A0A087Y075_POEFO Loading...

DnaJ homolog subfamily B member 14

AlphaFold DB , UniProt , Accession A0A087Y075, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 375 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
1M59Low79.7Confident218 Ų21891.2 Ų91.2100%1.07446%0.455SS*.  029.50-65177.2-177.900111.2
2E59.3Low80.7Confident152 Ų15283.9 Ų83.971%0.7142%0.419SS*.  trans-84.1-33-165.3-69.9150.3149.500113.8N4 R5 D6E2-N4 PolarHBondContact O-N 2.76Å; E2-N4 VanDerWaalsContact O-N 3.08Å; E2-R5 WeakPolarHBondContact O-CA 3.16Å; E2-R5 VanDerWaalsContact O-CB 3.29Å; E2-R5 WeakPolarHBondContact O-CB 3.33Å; E2-R5 PolarHBondContact O-N 3.28Å; E2-D6 PolarHBondContact O-N 3.04Å; E2-D6 VanDerWaalsContact O-N 3.14Å
3G67.3Low81.7Confident49 Ų4983 Ų8351%0.50542%0.416SS..Hα-helixtrans-58.5-28.8-17700000115.6E7G3-E7 PolarHBondContact O-N 3.24Å
4N76.7Confident82.3Confident104 Ų10482.7 Ų82.756%0.55642%0.416SS*.Hα-helixtrans-74-28.1174.7-72.411.3000112.4E2 A8E2-N4 PolarHBondContact O-N 2.76Å; E2-N4 VanDerWaalsContact O-N 3.08Å; N4-A8 WeakPolarHBondContact O-CB 3.48Å; N4-A8 PolarHBondContact O-N 3.39Å
5R82.8Confident83Confident125 Ų12577.2 Ų77.247%0.47239%0.388SS..Hα-helixtrans-72.5-46.6175.3179.1-177.4170.1169.9-0.4110.4E2 E7 A8 E9 Y38E2-R5 WeakPolarHBondContact O-CA 3.16Å; E2-R5 VanDerWaalsContact O-CB 3.29Å; E2-R5 WeakPolarHBondContact O-CB 3.33Å; E2-R5 PolarHBondContact O-N 3.28Å; R5-E7 VanDerWaalsContact C-N 3.27Å; R5-E7 PolarHBondContact O-N 3.35Å; R5-A8 WeakPolarHBondContact O-CB 3.43Å; R5-A8 PolarHBondContact O-N 3.26Å; R5-A8 VanDerWaalsContact O-N 3.14Å; R5-E9 HydrophobicContact CG-CG 4.5Å; R5-E9 IonicContact CZ-OE1 3.97Å; R5-E9 IonicContact NE-OE1 2.73Å; R5-E9 PolarHBondContact NE-OE1 3.09Å; R5-E9 IonicContact NH2-OE1 3.01Å; R5-E9 PolarHBondContact NH2-OE1 3.06Å; R5-E9 WeakPolarHBondContact O-CG 3.21Å; R5-E9 PolarHBondContact O-N 3.44Å; R5-Y38 HydrophobicContact CB-CD1 4.14Å; R5-Y38 HydrophobicContact CB-CE1 4.45Å; R5-Y38 HydrophobicContact CB-CG 4.29Å; R5-Y38 HydrophobicContact CG-CD1 4.05Å; R5-Y38 HydrophobicContact CG-CE1 4.19Å
6D84.2Confident83.5Confident85 Ų8574 Ų7446%0.45537%0.374SS..Hα-helixtrans-59-40.1178.4-59.5-23.7000111.8E2 E9 K10E2-D6 PolarHBondContact O-N 3.04Å; E2-D6 VanDerWaalsContact O-N 3.14Å; D6-E9 PolarHBondContact O-N 3.21Å; D6-K10 WeakPolarHBondContact O-CG 3.48Å; D6-K10 PolarHBondContact O-N 3.15Å
7E85.4Confident84Confident85 Ų8578.4 Ų78.440%0.39739%0.39SS..Hα-helixtrans-73-32.3179-155.461.8-156.700112.5G3 R5 K10 C11G3-E7 PolarHBondContact O-N 3.24Å; R5-E7 VanDerWaalsContact C-N 3.27Å; R5-E7 PolarHBondContact O-N 3.35Å; E7-K10 WeakPolarHBondContact OE2-CD 3.49Å; E7-K10 WeakPolarHBondContact OE2-CE 3.17Å; E7-K10 IonicContact OE2-NZ 3.91Å; E7-K10 PolarHBondContact OE2-NZ 2.97Å; E7-C11 PolarHBondContact O-N 3.3Å; E7-C11 VanDerWaalsContact O-N 3.13Å; E7-C11 PolarHBondContact O-SG 3.09Å
8A89.3Confident84.3Confident0 Ų074.4 Ų74.40%037%0.372CS..Hα-helixtrans-66.9-42.8169.700000111.6N4 R5 K10 C11 I12 A34 L37N4-A8 WeakPolarHBondContact O-CB 3.48Å; N4-A8 PolarHBondContact O-N 3.39Å; R5-A8 WeakPolarHBondContact O-CB 3.43Å; R5-A8 PolarHBondContact O-N 3.26Å; R5-A8 VanDerWaalsContact O-N 3.14Å; A8-K10 PolarHBondContact O-N 3.3Å; A8-C11 WeakPolarHBondContact O-CB 3.3Å; A8-C11 PolarHBondContact O-N 3.15Å; A8-C11 VanDerWaalsContact O-N 3.14Å; A8-I12 WeakPolarHBondContact O-CG1 3.4Å; A8-I12 PolarHBondContact O-N 2.62Å; A8-A34 HydrophobicContact CB-CB 4.33Å; A8-L37 HydrophobicContact CB-CB 4.3Å
9E89.9Confident84.5Confident71 Ų7172.9 Ų72.933%0.33237%0.365SS..Hα-helixtrans-63.8-38.2176.9-71.4-174.3-160.400112.1R5 D6 I12 N13R5-E9 HydrophobicContact CG-CG 4.5Å; R5-E9 IonicContact CZ-OE1 3.97Å; R5-E9 IonicContact NE-OE1 2.73Å; R5-E9 PolarHBondContact NE-OE1 3.09Å; R5-E9 IonicContact NH2-OE1 3.01Å; R5-E9 PolarHBondContact NH2-OE1 3.06Å; R5-E9 WeakPolarHBondContact O-CG 3.21Å; R5-E9 PolarHBondContact O-N 3.44Å; D6-E9 PolarHBondContact O-N 3.21Å; E9-I12 PolarHBondContact O-N 2.64Å; E9-N13 PolarHBondContact O-N 2.86Å; E9-N13 PolarHBondContact O-ND2 2.82Å
10K91.2Very high84.6Confident109 Ų10977.3 Ų77.347%0.47438%0.384SS..Hα-helixtrans-60-45169.1-70.4172.2-152.1161.80112.3D6 E7 A8 I12 N13 I14D6-K10 WeakPolarHBondContact O-CG 3.48Å; D6-K10 PolarHBondContact O-N 3.15Å; E7-K10 WeakPolarHBondContact OE2-CD 3.49Å; E7-K10 WeakPolarHBondContact OE2-CE 3.17Å; E7-K10 IonicContact OE2-NZ 3.91Å; E7-K10 PolarHBondContact OE2-NZ 2.97Å; A8-K10 PolarHBondContact O-N 3.3Å; K10-I12 VanDerWaalsContact C-N 3.32Å; K10-I12 PolarHBondContact O-N 3.29Å; K10-N13 PolarHBondContact O-N 2.82Å; K10-I14 WeakPolarHBondContact O-CG1 2.96Å; K10-I14 PolarHBondContact O-N 3.29Å
11C91.9Very high84.7Confident5 Ų577.5 Ų77.53%0.03440%0.397CS..Hα-helixtrans-61.5-39.5177.7-69.80000111.9E7 A8 I14 A15 A34E7-C11 PolarHBondContact O-N 3.3Å; E7-C11 VanDerWaalsContact O-N 3.13Å; E7-C11 PolarHBondContact O-SG 3.09Å; A8-C11 WeakPolarHBondContact O-CB 3.3Å; A8-C11 PolarHBondContact O-N 3.15Å; A8-C11 VanDerWaalsContact O-N 3.14Å; C11-I14 PolarHBondContact O-N 3.33Å; C11-A15 PolarHBondContact O-N 3.07Å; C11-A34 HydrophobicContact CB-CB 3.82Å
12I91.9Very high85.9Confident4 Ų469.8 Ų69.82%0.02137%0.374CS..Hα-helixtrans-63.3-45.2175-65162.9000110.9A8 E9 K10 I14 A15 T16 L31 A34 T40 R42 A43 L46A8-I12 WeakPolarHBondContact O-CG1 3.4Å; A8-I12 PolarHBondContact O-N 2.62Å; E9-I12 PolarHBondContact O-N 2.64Å; K10-I12 VanDerWaalsContact C-N 3.32Å; K10-I12 PolarHBondContact O-N 3.29Å; I12-I14 VanDerWaalsContact C-N 3.32Å; I12-I14 PolarHBondContact O-N 3.16Å; I12-A15 WeakPolarHBondContact O-CB 3.48Å; I12-A15 PolarHBondContact O-N 3.41Å; I12-A15 VanDerWaalsContact O-N 3.12Å; I12-T16 PolarHBondContact O-N 2.81Å; I12-L31 HydrophobicContact CG1-CD2 4.44Å; I12-A34 HydrophobicContact CD1-CB 4.33Å; I12-A34 HydrophobicContact CG1-CB 3.73Å; I12-T40 VanDerWaalsContact CD1-OG1 3.25Å; I12-T40 WeakPolarHBondContact CD1-OG1 3.42Å; I12-R42 HydrophobicContact CG2-CG 4.19Å; I12-A43 HydrophobicContact CD1-CB 3.94Å; I12-A43 HydrophobicContact CG1-CB 4.05Å; I12-L46 HydrophobicContact CG2-CD1 4.05Å
13N92.8Very high87.2Confident72 Ų7265.9 Ų65.939%0.38536%0.358SS..Hα-helixtrans-67.5-29.4179.4-68.8-33.6000113.3E9 K10 T16 K17E9-N13 PolarHBondContact O-N 2.86Å; E9-N13 PolarHBondContact O-ND2 2.82Å; K10-N13 PolarHBondContact O-N 2.82Å; N13-T16 PolarHBondContact O-OG1 3.48Å; N13-T16 VanDerWaalsContact O-OG1 3.12Å; N13-K17 WeakPolarHBondContact O-CG 3.4Å; N13-K17 PolarHBondContact O-N 2.93Å
14I91.3Very high88.1Confident79 Ų7968.4 Ų68.441%0.40536%0.355SS..Hα-helixtrans-70.2-40.6170.5-68.1165.7000110.1K10 C11 I12 K17 A18 F30K10-I14 WeakPolarHBondContact O-CG1 2.96Å; K10-I14 PolarHBondContact O-N 3.29Å; C11-I14 PolarHBondContact O-N 3.33Å; I12-I14 VanDerWaalsContact C-N 3.32Å; I12-I14 PolarHBondContact O-N 3.16Å; I14-K17 PolarHBondContact O-N 3.45Å; I14-A18 PolarHBondContact O-N 3.27Å; I14-F30 HydrophobicContact CG2-CD1 4.18Å; I14-F30 HydrophobicContact CG2-CD2 3.76Å; I14-F30 HydrophobicContact CG2-CE1 4.24Å; I14-F30 HydrophobicContact CG2-CE2 3.85Å; I14-F30 HydrophobicContact CG2-CG 3.95Å; I14-F30 HydrophobicContact CG2-CZ 4.1Å
15A91.8Very high88.5Confident0 Ų068.8 Ų68.80%036%0.357CS..Hα-helixtrans-65.4-42.6177.400000112.9C11 I12 K17 A18 L19 A27 F30 L31C11-A15 PolarHBondContact O-N 3.07Å; I12-A15 WeakPolarHBondContact O-CB 3.48Å; I12-A15 PolarHBondContact O-N 3.41Å; I12-A15 VanDerWaalsContact O-N 3.12Å; A15-K17 VanDerWaalsContact C-N 3.33Å; A15-K17 PolarHBondContact O-N 3.1Å; A15-A18 WeakPolarHBondContact O-CB 3.14Å; A15-A18 PolarHBondContact O-N 3.06Å; A15-A18 VanDerWaalsContact O-N 3.11Å; A15-L19 WeakPolarHBondContact O-CG 3.12Å; A15-L19 PolarHBondContact O-N 3.36Å; A15-A27 HydrophobicContact CB-CB 4.25Å; A15-A27 WeakPolarHBondContact O-CB 3.38Å; A15-F30 HydrophobicContact CB-CB 3.98Å; A15-L31 HydrophobicContact CB-CD1 4.29Å; A15-L31 HydrophobicContact CB-CD2 3.78Å; A15-L31 HydrophobicContact CB-CG 3.58Å
16T91Very high88.8Confident26 Ų2667.7 Ų67.716%0.1636%0.356CS..Hα-helixtrans-61.9-41.2177.554.10000111.8I12 N13 A18 L19 E20 L46I12-T16 PolarHBondContact O-N 2.81Å; N13-T16 PolarHBondContact O-OG1 3.48Å; N13-T16 VanDerWaalsContact O-OG1 3.12Å; T16-A18 VanDerWaalsContact C-N 3.31Å; T16-A18 PolarHBondContact O-N 3.38Å; T16-L19 WeakPolarHBondContact O-CB 3.48Å; T16-L19 PolarHBondContact O-N 3.47Å; T16-L19 VanDerWaalsContact O-N 3.13Å; T16-E20 WeakPolarHBondContact O-CG 2.87Å; T16-E20 PolarHBondContact O-N 2.78Å; T16-L46 HydrophobicContact CG2-CD1 3.68Å
17K92.4Very high89.1Confident148 Ų14863.7 Ų63.764%0.64333%0.334SS*.Hα-helixtrans-63.4-35173.4-71.9-178.1177.8-172.90113.1N13 I14 A15 L19 A21N13-K17 WeakPolarHBondContact O-CG 3.4Å; N13-K17 PolarHBondContact O-N 2.93Å; I14-K17 PolarHBondContact O-N 3.45Å; A15-K17 VanDerWaalsContact C-N 3.33Å; A15-K17 PolarHBondContact O-N 3.1Å; K17-L19 VanDerWaalsContact C-N 3.34Å; K17-A21 WeakPolarHBondContact O-CB 3.45Å; K17-A21 PolarHBondContact O-N 2.68Å; K17-A21 VanDerWaalsContact O-N 3.07Å
18A89.8Confident89.2Confident8 Ų862.1 Ų62.17%0.06633%0.328CS..Hα-helixtrans-67.4-35.3173.500000111.9I14 A15 T16 A21 G22 D23 K26 A27I14-A18 PolarHBondContact O-N 3.27Å; A15-A18 WeakPolarHBondContact O-CB 3.14Å; A15-A18 PolarHBondContact O-N 3.06Å; A15-A18 VanDerWaalsContact O-N 3.11Å; T16-A18 VanDerWaalsContact C-N 3.31Å; T16-A18 PolarHBondContact O-N 3.38Å; A18-A21 CarbonylContact O-C 3.58Å; A18-A21 PolarHBondContact O-N 2.93Å; A18-G22 PolarHBondContact O-N 3.05Å; A18-G22 VanDerWaalsContact O-N 3.16Å; A18-D23 PolarHBondContact O-N 3.04Å; A18-K26 HydrophobicContact CB-CB 4.24Å; A18-K26 HydrophobicContact CB-CD 4.46Å; A18-K26 HydrophobicContact CB-CG 4.27Å; A18-A27 HydrophobicContact CB-CB 4.04Å
19L87.7Confident89.3Confident46 Ų4669.4 Ų69.424%0.24136%0.36CS..Hα-helixtrans-68.2-41.1173.2-65-176.3000113.3A15 T16 K17 A21 G22 A27 L46 L50A15-L19 WeakPolarHBondContact O-CG 3.12Å; A15-L19 PolarHBondContact O-N 3.36Å; T16-L19 WeakPolarHBondContact O-CB 3.48Å; T16-L19 PolarHBondContact O-N 3.47Å; T16-L19 VanDerWaalsContact O-N 3.13Å; K17-L19 VanDerWaalsContact C-N 3.34Å; L19-A21 PolarHBondContact O-N 3.44Å; L19-G22 PolarHBondContact O-N 3.47Å; L19-A27 HydrophobicContact CD1-CB 4.41Å; L19-A27 HydrophobicContact CD2-CB 3.23Å; L19-A27 HydrophobicContact CG-CB 3.53Å; L19-L46 HydrophobicContact CD1-CD2 4.39Å; L19-L50 HydrophobicContact CD1-CD1 4.15Å; L19-L50 HydrophobicContact CD1-CD2 4.23Å; L19-L50 HydrophobicContact CD1-CG 4.4Å; L19-L50 HydrophobicContact CD2-CD1 3.91Å; L19-L50 HydrophobicContact CD2-CD2 3.34Å; L19-L50 HydrophobicContact CD2-CG 4.16Å; L19-L50 HydrophobicContact CG-CD2 4.42Å
20E86.5Confident89.4Confident160 Ų16068.8 Ų68.875%0.74836%0.356SS*.Hα-helixtrans-59.9-35.6172.3-70.7162.7-171.700111.4T16 G22T16-E20 WeakPolarHBondContact O-CG 2.87Å; T16-E20 PolarHBondContact O-N 2.78Å; E20-G22 VanDerWaalsContact C-N 3.27Å; E20-G22 PolarHBondContact O-N 2.92Å
21A86.5Confident89.4Confident81 Ų8163.6 Ų63.667%0.66933%0.334SS*.THydrogen-bonded Turntrans-79.60.1172.900000114.6K17 A18 L19 D23K17-A21 WeakPolarHBondContact O-CB 3.45Å; K17-A21 PolarHBondContact O-N 2.68Å; K17-A21 VanDerWaalsContact O-N 3.07Å; A18-A21 CarbonylContact O-C 3.58Å; A18-A21 PolarHBondContact O-N 2.93Å; L19-A21 PolarHBondContact O-N 3.44Å; A21-D23 VanDerWaalsContact C-N 3.27Å; A21-D23 PolarHBondContact O-N 3.45Å
22G83.6Confident89.3Confident56 Ų5666.9 Ų66.958%0.57735%0.351SS*.THydrogen-bonded Turntrans77.6-0.7-178.900000116A18 L19 E20 K24A18-G22 PolarHBondContact O-N 3.05Å; A18-G22 VanDerWaalsContact O-N 3.16Å; L19-G22 PolarHBondContact O-N 3.47Å; E20-G22 VanDerWaalsContact C-N 3.27Å; E20-G22 PolarHBondContact O-N 2.92Å; G22-K24 PolarHBondContact O-N 3.49Å
23D86.8Confident89.2Confident70 Ų7072 Ų7237%0.37437%0.373SS..  trans-84.476.9-176.7-172.4-6.2000111.3A18 A21 D25 K26 A27A18-D23 PolarHBondContact O-N 3.04Å; A21-D23 VanDerWaalsContact C-N 3.27Å; A21-D23 PolarHBondContact O-N 3.45Å; D23-D25 VanDerWaalsContact C-N 3.34Å; D23-D25 PolarHBondContact O-N 2.88Å; D23-K26 HydrophobicContact CB-CB 4.3Å; D23-K26 PolarHBondContact O-N 3.35Å; D23-K26 VanDerWaalsContact OD1-CB 3.31Å; D23-K26 WeakPolarHBondContact OD1-CB 3.29Å; D23-K26 PolarHBondContact OD1-N 3.26Å; D23-K26 VanDerWaalsContact OD2-CB 3.26Å; D23-K26 WeakPolarHBondContact OD2-CB 3.44Å; D23-K26 VanDerWaalsContact OD2-CD 3.22Å; D23-K26 WeakPolarHBondContact OD2-CD 3.47Å; D23-A27 PolarHBondContact O-N 2.99Å
24K87.1Confident89.2Confident102 Ų10268.5 Ų68.544%0.44336%0.355SS..Hα-helixtrans-59.1-40.2-176.8-65.4-176.2-179.6179.60112.8G22 A27 L28 L50 N53G22-K24 PolarHBondContact O-N 3.49Å; K24-A27 PolarHBondContact O-N 3.44Å; K24-L28 WeakPolarHBondContact O-CG 3.46Å; K24-L28 PolarHBondContact O-N 3.27Å; K24-L50 HydrophobicContact CB-CD2 4.41Å; K24-L50 HydrophobicContact CD-CD2 4.45Å; K24-L50 HydrophobicContact CG-CD2 4.12Å; K24-N53 PolarHBondContact NZ-O 2.88Å
25D84.7Confident89Confident113 Ų11367.6 Ų67.660%0.60435%0.349SS*.Hα-helixtrans-68.5-38.7-175.7-68.4-28.2000112D23 K29D23-D25 VanDerWaalsContact C-N 3.34Å; D23-D25 PolarHBondContact O-N 2.88Å; D25-K29 WeakPolarHBondContact O-CG 3.48Å; D25-K29 PolarHBondContact O-N 3.16Å
26K88.5Confident88.9Confident102 Ų10276.3 Ų76.344%0.44339%0.386SS..Hα-helixtrans-66.3-43.4173.7-170.3171.4-175.8173.90111.2A18 D23 K29 F30A18-K26 HydrophobicContact CB-CB 4.24Å; A18-K26 HydrophobicContact CB-CD 4.46Å; A18-K26 HydrophobicContact CB-CG 4.27Å; D23-K26 HydrophobicContact CB-CB 4.3Å; D23-K26 PolarHBondContact O-N 3.35Å; D23-K26 VanDerWaalsContact OD1-CB 3.31Å; D23-K26 WeakPolarHBondContact OD1-CB 3.29Å; D23-K26 PolarHBondContact OD1-N 3.26Å; D23-K26 VanDerWaalsContact OD2-CB 3.26Å; D23-K26 WeakPolarHBondContact OD2-CB 3.44Å; D23-K26 VanDerWaalsContact OD2-CD 3.22Å; D23-K26 WeakPolarHBondContact OD2-CD 3.47Å; K26-K29 PolarHBondContact O-N 2.94Å; K26-F30 HydrophobicContact CG-CD2 4.03Å; K26-F30 HydrophobicContact CG-CE2 3.89Å; K26-F30 VanDerWaalsContact O-CD2 3.29Å; K26-F30 WeakPolarHBondContact O-CD2 3.4Å; K26-F30 PolarHBondContact O-N 3.39Å
27A90.4Very high88.7Confident0 Ų078.1 Ų78.10%040%0.395CS..Hα-helixtrans-59.7-47.2175.400000112.6A15 A18 L19 D23 K24 K29 F30 L31 L50A15-A27 HydrophobicContact CB-CB 4.25Å; A15-A27 WeakPolarHBondContact O-CB 3.38Å; A18-A27 HydrophobicContact CB-CB 4.04Å; L19-A27 HydrophobicContact CD1-CB 4.41Å; L19-A27 HydrophobicContact CD2-CB 3.23Å; L19-A27 HydrophobicContact CG-CB 3.53Å; D23-A27 PolarHBondContact O-N 2.99Å; K24-A27 PolarHBondContact O-N 3.44Å; A27-K29 VanDerWaalsContact C-N 3.32Å; A27-K29 PolarHBondContact O-N 3.4Å; A27-F30 PolarHBondContact O-N 2.92Å; A27-L31 WeakPolarHBondContact O-CG 3.49Å; A27-L31 PolarHBondContact O-N 3.38Å; A27-L50 HydrophobicContact CB-CD1 4.39Å
