondContact O-N 2.95Å
167Q60.6Low68.4Low144 Ų144120.1 Ų120.167%0.67365%0.646SS**Hα-helixtrans-76.7-16.8175-70.2-174.118.300113.8I163 T164 E169 L170I163-Q167 WeakPolarHBondContact O-CG 3.46Å; I163-Q167 PolarHBondContact O-N 2.66Å; T164-Q167 CarbonylContact O-C 3.6Å; T164-Q167 PolarHBondContact O-N 3.48Å; Q167-E169 CarbonylContact O-C 3.57Å; Q167-E169 PolarHBondContact O-N 3.06Å; Q167-L170 PolarHBondContact O-N 3.26Å
168I55.3Low66.8Low90 Ų90122.6 Ų122.646%0.46266%0.659SS.*THydrogen-bonded Turntrans-73.41170-68.9159.2000111.7T164 Q165 E166 L170T164-I168 HydrophobicContact CG2-CD1 3.96Å; T164-I168 HydrophobicContact CG2-CG1 4.44Å; T164-I168 WeakPolarHBondContact O-CD1 3.22Å; T164-I168 WeakPolarHBondContact O-CG1 3.43Å; T164-I168 PolarHBondContact O-N 3.41Å; Q165-I168 PolarHBondContact O-N 3.4Å; E166-I168 VanDerWaalsContact C-N 3.34Å; I168-L170 HydrophobicContact CG2-CD1 4.43Å; I168-L170 PolarHBondContact O-N 3.31Å
169E56.4Low65.4Low169 Ų169121.8 Ų121.879%0.7967%0.666SS**SBendtrans-64.964.6142.5-67.8-167171.600109.1E166 Q167 P171E166-E169 PolarHBondContact O-N 2.95Å; Q167-E169 CarbonylContact O-C 3.57Å; Q167-E169 PolarHBondContact O-N 3.06Å; E169-P171 WeakPolarHBondContact O-CD 3.43Å
170L51.2Low63.4Low132 Ų132124.2 Ų124.269%0.69168%0.677SS**  trans-50.2112.4169.4-83146.6000105.3Q167 I168 E172Q167-L170 PolarHBondContact O-N 3.26Å; I168-L170 HydrophobicContact CG2-CD1 4.43Å; I168-L170 PolarHBondContact O-N 3.31Å; L170-E172 PolarHBondContact O-N 2.98Å
171P56.6Low61.4Low111 Ų111128 Ų12872%0.72169%0.689SS**  trans-55.6133173.521.8-30.4000106.8E169 V173E169-P171 WeakPolarHBondContact O-CD 3.43Å; P171-V173 PolarHBondContact O-N 2.95Å
172E57.2Low59.5Low187 Ų187131.7 Ų131.787%0.87470%0.702SS**  trans-42.4112.7178.3-78.9-173.4152.200108.3L170 P174L170-E172 PolarHBondContact O-N 2.98Å; E172-P174 WeakPolarHBondContact O-CD 3.48Å
173V50.1Low57.8Low121 Ų121134.9 Ų134.973%0.73372%0.719SS**  trans-55.3116.4173.3178.20000105.1P171 S175P171-V173 PolarHBondContact O-N 2.95Å; V173-S175 PolarHBondContact O-N 3.49Å
174P62Low56.1Low109 Ų109139.8 Ų139.871%0.70874%0.74SS**  trans-55.5115.4178.6-26.836.6000108E172 E176E172-P174 WeakPolarHBondContact O-CD 3.48Å; P174-E176 PolarHBondContact O-N 2.95Å
175S56.2Low53.9Low122 Ų122143.2 Ų143.285%0.85376%0.756SS**  trans-7927.3-178.546.20000112V173V173-S175 PolarHBondContact O-N 3.49Å
176E54.7Low52.4Low167 Ų167143.1 Ų143.178%0.7876%0.764SS**PPolyproline II helixtrans-89.7125.6176.4-69.7-171.2174.100109.8P174 L178P174-E176 PolarHBondContact O-N 2.95Å; E176-L178 PolarHBondContact O-N 3.36Å
177P50Low51.3Low122 Ų122141 Ų14179%0.79276%0.763SS**PPolyproline II helixtrans-63.2123.6-175.224-31.4000110.2
178L53.1Low50.6Low162 Ų162141 Ų14185%0.84877%0.773SS**PPolyproline II helixtrans-50.7128.1174.2-77.9164.3000110.1E176 E180E176-L178 PolarHBondContact O-N 3.36Å; L178-E180 PolarHBondContact O-N 3.23Å