28L89.2Confident88.4Confident52 Ų5276 Ų7627%0.27238%0.383SS..Hα-helixtrans-55.9-44176.5-75.5174.1000112K24 L31 N32 L47 L50K24-L28 WeakPolarHBondContact O-CG 3.46Å; K24-L28 PolarHBondContact O-N 3.27Å; L28-L31 PolarHBondContact O-N 2.68Å; L28-N32 WeakPolarHBondContact O-CB 3.43Å; L28-N32 PolarHBondContact O-N 3.12Å; L28-N32 PolarHBondContact O-ND2 2.89Å; L28-L47 HydrophobicContact CD2-CD2 3.74Å; L28-L50 HydrophobicContact CD2-CB 3.84Å; L28-L50 HydrophobicContact CD2-CD1 3.67Å; L28-L50 HydrophobicContact CD2-CG 4.4Å; L28-L50 HydrophobicContact CG-CD1 4.04Å
29K89.7Confident88.2Confident153 Ų15379.4 Ų79.467%0.66541%0.405SS*.Hα-helixtrans-61.3-45.2177.9-72.9169.4-177172.70112.4D25 K26 A27 K33D25-K29 WeakPolarHBondContact O-CG 3.48Å; D25-K29 PolarHBondContact O-N 3.16Å; K26-K29 PolarHBondContact O-N 2.94Å; A27-K29 VanDerWaalsContact C-N 3.32Å; A27-K29 PolarHBondContact O-N 3.4Å; K29-K33 PolarHBondContact O-N 3.13Å; K29-K33 VanDerWaalsContact O-N 3.12Å
30F92.3Very high88.2Confident58 Ų5878.3 Ų78.325%0.25440%0.4SS..Hα-helixtrans-72.9-34.5-179.7-78.6-72.5000113.3I14 A15 K26 A27 K33 A34I14-F30 HydrophobicContact CG2-CD1 4.18Å; I14-F30 HydrophobicContact CG2-CD2 3.76Å; I14-F30 HydrophobicContact CG2-CE1 4.24Å; I14-F30 HydrophobicContact CG2-CE2 3.85Å; I14-F30 HydrophobicContact CG2-CG 3.95Å; I14-F30 HydrophobicContact CG2-CZ 4.1Å; A15-F30 HydrophobicContact CB-CB 3.98Å; K26-F30 HydrophobicContact CG-CD2 4.03Å; K26-F30 HydrophobicContact CG-CE2 3.89Å; K26-F30 VanDerWaalsContact O-CD2 3.29Å; K26-F30 WeakPolarHBondContact O-CD2 3.4Å; K26-F30 PolarHBondContact O-N 3.39Å; A27-F30 PolarHBondContact O-N 2.92Å; F30-K33 PolarHBondContact O-N 3.4Å; F30-A34 PolarHBondContact O-N 2.87Å
31L91.5Very high88.2Confident0 Ų077.1 Ų77.10%040%0.399CS..Hα-helixtrans-66.8-45.5174.4-69.3167.6000112.2I12 A15 A27 L28 K33 A34 E35 A43 L46 L47 L50I12-L31 HydrophobicContact CG1-CD2 4.44Å; A15-L31 HydrophobicContact CB-CD1 4.29Å; A15-L31 HydrophobicContact CB-CD2 3.78Å; A15-L31 HydrophobicContact CB-CG 3.58Å; A27-L31 WeakPolarHBondContact O-CG 3.49Å; A27-L31 PolarHBondContact O-N 3.38Å; L28-L31 PolarHBondContact O-N 2.68Å; L31-K33 PolarHBondContact O-N 2.9Å; L31-A34 WeakPolarHBondContact O-CB 3.49Å; L31-A34 PolarHBondContact O-N 2.92Å; L31-A34 VanDerWaalsContact O-N 3.12Å; L31-E35 PolarHBondContact O-N 3.04Å; L31-A43 HydrophobicContact CD2-CB 4.43Å; L31-L46 HydrophobicContact CD1-CB 3.69Å; L31-L46 HydrophobicContact CD2-CB 3.9Å; L31-L46 HydrophobicContact CD2-CD1 3.89Å; L31-L46 HydrophobicContact CG-CB 4.47Å; L31-L47 HydrophobicContact CB-CD1 4.26Å; L31-L47 HydrophobicContact CB-CD2 3.49Å; L31-L47 VanDerWaalsContact CB-CD2 3.49Å; L31-L47 HydrophobicContact CB-CG 3.72Å; L31-L47 HydrophobicContact CD1-CD2 3.97Å; L31-L47 HydrophobicContact CD1-CG 4.17Å; L31-L47 HydrophobicContact CG-CD2 4.37Å; L31-L50 HydrophobicContact CD1-CD1 3.76Å
32N89.8Confident88.2Confident74 Ų7480 Ų8040%0.39639%0.392SS..Hα-helixtrans-60.5-33.5173.5-83.2-81.6000112.2L28 K36L28-N32 WeakPolarHBondContact O-CB 3.43Å; L28-N32 PolarHBondContact O-N 3.12Å; L28-N32 PolarHBondContact O-ND2 2.89Å; N32-K36 WeakPolarHBondContact O-CG 3.25Å; N32-K36 PolarHBondContact O-N 2.89Å
33K90.9Very high88.3Confident111 Ų11177.3 Ų77.348%0.48337%0.365SS..Hα-helixtrans-69.8-42.4173.5-169.6-177.9179.3-171.10111.7K29 F30 L31 K36 L37K29-K33 PolarHBondContact O-N 3.13Å; K29-K33 VanDerWaalsContact O-N 3.12Å; F30-K33 PolarHBondContact O-N 3.4Å; L31-K33 PolarHBondContact O-N 2.9Å; K33-K36 PolarHBondContact O-N 3.39Å; K33-L37 HydrophobicContact CG-CD1 4.15Å; K33-L37 WeakPolarHBondContact O-CG 3.33Å; K33-L37 PolarHBondContact O-N 3.4Å; K33-L37 VanDerWaalsContact O-N 3.15Å
34A91.3Very high88.4Confident0 Ų078.3 Ų78.30%037%0.366CS..Hα-helixtrans-60-47.7176.500000111.5A8 C11 I12 F30 L31 K36 L37 Y38 A43A8-A34 HydrophobicContact CB-CB 4.33Å; C11-A34 HydrophobicContact CB-CB 3.82Å; I12-A34 HydrophobicContact CD1-CB 4.33Å; I12-A34 HydrophobicContact CG1-CB 3.73Å; F30-A34 PolarHBondContact O-N 2.87Å; L31-A34 WeakPolarHBondContact O-CB 3.49Å; L31-A34 PolarHBondContact O-N 2.92Å; L31-A34 VanDerWaalsContact O-N 3.12Å; A34-K36 VanDerWaalsContact C-N 3.33Å; A34-K36 PolarHBondContact O-N 3.29Å; A34-L37 PolarHBondContact O-N 3.12Å; A34-L37 VanDerWaalsContact O-N 3.1Å; A34-Y38 CarbonylContact O-C 3.5Å; A34-Y38 PolarHBondContact O-N 2.97Å; A34-Y38 VanDerWaalsContact O-O 3.12Å; A34-A43 HydrophobicContact CB-CB 4.43Å
35E88.3Confident88.5Confident60 Ų6076.5 Ų76.528%0.2837%0.37SS..Hα-helixtrans-61-39.1179.3-176.1171.6-152.100112.8L31 L37 P39 K44L31-E35 PolarHBondContact O-N 3.04Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.43Å; E35-P39 WeakPolarHBondContact O-CD 3.44Å; E35-P39 WeakPolarHBondContact O-CG 3.29Å; E35-K44 WeakPolarHBondContact OE1-CE 3.29Å
36K88.5Confident88.5Confident183 Ų18372.9 Ų72.980%0.79635%0.35SS*.Hα-helixtrans-68.3-27.6175-74.1178.9-179-176.30114N32 K33 A34N32-K36 WeakPolarHBondContact O-CG 3.25Å; N32-K36 PolarHBondContact O-N 2.89Å; K33-K36 PolarHBondContact O-N 3.39Å; A34-K36 VanDerWaalsContact C-N 3.33Å; A34-K36 PolarHBondContact O-N 3.29Å
37L86.8Confident88.5Confident64 Ų6468.9 Ų68.934%0.33533%0.334SS..Hα-helixtrans-83.8-46.7179.4-72.6170.6000111.8A8 K33 A34 E35A8-L37 HydrophobicContact CB-CB 4.3Å; K33-L37 HydrophobicContact CG-CD1 4.15Å; K33-L37 WeakPolarHBondContact O-CG 3.33Å; K33-L37 PolarHBondContact O-N 3.4Å; K33-L37 VanDerWaalsContact O-N 3.15Å; A34-L37 PolarHBondContact O-N 3.12Å; A34-L37 VanDerWaalsContact O-N 3.1Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.43Å
38Y86.4Confident88.2Confident103 Ų10372.7 Ų72.740%0.40435%0.354SS..SBendtrans-156.6110.2174.4-168.7-101.1000109.5R5 A34 T40R5-Y38 HydrophobicContact CB-CD1 4.14Å; R5-Y38 HydrophobicContact CB-CE1 4.45Å; R5-Y38 HydrophobicContact CB-CG 4.29Å; R5-Y38 HydrophobicContact CG-CD1 4.05Å; R5-Y38 HydrophobicContact CG-CE1 4.19Å; A34-Y38 CarbonylContact O-C 3.5Å; A34-Y38 PolarHBondContact O-N 2.97Å; A34-Y38 VanDerWaalsContact O-O 3.12Å; Y38-T40 HydrophobicContact CD1-CG2 3.71Å; Y38-T40 HydrophobicContact CE1-CG2 4.18Å; Y38-T40 PolarHBondContact O-N 2.88Å
39P86.3Confident88Confident79 Ų7972.3 Ų72.351%0.51336%0.356SS..  trans-60.1121.3179.3-24.333.5000111.5E35E35-P39 WeakPolarHBondContact O-CD 3.44Å; E35-P39 WeakPolarHBondContact O-CG 3.29Å
40T87.4Confident87.5Confident23 Ų2365.8 Ų65.814%0.14133%0.328CS..  trans-128.7145.6175.458.60000110.5I12 Y38 R42 A43 K44I12-T40 VanDerWaalsContact CD1-OG1 3.25Å; I12-T40 WeakPolarHBondContact CD1-OG1 3.42Å; Y38-T40 HydrophobicContact CD1-CG2 3.71Å; Y38-T40 HydrophobicContact CE1-CG2 4.18Å; Y38-T40 PolarHBondContact O-N 2.88Å; T40-R42 PolarHBondContact O-N 2.87Å; T40-A43 PolarHBondContact O-N 3.13Å; T40-A43 VanDerWaalsContact O-N 3.13Å; T40-A43 WeakPolarHBondContact OG1-CB 3.48Å; T40-A43 PolarHBondContact OG1-N 3.37Å; T40-K44 PolarHBondContact O-N 3Å
41D86.7Confident86.9Confident135 Ų13567.3 Ų67.372%0.72234%0.342SS*.Hα-helixtrans-63.2-31.5-179.7-53.1-45.1000111.8K44 A45D41-K44 PolarHBondContact O-N 3.11Å; D41-A45 WeakPolarHBondContact O-CB 3.37Å; D41-A45 PolarHBondContact O-N 3.28Å
42R86.3Confident86.1Confident141 Ų14175.8 Ų75.853%0.53237%0.374SS..Hα-helixtrans-65.3-37.9175.4-170.2175.5176.3-159.4-6.5112.8I12 T40 L46I12-R42 HydrophobicContact CG2-CG 4.19Å; T40-R42 PolarHBondContact O-N 2.87Å; R42-L46 WeakPolarHBondContact O-CD1 3.48Å; R42-L46 WeakPolarHBondContact O-CG 3.42Å; R42-L46 PolarHBondContact O-N 3.12Å
43A85.6Confident84.7Confident0 Ų077.7 Ų77.70%038%0.384CS..Hα-helixtrans-67.6-44.6175.400000111.3I12 L31 A34 T40 L46 L47I12-A43 HydrophobicContact CD1-CB 3.94Å; I12-A43 HydrophobicContact CG1-CB 4.05Å; L31-A43 HydrophobicContact CD2-CB 4.43Å; A34-A43 HydrophobicContact CB-CB 4.43Å; T40-A43 PolarHBondContact O-N 3.13Å; T40-A43 VanDerWaalsContact O-N 3.13Å; T40-A43 WeakPolarHBondContact OG1-CB 3.48Å; T40-A43 PolarHBondContact OG1-N 3.37Å; A43-L46 PolarHBondContact O-N 2.78Å; A43-L47 PolarHBondContact O-N 2.95Å; A43-L47 VanDerWaalsContact O-N 3.08Å
44K88.9Confident83.2Confident92 Ų9275.1 Ų75.140%0.439%0.389SS..Hα-helixtrans-62.9-48.1179.3-70.8177173.1176.90112.5E35 T40 D41 L46 L47 D48E35-K44 WeakPolarHBondContact OE1-CE 3.29Å; T40-K44 PolarHBondContact O-N 3Å; D41-K44 PolarHBondContact O-N 3.11Å; K44-L46 PolarHBondContact O-N 3.03Å; K44-L47 PolarHBondContact O-N 3.22Å; K44-L47 VanDerWaalsContact O-N 3.16Å; K44-D48 WeakPolarHBondContact O-CB 3.39Å; K44-D48 PolarHBondContact O-N 3.42Å
45A88.6Confident81.3Confident64 Ų6480.1 Ų80.153%0.52943%0.425SS..Hα-helixtrans-58.6-35.9178.400000112.9D41 S49D41-A45 WeakPolarHBondContact O-CB 3.37Å; D41-A45 PolarHBondContact O-N 3.28Å; A45-S49 PolarHBondContact O-N 3.44Å; A45-S49 VanDerWaalsContact O-N 3.13Å
46L85.8Confident78.9Confident36 Ų3682.9 Ų82.919%0.18845%0.45CS..Hα-helixtrans-72.2-41.5175.9-70.2170.9000112.4I12 T16 L19 L31 R42 A43 K44 D48 S49 L50I12-L46 HydrophobicContact CG2-CD1 4.05Å; T16-L46 HydrophobicContact CG2-CD1 3.68Å; L19-L46 HydrophobicContact CD1-CD2 4.39Å; L31-L46 HydrophobicContact CD1-CB 3.69Å; L31-L46 HydrophobicContact CD2-CB 3.9Å; L31-L46 HydrophobicContact CD2-CD1 3.89Å; L31-L46 HydrophobicContact CG-CB 4.47Å; R42-L46 WeakPolarHBondContact O-CD1 3.48Å; R42-L46 WeakPolarHBondContact O-CG 3.42Å; R42-L46 PolarHBondContact O-N 3.12Å; A43-L46 PolarHBondContact O-N 2.78Å; K44-L46 PolarHBondContact O-N 3.03Å; L46-D48 VanDerWaalsContact C-N 3.34Å; L46-D48 PolarHBondContact O-N 3.35Å; L46-S49 PolarHBondContact O-N 3.15Å; L46-S49 PolarHBondContact O-OG 2.96Å; L46-L50 WeakPolarHBondContact O-CG 3.5Å; L46-L50 PolarHBondContact O-N 2.85Å
47L86.8Confident76.5Confident19 Ų1979.1 Ų79.110%0.09945%0.454CS..Hα-helixtrans-58.2-46.3172.4-72.9171.7000111.6L28 L31 A43 K44 S49 L50 T51L28-L47 HydrophobicContact CD2-CD2 3.74Å; L31-L47 HydrophobicContact CB-CD1 4.26Å; L31-L47 HydrophobicContact CB-CD2 3.49Å; L31-L47 VanDerWaalsContact CB-CD2 3.49Å; L31-L47 HydrophobicContact CB-CG 3.72Å; L31-L47 HydrophobicContact CD1-CD2 3.97Å; L31-L47 HydrophobicContact CD1-CG 4.17Å; L31-L47 HydrophobicContact CG-CD2 4.37Å; A43-L47 PolarHBondContact O-N 2.95Å; A43-L47 VanDerWaalsContact O-N 3.08Å; K44-L47 PolarHBondContact O-N 3.22Å; K44-L47 VanDerWaalsContact O-N 3.16Å; L47-S49 VanDerWaalsContact C-N 3.3Å; L47-S49 PolarHBondContact O-N 3.41Å; L47-L50 PolarHBondContact O-N 3.35Å; L47-L50 VanDerWaalsContact O-N 3.07Å; L47-T51 PolarHBondContact O-N 2.9Å; L47-T51 PolarHBondContact O-OG1 3.06Å
48D86.1Confident74Confident79 Ų7979.6 Ų79.642%0.42247%0.474SS..Hα-helixtrans-61.3-33.7177.8-97.127.5000114K44 L46 L50 T51 R52K44-D48 WeakPolarHBondContact O-CB 3.39Å; K44-D48 PolarHBondContact O-N 3.42Å; L46-D48 VanDerWaalsContact C-N 3.34Å; L46-D48 PolarHBondContact O-N 3.35Å; D48-L50 VanDerWaalsContact C-N 3.33Å; D48-T51 PolarHBondContact O-OG1 3.27Å; D48-R52 WeakPolarHBondContact O-CB 3.4Å; D48-R52 WeakPolarHBondContact O-CG 3.42Å; D48-R52 PolarHBondContact O-N 3.25Å; D48-R52 PolarHBondContact O-NE 3.37Å; D48-R52 VanDerWaalsContact O-NE 3.16Å; D48-R52 IonicContact OD2-NH2 2.92Å; D48-R52 PolarHBondContact OD2-NH2 3.24Å
49S83.4Confident71.6Confident45 Ų4583 Ų8332%0.31550%0.499SS..Hα-helixtrans-70.5-31.6174.977.40000112.2A45 L46 L47 N53A45-S49 PolarHBondContact O-N 3.44Å; A45-S49 VanDerWaalsContact O-N 3.13Å; L46-S49 PolarHBondContact O-N 3.15Å; L46-S49 PolarHBondContact O-OG 2.96Å; L47-S49 VanDerWaalsContact C-N 3.3Å; L47-S49 PolarHBondContact O-N 3.41Å; S49-N53 VanDerWaalsContact O-CB 3.31Å; S49-N53 WeakPolarHBondContact O-CB 3.25Å; S49-N53 VanDerWaalsContact O-CG 3.31Å; S49-N53 PolarHBondContact O-N 3.45Å; S49-N53 VanDerWaalsContact O-N 3.12Å; S49-N53 PolarHBondContact O-ND2 3.16Å
50L80.4Confident68.9Low16 Ų1683 Ų838%0.08451%0.514CS..Hα-helixtrans-79.8-39.5-177.9-70164.6000112.1L19 K24 A27 L28 L31 L46 L47 D48 N53 G54L19-L50 HydrophobicContact CD1-CD1 4.15Å; L19-L50 HydrophobicContact CD1-CD2 4.23Å; L19-L50 HydrophobicContact CD1-CG 4.4Å; L19-L50 HydrophobicContact CD2-CD1 3.91Å; L19-L50 HydrophobicContact CD2-CD2 3.34Å; L19-L50 HydrophobicContact CD2-CG 4.16Å; L19-L50 HydrophobicContact CG-CD2 4.42Å; K24-L50 HydrophobicContact CB-CD2 4.41Å; K24-L50 HydrophobicContact CD-CD2 4.45Å; K24-L50 HydrophobicContact CG-CD2 4.12Å; A27-L50 HydrophobicContact CB-CD1 4.39Å; L28-L50 HydrophobicContact CD2-CB 3.84Å; L28-L50 HydrophobicContact CD2-CD1 3.67Å; L28-L50 HydrophobicContact CD2-CG 4.4Å; L28-L50 HydrophobicContact CG-CD1 4.04Å; L31-L50 HydrophobicContact CD1-CD1 3.76Å; L46-L50 WeakPolarHBondContact O-CG 3.5Å; L46-L50 PolarHBondContact O-N 2.85Å; L47-L50 PolarHBondContact O-N 3.35Å; L47-L50 VanDerWaalsContact O-N 3.07Å; D48-L50 VanDerWaalsContact C-N 3.33Å; L50-N53 CarbonylContact O-C 3.58Å; L50-N53 PolarHBondContact O-N 2.95Å; L50-G54 PolarHBondContact O-N 2.8Å
51T78.7Confident66.2Low89 Ų8986.7 Ų86.755%0.54655%0.547SS..Hα-helixtrans-66.4-38.7174.752.90000111.6L47 D48 G54L47-T51 PolarHBondContact O-N 2.9Å; L47-T51 PolarHBondContact O-OG1 3.06Å; D48-T51 PolarHBondContact O-OG1 3.27Å; T51-G54 PolarHBondContact O-N 3.32Å
52R74.5Confident63.6Low178 Ų17889.4 Ų89.467%0.67255%0.552SS**Hα-helixtrans-66.9-37.7173.2-75.3179.2-114.6-167.6-8.8113.5D48 G54D48-R52 WeakPolarHBondContact O-CB 3.4Å; D48-R52 WeakPolarHBondContact O-CG 3.42Å; D48-R52 PolarHBondContact O-N 3.25Å; D48-R52 PolarHBondContact O-NE 3.37Å; D48-R52 VanDerWaalsContact O-NE 3.16Å; D48-R52 IonicContact OD2-NH2 2.92Å; D48-R52 PolarHBondContact OD2-NH2 3.24Å; R52-G54 VanDerWaalsContact C-N 3.26Å; R52-G54 PolarHBondContact O-N 3.17Å
53N61.1Low61Low114 Ų11494.5 Ų94.561%0.6157%0.572SS**THydrogen-bonded Turntrans-86.614.5178.1-69.7-21.5000114.1K24 S49 L50K24-N53 PolarHBondContact NZ-O 2.88Å; S49-N53 VanDerWaalsContact O-CB 3.31Å; S49-N53 WeakPolarHBondContact O-CB 3.25Å; S49-N53 VanDerWaalsContact O-CG 3.31Å; S49-N53 PolarHBondContact O-N 3.45Å; S49-N53 VanDerWaalsContact O-N 3.12Å; S49-N53 PolarHBondContact O-ND2 3.16Å; L50-N53 CarbonylContact O-C 3.58Å; L50-N53 PolarHBondContact O-N 2.95Å
54G60.2Low58.6Low57 Ų57105.3 Ų105.359%0.58861%0.612SS**THydrogen-bonded Turntrans-101.7-4.5-179.100000115.4L50 T51 R52L50-G54 PolarHBondContact O-N 2.8Å; T51-G54 PolarHBondContact O-N 3.32Å; R52-G54 VanDerWaalsContact C-N 3.26Å; R52-G54 PolarHBondContact O-N 3.17Å
55S51.1Low56Low106 Ų106112.3 Ų112.374%0.74164%0.636SS**SBendtrans-129.666.8-168.3-65.80000114
56S37.7Very low53.5Low117 Ų117115.1 Ų115.182%0.81865%0.649SS**  trans-166.2135.9156.7-152.20000112.6
57A38.1Very low51.1Low105 Ų105122.1 Ų122.187%0.86868%0.678SS**  trans28.7150.9158.100000121.8
58G34.2Very low48.4Very low74 Ų74126.5 Ų126.576%0.76370%0.702SS**  cis169.5176.26.300000111.1
59N34.8Very low45.8Very low174 Ų174130.7 Ų130.793%0.9372%0.718SS**  trans-45.3130.6-171.4-70.7-34.5000119
60G31Very low43.2Very low80 Ų80133.3 Ų133.383%0.82574%0.737SS**  83.8133.9113.400000121.7
61A30.7Very low40.6Very low100 Ų100141.1 Ų141.183%0.82677%0.773SS**  -173118.8128.200000114.4
62F32.3Very low38.1Very low191 Ų191143 Ų14384%0.83878%0.784SS**  trans-7.4136.7156.7-74-100.4000122.2
63R31.4Very low36Very low249 Ų249139.5 Ų139.594%0.9479%0.787SS**  -162.6155.898.9-100.9174-178.5-172.20.6111.9
64R33.9Very low34.5Very low226 Ų226143.3 Ų143.385%0.85380%0.801SS**  trans-128133.5-171.3-85.3-178.1170.1175-2.4112.9
65R34.1Very low32.9Very low239 Ų239145.7 Ų145.790%0.90282%0.815SS**  trans60.5163.8143.2-80-172173.6-165.5-1.6119
66P37.8Very low31.9Very low123 Ų123144.5 Ų144.580%0.79982%0.82SS**  cis-127.5-172.415.540.3-21.9000117.1
67K34.5Very low31.4Very low184 Ų184142.5 Ų142.580%0.882%0.818SS**  trans-82.1171.1167.4-63.9-174.9169.6-168.40110.2
68D30.5Very low31.1Very low111 Ų111144.8 Ų144.859%0.59481%0.81SS**  cis-164.7168.332.1-137-32.8000113.6
69H32Very low31Very low167 Ų167144.8 Ų144.877%0.77380%0.799SS**  trans55.7147.2164-60.9-53.3000120.2
70S27.8Very low31.2Very low100 Ų100141.8 Ų141.870%0.69978%0.779SS**  cis-161.7156.3-5.846.40000112.4
71E26.7Very low31.9Very low180 Ų180144.1 Ų144.184%0.84177%0.768SS**  trans77.9127.7157.3-72.2-174167.500124
72T26.5Very low33.1Very low129 Ų129145.2 Ų145.279%0.79177%0.767SS**  trans88.2130.4152.9-23.10000121
73S29.2Very low33.2Very low103 Ų103140.9 Ų140.972%0.7277%0.766SS**  trans94.4106.4158.6-520000119.9
74Q29.6Very low33.5Very low195 Ų195132.8 Ų132.891%0.91176%0.761SS**  trans67.9138.9144.9-64.9-176.5-14.900122.1
75A27.8Very low33.5Very low106 Ų106125.7 Ų125.788%0.87676%0.757SS**  trans71118.4154.100000121.2
76G28.8Very low33.9Very low82 Ų82122.2 Ų122.285%0.84576%0.757SS**  trans109.1119134.700000119.5
77G28.7Very low34.2Very low75 Ų75120.5 Ų120.577%0.77375%0.748SS**  90.594.9129.900000120.7
78Q31.3Very low35.2Very low153 Ų153117.8 Ų117.872%0.71574%0.736SS**  43.2117.3128.8-65.5-170.83.200121.2
79S31.3Very low36.3Very low74 Ų74118.3 Ų118.352%0.51775%0.749SS.*  68.7141.6101-17.90000116.5
80Q39.3Very low37.9Very low110 Ų110113.9 Ų113.951%0.51473%0.727SS.*  cis-174.3167.1-6.3-123-176-42.800110.7
81E45.6Very low40.4Very low130 Ų130112.7 Ų112.761%0.60772%0.715SS**  trans71.8166.9145.2-80166.5-151.600119.1
82P55.8Low42.8Very low122 Ų122112.1 Ų112.179%0.79271%0.713SS**  cis-122.1-170.814.742.4-24.9000113.8
83A35.7Very low45.3Very low100 Ų100111.5 Ų111.583%0.82670%0.701SS**  cis-152.1174.317.500000109.9
84G35.8Very low47.8Very low80 Ų80108.3 Ų108.383%0.82568%0.675SS**  cis158.7143.6-2.500000109.8
85G34.2Very low50.3Low76 Ų7699.6 Ų99.678%0.78464%0.635SS**  trans163129.617800000113.7S87G85-S87 PolarHBondContact O-N 3.36Å
86D42.7Very low52.9Low167 Ų16799.9 Ų99.989%0.89362%0.618SS**  trans34.472.1173.6-72.6-24.3000117.6K88D86-K88 VanDerWaalsContact C-N 3.32Å; D86-K88 PolarHBondContact O-N 3.01Å
87S45.1Very low55.5Low87 Ų8796.6 Ų96.661%0.60858%0.584SS**  trans-71.585.5166.460.80000111.2G85 S89 F90G85-S87 PolarHBondContact O-N 3.36Å; S87-S89 PolarHBondContact O-N 2.93Å; S87-S89 VanDerWaalsContact O-N 3.16Å; S87-F90 VanDerWaalsContact CB-CE1 3.43Å
88K54.7Low58.1Low127 Ų12793.1 Ų93.155%0.55255%0.548SS*.  trans-42.1122.6148.3-75.9-178.6174.3-179.60107.2D86 F90 H139D86-K88 VanDerWaalsContact C-N 3.32Å; D86-K88 PolarHBondContact O-N 3.01Å; K88-F90 VanDerWaalsContact O-CD1 3.24Å; K88-F90 WeakPolarHBondContact O-CD1 3.33Å; K88-F90 PolarHBondContact O-N 2.76Å; K88-H139 HydrophobicContact CB-CB 3.56Å; K88-H139 HydrophobicContact CD-CB 3.68Å; K88-H139 WeakPolarHBondContact CD-CD2 3.45Å; K88-H139 HydrophobicContact CG-CB 4.29Å; K88-H139 PolarHBondContact NZ-CD2 3.36Å; K88-H139 PolarHBondContact NZ-NE2 2.84Å
89S54.6Low60.7Low122 Ų12289.4 Ų89.485%0.85353%0.528SS*.  trans-57.697.2-164.759.70000112.6S87S87-S89 PolarHBondContact O-N 2.93Å; S87-S89 VanDerWaalsContact O-N 3.16Å
90F65.4Low63.3Low74 Ų7493.4 Ų93.433%0.32553%0.531SS..  trans-93.1146.2175.647.8-109.1000109.7S87 K88 V95 A140S87-F90 VanDerWaalsContact CB-CE1 3.43Å; K88-F90 VanDerWaalsContact O-CD1 3.24Å; K88-F90 WeakPolarHBondContact O-CD1 3.33Å; K88-F90 PolarHBondContact O-N 2.76Å; F90-V95 HydrophobicContact CD2-CG2 3.2Å; F90-V95 HydrophobicContact CE2-CG2 3.44Å; F90-V95 VanDerWaalsContact CE2-CG2 3.44Å; F90-V95 HydrophobicContact CG-CG2 4.01Å; F90-V95 HydrophobicContact CZ-CG2 4.38Å; F90-A140 HydrophobicContact CB-CB 4.09Å; F90-A140 HydrophobicContact CG-CB 4.25Å
91T80.7Confident65.5Low74 Ų7488.6 Ų88.645%0.45451%0.509SS..  trans-77151.2172.263.50000110.1E93 Q94 V95T91-E93 PolarHBondContact O-N 2.93Å; T91-Q94 WeakPolarHBondContact O-CB 3.46Å; T91-Q94 PolarHBondContact O-N 2.88Å; T91-Q94 WeakPolarHBondContact OG1-CG 3.24Å; T91-Q94 PolarHBondContact OG1-N 2.6Å; T91-Q94 PolarHBondContact OG1-OE1 2.93Å; T91-V95 PolarHBondContact O-N 3.45Å
92E77Confident67.2Low168 Ų16886.8 Ų86.879%0.78550%0.499SS*.Hα-helixtrans-56.8-35.1175.2-168.9169.5-169.500111.5Q94 V95 E96E92-Q94 PolarHBondContact O-N 3.16Å; E92-V95 PolarHBondContact O-N 3.01Å; E92-E96 PolarHBondContact O-N 3.44Å
93E77.8Confident68.5Low117 Ų11787.3 Ų87.355%0.54749%0.485SS..Hα-helixtrans-62-35.6172.8-161.7-157.3143.600113.4T91 G97 K132T91-E93 PolarHBondContact O-N 2.93Å; E93-G97 PolarHBondContact O-N 3.33Å; E93-K132 IonicContact OE1-NZ 2.6Å; E93-K132 PolarHBondContact OE1-NZ 2.75Å
94Q81.1Confident70.7Confident36 Ų3683.4 Ų83.417%0.16845%0.452CS..Hα-helixtrans-67.5-42.9174.8-80170.1-40.200111T91 E92 G97 V98 K137 A140T91-Q94 WeakPolarHBondContact O-CB 3.46Å; T91-Q94 PolarHBondContact O-N 2.88Å; T91-Q94 WeakPolarHBondContact OG1-CG 3.24Å; T91-Q94 PolarHBondContact OG1-N 2.6Å; T91-Q94 PolarHBondContact OG1-OE1 2.93Å; E92-Q94 PolarHBondContact O-N 3.16Å; Q94-G97 PolarHBondContact O-N 3.26Å; Q94-V98 WeakPolarHBondContact O-CG2 3.42Å; Q94-V98 PolarHBondContact O-N 3.19Å; Q94-K137 PolarHBondContact NE2-O 2.94Å; Q94-A140 HydrophobicContact CB-CB 4.23Å
95V82.3Confident72.7Confident11 Ų1185.9 Ų85.97%0.06744%0.44CS..Hα-helixtrans-66.1-45.7177.3-1710000111F90 T91 E92 G97 V98 R99 A140F90-V95 HydrophobicContact CD2-CG2 3.2Å; F90-V95 HydrophobicContact CE2-CG2 3.44Å; F90-V95 VanDerWaalsContact CE2-CG2 3.44Å; F90-V95 HydrophobicContact CG-CG2 4.01Å; F90-V95 HydrophobicContact CZ-CG2 4.38Å; T91-V95 PolarHBondContact O-N 3.45Å; E92-V95 PolarHBondContact O-N 3.01Å; V95-G97 VanDerWaalsContact C-N 3.31Å; V95-G97 PolarHBondContact O-N 3.35Å; V95-V98 PolarHBondContact O-N 3.4Å; V95-R99 HydrophobicContact CG1-CG 4.45Å; V95-R99 VanDerWaalsContact CG1-CZ 3.49Å; V95-R99 WeakPolarHBondContact O-CB 3.32Å; V95-R99 WeakPolarHBondContact O-CG 3.48Å; V95-R99 PolarHBondContact O-N 3.44Å; V95-A140 HydrophobicContact CG2-CB 3.99Å
96E83.6Confident75.1Confident112 Ų11283.7 Ų83.752%0.52341%0.41SS..Hα-helixtrans-60.8-42.1176-174176.8-158.600111.7E92 V98 R99 R100E92-E96 PolarHBondContact O-N 3.44Å; E96-V98 PolarHBondContact O-N 3.16Å; E96-R99 PolarHBondContact O-N 3.29Å; E96-R100 WeakPolarHBondContact O-CB 3.36Å; E96-R100 PolarHBondContact O-N 3.08Å
97G83.6Confident77.3Confident14 Ų1476.3 Ų76.314%0.14437%0.37CS..Hα-helixtrans-57.9-46.4173.800000113.1E93 Q94 V95 R100 I101E93-G97 PolarHBondContact O-N 3.33Å; Q94-G97 PolarHBondContact O-N 3.26Å; V95-G97 VanDerWaalsContact C-N 3.31Å; V95-G97 PolarHBondContact O-N 3.35Å; G97-R100 PolarHBondContact O-N 3.26Å; G97-I101 WeakPolarHBondContact O-CG1 3.37Å; G97-I101 PolarHBondContact O-N 3.13Å; G97-I101 VanDerWaalsContact O-N 3.12Å
98V83.3Confident79.4Confident2 Ų272.4 Ų72.41%0.01234%0.342CS..Hα-helixtrans-63.5-47.3176.8169.80000110.7Q94 V95 E96 R100 I101 K102 F133 A140 P141 G142 A143 A146Q94-V98 WeakPolarHBondContact O-CG2 3.42Å; Q94-V98 PolarHBondContact O-N 3.19Å; V95-V98 PolarHBondContact O-N 3.4Å; E96-V98 PolarHBondContact O-N 3.16Å; V98-R100 VanDerWaalsContact C-N 3.3Å; V98-R100 PolarHBondContact O-N 2.74Å; V98-I101 PolarHBondContact O-N 2.96Å; V98-K102 HydrophobicContact CG1-CD 4.06Å; V98-K102 HydrophobicContact CG1-CG 4.45Å; V98-K102 WeakPolarHBondContact O-CG 3.4Å; V98-K102 PolarHBondContact O-N 2.69Å; V98-F133 HydrophobicContact CB-CE1 4.45Å; V98-F133 HydrophobicContact CG2-CD1 3.82Å; V98-F133 HydrophobicContact CG2-CE1 3.66Å; V98-A140 HydrophobicContact CG2-CB 4.09Å; V98-P141 WeakPolarHBondContact CG1-O 3.38Å; V98-G142 VanDerWaalsContact CG1-C 3.46Å; V98-G142 WeakPolarHBondContact CG1-O 3.05Å; V98-A143 HydrophobicContact CG2-CB 3.96Å; V98-A146 HydrophobicContact CB-CB 4.47Å; V98-A146 HydrophobicContact CG1-CB 4.1Å; V98-A146 HydrophobicContact CG2-CB 4.36Å
99R84.3Confident81Confident75 Ų7571.4 Ų71.428%0.28334%0.339SS..Hα-helixtrans-59.8-37.4176.9-71.6175.1-178.9140.9-3.2112.3V95 E96 R103V95-R99 HydrophobicContact CG1-CG 4.45Å; V95-R99 VanDerWaalsContact CG1-CZ 3.49Å; V95-R99 WeakPolarHBondContact O-CB 3.32Å; V95-R99 WeakPolarHBondContact O-CG 3.48Å; V95-R99 PolarHBondContact O-N 3.44Å; E96-R99 PolarHBondContact O-N 3.29Å; R99-R103 WeakPolarHBondContact O-CB 3.32Å; R99-R103 VanDerWaalsContact O-CG 3.32Å; R99-R103 WeakPolarHBondContact O-CG 3.32Å; R99-R103 PolarHBondContact O-N 3.17Å; R99-R103 PolarHBondContact O-NE 2.86Å
100R86.1Confident82.6Confident157 Ų15765.8 Ų65.859%0.59230%0.3SS*.Hα-helixtrans-62.3-53.7175.4177.3179.2169.1176.6-2.7110.6E96 G97 V98 K102 R103 C104E96-R100 WeakPolarHBondContact O-CB 3.36Å; E96-R100 PolarHBondContact O-N 3.08Å; G97-R100 PolarHBondContact O-N 3.26Å; V98-R100 VanDerWaalsContact C-N 3.3Å; V98-R100 PolarHBondContact O-N 2.74Å; R100-K102 VanDerWaalsContact C-N 3.31Å; R100-K102 PolarHBondContact O-N 3.18Å; R100-R103 PolarHBondContact O-N 3.39Å; R100-C104 PolarHBondContact O-N 2.88Å; R100-C104 VanDerWaalsContact O-N 3.13Å
101I86.3Confident83.7Confident9 Ų962.6 Ų62.65%0.04629%0.286CS..Hα-helixtrans-63.2-37.9-177-67.2179.6000111.7G97 V98 R103 C104 V110 L129 F133 A146 K149 I150G97-I101 WeakPolarHBondContact O-CG1 3.37Å; G97-I101 PolarHBondContact O-N 3.13Å; G97-I101 VanDerWaalsContact O-N 3.12Å; V98-I101 PolarHBondContact O-N 2.96Å; I101-R103 VanDerWaalsContact C-N 3.27Å; I101-R103 PolarHBondContact O-N 2.04Å; I101-C104 PolarHBondContact O-N 3.3Å; I101-V110 HydrophobicContact CG2-CG1 4.24Å; I101-L129 HydrophobicContact CD1-CD2 4.28Å; I101-F133 HydrophobicContact CD1-CD1 4.48Å; I101-F133 HydrophobicContact CD1-CD2 3.84Å; I101-F133 HydrophobicContact CD1-CE1 4.13Å; I101-F133 HydrophobicContact CD1-CE2 3.43Å; I101-F133 VanDerWaalsContact CD1-CE2 3.43Å; I101-F133 HydrophobicContact CD1-CG 4.36Å; I101-F133 HydrophobicContact CD1-CZ 3.59Å; I101-A146 HydrophobicContact CB-CB 4.06Å; I101-A146 HydrophobicContact CG2-CB 3.8Å; I101-K149 HydrophobicContact CG2-CB 4.32Å; I101-I150 HydrophobicContact CD1-CD1 3.62Å; I101-I150 HydrophobicContact CD1-CG1 3.93Å; I101-I150 HydrophobicContact CG2-CG1 4.17Å
102K81.6Confident84.1Confident93 Ų9361.7 Ų61.740%0.40429%0.291SS..Hα-helixtrans-67-22.5174.1-74-174.659.2166.70114.2V98 R100 E145V98-K102 HydrophobicContact CG1-CD 4.06Å; V98-K102 HydrophobicContact CG1-CG 4.45Å; V98-K102 WeakPolarHBondContact O-CG 3.4Å; V98-K102 PolarHBondContact O-N 2.69Å; R100-K102 VanDerWaalsContact C-N 3.31Å; R100-K102 PolarHBondContact O-N 3.18Å; K102-E145 WeakPolarHBondContact CE-OE2 3.36Å; K102-E145 IonicContact NZ-OE2 2.62Å; K102-E145 PolarHBondContact NZ-OE2 3.49Å
103R83.3Confident84.7Confident133 Ų13355.1 Ų55.150%0.50226%0.262SS..Hα-helixtrans-89.7-24.6178.1-77-177.3-65-127.92.9113.8R99 R100 I101R99-R103 WeakPolarHBondContact O-CB 3.32Å; R99-R103 VanDerWaalsContact O-CG 3.32Å; R99-R103 WeakPolarHBondContact O-CG 3.32Å; R99-R103 PolarHBondContact O-N 3.17Å; R99-R103 PolarHBondContact O-NE 2.86Å; R100-R103 PolarHBondContact O-N 3.39Å; I101-R103 VanDerWaalsContact C-N 3.27Å; I101-R103 PolarHBondContact O-N 2.04Å
104C82.3Confident85.2Confident17 Ų1754.4 Ų54.412%0.11526%0.263CS..  trans-65.8135173.3-69.40000110.3R100 I101 E109 V110R100-C104 PolarHBondContact O-N 2.88Å; R100-C104 VanDerWaalsContact O-N 3.13Å; I101-C104 PolarHBondContact O-N 3.3Å; C104-E109 HydrophobicContact CB-CB 3.95Å; C104-V110 HydrophobicContact CB-CG2 3.66Å
105K76.3Confident85.3Confident132 Ų13258 Ų5857%0.57428%0.278SS*.  trans-102.3-38.7175.6-64.3-170.8-179.3-167.90111.7
106D85.6Confident85.3Confident31 Ų3165.6 Ų65.617%0.16631%0.313CS..SBendtrans-76132.7177.9-83.433.4000111.4Y108 E109 V110 K115 Y166D106-Y108 PolarHBondContact O-N 3.35Å; D106-E109 HydrophobicContact CB-CB 4.18Å; D106-E109 HydrophobicContact CB-CG 3.87Å; D106-E109 WeakPolarHBondContact O-CB 3.21Å; D106-E109 PolarHBondContact O-N 3Å; D106-V110 WeakPolarHBondContact O-CG2 3.3Å; D106-V110 PolarHBondContact O-N 2.93Å; D106-K115 WeakPolarHBondContact OD2-CE 3.28Å; D106-K115 IonicContact OD2-NZ 3.06Å; D106-K115 PolarHBondContact OD2-NZ 2.81Å; D106-Y166 WeakPolarHBondContact CA-OH 3.49Å
107Y88.7Confident85.4Confident11 Ų1160.9 Ų60.94%0.04329%0.292CS..Hα-helixtrans-60.3-31.6177.5-68.8-33.2000113.3V110 L111 A153 V156 Y166 E173Y107-V110 PolarHBondContact O-N 3.1Å; Y107-L111 PolarHBondContact O-N 3.06Å; Y107-L111 VanDerWaalsContact O-N 3.12Å; Y107-A153 HydrophobicContact CD1-CB 3.6Å; Y107-A153 HydrophobicContact CE1-CB 4.46Å; Y107-A153 HydrophobicContact CG-CB 3.87Å; Y107-V156 HydrophobicContact CD2-CB 4.06Å; Y107-V156 HydrophobicContact CD2-CG1 3.98Å; Y107-V156 HydrophobicContact CE2-CB 3.89Å; Y107-V156 HydrophobicContact CE2-CG1 3.86Å; Y107-V156 HydrophobicContact CE2-CG2 3.86Å; Y107-Y166 AromaticContact CD2-CD1 3.9Å; Y107-Y166 HydrophobicContact CD2-CD1 3.9Å; Y107-Y166 AromaticContact CD2-CD2 3.65Å; Y107-Y166 HydrophobicContact CD2-CD2 3.65Å; Y107-Y166 AromaticContact CD2-CE1 3.61Å; Y107-Y166 HydrophobicContact CD2-CE1 3.61Å; Y107-Y166 AromaticContact CD2-CE2 3.36Å; Y107-Y166 HydrophobicContact CD2-CE2 3.36Å; Y107-Y166 AromaticContact CD2-CG 3.9Å; Y107-Y166 HydrophobicContact CD2-CG 3.9Å; Y107-Y166 AromaticContact CD2-CZ 3.33Å; Y107-Y166 AromaticContact CE2-CD2 3.58Å; Y107-Y166 HydrophobicContact CE2-CD2 3.58Å; Y107-Y166 AromaticContact CE2-CE2 3.46Å; Y107-Y166 HydrophobicContact CE2-CE2 3.46Å; Y107-Y166 VanDerWaalsContact CE2-CE2 3.46Å; Y107-Y166 HydrophobicContact CE2-CG 4.18Å; Y107-Y166 AromaticContact CE2-CZ 3.95Å; Y107-Y166 HydrophobicContact CG-CE1 4.11Å; Y107-Y166 HydrophobicContact CG-CE2 4.15Å; Y107-Y166 AromaticContact CG-CZ 3.77Å; Y107-Y166 PolarHBondContact N-OH 2.92Å; Y107-E173 HydrophobicContact CE1-CB 4.26Å; Y107-E173 HydrophobicContact CE1-CG 3.98Å