179P58.8Low50Low124 Ų124146 Ų14681%0.80579%0.791SS**PPolyproline II helixtrans-66.1119.5-179.122.8-30.2000111K181P179-K181 PolarHBondContact O-N 3.17Å
180E46.1Very low49.1Very low189 Ų189142.3 Ų142.388%0.88379%0.79SS**  trans-62.8111.3168.3-66.8179.3167.400110.4L178L178-E180 PolarHBondContact O-N 3.23Å
181K43.4Very low48.4Very low181 Ų181147.5 Ų147.579%0.78780%0.8SS**  trans-163.595.5144.7-120.6160.7-179.5-179.90112.6P179P179-K181 PolarHBondContact O-N 3.17Å
182I44.4Very low48.1Very low146 Ų146147.4 Ų147.475%0.74980%0.8SS**  94.4133.794.4-74.7174.7000111
183P49Very low47.4Very low115 Ų115150.2 Ų150.275%0.74780%0.802SS**  trans-97.1124.5-154.133.9-23.1000111.4N185P183-N185 PolarHBondContact O-N 2.67Å
184E45.3Very low46.8Very low195 Ų195153.5 Ų153.591%0.91181%0.81SS**  trans-99.584.9161.9-143.5168-162.900109.6V186E184-V186 PolarHBondContact O-N 2.89Å
185N36.7Very low45.9Very low137 Ų137152.3 Ų152.373%0.73381%0.809SS**  trans-51.4113.1164-17014.3000110.4P183P183-N185 PolarHBondContact O-N 2.67Å
186V43.1Very low45Very low136 Ų136154.3 Ų154.382%0.82481%0.805SS**  trans-157.3139.3137.2-99.70000112.7E184E184-V186 PolarHBondContact O-N 2.89Å
187P47.8Very low44.4Very low103 Ų103153.9 Ų153.967%0.66981%0.807SS**  trans-102.6138.7-16536.6-26000111.9
188V45.8Very low43.9Very low144 Ų144153.5 Ų153.587%0.87380%0.802SS**  trans-126.987.5155.7-171.80000109.2A190V188-A190 PolarHBondContact O-N 3.44Å
189K42.2Very low43.1Very low193 Ų193150.1 Ų150.184%0.83980%0.798SS**  trans17.2102.9143-76.1173.6174.2171.90115.6
190A36.6Very low42.3Very low93 Ų93148.6 Ų148.677%0.76980%0.796SS**  trans-35.6138.3138.100000111.9V188V188-A190 PolarHBondContact O-N 3.44Å
191R38.1Very low42.3Very low241 Ų241149 Ų14991%0.90982%0.82SS**  trans-169.6155.6137.5-102.5-178.1-172.5-155.40.1110.1
192P49.9Very low42.2Very low109 Ų109147.5 Ų147.571%0.70882%0.821SS**  -122.9169.3-124.636.1-19.5000111.6
193R42.2Very low42.1Very low245 Ų245147.5 Ų147.593%0.92583%0.825SS**  trans-159.879.2147-108.7165.1-171177.81.7108.9A195R193-A195 PolarHBondContact O-N 3.02Å
194Q37.2Very low41.7Very low191 Ų191149.3 Ų149.389%0.89383%0.829SS**  trans-69.2111.6136.3-76.5172.6-13.200106.2
195A42.9Very low41.5Very low84 Ų84146.6 Ų146.669%0.69483%0.825SS**  trans-135.491.7144.600000101.3R193R193-A195 PolarHBondContact O-N 3.02Å
196E38.7Very low41.8Very low164 Ų164147.3 Ų147.377%0.76683%0.83SS**  46142.685.2-72.8-161.4157.100112.9
197L41.5Very low41.7Very low157 Ų157148 Ų14882%0.82283%0.831SS**  trans96.4124.8169.9-49.7174.7000112.2
198V39.1Very low41.3Very low114 Ų114151.2 Ų151.269%0.69184%0.842SS**  cis-170.712316.1123.90000104.8
199A36.6Very low40.9Very low92 Ų92151.8 Ų151.876%0.7684%0.84SS**  47.9103.6103.700000114.3
200A41.9Very low40.8Very low92 Ų92148.3 Ų148.376%0.7684%0.84SS**  trans-155106.7149.900000110.3
201S45.1Very low41.2Very low198 Ų198153.4 Ų153.4100%1.38585%0.847SS**  trans740155.81.90000118.1

Retrieved 201 of 201 residues in 137.5 ms (Link to these results)