108Y89Confident85.4Confident5 Ų562 Ų622%0.0230%0.304CS..Hα-helixtrans-66.2-39.8174.2-61.9-77.6000111.8D106 L111 G112 V113 K115 L157 R163 Y166 D167D106-Y108 PolarHBondContact O-N 3.35Å; Y108-L111 PolarHBondContact O-N 3.05Å; Y108-G112 PolarHBondContact O-N 2.84Å; Y108-V113 HydrophobicContact CD1-CG2 4.07Å; Y108-V113 PolarHBondContact O-N 2.98Å; Y108-K115 HydrophobicContact CD2-CB 4.29Å; Y108-K115 HydrophobicContact CD2-CD 4.15Å; Y108-K115 HydrophobicContact CD2-CG 3.74Å; Y108-K115 HydrophobicContact CE2-CB 4.28Å; Y108-K115 HydrophobicContact CE2-CD 4.4Å; Y108-K115 HydrophobicContact CE2-CG 4.13Å; Y108-K115 HydrophobicContact CG-CB 4.39Å; Y108-K115 HydrophobicContact CG-CG 3.95Å; Y108-L157 HydrophobicContact CD1-CD1 3.63Å; Y108-L157 HydrophobicContact CD1-CD2 4.31Å; Y108-L157 HydrophobicContact CD2-CD1 4.42Å; Y108-L157 HydrophobicContact CD2-CD2 4.41Å; Y108-L157 HydrophobicContact CE1-CD1 3.79Å; Y108-L157 HydrophobicContact CE1-CD2 3.69Å; Y108-L157 HydrophobicContact CE1-CG 4.33Å; Y108-L157 HydrophobicContact CE2-CD2 3.82Å; Y108-L157 HydrophobicContact CG-CD1 3.98Å; Y108-L157 VanDerWaalsContact CZ-CD2 3.43Å; Y108-R163 WeakPolarHBondContact OH-CG 3.31Å; Y108-R163 PolarHBondContact OH-NE 3.49Å; Y108-Y166 HydrophobicContact CD2-CE1 4.28Å; Y108-Y166 HydrophobicContact CE2-CD1 4.31Å; Y108-Y166 HydrophobicContact CE2-CE1 4.07Å; Y108-D167 VanDerWaalsContact CE2-OD1 3.25Å; Y108-D167 WeakPolarHBondContact CE2-OD1 3.25Å; Y108-D167 VanDerWaalsContact OH-CG 3.29Å; Y108-D167 PolarHBondContact OH-OD1 3.5Å; Y108-D167 PolarHBondContact OH-OD2 2.83Å
109E88.2Confident85.4Confident106 Ų10665.3 Ų65.350%0.49532%0.321SS..Hα-helixtrans-70.2-37.8175.8-66.1-173.9166.400112.5C104 D106 L111 G112C104-E109 HydrophobicContact CB-CB 3.95Å; D106-E109 HydrophobicContact CB-CB 4.18Å; D106-E109 HydrophobicContact CB-CG 3.87Å; D106-E109 WeakPolarHBondContact O-CB 3.21Å; D106-E109 PolarHBondContact O-N 3Å; E109-L111 VanDerWaalsContact C-N 3.29Å; E109-L111 PolarHBondContact O-N 3.4Å; E109-G112 PolarHBondContact O-N 3.1Å
110V88.1Confident85.4Confident5 Ų566.4 Ų66.43%0.0333%0.333CS..Hα-helixtrans-57.5-42.5173.6165.30000111.1I101 C104 D106 Y107 G112 L129 K149 I150 A153I101-V110 HydrophobicContact CG2-CG1 4.24Å; C104-V110 HydrophobicContact CB-CG2 3.66Å; D106-V110 WeakPolarHBondContact O-CG2 3.3Å; D106-V110 PolarHBondContact O-N 2.93Å; Y107-V110 PolarHBondContact O-N 3.1Å; V110-G112 VanDerWaalsContact C-N 3.34Å; V110-L129 WeakPolarHBondContact O-CD1 3.38Å; V110-K149 HydrophobicContact CG1-CB 4.41Å; V110-I150 HydrophobicContact CG1-CG1 4.33Å; V110-A153 HydrophobicContact CB-CB 4.09Å; V110-A153 HydrophobicContact CG1-CB 3.68Å
111L89.1Confident85.5Confident6 Ų662.6 Ų62.63%0.03132%0.324CS..Hα-helixtrans-81.1-12.3173.9-63.8-178.9000113.6Y107 Y108 E109 V113 L122 A125 L129 I150 A153 Y154 L157Y107-L111 PolarHBondContact O-N 3.06Å; Y107-L111 VanDerWaalsContact O-N 3.12Å; Y108-L111 PolarHBondContact O-N 3.05Å; E109-L111 VanDerWaalsContact C-N 3.29Å; E109-L111 PolarHBondContact O-N 3.4Å; L111-V113 HydrophobicContact CB-CG1 4.44Å; L111-V113 HydrophobicContact CB-CG2 4.14Å; L111-L122 HydrophobicContact CD1-CD2 3.55Å; L111-A125 HydrophobicContact CB-CB 4.39Å; L111-A125 WeakPolarHBondContact O-CB 3.23Å; L111-L129 HydrophobicContact CD2-CD1 4.22Å; L111-L129 WeakPolarHBondContact O-CD1 3.24Å; L111-I150 HydrophobicContact CD2-CG2 4.03Å; L111-A153 HydrophobicContact CD1-CB 4.42Å; L111-A153 HydrophobicContact CD2-CB 4.32Å; L111-A153 HydrophobicContact CG-CB 4.02Å; L111-Y154 HydrophobicContact CD1-CD2 4.47Å; L111-L157 HydrophobicContact CD1-CD1 4.03Å
112G87.9Confident85.5Confident55 Ų5562.1 Ų62.157%0.56732%0.322SS*.THydrogen-bonded Turntrans6932.9-178.200000113.8Y108 E109 V110Y108-G112 PolarHBondContact O-N 2.84Å; E109-G112 PolarHBondContact O-N 3.1Å; V110-G112 VanDerWaalsContact C-N 3.34Å
113V89.8Confident85.7Confident30 Ų3061.6 Ų61.618%0.18232%0.32CS..  trans-117.6163.3179.6-59.10000111.3Y108 L111 A117 L122 A125Y108-V113 HydrophobicContact CD1-CG2 4.07Å; Y108-V113 PolarHBondContact O-N 2.98Å; L111-V113 HydrophobicContact CB-CG1 4.44Å; L111-V113 HydrophobicContact CB-CG2 4.14Å; V113-A117 HydrophobicContact CB-CB 3.76Å; V113-A117 HydrophobicContact CG2-CB 4Å; V113-L122 HydrophobicContact CG2-CD2 3.78Å; V113-A125 HydrophobicContact CG1-CB 3.58Å
114N88.1Confident85.9Confident103 Ų10361.1 Ų61.155%0.55132%0.321SS*.  trans-76.5158.4171.8-164.73.1000110.9E116 A117N114-E116 PolarHBondContact O-N 3.12Å; N114-A117 WeakPolarHBondContact O-CB 3.45Å; N114-A117 PolarHBondContact O-N 2.82Å
115K84.4Confident86.2Confident112 Ų11261 Ų6149%0.48732%0.322SS..THydrogen-bonded Turntrans-62.4-26.9176.4-56.5-161.5175.4-167.20112.7D106 Y108 A117 R163D106-K115 WeakPolarHBondContact OD2-CE 3.28Å; D106-K115 IonicContact OD2-NZ 3.06Å; D106-K115 PolarHBondContact OD2-NZ 2.81Å; Y108-K115 HydrophobicContact CD2-CB 4.29Å; Y108-K115 HydrophobicContact CD2-CD 4.15Å; Y108-K115 HydrophobicContact CD2-CG 3.74Å; Y108-K115 HydrophobicContact CE2-CB 4.28Å; Y108-K115 HydrophobicContact CE2-CD 4.4Å; Y108-K115 HydrophobicContact CE2-CG 4.13Å; Y108-K115 HydrophobicContact CG-CB 4.39Å; Y108-K115 HydrophobicContact CG-CG 3.95Å; K115-A117 VanDerWaalsContact C-N 3.3Å; K115-A117 PolarHBondContact O-N 3.19Å; K115-R163 PolarHBondContact O-NH2 3.07Å
116E82.6Confident86.8Confident170 Ų17054.9 Ų54.979%0.79430%0.295SS*.THydrogen-bonded Turntrans-81-0.9173.9-62.2176.1174.500114.1N114 G118N114-E116 PolarHBondContact O-N 3.12Å; E116-G118 PolarHBondContact O-N 2.96Å
117A84.2Confident86.8Confident12 Ų1259.6 Ų59.610%0.09931%0.31CS..  trans-62.9136-174.300000112.6V113 N114 K115 D121 R163V113-A117 HydrophobicContact CB-CB 3.76Å; V113-A117 HydrophobicContact CG2-CB 4Å; N114-A117 WeakPolarHBondContact O-CB 3.45Å; N114-A117 PolarHBondContact O-N 2.82Å; K115-A117 VanDerWaalsContact C-N 3.3Å; K115-A117 PolarHBondContact O-N 3.19Å; A117-D121 HydrophobicContact CB-CB 4.4Å; A117-R163 PolarHBondContact O-NH1 2.73Å; A117-R163 PolarHBondContact O-NH2 2.93Å
118G84.4Confident86.8Confident37 Ų3766.9 Ų66.938%0.38134%0.342SS..  trans-74162.6175.900000112.9E116 D120 D121 L122E116-G118 PolarHBondContact O-N 2.96Å; G118-D120 PolarHBondContact O-N 2.95Å; G118-D120 VanDerWaalsContact O-N 3.12Å; G118-D121 PolarHBondContact O-N 3.33Å; G118-L122 PolarHBondContact O-N 3.42Å
119D84.1Confident86.8Confident72 Ų7268.2 Ų68.239%0.38535%0.349SS..Hα-helixtrans-58.2-29.5-176.5-58.8-14.8000113.2K123 R163D119-K123 WeakPolarHBondContact O-CB 3.3Å; D119-K123 WeakPolarHBondContact O-CD 3.41Å; D119-K123 WeakPolarHBondContact O-CG 3.38Å; D119-K123 PolarHBondContact O-N 3.49Å; D119-R163 IonicContact OD1-NH1 3.6Å
120D83.7Confident86.6Confident98 Ų9863.1 Ų63.152%0.52433%0.326SS..Hα-helixtrans-73.9-29.8176.5-73.1-11.9000113.1G118 K123 K124G118-D120 PolarHBondContact O-N 2.95Å; G118-D120 VanDerWaalsContact O-N 3.12Å; D120-K123 IonicContact OD1-NZ 3.93Å; D120-K123 PolarHBondContact OD1-NZ 3.33Å; D120-K124 WeakPolarHBondContact O-CB 3.14Å; D120-K124 WeakPolarHBondContact O-CD 3.47Å; D120-K124 WeakPolarHBondContact O-CE 3.42Å; D120-K124 WeakPolarHBondContact O-CG 3.5Å; D120-K124 PolarHBondContact O-N 3.11Å
121D87.8Confident86.5Confident77 Ų7766.5 Ų66.541%0.41234%0.343SS..Hα-helixtrans-79.6-34.9174.8-62.6-32.8000110.8A117 G118 K124 A125A117-D121 HydrophobicContact CB-CB 4.4Å; G118-D121 PolarHBondContact O-N 3.33Å; D121-K124 PolarHBondContact O-N 2.98Å; D121-K124 IonicContact OD1-NZ 2.68Å; D121-K124 PolarHBondContact OD1-NZ 3.01Å; D121-A125 WeakPolarHBondContact O-CB 3.41Å; D121-A125 PolarHBondContact O-N 3.36Å
122L86.6Confident86.2Confident0 Ų070.3 Ų70.30%036%0.359CS..Hα-helixtrans-56.9-48.4165.5-71.1169.8000111.4L111 V113 G118 A125 Y126 Y154 L157L111-L122 HydrophobicContact CD1-CD2 3.55Å; V113-L122 HydrophobicContact CG2-CD2 3.78Å; G118-L122 PolarHBondContact O-N 3.42Å; L122-A125 PolarHBondContact O-N 2.98Å; L122-Y126 VanDerWaalsContact O-CB 3.31Å; L122-Y126 WeakPolarHBondContact O-CB 3.35Å; L122-Y126 PolarHBondContact O-N 3.32Å; L122-Y154 HydrophobicContact CB-CD2 4.24Å; L122-Y154 HydrophobicContact CB-CE2 4.15Å; L122-L157 HydrophobicContact CD1-CB 4Å; L122-L157 HydrophobicContact CD2-CB 3.97Å; L122-L157 HydrophobicContact CD2-CD1 3.94Å
123K85.9Confident86.1Confident81 Ų8167.9 Ų67.935%0.35233%0.333SS..Hα-helixtrans-61-44.7176.1-76.1160.4-165.6157.50112.7D119 D120 R127 Y154D119-K123 WeakPolarHBondContact O-CB 3.3Å; D119-K123 WeakPolarHBondContact O-CD 3.41Å; D119-K123 WeakPolarHBondContact O-CG 3.38Å; D119-K123 PolarHBondContact O-N 3.49Å; D120-K123 IonicContact OD1-NZ 3.93Å; D120-K123 PolarHBondContact OD1-NZ 3.33Å; K123-R127 WeakPolarHBondContact O-CB 3.25Å; K123-R127 PolarHBondContact O-N 3.01Å; K123-Y154 HydrophobicContact CG-CE2 4.04Å; K123-Y154 WeakPolarHBondContact CG-OH 3.4Å
124K87.4Confident85.8Confident123 Ų12368 Ų6854%0.53533%0.332SS..Hα-helixtrans-65.2-43.9178.1-71.8163.1-150.4158.30111.3D120 D121 R127 K128D120-K124 WeakPolarHBondContact O-CB 3.14Å; D120-K124 WeakPolarHBondContact O-CD 3.47Å; D120-K124 WeakPolarHBondContact O-CE 3.42Å; D120-K124 WeakPolarHBondContact O-CG 3.5Å; D120-K124 PolarHBondContact O-N 3.11Å; D121-K124 PolarHBondContact O-N 2.98Å; D121-K124 IonicContact OD1-NZ 2.68Å; D121-K124 PolarHBondContact OD1-NZ 3.01Å; K124-R127 PolarHBondContact O-N 3.48Å; K124-K128 WeakPolarHBondContact O-CB 3.47Å; K124-K128 PolarHBondContact O-N 2.81Å
125A89.1Confident85.4Confident15 Ų1565.1 Ų65.112%0.12432%0.319CS..Hα-helixtrans-62.5-51.2177.500000111.3L111 V113 D121 L122 R127 K128 L129L111-A125 HydrophobicContact CB-CB 4.39Å; L111-A125 WeakPolarHBondContact O-CB 3.23Å; V113-A125 HydrophobicContact CG1-CB 3.58Å; D121-A125 WeakPolarHBondContact O-CB 3.41Å; D121-A125 PolarHBondContact O-N 3.36Å; L122-A125 PolarHBondContact O-N 2.98Å; A125-R127 PolarHBondContact O-N 2.93Å; A125-K128 PolarHBondContact O-N 3.01Å; A125-L129 WeakPolarHBondContact O-CB 3.42Å; A125-L129 WeakPolarHBondContact O-CG 3.05Å; A125-L129 PolarHBondContact O-N 3.11Å
126Y88.8Confident85.1Confident3 Ų365.4 Ų65.41%0.01233%0.326CS..Hα-helixtrans-57-49.5174.7177.3-107.7000111.7L122 K128 L129 A130 I150 Y154 P197 L200L122-Y126 VanDerWaalsContact O-CB 3.31Å; L122-Y126 WeakPolarHBondContact O-CB 3.35Å; L122-Y126 PolarHBondContact O-N 3.32Å; Y126-K128 VanDerWaalsContact C-N 3.31Å; Y126-K128 PolarHBondContact O-N 2.74Å; Y126-L129 PolarHBondContact O-N 2.87Å; Y126-A130 HydrophobicContact CE2-CB 4.35Å; Y126-A130 WeakPolarHBondContact O-CB 3.31Å; Y126-A130 PolarHBondContact O-N 2.7Å; Y126-I150 HydrophobicContact CD2-CG2 3.63Å; Y126-I150 HydrophobicContact CE2-CG2 3.93Å; Y126-Y154 AromaticContact CD1-CD1 3.59Å; Y126-Y154 HydrophobicContact CD1-CD1 3.59Å; Y126-Y154 HydrophobicContact CD1-CD2 4.44Å; Y126-Y154 AromaticContact CD1-CE1 3.83Å; Y126-Y154 HydrophobicContact CD1-CE1 3.83Å; Y126-Y154 AromaticContact CD1-CG 3.95Å; Y126-Y154 HydrophobicContact CD1-CG 3.95Å; Y126-Y154 VanDerWaalsContact CD2-CB 3.42Å; Y126-Y154 AromaticContact CD2-CD1 3.86Å; Y126-Y154 HydrophobicContact CD2-CD1 3.86Å; Y126-Y154 HydrophobicContact CD2-CD2 4.49Å; Y126-Y154 AromaticContact CD2-CG 3.67Å; Y126-Y154 HydrophobicContact CD2-CG 3.67Å; Y126-Y154 AromaticContact CE1-CD1 3.9Å; Y126-Y154 HydrophobicContact CE1-CD1 3.9Å; Y126-Y154 HydrophobicContact CE1-CE1 4.18Å; Y126-Y154 HydrophobicContact CE2-CD1 4.17Å; Y126-Y154 HydrophobicContact CE2-CG 4.37Å; Y126-Y154 AromaticContact CG-CD1 3.58Å; Y126-Y154 HydrophobicContact CG-CD1 3.58Å; Y126-Y154 AromaticContact CG-CD2 3.92Å; Y126-Y154 HydrophobicContact CG-CD2 3.92Å; Y126-Y154 HydrophobicContact CG-CE1 4.2Å; Y126-Y154 HydrophobicContact CG-CE2 4.49Å; Y126-Y154 AromaticContact CG-CG 3.44Å; Y126-Y154 HydrophobicContact CG-CG 3.44Å; Y126-Y154 VanDerWaalsContact CG-CG 3.44Å; Y126-P197 PolarHBondContact OH-O 2.98Å; Y126-L200 HydrophobicContact CE1-CG 4.48Å
127R85.7Confident84.9Confident130 Ų13064.1 Ų64.149%0.49132%0.318SS..Hα-helixtrans-54.4-44.3176176.3-176.9-71.6-156.8-9.3112.2K123 K124 A125 L131 F204 F205K123-R127 WeakPolarHBondContact O-CB 3.25Å; K123-R127 PolarHBondContact O-N 3.01Å; K124-R127 PolarHBondContact O-N 3.48Å; A125-R127 PolarHBondContact O-N 2.93Å; R127-L131 HydrophobicContact CG-CD1 4.44Å; R127-L131 WeakPolarHBondContact O-CD1 3.39Å; R127-L131 VanDerWaalsContact O-CG 3.3Å; R127-L131 WeakPolarHBondContact O-CG 3.39Å; R127-L131 PolarHBondContact O-N 2.9Å; R127-F204 HydrophobicContact CB-CE1 4.29Å; R127-F204 HydrophobicContact CG-CE1 4.23Å; R127-F204 VanDerWaalsContact NH2-CE1 3.28Å; R127-F205 HydrophobicContact CB-CZ 4.34Å; R127-F205 HydrophobicContact CG-CE1 4.17Å; R127-F205 HydrophobicContact CG-CZ 3.86Å
128K88.4Confident84.7Confident165 Ų16563.7 Ų63.772%0.71731%0.313SS*.Hα-helixtrans-69.6-42.3-179.6-175.2179.4179.8-178.50112.2K124 A125 Y126 K132K124-K128 WeakPolarHBondContact O-CB 3.47Å; K124-K128 PolarHBondContact O-N 2.81Å; A125-K128 PolarHBondContact O-N 3.01Å; Y126-K128 VanDerWaalsContact C-N 3.31Å; Y126-K128 PolarHBondContact O-N 2.74Å; K128-K132 PolarHBondContact O-N 3.28Å
129L88.3Confident84.4Confident32 Ų3265.2 Ų65.217%0.16831%0.31CS..Hα-helixtrans-73.1-45.9-179.8-70.4171.9000111.6I101 V110 L111 A125 Y126 L131 K132 F133 I150I101-L129 HydrophobicContact CD1-CD2 4.28Å; V110-L129 WeakPolarHBondContact O-CD1 3.38Å; L111-L129 HydrophobicContact CD2-CD1 4.22Å; L111-L129 WeakPolarHBondContact O-CD1 3.24Å; A125-L129 WeakPolarHBondContact O-CB 3.42Å; A125-L129 WeakPolarHBondContact O-CG 3.05Å; A125-L129 PolarHBondContact O-N 3.11Å; Y126-L129 PolarHBondContact O-N 2.87Å; L129-L131 VanDerWaalsContact C-N 3.27Å; L129-L131 PolarHBondContact O-N 3.2Å; L129-K132 CarbonylContact O-C 3.55Å; L129-K132 PolarHBondContact O-N 3.4Å; L129-F133 HydrophobicContact CB-CD2 4.44Å; L129-F133 HydrophobicContact CD2-CD2 4.15Å; L129-F133 HydrophobicContact CD2-CE2 3.81Å; L129-F133 WeakPolarHBondContact O-CD2 3.48Å; L129-F133 PolarHBondContact O-N 3.47Å; L129-I150 HydrophobicContact CB-CD1 3.94Å; L129-I150 HydrophobicContact CB-CG1 4.27Å; L129-I150 HydrophobicContact CB-CG2 3.93Å; L129-I150 HydrophobicContact CD1-CG1 4.43Å
130A84.8Confident84.1Confident0 Ų062 Ų620%029%0.294CS..Hα-helixtrans-56.9-40.1177.700000112Y126 H134 F147 F201Y126-A130 HydrophobicContact CE2-CB 4.35Å; Y126-A130 WeakPolarHBondContact O-CB 3.31Å; Y126-A130 PolarHBondContact O-N 2.7Å; A130-H134 WeakPolarHBondContact O-CA 3.35Å; A130-H134 WeakPolarHBondContact O-CB 3.43Å; A130-H134 PolarHBondContact O-N 2.84Å; A130-F147 HydrophobicContact CB-CE2 3.96Å; A130-F201 HydrophobicContact CB-CD2 3.82Å; A130-F201 HydrophobicContact CB-CE2 3.94Å
131L84.8Confident83.9Confident76 Ų7661 Ų6140%0.39829%0.293SS..Hα-helixtrans-69.6-30.4174-70.3172.2000114R127 L129 F201 F205R127-L131 HydrophobicContact CG-CD1 4.44Å; R127-L131 WeakPolarHBondContact O-CD1 3.39Å; R127-L131 VanDerWaalsContact O-CG 3.3Å; R127-L131 WeakPolarHBondContact O-CG 3.39Å; R127-L131 PolarHBondContact O-N 2.9Å; L129-L131 VanDerWaalsContact C-N 3.27Å; L129-L131 PolarHBondContact O-N 3.2Å; L131-F201 HydrophobicContact CD2-CE2 4.4Å; L131-F201 HydrophobicContact CD2-CZ 4.3Å; L131-F205 HydrophobicContact CD1-CE1 4.12Å; L131-F205 HydrophobicContact CD1-CZ 4.45Å; L131-F205 HydrophobicContact CD2-CD1 4.45Å; L131-F205 HydrophobicContact CD2-CE1 4Å; L131-F205 HydrophobicContact CD2-CZ 4.37Å; L131-F205 HydrophobicContact CG-CE1 4.08Å; L131-F205 HydrophobicContact CG-CZ 4.15Å
132K84.1Confident83.5Confident85 Ų8558.4 Ų58.437%0.3729%0.285SS..Hα-helixtrans-82.3-26.6178.6-174.5170.9-175.8174.90113.2E93 K128 L129 N138E93-K132 IonicContact OE1-NZ 2.6Å; E93-K132 PolarHBondContact OE1-NZ 2.75Å; K128-K132 PolarHBondContact O-N 3.28Å; L129-K132 CarbonylContact O-C 3.55Å; L129-K132 PolarHBondContact O-N 3.4Å; K132-N138 WeakPolarHBondContact O-CB 3.48Å; K132-N138 PolarHBondContact O-ND2 3.21Å
133F84.8Confident83.1Confident5 Ų558.6 Ų58.62%0.02229%0.286CS..Hα-helixtrans-113.79-176.7-67.2-80.9000113.5V98 I101 L129 N138 A146 F147 I150V98-F133 HydrophobicContact CB-CE1 4.45Å; V98-F133 HydrophobicContact CG2-CD1 3.82Å; V98-F133 HydrophobicContact CG2-CE1 3.66Å; I101-F133 HydrophobicContact CD1-CD1 4.48Å; I101-F133 HydrophobicContact CD1-CD2 3.84Å; I101-F133 HydrophobicContact CD1-CE1 4.13Å; I101-F133 HydrophobicContact CD1-CE2 3.43Å; I101-F133 VanDerWaalsContact CD1-CE2 3.43Å; I101-F133 HydrophobicContact CD1-CG 4.36Å; I101-F133 HydrophobicContact CD1-CZ 3.59Å; L129-F133 HydrophobicContact CB-CD2 4.44Å; L129-F133 HydrophobicContact CD2-CD2 4.15Å; L129-F133 HydrophobicContact CD2-CE2 3.81Å; L129-F133 WeakPolarHBondContact O-CD2 3.48Å; L129-F133 PolarHBondContact O-N 3.47Å; F133-N138 VanDerWaalsContact CD1-ND2 3.31Å; F133-N138 WeakPolarHBondContact CD1-ND2 3.29Å; F133-A146 HydrophobicContact CD1-CB 4.49Å; F133-F147 HydrophobicContact CB-CD2 4.35Å; F133-F147 WeakPolarHBondContact O-CD2 3.32Å; F133-I150 HydrophobicContact CB-CD1 3.82Å; F133-I150 HydrophobicContact CD2-CD1 3.68Å; F133-I150 HydrophobicContact CG-CD1 3.85Å
134H83.8Confident82.9Confident31 Ų3158.3 Ų58.314%0.14429%0.291CS..  trans-55.2132.6175.5-163.6-92.2000110.9A130 D136 K137 N138 F201A130-H134 WeakPolarHBondContact O-CA 3.35Å; A130-H134 WeakPolarHBondContact O-CB 3.43Å; A130-H134 PolarHBondContact O-N 2.84Å; H134-D136 IonicContact CE1-OD2 3.22Å; H134-D136 PolarHBondContact CE1-OD2 3.31Å; H134-D136 PolarHBondContact ND1-N 3.38Å; H134-D136 IonicContact ND1-OD2 3.61Å; H134-D136 PolarHBondContact O-N 3.24Å; H134-D136 VanDerWaalsContact O-N 3.15Å; H134-K137 HydrophobicContact CB-CB 4.43Å; H134-K137 PolarHBondContact O-N 3.1Å; H134-N138 PolarHBondContact O-N 3.43Å; H134-F201 AromaticContact CD2-CE1 3.53Å; H134-F201 AromaticContact CD2-CE2 3.89Å; H134-F201 AromaticContact CD2-CZ 3.45Å; H134-F201 VanDerWaalsContact CD2-CZ 3.45Å; H134-F201 WeakPolarHBondContact CD2-CZ 3.29Å; H134-F201 AromaticContact NE2-CD1 3.83Å; H134-F201 AromaticContact NE2-CE1 3.4Å; H134-F201 WeakPolarHBondContact NE2-CE1 3.38Å; H134-F201 AromaticContact NE2-CZ 3.83Å
135P79.1Confident82.7Confident43 Ų4357.4 Ų57.428%0.27929%0.289SS..THydrogen-bonded Turntrans-57.8-32.4-174.420.7-33000113.8K137 H139P135-K137 VanDerWaalsContact C-N 3.31Å; P135-K137 PolarHBondContact O-N 3.05Å; P135-H139 PolarHBondContact O-CD2 2.87Å; P135-H139 PolarHBondContact O-NE2 3.25Å
136D79.4Confident82.4Confident119 Ų11956.7 Ų56.764%0.63628%0.283SS*.THydrogen-bonded Turntrans-73.5-18.4177.2-55.4-12.9000114.4H134 H139H134-D136 IonicContact CE1-OD2 3.22Å; H134-D136 PolarHBondContact CE1-OD2 3.31Å; H134-D136 PolarHBondContact ND1-N 3.38Å; H134-D136 IonicContact ND1-OD2 3.61Å; H134-D136 PolarHBondContact O-N 3.24Å; H134-D136 VanDerWaalsContact O-N 3.15Å; D136-H139 PolarHBondContact O-CE1 3.25Å
137K76.9Confident82.3Confident143 Ų14356.8 Ų56.862%0.62228%0.283SS*.THydrogen-bonded Turntrans-113.7-27.4-174-65.4-169.9178-176.10113.2Q94 H134 P135Q94-K137 PolarHBondContact NE2-O 2.94Å; H134-K137 HydrophobicContact CB-CB 4.43Å; H134-K137 PolarHBondContact O-N 3.1Å; P135-K137 VanDerWaalsContact C-N 3.31Å; P135-K137 PolarHBondContact O-N 3.05Å
138N80.1Confident82.3Confident2 Ų255.4 Ų55.41%0.01128%0.281CS..  trans-120.6111.6177.2-173-9.9000109.9K132 F133 H134 A140 A143K132-N138 WeakPolarHBondContact O-CB 3.48Å; K132-N138 PolarHBondContact O-ND2 3.21Å; F133-N138 VanDerWaalsContact CD1-ND2 3.31Å; F133-N138 WeakPolarHBondContact CD1-ND2 3.29Å; H134-N138 PolarHBondContact O-N 3.43Å; N138-A140 VanDerWaalsContact OD1-CB 3.27Å; N138-A140 WeakPolarHBondContact OD1-CB 3.35Å; N138-A140 PolarHBondContact OD1-N 2.92Å; N138-A143 HydrophobicContact CB-CB 4.42Å; N138-A143 WeakPolarHBondContact O-CB 3.41Å
139H79Confident82.1Confident69 Ų6949.5 Ų49.532%0.31926%0.255SS..  trans-10917-176.1-57.2114000112.7K88 P135 D136K88-H139 HydrophobicContact CB-CB 3.56Å; K88-H139 HydrophobicContact CD-CB 3.68Å; K88-H139 WeakPolarHBondContact CD-CD2 3.45Å; K88-H139 HydrophobicContact CG-CB 4.29Å; K88-H139 PolarHBondContact NZ-CD2 3.36Å; K88-H139 PolarHBondContact NZ-NE2 2.84Å; P135-H139 PolarHBondContact O-CD2 2.87Å; P135-H139 PolarHBondContact O-NE2 3.25Å; D136-H139 PolarHBondContact O-CE1 3.25Å
140A78.2Confident82.1Confident5 Ų548 Ų484%0.04125%0.247CC..SBendtrans-63.1147.617400000111.4F90 Q94 V95 V98 N138 G142 A143F90-A140 HydrophobicContact CB-CB 4.09Å; F90-A140 HydrophobicContact CG-CB 4.25Å; Q94-A140 HydrophobicContact CB-CB 4.23Å; V95-A140 HydrophobicContact CG2-CB 3.99Å; V98-A140 HydrophobicContact CG2-CB 4.09Å; N138-A140 VanDerWaalsContact OD1-CB 3.27Å; N138-A140 WeakPolarHBondContact OD1-CB 3.35Å; N138-A140 PolarHBondContact OD1-N 2.92Å; A140-G142 PolarHBondContact O-N 3.44Å; A140-A143 WeakPolarHBondContact O-CB 3.37Å; A140-A143 PolarHBondContact O-N 2.79Å
141P79.1Confident82.1Confident76 Ų7648 Ų4849%0.49425%0.248SC..THydrogen-bonded Turntrans-59.1123.2178.723.9-34.2000111V98V98-P141 WeakPolarHBondContact CG1-O 3.38Å
142G78.3Confident82.2Confident24 Ų2446.6 Ų46.625%0.24724%0.241CC..THydrogen-bonded Turntrans84.47.4-175.700000115.7V98 A140 T144 E145 A146V98-G142 VanDerWaalsContact CG1-C 3.46Å; V98-G142 WeakPolarHBondContact CG1-O 3.05Å; A140-G142 PolarHBondContact O-N 3.44Å; G142-T144 VanDerWaalsContact C-N 3.31Å; G142-T144 PolarHBondContact O-N 3.5Å; G142-E145 PolarHBondContact O-N 3.23Å; G142-E145 VanDerWaalsContact O-N 3.14Å; G142-A146 PolarHBondContact O-N 3.16Å
143A78.9Confident82.3Confident3 Ų342.6 Ų42.63%0.02522%0.223CC..Hα-helixtrans-56.7-41.517800000112.9V98 N138 A140 E145 A146 F147V98-A143 HydrophobicContact CG2-CB 3.96Å; N138-A143 HydrophobicContact CB-CB 4.42Å; N138-A143 WeakPolarHBondContact O-CB 3.41Å; A140-A143 WeakPolarHBondContact O-CB 3.37Å; A140-A143 PolarHBondContact O-N 2.79Å; A143-E145 VanDerWaalsContact C-N 3.34Å; A143-E145 PolarHBondContact O-N 3.41Å; A143-A146 PolarHBondContact O-N 3.42Å; A143-F147 WeakPolarHBondContact O-CB 3.37Å; A143-F147 PolarHBondContact O-N 3Å
144T81.3Confident82.5Confident75 Ų7543.3 Ų43.346%0.4623%0.226SC..Hα-helixtrans-60.7-39.8175.8-41.60000112.5G142 F147 K148G142-T144 VanDerWaalsContact C-N 3.31Å; G142-T144 PolarHBondContact O-N 3.5Å; T144-F147 PolarHBondContact O-N 2.99Å; T144-K148 WeakPolarHBondContact O-CG 3.2Å; T144-K148 PolarHBondContact O-N 3.35Å
145E82.9Confident82.5Confident105 Ų10542.7 Ų42.749%0.49123%0.226SC..Hα-helixtrans-69.3-40.6177.9-63173.7178.800111.5K102 G142 A143 K148 K149K102-E145 WeakPolarHBondContact CE-OE2 3.36Å; K102-E145 IonicContact NZ-OE2 2.62Å; K102-E145 PolarHBondContact NZ-OE2 3.49Å; G142-E145 PolarHBondContact O-N 3.23Å; G142-E145 VanDerWaalsContact O-N 3.14Å; A143-E145 VanDerWaalsContact C-N 3.34Å; A143-E145 PolarHBondContact O-N 3.41Å; E145-K148 PolarHBondContact O-N 3.19Å; E145-K149 PolarHBondContact O-N 3.23Å
146A84.1Confident82.9Confident0 Ų040.8 Ų40.80%021%0.214CC..Hα-helixtrans-63.4-41.5173.200000111.7V98 I101 F133 G142 A143 K149 I150V98-A146 HydrophobicContact CB-CB 4.47Å; V98-A146 HydrophobicContact CG1-CB 4.1Å; V98-A146 HydrophobicContact CG2-CB 4.36Å; I101-A146 HydrophobicContact CB-CB 4.06Å; I101-A146 HydrophobicContact CG2-CB 3.8Å; F133-A146 HydrophobicContact CD1-CB 4.49Å; G142-A146 PolarHBondContact O-N 3.16Å; A143-A146 PolarHBondContact O-N 3.42Å; A146-K149 PolarHBondContact O-N 3.17Å; A146-I150 WeakPolarHBondContact O-CD1 3.48Å; A146-I150 VanDerWaalsContact O-CG1 3.26Å; A146-I150 WeakPolarHBondContact O-CG1 3.28Å; A146-I150 PolarHBondContact O-N 2.92Å
147F86.4Confident83.2Confident4 Ų435.1 Ų35.12%0.01818%0.183CC..Hα-helixtrans-61.6-43.8175.2-175.1-97000112A130 F133 A143 T144 I150 G151 P197 E198 F201A130-F147 HydrophobicContact CB-CE2 3.96Å; F133-F147 HydrophobicContact CB-CD2 4.35Å; F133-F147 WeakPolarHBondContact O-CD2 3.32Å; A143-F147 WeakPolarHBondContact O-CB 3.37Å; A143-F147 PolarHBondContact O-N 3Å; T144-F147 PolarHBondContact O-N 2.99Å; F147-I150 WeakPolarHBondContact O-CB 3.14Å; F147-I150 PolarHBondContact O-N 3.08Å; F147-G151 PolarHBondContact O-N 3.14Å; F147-P197 HydrophobicContact CD1-CB 4.34Å; F147-P197 HydrophobicContact CE1-CB 4.04Å; F147-E198 HydrophobicContact CE1-CG 4.39Å; F147-F201 HydrophobicContact CZ-CB 4.33Å; F147-F201 HydrophobicContact CZ-CD2 4.32Å; F147-F201 HydrophobicContact CZ-CG 4.43Å
148K85.4Confident83.6Confident102 Ų10230.2 Ų30.244%0.44317%0.167SC..Hα-helixtrans-61.6-44.1174.4-73.6-178.1177.3-166.50112.5T144 E145 I150 G151 N152 P197T144-K148 WeakPolarHBondContact O-CG 3.2Å; T144-K148 PolarHBondContact O-N 3.35Å; E145-K148 PolarHBondContact O-N 3.19Å; K148-I150 PolarHBondContact O-N 3.42Å; K148-G151 PolarHBondContact O-N 3.46Å; K148-G151 VanDerWaalsContact O-N 3.17Å; K148-N152 PolarHBondContact O-N 2.88Å; K148-N152 PolarHBondContact O-OD1 2.89Å; K148-P197 HydrophobicContact CG-CG 4.42Å
149K85.4Confident83.8Confident40 Ų4032.8 Ų32.817%0.17418%0.181CC..Hα-helixtrans-59.2-43.6173-81.4176.1169.3-86.90112.5I101 V110 E145 A146 G151 N152 A153 E173I101-K149 HydrophobicContact CG2-CB 4.32Å; V110-K149 HydrophobicContact CG1-CB 4.41Å; E145-K149 PolarHBondContact O-N 3.23Å; A146-K149 PolarHBondContact O-N 3.17Å; K149-G151 VanDerWaalsContact C-N 3.33Å; K149-G151 PolarHBondContact O-N 3.42Å; K149-N152 PolarHBondContact O-N 2.84Å; K149-A153 VanDerWaalsContact O-CB 3.22Å; K149-A153 WeakPolarHBondContact O-CB 3.5Å; K149-A153 PolarHBondContact O-N 3.21Å; K149-E173 IonicContact NZ-OE2 2.87Å; K149-E173 PolarHBondContact NZ-OE2 3.34Å
150I87.1Confident84Confident0 Ų033 Ų330%019%0.189CC..Hα-helixtrans-58.7-44.3173.7-68.2156.1000111I101 V110 L111 Y126 L129 F133 A146 F147 K148 Y154I101-I150 HydrophobicContact CD1-CD1 3.62Å; I101-I150 HydrophobicContact CD1-CG1 3.93Å; I101-I150 HydrophobicContact CG2-CG1 4.17Å; V110-I150 HydrophobicContact CG1-CG1 4.33Å; L111-I150 HydrophobicContact CD2-CG2 4.03Å; Y126-I150 HydrophobicContact CD2-CG2 3.63Å; Y126-I150 HydrophobicContact CE2-CG2 3.93Å; L129-I150 HydrophobicContact CB-CD1 3.94Å; L129-I150 HydrophobicContact CB-CG1 4.27Å; L129-I150 HydrophobicContact CB-CG2 3.93Å; L129-I150 HydrophobicContact CD1-CG1 4.43Å; F133-I150 HydrophobicContact CB-CD1 3.82Å; F133-I150 HydrophobicContact CD2-CD1 3.68Å; F133-I150 HydrophobicContact CG-CD1 3.85Å; A146-I150 WeakPolarHBondContact O-CD1 3.48Å; A146-I150 VanDerWaalsContact O-CG1 3.26Å; A146-I150 WeakPolarHBondContact O-CG1 3.28Å; A146-I150 PolarHBondContact O-N 2.92Å; F147-I150 WeakPolarHBondContact O-CB 3.14Å; F147-I150 PolarHBondContact O-N 3.08Å; K148-I150 PolarHBondContact O-N 3.42Å; I150-Y154 WeakPolarHBondContact O-CB 3.46Å; I150-Y154 PolarHBondContact O-N 2.75Å
151G85.8Confident84.1Confident2 Ų235.3 Ų35.32%0.02121%0.208CC..Hα-helixtrans-61.5-51.717700000113.2F147 K148 K149 Y154 A155F147-G151 PolarHBondContact O-N 3.14Å; K148-G151 PolarHBondContact O-N 3.46Å; K148-G151 VanDerWaalsContact O-N 3.17Å; K149-G151 VanDerWaalsContact C-N 3.33Å; K149-G151 PolarHBondContact O-N 3.42Å; G151-Y154 PolarHBondContact O-N 2.94Å; G151-A155 WeakPolarHBondContact O-CB 3.26Å; G151-A155 PolarHBondContact O-N 3.45Å
152N85.1Confident84.2Confident46 Ų4633.4 Ų33.425%0.24619%0.192CC..Hα-helixtrans-61.4-46.4179.3-69.4-1.2000111.6K148 K149 Y154 A155 V156K148-N152 PolarHBondContact O-N 2.88Å; K148-N152 PolarHBondContact O-OD1 2.89Å; K149-N152 PolarHBondContact O-N 2.84Å; N152-Y154 VanDerWaalsContact C-N 3.34Å; N152-Y154 PolarHBondContact O-N 3.12Å; N152-A155 PolarHBondContact O-N 2.83Å; N152-V156 WeakPolarHBondContact O-CG2 3.29Å; N152-V156 PolarHBondContact O-N 2.67Å
153A87.9Confident84.6Confident0 Ų033.9 Ų33.90%019%0.186CC..Hα-helixtrans-56.3-47.2176.200000111.8Y107 V110 L111 K149 L157Y107-A153 HydrophobicContact CD1-CB 3.6Å; Y107-A153 HydrophobicContact CE1-CB 4.46Å; Y107-A153 HydrophobicContact CG-CB 3.87Å; V110-A153 HydrophobicContact CB-CB 4.09Å; V110-A153 HydrophobicContact CG1-CB 3.68Å; L111-A153 HydrophobicContact CD1-CB 4.42Å; L111-A153 HydrophobicContact CD2-CB 4.32Å; L111-A153 HydrophobicContact CG-CB 4.02Å; K149-A153 VanDerWaalsContact O-CB 3.22Å; K149-A153 WeakPolarHBondContact O-CB 3.5Å; K149-A153 PolarHBondContact O-N 3.21Å; A153-L157 VanDerWaalsContact O-CB 3.25Å; A153-L157 WeakPolarHBondContact O-CB 3.31Å; A153-L157 WeakPolarHBondContact O-CG 3.48Å; A153-L157 PolarHBondContact O-N 2.94Å
154Y87.4Confident84.8Confident21 Ų2142 Ų428%0.08222%0.216CC..Hα-helixtrans-69.1-40.8177.4178.5-105.4000112.4L111 L122 K123 Y126 I150 G151 N152 V156 L157 S158 L200L111-Y154 HydrophobicContact CD1-CD2 4.47Å; L122-Y154 HydrophobicContact CB-CD2 4.24Å; L122-Y154 HydrophobicContact CB-CE2 4.15Å; K123-Y154 HydrophobicContact CG-CE2 4.04Å; K123-Y154 WeakPolarHBondContact CG-OH 3.4Å; Y126-Y154 AromaticContact CD1-CD1 3.59Å; Y126-Y154 HydrophobicContact CD1-CD1 3.59Å; Y126-Y154 HydrophobicContact CD1-CD2 4.44Å; Y126-Y154 AromaticContact CD1-CE1 3.83Å; Y126-Y154 HydrophobicContact CD1-CE1 3.83Å; Y126-Y154 AromaticContact CD1-CG 3.95Å; Y126-Y154 HydrophobicContact CD1-CG 3.95Å; Y126-Y154 VanDerWaalsContact CD2-CB 3.42Å; Y126-Y154 AromaticContact CD2-CD1 3.86Å; Y126-Y154 HydrophobicContact CD2-CD1 3.86Å; Y126-Y154 HydrophobicContact CD2-CD2 4.49Å; Y126-Y154 AromaticContact CD2-CG 3.67Å; Y126-Y154 HydrophobicContact CD2-CG 3.67Å; Y126-Y154 AromaticContact CE1-CD1 3.9Å; Y126-Y154 HydrophobicContact CE1-CD1 3.9Å; Y126-Y154 HydrophobicContact CE1-CE1 4.18Å; Y126-Y154 HydrophobicContact CE2-CD1 4.17Å; Y126-Y154 HydrophobicContact CE2-CG 4.37Å; Y126-Y154 AromaticContact CG-CD1 3.58Å; Y126-Y154 HydrophobicContact CG-CD1 3.58Å; Y126-Y154 AromaticContact CG-CD2 3.92Å; Y126-Y154 HydrophobicContact CG-CD2 3.92Å; Y126-Y154 HydrophobicContact CG-CE1 4.2Å; Y126-Y154 HydrophobicContact CG-CE2 4.49Å; Y126-Y154 AromaticContact CG-CG 3.44Å; Y126-Y154 HydrophobicContact CG-CG 3.44Å; Y126-Y154 VanDerWaalsContact CG-CG 3.44Å; I150-Y154 WeakPolarHBondContact O-CB 3.46Å; I150-Y154 PolarHBondContact O-N 2.75Å; G151-Y154 PolarHBondContact O-N 2.94Å; N152-Y154 VanDerWaalsContact C-N 3.34Å; N152-Y154 PolarHBondContact O-N 3.12Å; Y154-V156 VanDerWaalsContact C-N 3.34Å; Y154-V156 PolarHBondContact O-N 3.04Å; Y154-L157 PolarHBondContact O-N 3.06Å; Y154-S158 WeakPolarHBondContact O-CB 3.41Å; Y154-S158 PolarHBondContact O-N 3.49Å; Y154-S158 PolarHBondContact O-OG 2.97Å; Y154-L200 HydrophobicContact CD1-CD2 3.74Å; Y154-L200 HydrophobicContact CE1-CD2 4.09Å
155A85.2Confident84.7Confident17 Ų1743.5 Ų43.514%0.1422%0.218CC..Hα-helixtrans-64.6-34.3179.800000113.6G151 N152 A193 L200G151-A155 WeakPolarHBondContact O-CB 3.26Å; G151-A155 PolarHBondContact O-N 3.45Å; N152-A155 PolarHBondContact O-N 2.83Å; A155-A193 HydrophobicContact CB-CB 3.52Å; A155-L200 HydrophobicContact CB-CD2 4.41Å
156V86.3Confident84.7Confident3 Ų338.9 Ų38.92%0.01820%0.196CC..Hα-helixtrans-73.9-49.6172.5174.70000110.6Y107 N152 Y154 N159 K162 R163 Y166Y107-V156 HydrophobicContact CD2-CB 4.06Å; Y107-V156 HydrophobicContact CD2-CG1 3.98Å; Y107-V156 HydrophobicContact CE2-CB 3.89Å; Y107-V156 HydrophobicContact CE2-CG1 3.86Å; Y107-V156 HydrophobicContact CE2-CG2 3.86Å; N152-V156 WeakPolarHBondContact O-CG2 3.29Å; N152-V156 PolarHBondContact O-N 2.67Å; Y154-V156 VanDerWaalsContact C-N 3.34Å; Y154-V156 PolarHBondContact O-N 3.04Å; V156-N159 PolarHBondContact O-N 3.25Å; V156-K162 HydrophobicContact CG1-CB 4.24Å; V156-R163 PolarHBondContact O-N 2.93Å; V156-R163 VanDerWaalsContact O-N 3.16Å; V156-Y166 HydrophobicContact CG1-CG 4.2Å
157L87.4Confident84.8Confident0 Ų042.6 Ų42.60%022%0.216CC..Hα-helixtrans-74.9-26.7-174-65.4-178.9000114.1Y108 L111 L122 A153 Y154 N159 R163 Y166Y108-L157 HydrophobicContact CD1-CD1 3.63Å; Y108-L157 HydrophobicContact CD1-CD2 4.31Å; Y108-L157 HydrophobicContact CD2-CD1 4.42Å; Y108-L157 HydrophobicContact CD2-CD2 4.41Å; Y108-L157 HydrophobicContact CE1-CD1 3.79Å; Y108-L157 HydrophobicContact CE1-CD2 3.69Å; Y108-L157 HydrophobicContact CE1-CG 4.33Å; Y108-L157 HydrophobicContact CE2-CD2 3.82Å; Y108-L157 HydrophobicContact CG-CD1 3.98Å; Y108-L157 VanDerWaalsContact CZ-CD2 3.43Å; L111-L157 HydrophobicContact CD1-CD1 4.03Å; L122-L157 HydrophobicContact CD1-CB 4Å; L122-L157 HydrophobicContact CD2-CB 3.97Å; L122-L157 HydrophobicContact CD2-CD1 3.94Å; A153-L157 VanDerWaalsContact O-CB 3.25Å; A153-L157 WeakPolarHBondContact O-CB 3.31Å; A153-L157 WeakPolarHBondContact O-CG 3.48Å; A153-L157 PolarHBondContact O-N 2.94Å; Y154-L157 PolarHBondContact O-N 3.06Å; L157-N159 VanDerWaalsContact C-N 3.26Å; L157-N159 PolarHBondContact O-N 2.76Å; L157-R163 HydrophobicContact CD2-CB 4.46Å; L157-R163 HydrophobicContact CD2-CG 3.92Å; L157-R163 WeakPolarHBondContact O-CD 3.1Å; L157-Y166 HydrophobicContact CD2-CD1 3.99Å; L157-Y166 HydrophobicContact CD2-CE1 4.36Å
158S83.8Confident84.5Confident41 Ų4148.5 Ų48.529%0.28725%0.252SS..THydrogen-bonded Turntrans-75.9-13.7178.471.20000113.6Y154Y154-S158 WeakPolarHBondContact O-CB 3.41Å; Y154-S158 PolarHBondContact O-N 3.49Å; Y154-S158 PolarHBondContact O-OG 2.97Å
159N84Confident83.9Confident56 Ų5648.9 Ų48.930%0.29926%0.263SS..SBendtrans-101.4116.6175.4-178.3-39.9000109.2V156 L157 A161 K162 R163V156-N159 PolarHBondContact O-N 3.25Å; L157-N159 VanDerWaalsContact C-N 3.26Å; L157-N159 PolarHBondContact O-N 2.76Å; N159-A161 PolarHBondContact O-N 2.65Å; N159-A161 WeakPolarHBondContact OD1-CB 3.26Å; N159-A161 PolarHBondContact OD1-N 2.92Å; N159-K162 HydrophobicContact CB-CB 4.17Å; N159-K162 HydrophobicContact CB-CG 4.33Å; N159-K162 PolarHBondContact O-N 3.31Å; N159-K162 PolarHBondContact OD1-N 3.05Å; N159-R163 VanDerWaalsContact O-CB 3.28Å; N159-R163 WeakPolarHBondContact O-CB 3.37Å; N159-R163 PolarHBondContact O-N 3.15Å
160P83.3Confident82.8Confident73 Ų7348.7 Ų48.747%0.47427%0.273SS..Hα-helixtrans-67.5-11.8-173.828.1-36.4000114.5R164P160-R164 WeakPolarHBondContact O-CG 3.5Å; P160-R164 PolarHBondContact O-NE 3.26Å
161A81.1Confident81.4Confident54 Ų5449.8 Ų49.845%0.44628%0.284SS..Hα-helixtrans-86.9-49.1170.600000111.6N159 R163 R164 Q165N159-A161 PolarHBondContact O-N 2.65Å; N159-A161 WeakPolarHBondContact OD1-CB 3.26Å; N159-A161 PolarHBondContact OD1-N 2.92Å; A161-R163 PolarHBondContact O-N 3.39Å; A161-R164 PolarHBondContact O-N 3.3Å; A161-Q165 WeakPolarHBondContact O-CG 3.32Å; A161-Q165 PolarHBondContact O-N 3.47Å
162K81.9Confident79.7Confident36 Ų3657 Ų5716%0.15732%0.317CS..Hα-helixtrans-65.1-37.8177-63.8-166178.8-173.30111.4V156 N159 Q165 Y166 E192 D194V156-K162 HydrophobicContact CG1-CB 4.24Å; N159-K162 HydrophobicContact CB-CB 4.17Å; N159-K162 HydrophobicContact CB-CG 4.33Å; N159-K162 PolarHBondContact O-N 3.31Å; N159-K162 PolarHBondContact OD1-N 3.05Å; K162-Q165 PolarHBondContact O-N 2.73Å; K162-Y166 WeakPolarHBondContact O-CB 3.42Å; K162-Y166 PolarHBondContact O-N 3.2Å; K162-E192 PolarHBondContact NZ-O 3.33Å; K162-D194 IonicContact NZ-OD2 3.41Å; K162-D194 PolarHBondContact NZ-OD2 2.93Å
163R86.6Confident78.1Confident33 Ų3356.4 Ų56.413%0.12531%0.313CS..Hα-helixtrans-56.8-51.5171.6-177.9170.5179.3176.72.4112.1Y108 K115 A117 D119 V156 L157 N159 A161 Q165 Y166 D167Y108-R163 WeakPolarHBondContact OH-CG 3.31Å; Y108-R163 PolarHBondContact OH-NE 3.49Å; K115-R163 PolarHBondContact O-NH2 3.07Å; A117-R163 PolarHBondContact O-NH1 2.73Å; A117-R163 PolarHBondContact O-NH2 2.93Å; D119-R163 IonicContact OD1-NH1 3.6Å; V156-R163 PolarHBondContact O-N 2.93Å; V156-R163 VanDerWaalsContact O-N 3.16Å; L157-R163 HydrophobicContact CD2-CB 4.46Å; L157-R163 HydrophobicContact CD2-CG 3.92Å; L157-R163 WeakPolarHBondContact O-CD 3.1Å; N159-R163 VanDerWaalsContact O-CB 3.28Å; N159-R163 WeakPolarHBondContact O-CB 3.37Å; N159-R163 PolarHBondContact O-N 3.15Å; A161-R163 PolarHBondContact O-N 3.39Å; R163-Q165 VanDerWaalsContact C-N 3.33Å; R163-Q165 PolarHBondContact O-N 2.99Å; R163-Y166 WeakPolarHBondContact O-CB 3.21Å; R163-Y166 PolarHBondContact O-N 3.2Å; R163-D167 WeakPolarHBondContact CG-OD2 3.45Å; R163-D167 WeakPolarHBondContact O-CB 3.42Å; R163-D167 PolarHBondContact O-N 2.84Å
164R83.6Confident76Confident175 Ų17560.9 Ų60.966%0.6634%0.342SS*.Hα-helixtrans-61-39.1177-79.8-176-118-152.2-5.4113P160 A161 V168P160-R164 WeakPolarHBondContact O-CG 3.5Å; P160-R164 PolarHBondContact O-NE 3.26Å; A161-R164 PolarHBondContact O-N 3.3Å; R164-V168 WeakPolarHBondContact O-CB 3.48Å; R164-V168 VanDerWaalsContact O-CG2 3.22Å; R164-V168 WeakPolarHBondContact O-CG2 3.48Å; R164-V168 PolarHBondContact O-N 2.86Å; R164-V168 VanDerWaalsContact O-N 3.07Å
165Q79.1Confident73.6Confident105 Ų10565.3 Ų65.349%0.49138%0.376SS..Hα-helixtrans-63.8-46175.4-72.4171.3-16.800111A161 K162 R163 V168 T169 F191A161-Q165 WeakPolarHBondContact O-CG 3.32Å; A161-Q165 PolarHBondContact O-N 3.47Å; K162-Q165 PolarHBondContact O-N 2.73Å; R163-Q165 VanDerWaalsContact C-N 3.33Å; R163-Q165 PolarHBondContact O-N 2.99Å; Q165-V168 PolarHBondContact O-N 3.31Å; Q165-T169 WeakPolarHBondContact O-CB 3.35Å; Q165-T169 PolarHBondContact O-N 2.85Å; Q165-T169 PolarHBondContact O-OG1 3.4Å; Q165-T169 VanDerWaalsContact O-OG1 3.1Å; Q165-F191 HydrophobicContact CB-CZ 4.24Å
166Y82.8Confident71.3Confident9 Ų969.1 Ų69.14%0.03540%0.401CS..Hα-helixtrans-60.5-45.6175177.9-107.1000112.8D106 Y107 Y108 V156 L157 K162 R163 V168 T169 G170 G171D106-Y166 WeakPolarHBondContact CA-OH 3.49Å; Y107-Y166 AromaticContact CD2-CD1 3.9Å; Y107-Y166 HydrophobicContact CD2-CD1 3.9Å; Y107-Y166 AromaticContact CD2-CD2 3.65Å; Y107-Y166 HydrophobicContact CD2-CD2 3.65Å; Y107-Y166 AromaticContact CD2-CE1 3.61Å; Y107-Y166 HydrophobicContact CD2-CE1 3.61Å; Y107-Y166 AromaticContact CD2-CE2 3.36Å; Y107-Y166 HydrophobicContact CD2-CE2 3.36Å; Y107-Y166 AromaticContact CD2-CG 3.9Å; Y107-Y166 HydrophobicContact CD2-CG 3.9Å; Y107-Y166 AromaticContact CD2-CZ 3.33Å; Y107-Y166 AromaticContact CE2-CD2 3.58Å; Y107-Y166 HydrophobicContact CE2-CD2 3.58Å; Y107-Y166 AromaticContact CE2-CE2 3.46Å; Y107-Y166 HydrophobicContact CE2-CE2 3.46Å; Y107-Y166 VanDerWaalsContact CE2-CE2 3.46Å; Y107-Y166 HydrophobicContact CE2-CG 4.18Å; Y107-Y166 AromaticContact CE2-CZ 3.95Å; Y107-Y166 HydrophobicContact CG-CE1 4.11Å; Y107-Y166 HydrophobicContact CG-CE2 4.15Å; Y107-Y166 AromaticContact CG-CZ 3.77Å; Y107-Y166 PolarHBondContact N-OH 2.92Å; Y108-Y166 HydrophobicContact CD2-CE1 4.28Å; Y108-Y166 HydrophobicContact CE2-CD1 4.31Å; Y108-Y166 HydrophobicContact CE2-CE1 4.07Å; V156-Y166 HydrophobicContact CG1-CG 4.2Å; L157-Y166 HydrophobicContact CD2-CD1 3.99Å; L157-Y166 HydrophobicContact CD2-CE1 4.36Å; K162-Y166 WeakPolarHBondContact O-CB 3.42Å; K162-Y166 PolarHBondContact O-N 3.2Å; R163-Y166 WeakPolarHBondContact O-CB 3.21Å; R163-Y166 PolarHBondContact O-N 3.2Å; Y166-V168 PolarHBondContact O-N 3.38Å; Y166-T169 PolarHBondContact O-N 2.91Å; Y166-G170 PolarHBondContact O-N 3.31Å; Y166-G171 WeakPolarHBondContact OH-CA 3.46Å; Y166-G171 PolarHBondContact OH-O 2.76Å
167D85.1Confident69.4Low78 Ų7874.9 Ų74.942%0.41744%0.439SS..Hα-helixtrans-63.2-29.1178.2-64.1-30000112.6Y108 R163Y108-D167 VanDerWaalsContact CE2-OD1 3.25Å; Y108-D167 WeakPolarHBondContact CE2-OD1 3.25Å; Y108-D167 VanDerWaalsContact OH-CG 3.29Å; Y108-D167 PolarHBondContact OH-OD1 3.5Å; Y108-D167 PolarHBondContact OH-OD2 2.83Å; R163-D167 WeakPolarHBondContact CG-OD2 3.45Å; R163-D167 WeakPolarHBondContact O-CB 3.42Å; R163-D167 PolarHBondContact O-N 2.84Å
168V80.4Confident66.8Low127 Ų12780.5 Ų80.577%0.7748%0.478SS*.Hα-helixtrans-87.3-38.4179169.30000112.9R164 Q165 Y166 G170R164-V168 WeakPolarHBondContact O-CB 3.48Å; R164-V168 VanDerWaalsContact O-CG2 3.22Å; R164-V168 WeakPolarHBondContact O-CG2 3.48Å; R164-V168 PolarHBondContact O-N 2.86Å; R164-V168 VanDerWaalsContact O-N 3.07Å; Q165-V168 PolarHBondContact O-N 3.31Å; Y166-V168 PolarHBondContact O-N 3.38Å; V168-G170 VanDerWaalsContact C-N 3.28Å; V168-G170 PolarHBondContact O-N 2.96Å
169T72.5Confident64.9Low110 Ų11087.6 Ų87.668%0.67551%0.507SS*.Hα-helixtrans-74.4-19.2-179.4-62.10000112.7Q165 Y166Q165-T169 WeakPolarHBondContact O-CB 3.35Å; Q165-T169 PolarHBondContact O-N 2.85Å; Q165-T169 PolarHBondContact O-OG1 3.4Å; Q165-T169 VanDerWaalsContact O-OG1 3.1Å; Y166-T169 PolarHBondContact O-N 2.91Å
170G62Low62.1Low37 Ų3790.3 Ų90.338%0.38153%0.53SS..  trans97.5144.6-178.300000111.6Y166 V168 E172Y166-G170 PolarHBondContact O-N 3.31Å; V168-G170 VanDerWaalsContact C-N 3.28Å; V168-G170 PolarHBondContact O-N 2.96Å; G170-E172 PolarHBondContact O-N 2.94Å
171G57.7Low59.8Low23 Ų2395.5 Ų95.524%0.23755%0.548CS..SBendtrans-69.38.4-162.600000117.7Y166 E173Y166-G171 WeakPolarHBondContact OH-CA 3.46Å; Y166-G171 PolarHBondContact OH-O 2.76Å; G171-E173 PolarHBondContact O-N 3.43Å
172E49.9Very low57.3Low152 Ų15296.6 Ų96.671%0.7156%0.564SS**  trans-75.5106.1179.8-61.1-152.412500111G170G170-E172 PolarHBondContact O-N 2.94Å
173E51.7Low54.8Low35 Ų3599.1 Ų99.116%0.16460%0.6CS.*PPolyproline II helixtrans-57.5123.6159.2-170.4-172.8-131.400107.9Y107 K149 G171 S175Y107-E173 HydrophobicContact CE1-CB 4.26Å; Y107-E173 HydrophobicContact CE1-CG 3.98Å; K149-E173 IonicContact NZ-OE2 2.87Å; K149-E173 PolarHBondContact NZ-OE2 3.34Å; G171-E173 PolarHBondContact O-N 3.43Å; E173-S175 PolarHBondContact O-N 3.38Å
174P45Very low52Low94 Ų94100.8 Ų100.861%0.6163%0.628SS**PPolyproline II helixtrans-61.2116.9177.824-32.2000108.8S176P174-S176 PolarHBondContact O-N 3Å
175S36.9Very low49.5Very low114 Ų114101.8 Ų101.880%0.79764%0.637SS**PPolyproline II helixtrans-58.1130.5-17253.20000111.9E173E173-S175 PolarHBondContact O-N 3.38Å
176S36.3Very low47.2Very low96 Ų96103.2 Ų103.267%0.67165%0.648SS**SBendtrans-62.2166.3-177.7-35.50000113.3P174P174-S176 PolarHBondContact O-N 3Å
177P47.4Very low44.9Very low124 Ų124112.9 Ų112.981%0.80569%0.691SS**PPolyproline II helix-87138.6-100.635.5-28.5000113.3
178S31.7Very low42.7Very low118 Ų118116.6 Ų116.683%0.82571%0.705SS**PPolyproline II helixtrans-95.611616762.80000111.6S180S178-S180 PolarHBondContact O-N 3.18Å
179Q43Very low40.8Very low191 Ų191118.9 Ų118.989%0.89370%0.7SS**PPolyproline II helixtrans-57.4118.4173-167168.51700111.9
180S25.7Very low39.3Very low112 Ų112116 Ų11678%0.78369%0.692SS**  trans-149.5138163.9-170.30000110.6S178S178-S180 PolarHBondContact O-N 3.18Å
181H35.7Very low38.5Very low183 Ų183118.1 Ų118.185%0.84769%0.691SS**  trans-88.4127.5179.6-78.823000110.9
182G28.9Very low38.1Very low77 Ų77123.6 Ų123.679%0.79471%0.711SS**  trans158.9121.3169.500000111.7
183G29.7Very low38.2Very low89 Ų89117.8 Ų117.892%0.91869%0.688SS**  trans-82.5149.8179.500000112.7
184G27.4Very low38.2Very low68 Ų68121.3 Ų121.370%0.70171%0.708SS**SBendtrans160.261.9172.100000116.9
185F30.7Very low38.8Very low196 Ų196119.8 Ų119.886%0.8670%0.697SS**  trans57.580.2165.4-74.2-93.2000116.9F187F185-F187 PolarHBondContact O-N 3.49Å
186D31.6Very low40.1Very low134 Ų134117.2 Ų117.272%0.71768%0.677SS**  trans-53.8117.6178.5-67.1-84.6000116.2H188D186-H188 PolarHBondContact O-N 2.83Å
187F32.9Very low41.3Very low213 Ų213113.3 Ų113.393%0.93465%0.649SS**G310 helixtrans-74.6-3.2162.6-142.4-100.5000112.7F185 R189F185-F187 PolarHBondContact O-N 3.49Å; F187-R189 PolarHBondContact O-N 3.16Å
188H39.1Very low42Very low155 Ų155110.4 Ų110.472%0.71863%0.625SS**G310 helixtrans-82-6.3-171.9-92.8-73.6000115.8D186 G190D186-H188 PolarHBondContact O-N 2.83Å; H188-G190 PolarHBondContact O-N 2.92Å
189R40.3Very low43.6Very low175 Ų175108.8 Ų108.866%0.6661%0.607SS**G310 helixtrans-78.95.1-174.7-145.2-178-171.9-160.2-0.4115.3F187F187-R189 PolarHBondContact O-N 3.16Å
190G42.2Very low44.7Very low50 Ų50100.9 Ų100.952%0.51557%0.571SS.*G310 helixtrans-85.6-22.5-174.100000116H188H188-G190 PolarHBondContact O-N 2.92Å
191F45.1Very low46.6Very low82 Ų8296.6 Ų96.636%0.3654%0.538SS..SBendtrans-111.7-8.1-173.5-96.2-86.1000115.2Q165Q165-F191 HydrophobicContact CB-CZ 4.24Å
192E48.9Very low48.2Very low138 Ų13892.3 Ų92.365%0.64552%0.522SS*.SBendtrans-69.3152.4163.2-89.3-169.5139.200110.7K162K162-E192 PolarHBondContact NZ-O 3.33Å
193A51.8Low49.9Very low29 Ų2994 Ų9424%0.2451%0.51CS..  trans-73.8130.117100000109.3A155 V195A155-A193 HydrophobicContact CB-CB 3.52Å; A193-V195 WeakPolarHBondContact CB-O 3.44Å; A193-V195 PolarHBondContact O-N 2.65Å
194D51.3Low51.5Low109 Ų10993 Ų9358%0.58348%0.481SS*.SBendtrans-66.54.1173.1-53.1-87.7000113.2K162K162-D194 IonicContact NZ-OD2 3.41Å; K162-D194 PolarHBondContact NZ-OD2 2.93Å
195V57.8Low53.2Low63 Ų6393.1 Ų93.138%0.38246%0.462SS..SBendtrans-138.8126.3-179-177.60000106.5A193 D199 L200A193-V195 WeakPolarHBondContact CB-O 3.44Å; A193-V195 PolarHBondContact O-N 2.65Å; V195-D199 HydrophobicContact CG1-CB 3.72Å; V195-L200 HydrophobicContact CG1-CB 3.98Å
196T64.8Low54.6Low60 Ų6086.4 Ų86.437%0.36845%0.448SS..  trans-66.5153.718069.30000111.2E198 D199 L200T196-E198 PolarHBondContact O-N 3.47Å; T196-E198 VanDerWaalsContact O-N 3.15Å; T196-D199 WeakPolarHBondContact CB-OD2 3.39Å; T196-D199 WeakPolarHBondContact CG2-OD2 3.32Å; T196-D199 PolarHBondContact O-N 2.87Å; T196-D199 VanDerWaalsContact O-N 3.11Å; T196-D199 WeakPolarHBondContact OG1-CB 3.22Å; T196-D199 PolarHBondContact OG1-N 3.19Å; T196-D199 PolarHBondContact OG1-OD2 2.9Å; T196-L200 WeakPolarHBondContact O-CB 3.35Å; T196-L200 PolarHBondContact O-N 3.22Å
197P62.4Low55.5Low13 Ų1384.1 Ų84.18%0.08446%0.456CS..Hα-helixtrans-51.1-34.7172.2-30.638.1000113.6Y126 F147 K148 F201Y126-P197 PolarHBondContact OH-O 2.98Å; F147-P197 HydrophobicContact CD1-CB 4.34Å; F147-P197 HydrophobicContact CE1-CB 4.04Å; K148-P197 HydrophobicContact CG-CG 4.42Å; P197-F201 WeakPolarHBondContact O-CB 3.46Å; P197-F201 PolarHBondContact O-N 3.38Å; P197-F201 VanDerWaalsContact O-N 3.13Å
198E62Low55.9Low63 Ų6377 Ų7729%0.29444%0.442SS..Hα-helixtrans-71.9-45.2177-63.276.9-171.600111.9F147 T196 F201 N202F147-E198 HydrophobicContact CE1-CG 4.39Å; T196-E198 PolarHBondContact O-N 3.47Å; T196-E198 VanDerWaalsContact O-N 3.15Å; E198-F201 PolarHBondContact O-N 2.95Å; E198-N202 WeakPolarHBondContact O-CB 3.29Å; E198-N202 PolarHBondContact O-N 3.46Å; E198-N202 PolarHBondContact O-ND2 2.88Å
199D64.6Low55.9Low85 Ų8577.4 Ų77.446%0.45544%0.442SS..Hα-helixtrans-65.2-38.8174.7-65.2-43.5000112.1V195 T196 F201 N202 M203V195-D199 HydrophobicContact CG1-CB 3.72Å; T196-D199 WeakPolarHBondContact CB-OD2 3.39Å; T196-D199 WeakPolarHBondContact CG2-OD2 3.32Å; T196-D199 PolarHBondContact O-N 2.87Å; T196-D199 VanDerWaalsContact O-N 3.11Å; T196-D199 WeakPolarHBondContact OG1-CB 3.22Å; T196-D199 PolarHBondContact OG1-N 3.19Å; T196-D199 PolarHBondContact OG1-OD2 2.9Å; D199-F201 VanDerWaalsContact C-N 3.3Å; D199-F201 PolarHBondContact O-N 3.45Å; D199-N202 PolarHBondContact O-N 3.1Å; D199-M203 WeakPolarHBondContact O-CB 3.35Å; D199-M203 PolarHBondContact O-N 3.27Å
200L65.2Low56.4Low25 Ų2574.7 Ų74.713%0.13145%0.447CS..Hα-helixtrans-65.5-35.9177.2-172.658.7000111.5Y126 Y154 A155 V195 T196 M203 F204Y126-L200 HydrophobicContact CE1-CG 4.48Å; Y154-L200 HydrophobicContact CD1-CD2 3.74Å; Y154-L200 HydrophobicContact CE1-CD2 4.09Å; A155-L200 HydrophobicContact CB-CD2 4.41Å; V195-L200 HydrophobicContact CG1-CB 3.98Å; T196-L200 WeakPolarHBondContact O-CB 3.35Å; T196-L200 PolarHBondContact O-N 3.22Å; L200-M203 HydrophobicContact CD1-CE 3.83Å; L200-F204 WeakPolarHBondContact O-CB 3.38Å; L200-F204 PolarHBondContact O-N 3.2Å
201F66.9Low56.2Low21 Ų2177.5 Ų77.59%0.09246%0.459CS..Hα-helixtrans-68.7-47.6170.9-173.9-90.1000111.2A130 L131 H134 F147 P197 E198 D199 M203 F204 F205A130-F201 HydrophobicContact CB-CD2 3.82Å; A130-F201 HydrophobicContact CB-CE2 3.94Å; L131-F201 HydrophobicContact CD2-CE2 4.4Å; L131-F201 HydrophobicContact CD2-CZ 4.3Å; H134-F201 AromaticContact CD2-CE1 3.53Å; H134-F201 AromaticContact CD2-CE2 3.89Å; H134-F201 AromaticContact CD2-CZ 3.45Å; H134-F201 VanDerWaalsContact CD2-CZ 3.45Å; H134-F201 WeakPolarHBondContact CD2-CZ 3.29Å; H134-F201 AromaticContact NE2-CD1 3.83Å; H134-F201 AromaticContact NE2-CE1 3.4Å; H134-F201 WeakPolarHBondContact NE2-CE1 3.38Å; H134-F201 AromaticContact NE2-CZ 3.83Å; F147-F201 HydrophobicContact CZ-CB 4.33Å; F147-F201 HydrophobicContact CZ-CD2 4.32Å; F147-F201 HydrophobicContact CZ-CG 4.43Å; P197-F201 WeakPolarHBondContact O-CB 3.46Å; P197-F201 PolarHBondContact O-N 3.38Å; P197-F201 VanDerWaalsContact O-N 3.13Å; E198-F201 PolarHBondContact O-N 2.95Å; D199-F201 VanDerWaalsContact C-N 3.3Å; D199-F201 PolarHBondContact O-N 3.45Å; F201-M203 VanDerWaalsContact C-N 3.33Å; F201-M203 PolarHBondContact O-N 3.02Å; F201-F204 CarbonylContact O-C 3.54Å; F201-F204 PolarHBondContact O-N 2.98Å; F201-F205 HydrophobicContact CB-CD2 4.48Å; F201-F205 HydrophobicContact CD1-CB 4.22Å; F201-F205 HydrophobicContact CD1-CD2 4.01Å; F201-F205 HydrophobicContact CD1-CG 4.48Å; F201-F205 AromaticContact CD2-CD2 3.22Å; F201-F205 HydrophobicContact CD2-CD2 3.22Å; F201-F205 AromaticContact CD2-CE2 3.31Å; F201-F205 HydrophobicContact CD2-CE2 3.31Å; F201-F205 HydrophobicContact CD2-CG 4.22Å; F201-F205 HydrophobicContact CD2-CZ 4.35Å; F201-F205 HydrophobicContact CE1-CB 3.82Å; F201-F205 AromaticContact CE1-CD2 3.96Å; F201-F205 HydrophobicContact CE1-CD2 3.96Å; F201-F205 HydrophobicContact CE1-CG 4.08Å; F201-F205 HydrophobicContact CE2-CB 4.47Å; F201-F205 HydrophobicContact CE2-CD1 4.43Å; F201-F205 AromaticContact CE2-CD2 3.18Å; F201-F205 HydrophobicContact CE2-CD2 3.18Å; F201-F205 HydrophobicContact CE2-CE1 4.46Å; F201-F205 AromaticContact CE2-CE2 3.22Å; F201-F205 HydrophobicContact CE2-CE2 3.22Å; F201-F205 AromaticContact CE2-CG 3.82Å; F201-F205 HydrophobicContact CE2-CG 3.82Å; F201-F205 AromaticContact CE2-CZ 3.88Å; F201-F205 HydrophobicContact CE2-CZ 3.88Å; F201-F205 AromaticContact CG-CD2 3.66Å; F201-F205 HydrophobicContact CG-CD2 3.66Å; F201-F205 HydrophobicContact CG-CE2 4.18Å; F201-F205 HydrophobicContact CZ-CB 3.96Å; F201-F205 HydrophobicContact CZ-CD1 4.36Å; F201-F205 AromaticContact CZ-CD2 3.56Å; F201-F205 HydrophobicContact CZ-CD2 3.56Å; F201-F205 HydrophobicContact CZ-CE2 4.02Å; F201-F205 AromaticContact CZ-CG 3.73Å; F201-F205 HydrophobicContact CZ-CG 3.73Å; F201-F205 WeakPolarHBondContact O-CD2 3.36Å; F201-F205 PolarHBondContact O-N 3.47Å
202N69.1Low55.7Low94 Ų9478.9 Ų78.950%0.50348%0.479SS..Hα-helixtrans-61.3-39.4179.1-71.4-29.2000112.4E198 D199 F204 G206E198-N202 WeakPolarHBondContact O-CB 3.29Å; E198-N202 PolarHBondContact O-N 3.46Å; E198-N202 PolarHBondContact O-ND2 2.88Å; D199-N202 PolarHBondContact O-N 3.1Å; N202-F204 PolarHBondContact O-N 3.29Å; N202-G206 WeakPolarHBondContact O-CA 3.43Å; N202-G206 PolarHBondContact O-N 3.49Å
203M65.2Low54.9Low112 Ų11277.5 Ų77.555%0.55248%0.484SS*.Hα-helixtrans-61.8-24.5173.7-171.1-179.376.100113.1D199 L200 F201 F209D199-M203 WeakPolarHBondContact O-CB 3.35Å; D199-M203 PolarHBondContact O-N 3.27Å; L200-M203 HydrophobicContact CD1-CE 3.83Å; F201-M203 VanDerWaalsContact C-N 3.33Å; F201-M203 PolarHBondContact O-N 3.02Å; M203-F209 VanDerWaalsContact O-CE2 3.23Å; M203-F209 WeakPolarHBondContact O-CE2 3.12Å
204F62.6Low54.2Low69 Ų6980.9 Ų80.930%0.30351%0.512SS..Hα-helixtrans-107.6-24.7-173.3-168.7-87.6000114R127 L200 F201 N202R127-F204 HydrophobicContact CB-CE1 4.29Å; R127-F204 HydrophobicContact CG-CE1 4.23Å; R127-F204 VanDerWaalsContact NH2-CE1 3.28Å; L200-F204 WeakPolarHBondContact O-CB 3.38Å; L200-F204 PolarHBondContact O-N 3.2Å; F201-F204 CarbonylContact O-C 3.54Å; F201-F204 PolarHBondContact O-N 2.98Å; N202-F204 PolarHBondContact O-N 3.29Å
205F63.9Low53.3Low70 Ų7083.8 Ų83.831%0.30752%0.522SS..Hα-helixtrans-124.8-16.3-176.8-62.5-85.6000114.1R127 L131 F201 G207R127-F205 HydrophobicContact CB-CZ 4.34Å; R127-F205 HydrophobicContact CG-CE1 4.17Å; R127-F205 HydrophobicContact CG-CZ 3.86Å; L131-F205 HydrophobicContact CD1-CE1 4.12Å; L131-F205 HydrophobicContact CD1-CZ 4.45Å; L131-F205 HydrophobicContact CD2-CD1 4.45Å; L131-F205 HydrophobicContact CD2-CE1 4Å; L131-F205 HydrophobicContact CD2-CZ 4.37Å; L131-F205 HydrophobicContact CG-CE1 4.08Å; L131-F205 HydrophobicContact CG-CZ 4.15Å; F201-F205 HydrophobicContact CB-CD2 4.48Å; F201-F205 HydrophobicContact CD1-CB 4.22Å; F201-F205 HydrophobicContact CD1-CD2 4.01Å; F201-F205 HydrophobicContact CD1-CG 4.48Å; F201-F205 AromaticContact CD2-CD2 3.22Å; F201-F205 HydrophobicContact CD2-CD2 3.22Å; F201-F205 AromaticContact CD2-CE2 3.31Å; F201-F205 HydrophobicContact CD2-CE2 3.31Å; F201-F205 HydrophobicContact CD2-CG 4.22Å; F201-F205 HydrophobicContact CD2-CZ 4.35Å; F201-F205 HydrophobicContact CE1-CB 3.82Å; F201-F205 AromaticContact CE1-CD2 3.96Å; F201-F205 HydrophobicContact CE1-CD2 3.96Å; F201-F205 HydrophobicContact CE1-CG 4.08Å; F201-F205 HydrophobicContact CE2-CB 4.47Å; F201-F205 HydrophobicContact CE2-CD1 4.43Å; F201-F205 AromaticContact CE2-CD2 3.18Å; F201-F205 HydrophobicContact CE2-CD2 3.18Å; F201-F205 HydrophobicContact CE2-CE1 4.46Å; F201-F205 AromaticContact CE2-CE2 3.22Å; F201-F205 HydrophobicContact CE2-CE2 3.22Å; F201-F205 AromaticContact CE2-CG 3.82Å; F201-F205 HydrophobicContact CE2-CG 3.82Å; F201-F205 AromaticContact CE2-CZ 3.88Å; F201-F205 HydrophobicContact CE2-CZ 3.88Å; F201-F205 AromaticContact CG-CD2 3.66Å; F201-F205 HydrophobicContact CG-CD2 3.66Å; F201-F205 HydrophobicContact CG-CE2 4.18Å; F201-F205 HydrophobicContact CZ-CB 3.96Å; F201-F205 HydrophobicContact CZ-CD1 4.36Å; F201-F205 AromaticContact CZ-CD2 3.56Å; F201-F205 HydrophobicContact CZ-CD2 3.56Å; F201-F205 HydrophobicContact CZ-CE2 4.02Å; F201-F205 AromaticContact CZ-CG 3.73Å; F201-F205 HydrophobicContact CZ-CG 3.73Å; F201-F205 WeakPolarHBondContact O-CD2 3.36Å; F201-F205 PolarHBondContact O-N 3.47Å; F205-G207 VanDerWaalsContact C-N 3.29Å; F205-G207 PolarHBondContact O-N 2.9Å
206G58.1Low52.1Low55 Ų5587.2 Ų87.257%0.56754%0.543SS*.SBendtrans-79.88.3-172.600000116.4N202 G208N202-G206 WeakPolarHBondContact O-CA 3.43Å; N202-G206 PolarHBondContact O-N 3.49Å; G206-G208 PolarHBondContact O-N 2.88Å
207G50.6Low50.6Low85 Ų8591.8 Ų91.888%0.87656%0.558SS**SBendtrans76.416.4165.400000117.4F205F205-G207 VanDerWaalsContact C-N 3.29Å; F205-G207 PolarHBondContact O-N 2.9Å
208G41.6Very low49.1Very low63 Ų6396.1 Ų96.165%0.64959%0.585SS**  trans-12499.6175.100000113G206G206-G208 PolarHBondContact O-N 2.88Å
209F39.7Very low47.9Very low165 Ų16599.5 Ų99.572%0.72461%0.605SS**  trans-122.2156.9171.8-109.8-85.3000109M203M203-F209 VanDerWaalsContact O-CE2 3.23Å; M203-F209 WeakPolarHBondContact O-CE2 3.12Å
210P51.5Low46.5Very low118 Ų11898.5 Ų98.577%0.76661%0.614SS**  -111.3156.1-92.237.4-25.5000111.9
211S36.8Very low45Very low108 Ų108107.7 Ų107.776%0.75565%0.647SS**  trans-138.2130.4162.162.60000112.3
212S35.4Very low43.4Very low111 Ų111113 Ų11378%0.77668%0.682SS**SBendtrans64.1131.1169.831.30000119.1
213S31.1Very low41.8Very low109 Ų109113.4 Ų113.476%0.76269%0.692SS**  trans79.480.5154.2-52.20000118.6H215S213-H215 PolarHBondContact O-N 2.89Å
214A38.2Very low40.2Very low100 Ų100117.9 Ų117.983%0.82670%0.704SS**  trans-83.777.1162.500000112
215H33Very low38.7Very low171 Ų171119.7 Ų119.779%0.79273%0.726SS**  trans-146.6132.4162.4-66.2-71.3000106.2S213S213-H215 PolarHBondContact O-N 2.89Å
216T32.5Very low37.3Very low135 Ų135123.5 Ų123.583%0.82874%0.744SS**  cis-152.4162.410.9-33.60000109.2
217F33Very low36.1Very low156 Ų156128.2 Ų128.268%0.68475%0.751SS**  trans-69.7150.9163.6-115.7-90.4000111.7
218T30.9Very low35.3Very low104 Ų104129.8 Ų129.864%0.63874%0.739SS**  trans76.3120.8146.7-159.50000122.6
219N36.5Very low34.9Very low133 Ų133132.5 Ų132.571%0.71174%0.739SS**  trans69.6103.5146.9-73.9-18000122.1
220G34.3Very low34.6Very low64 Ų64133.2 Ų133.266%0.6674%0.742SS**  146.478.5111.300000119.7
221R34.1Very low33.7Very low218 Ų218138.1 Ų138.182%0.82375%0.745SS**  trans64.1144159.5-55.3173.5172.5156.8-3.1114.3
222T34Very low33.6Very low134 Ų134141.8 Ų141.882%0.82275%0.751SS**  cis-150.6148.826.6-39.40000109.7
223S34.8Very low33.6Very low102 Ų102143.5 Ų143.571%0.71375%0.746SS**  trans-70.2146.6167.8-177.60000110.6
224Y31.9Very low33.9Very low205 Ų205148.7 Ų148.780%0.80475%0.749SS**  trans-136.5106.2151.9-135.7-90.7000109.1
225S30.8Very low33.9Very low108 Ų108149.7 Ų149.776%0.75575%0.745SS**  trans-103.8145.8152.9-169.60000107.5
226H35.3Very low34.4Very low149 Ų149149.4 Ų149.469%0.6974%0.744SS**  trans-67.8158.8-165.2-96.9-92.8000115.6
227H32.9Very low34.9Very low154 Ų154152.6 Ų152.671%0.71375%0.749SS**  trans20.7141.1143.7-75.3-22.6000119.4
228N33.9Very low35.8Very low119 Ų119157.1 Ų157.164%0.63676%0.762SS**  cis-160.9-179.925.4-133.317.8000110.1
229D33.1Very low36.4Very low120 Ų120155.8 Ų155.864%0.64277%0.769SS**  cis-155.1-160.47.8-154.1-33.1000109
230F31.7Very low36.9Very low179 Ų179157.4 Ų157.479%0.78578%0.778SS**  trans77.386.5165.4-67.9-71.7000118.8
231R34.3Very low38.1Very low222 Ų222157.3 Ų157.384%0.83878%0.777SS**  67.798.6116.3-169.4-172.8-168.1159.54.7118.5
232Q33.3Very low39.4Very low185 Ų185148.8 Ų148.886%0.86476%0.757SS**  -151.7164.5115.8-145.4154.5-000112
233E36Very low40.7Very low147 Ų147150.2 Ų150.269%0.68775%0.752SS**  trans-87.2156.4-160.5-65.316192.500115.2
234R37.8Very low42.4Very low218 Ų218149.7 Ų149.782%0.82375%0.749SS**  trans47.4138148.6-65.9179.8-170.7172.95.1118.2
235T38Very low44.2Very low120 Ų120145.5 Ų145.574%0.73674%0.738SS**  -159.7162.757.8-49.30000110.9
236E44.3Very low46.2Very low166 Ų166147.1 Ų147.178%0.77673%0.732SS**  trans-49.2153.6167.3-66.7140.7120.900111.7
237E43Very low48.4Very low201 Ų201145.9 Ų145.994%0.93973%0.729SS**  -145.6165.666.8-74-166.3114.200116.3
238R50.6Low50.4Low251 Ų251145 Ų14595%0.94773%0.725SS**  trans-106.2110.3-173172.3-175.2175.6100.1-4109.7
239G44Very low52.9Low77 Ų77143.2 Ų143.279%0.79472%0.715SS**  trans-137.685-173.500000115.4
240D47.8Very low55.5Low166 Ų166143 Ų14389%0.88871%0.712SS**  trans54.5145.3156.9-143.46000122.4
241G58.7Low58.1Low63 Ų63138.2 Ų138.265%0.64970%0.698SS**SBendtrans-92.2155.2-17300000114.6
242G60.9Low60.7Low39 Ų39132.3 Ų132.340%0.40268%0.682SS.*SBendtrans113.9-65.1174.400000113.3S244 M245 F246G242-S244 VanDerWaalsContact C-N 3.32Å; G242-S244 PolarHBondContact O-N 2.96Å; G242-M245 WeakPolarHBondContact O-CB 3.17Å; G242-M245 PolarHBondContact O-N 2.84Å; G242-M245 VanDerWaalsContact O-N 3.13Å; G242-F246 VanDerWaalsContact O-CD2 3.29Å; G242-F246 WeakPolarHBondContact O-CD2 3.2Å; G242-F246 PolarHBondContact O-N 3.4Å
243F62.6Low63.5Low163 Ų163126.9 Ų126.972%0.71566%0.662SS**Hα-helixtrans-61.4-33-172.7-100.6-85.7000114.9M245 F246 I247F243-M245 VanDerWaalsContact C-N 3.33Å; F243-M245 PolarHBondContact O-N 3.42Å; F243-F246 PolarHBondContact O-N 3.3Å; F243-I247 WeakPolarHBondContact O-CG1 3.43Å; F243-I247 PolarHBondContact O-N 3.07Å; F243-I247 VanDerWaalsContact O-N 3.08Å
244S69.1Low66.2Low91 Ų91123.1 Ų123.164%0.63665%0.649SS**Hα-helixtrans-59.6-40.9175.6-1780000112.8G242 I247 Q248G242-S244 VanDerWaalsContact C-N 3.32Å; G242-S244 PolarHBondContact O-N 2.96Å; S244-I247 PolarHBondContact O-N 2.98Å; S244-Q248 WeakPolarHBondContact O-CB 3.42Å; S244-Q248 PolarHBondContact O-N 3.24Å
245M69.6Low68.6Low118 Ų118118.4 Ų118.458%0.58164%0.639SS**Hα-helixtrans-64.6-40.2175.9-104.5-86.8169.600112.1G242 F243 Q248 L249G242-M245 WeakPolarHBondContact O-CB 3.17Å; G242-M245 PolarHBondContact O-N 2.84Å; G242-M245 VanDerWaalsContact O-N 3.13Å; F243-M245 VanDerWaalsContact C-N 3.33Å; F243-M245 PolarHBondContact O-N 3.42Å; M245-Q248 PolarHBondContact O-N 3.39Å; M245-L249 WeakPolarHBondContact O-CB 3.12Å; M245-L249 WeakPolarHBondContact O-CG 3.28Å; M245-L249 PolarHBondContact O-N 3.31Å; M245-L249 HydrophobicContact SD-CD1 4.04Å; M245-L249 HydrophobicContact SD-CG 4.49Å
246F74.3Confident71.2Confident142 Ų142117.1 Ų117.162%0.62363%0.627SS**Hα-helixtrans-65.1-40.3176.8-71.2-70.9000112.5G242 F243 L249 M250G242-F246 VanDerWaalsContact O-CD2 3.29Å; G242-F246 WeakPolarHBondContact O-CD2 3.2Å; G242-F246 PolarHBondContact O-N 3.4Å; F243-F246 PolarHBondContact O-N 3.3Å; F246-L249 PolarHBondContact O-N 3Å; F246-M250 WeakPolarHBondContact O-CB 3.18Å; F246-M250 PolarHBondContact O-N 2.92Å
247I80.3Confident73.5Confident122 Ų122113.5 Ų113.563%0.62661%0.612SS**Hα-helixtrans-67.3-38.7176.7-65.2169.8000110.8F243 S244F243-I247 WeakPolarHBondContact O-CG1 3.43Å; F243-I247 PolarHBondContact O-N 3.07Å; F243-I247 VanDerWaalsContact O-N 3.08Å; S244-I247 PolarHBondContact O-N 2.98Å
248Q76.3Confident75.8Confident137 Ų137107.6 Ų107.664%0.6459%0.59SS**Hα-helixtrans-68.5-35.2177.5-170176.17.100113.2S244 M245S244-Q248 WeakPolarHBondContact O-CB 3.42Å; S244-Q248 PolarHBondContact O-N 3.24Å; M245-Q248 PolarHBondContact O-N 3.39Å
249L84.9Confident77.6Confident81 Ų8198.6 Ų98.642%0.42457%0.565SS.*Hα-helixtrans-86.2-19.1179-67.2173.7000113.7M245 F246 I252 V253M245-L249 WeakPolarHBondContact O-CB 3.12Å; M245-L249 WeakPolarHBondContact O-CG 3.28Å; M245-L249 PolarHBondContact O-N 3.31Å; M245-L249 HydrophobicContact SD-CD1 4.04Å; M245-L249 HydrophobicContact SD-CG 4.49Å; F246-L249 PolarHBondContact O-N 3Å; L249-I252 HydrophobicContact CD2-CD1 4.33Å; L249-I252 WeakPolarHBondContact O-CB 3.46Å; L249-I252 PolarHBondContact O-N 3.44Å; L249-V253 WeakPolarHBondContact O-CG2 3.25Å; L249-V253 PolarHBondContact O-N 3.47Å
250M87.3Confident79.8Confident116 Ų11699 Ų9957%0.57155%0.548SS*.Hα-helixtrans-48.2-47.9-178.1-126-68.7-17400113.8F246 I252 V253 V254F246-M250 WeakPolarHBondContact O-CB 3.18Å; F246-M250 PolarHBondContact O-N 2.92Å; M250-I252 VanDerWaalsContact C-N 3.32Å; M250-I252 PolarHBondContact O-N 3.43Å; M250-V253 PolarHBondContact O-N 2.98Å; M250-V254 WeakPolarHBondContact O-CG2 3.15Å; M250-V254 PolarHBondContact O-N 3.23Å; M250-V254 HydrophobicContact SD-CG2 3.67Å
251P87.3Confident81.6Confident78 Ų7895.8 Ų95.851%0.50653%0.531SS..Hα-helixtrans-61.9-37.2178.6-23.334.9000113.4L255P251-L255 WeakPolarHBondContact O-CG 3.39Å; P251-L255 PolarHBondContact O-N 3.03Å
252I89.1Confident82.8Confident97 Ų9796 Ų9650%0.49752%0.522SS..Hα-helixtrans-70-44.3178.4-58.8173.6000109.7L249 M250 V254 L255 I256L249-I252 HydrophobicContact CD2-CD1 4.33Å; L249-I252 WeakPolarHBondContact O-CB 3.46Å; L249-I252 PolarHBondContact O-N 3.44Å; M250-I252 VanDerWaalsContact C-N 3.32Å; M250-I252 PolarHBondContact O-N 3.43Å; I252-V254 VanDerWaalsContact C-N 3.33Å; I252-V254 PolarHBondContact O-N 3.2Å; I252-L255 PolarHBondContact O-N 3.12Å; I252-I256 HydrophobicContact CG2-CD1 3.89Å; I252-I256 VanDerWaalsContact O-CG1 3.31Å; I252-I256 WeakPolarHBondContact O-CG1 3.31Å; I252-I256 PolarHBondContact O-N 3.17Å
253V91.1Very high83.8Confident72 Ų72101 Ų10144%0.43654%0.535SS..Hα-helixtrans-61.2-41.9176.1174.30000111.1L249 M250 I256 L257L249-V253 WeakPolarHBondContact O-CG2 3.25Å; L249-V253 PolarHBondContact O-N 3.47Å; M250-V253 PolarHBondContact O-N 2.98Å; V253-I256 PolarHBondContact O-N 2.86Å; V253-L257 HydrophobicContact CG1-CD1 3.89Å; V253-L257 HydrophobicContact CG1-CG 4.38Å; V253-L257 WeakPolarHBondContact O-CB 3.23Å; V253-L257 VanDerWaalsContact O-CG 3.29Å; V253-L257 WeakPolarHBondContact O-CG 3.33Å; V253-L257 PolarHBondContact O-N 3.25Å
254V92.8Very high84.6Confident68 Ų68100.6 Ų100.641%0.41254%0.537SS..Hα-helixtrans-63.3-44.3175.1170.10000111.5M250 I252 I256 L257 V258M250-V254 WeakPolarHBondContact O-CG2 3.15Å; M250-V254 PolarHBondContact O-N 3.23Å; M250-V254 HydrophobicContact SD-CG2 3.67Å; I252-V254 VanDerWaalsContact C-N 3.33Å; I252-V254 PolarHBondContact O-N 3.2Å; V254-I256 VanDerWaalsContact C-N 3.35Å; V254-I256 PolarHBondContact O-N 2.99Å; V254-L257 PolarHBondContact O-N 3.41Å; V254-V258 HydrophobicContact CG1-CG2 4.29Å; V254-V258 WeakPolarHBondContact O-CB 3.34Å; V254-V258 VanDerWaalsContact O-CG2 3.29Å; V254-V258 WeakPolarHBondContact O-CG2 3.19Å; V254-V258 PolarHBondContact O-N 2.97Å
255L88.9Confident84.9Confident119 Ų119104 Ų10462%0.62355%0.545SS*.Hα-helixtrans-63.3-38.8176.6-73171.9000112.7P251 I252 S259P251-L255 WeakPolarHBondContact O-CG 3.39Å; P251-L255 PolarHBondContact O-N 3.03Å; I252-L255 PolarHBondContact O-N 3.12Å; L255-S259 WeakPolarHBondContact O-CB 3.36Å; L255-S259 PolarHBondContact O-N 3.35Å; L255-S259 PolarHBondContact O-OG 3.22Å
256I91.7Very high85.4Confident93 Ų93103.7 Ų103.748%0.47755%0.55SS..Hα-helixtrans-65.6-47.3174.6-69.2168000110.1I252 V253 V254 V258 S259 I260I252-I256 HydrophobicContact CG2-CD1 3.89Å; I252-I256 VanDerWaalsContact O-CG1 3.31Å; I252-I256 WeakPolarHBondContact O-CG1 3.31Å; I252-I256 PolarHBondContact O-N 3.17Å; V253-I256 PolarHBondContact O-N 2.86Å; V254-I256 VanDerWaalsContact C-N 3.35Å; V254-I256 PolarHBondContact O-N 2.99Å; I256-V258 PolarHBondContact O-N 3.28Å; I256-S259 WeakPolarHBondContact O-CB 3.38Å; I256-S259 PolarHBondContact O-N 2.95Å; I256-I260 HydrophobicContact CG2-CD1 3.69Å; I256-I260 HydrophobicContact CG2-CG1 4.45Å; I256-I260 WeakPolarHBondContact O-CG1 3.44Å; I256-I260 PolarHBondContact O-N 2.99Å
257L92.5Very high85.5Confident89 Ų89101.8 Ų101.847%0.46655%0.554SS.*Hα-helixtrans-60.5-45.8177.2-76.1170000112V253 V254 S259 I260 L261V253-L257 HydrophobicContact CG1-CD1 3.89Å; V253-L257 HydrophobicContact CG1-CG 4.38Å; V253-L257 WeakPolarHBondContact O-CB 3.23Å; V253-L257 VanDerWaalsContact O-CG 3.29Å; V253-L257 WeakPolarHBondContact O-CG 3.33Å; V253-L257 PolarHBondContact O-N 3.25Å; V254-L257 PolarHBondContact O-N 3.41Å; L257-S259 VanDerWaalsContact C-N 3.29Å; L257-S259 PolarHBondContact O-N 2.83Å; L257-I260 PolarHBondContact O-N 3.49Å; L257-L261 VanDerWaalsContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CG 3.49Å; L257-L261 PolarHBondContact O-N 3.38Å
258V91.9Very high85.5Confident77 Ų77100.3 Ų100.347%0.46755%0.552SS.*Hα-helixtrans-61.8-38.6176.2169.60000110.9V254 I256 S262V254-V258 HydrophobicContact CG1-CG2 4.29Å; V254-V258 WeakPolarHBondContact O-CB 3.34Å; V254-V258 VanDerWaalsContact O-CG2 3.29Å; V254-V258 WeakPolarHBondContact O-CG2 3.19Å; V254-V258 PolarHBondContact O-N 2.97Å; I256-V258 PolarHBondContact O-N 3.28Å; V258-S262 VanDerWaalsContact O-CB 3.26Å; V258-S262 WeakPolarHBondContact O-CB 3.48Å; V258-S262 PolarHBondContact O-N 2.82Å; V258-S262 PolarHBondContact O-OG 3.01Å
259S88Confident86Confident62 Ų6297.2 Ų97.243%0.43454%0.544SS..Hα-helixtrans-65.9-44.1176.7-59.60000112.3L255 I256 L257 S262 Q263L255-S259 WeakPolarHBondContact O-CB 3.36Å; L255-S259 PolarHBondContact O-N 3.35Å; L255-S259 PolarHBondContact O-OG 3.22Å; I256-S259 WeakPolarHBondContact O-CB 3.38Å; I256-S259 PolarHBondContact O-N 2.95Å; L257-S259 VanDerWaalsContact C-N 3.29Å; L257-S259 PolarHBondContact O-N 2.83Å; S259-S262 PolarHBondContact O-N 2.81Å; S259-Q263 WeakPolarHBondContact O-CG 3.46Å; S259-Q263 PolarHBondContact O-N 2.87Å; S259-Q263 VanDerWaalsContact O-N 3.08Å
260I90.1Very high86.3Confident85 Ų8595.6 Ų95.644%0.43654%0.538SS..Hα-helixtrans-66.7-46.4177.3-66.7166.4000110.7I256 L257 S262 Q263 M264I256-I260 HydrophobicContact CG2-CD1 3.69Å; I256-I260 HydrophobicContact CG2-CG1 4.45Å; I256-I260 WeakPolarHBondContact O-CG1 3.44Å; I256-I260 PolarHBondContact O-N 2.99Å; L257-I260 PolarHBondContact O-N 3.49Å; I260-S262 VanDerWaalsContact C-N 3.31Å; I260-S262 PolarHBondContact O-N 3.32Å; I260-Q263 WeakPolarHBondContact O-CB 3.21Å; I260-Q263 PolarHBondContact O-N 3.26Å; I260-Q263 VanDerWaalsContact O-N 3.14Å; I260-M264 PolarHBondContact O-N 2.78Å
261L87Confident86.6Confident99 Ų9991.7 Ų91.752%0.51852%0.517SS..Hα-helixtrans-60.6-41.5176.4-71.1169.6000111.2L257 Q263 M264 M265L257-L261 VanDerWaalsContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CB 3.31Å; L257-L261 WeakPolarHBondContact O-CG 3.49Å; L257-L261 PolarHBondContact O-N 3.38Å; L261-Q263 VanDerWaalsContact C-N 3.32Å; L261-Q263 PolarHBondContact O-N 2.68Å; L261-M264 PolarHBondContact O-N 2.83Å; L261-M264 VanDerWaalsContact O-N 3.17Å; L261-M265 WeakPolarHBondContact O-CG 3.46Å; L261-M265 PolarHBondContact O-N 2.95Å; L261-M265 VanDerWaalsContact O-N 3.16Å
262S84.2Confident87Confident67 Ų6788.4 Ų88.447%0.46950%0.497SS..Hα-helixtrans-60.1-41.8174.6-60.30000111.8V258 S259 I260 M264 M265 V266V258-S262 VanDerWaalsContact O-CB 3.26Å; V258-S262 WeakPolarHBondContact O-CB 3.48Å; V258-S262 PolarHBondContact O-N 2.82Å; V258-S262 PolarHBondContact O-OG 3.01Å; S259-S262 PolarHBondContact O-N 2.81Å; I260-S262 VanDerWaalsContact C-N 3.31Å; I260-S262 PolarHBondContact O-N 3.32Å; S262-M264 VanDerWaalsContact C-N 3.34Å; S262-M264 PolarHBondContact O-N 3.13Å; S262-M265 PolarHBondContact O-N 3.47Å; S262-V266 PolarHBondContact O-N 3.25Å
263Q82Confident87.2Confident146 Ų14685.4 Ų85.468%0.68248%0.481SS*.Hα-helixtrans-65.5-34.9175.8-70.7173.117.200112.7S259 I260 L261 M265 V266S259-Q263 WeakPolarHBondContact O-CG 3.46Å; S259-Q263 PolarHBondContact O-N 2.87Å; S259-Q263 VanDerWaalsContact O-N 3.08Å; I260-Q263 WeakPolarHBondContact O-CB 3.21Å; I260-Q263 PolarHBondContact O-N 3.26Å; I260-Q263 VanDerWaalsContact O-N 3.14Å; L261-Q263 VanDerWaalsContact C-N 3.32Å; L261-Q263 PolarHBondContact O-N 2.68Å; Q263-M265 VanDerWaalsContact C-N 3.27Å; Q263-M265 PolarHBondContact O-N 3.27Å; Q263-V266 PolarHBondContact O-N 3.34Å
264M79.1Confident87.3Confident153 Ų15388.7 Ų88.775%0.75449%0.487SS*.Hα-helixtrans-69.8-20.9175.1-68.7-16872.500113.8I260 L261 S262I260-M264 PolarHBondContact O-N 2.78Å; L261-M264 PolarHBondContact O-N 2.83Å; L261-M264 VanDerWaalsContact O-N 3.17Å; S262-M264 VanDerWaalsContact C-N 3.34Å; S262-M264 PolarHBondContact O-N 3.13Å
265M75.8Confident87.3Confident162 Ų16288.4 Ų88.480%0.79849%0.488SS*.THydrogen-bonded Turntrans-90.5-5.1177.8-64.5-176.18400113.8L261 S262 Q263 S267L261-M265 WeakPolarHBondContact O-CG 3.46Å; L261-M265 PolarHBondContact O-N 2.95Å; L261-M265 VanDerWaalsContact O-N 3.16Å; S262-M265 PolarHBondContact O-N 3.47Å; Q263-M265 VanDerWaalsContact C-N 3.27Å; Q263-M265 PolarHBondContact O-N 3.27Å; M265-S267 PolarHBondContact O-N 3.28Å
266V79Confident87.4Confident113 Ų11388.7 Ų88.769%0.68548%0.48SS*.  trans-81.397.7173.9-179.80000109.6S262 Q263S262-V266 PolarHBondContact O-N 3.25Å; Q263-V266 PolarHBondContact O-N 3.34Å
267S75.9Confident87.4Confident101 Ų10189 Ų8971%0.70649%0.489SS*.PPolyproline II helixtrans-59.8139.5168.8-62.10000110.9M265M265-S267 PolarHBondContact O-N 3.28Å
268P79.9Confident87.2Confident91 Ų9190.4 Ų90.459%0.59151%0.506SS*.PPolyproline II helixtrans-64.2150.4175.728.7-35000110.5
269P88.2Confident86.9Confident73 Ų7389.3 Ų89.347%0.47450%0.5SS..PPolyproline II helixtrans-62144.8177.226.2-34000110.8Y271 Q281P269-Y271 PolarHBondContact O-N 3.47Å; P269-Y271 VanDerWaalsContact O-N 3.17Å; P269-Q281 PolarHBondContact O-NE2 3.13Å
270P90.2Very high86.9Confident47 Ų4788 Ų8831%0.30550%0.495SS..SBendtrans-68-17.1-174.824.7-32.7000113.9F300 F304 I312P270-F300 HydrophobicContact CB-CE2 4.31Å; P270-F300 WeakPolarHBondContact O-CD2 3.41Å; P270-F304 HydrophobicContact CB-CE2 3.8Å; P270-F304 HydrophobicContact CB-CZ 3.93Å; P270-I312 HydrophobicContact CB-CD1 4.38Å; P270-I312 HydrophobicContact CG-CD1 4.47Å
271Y93.9Very high87Confident33 Ų3384 Ų8413%0.12948%0.475CS..EExtended strand (participates in β ladder)trans-144171.9177.963.5-92.8000112.9P269 Q281 Y295 I312 N315 V316 D319P269-Y271 PolarHBondContact O-N 3.47Å; P269-Y271 VanDerWaalsContact O-N 3.17Å; Y271-Q281 VanDerWaalsContact C-NE2 3.28Å; Y271-Q281 PolarHBondContact O-NE2 3.15Å; Y271-Q281 VanDerWaalsContact O-NE2 3.12Å; Y271-Y295 CarbonylContact C-O 3.51Å; Y271-Y295 WeakPolarHBondContact CA-O 3.22Å; Y271-I312 HydrophobicContact CD1-CG2 3.64Å; Y271-I312 HydrophobicContact CE1-CG2 4.06Å; Y271-N315 HydrophobicContact CE1-CB 4.36Å; Y271-N315 WeakPolarHBondContact OH-CB 3.22Å; Y271-V316 HydrophobicContact CD1-CG2 3.87Å; Y271-V316 HydrophobicContact CD2-CG2 3.51Å; Y271-V316 HydrophobicContact CE1-CG2 3.99Å; Y271-V316 HydrophobicContact CE2-CB 4.47Å; Y271-V316 HydrophobicContact CE2-CG2 3.66Å; Y271-V316 HydrophobicContact CG-CG2 3.63Å; Y271-D319 WeakPolarHBondContact CE2-OD2 3.35Å; Y271-D319 PolarHBondContact OH-OD2 2.95Å
272S95Very high87.3Confident10 Ų1082.1 Ų82.17%0.0747%0.467CS..EExtended strand (participates in β ladder)trans-145.2149.3163.357.30000111.5Y274 Q281 Y295S272-Y274 WeakPolarHBondContact CB-O 3.47Å; S272-Y274 PolarHBondContact O-N 2.93Å; S272-Y274 PolarHBondContact OG-O 3.47Å; S272-Q281 PolarHBondContact OG-OE1 3.26Å; S272-Y295 PolarHBondContact N-O 2.87Å; S272-Y295 PolarHBondContact O-N 3.41Å
273L94.3Very high87.8Confident33 Ų3381.3 Ų81.317%0.17346%0.46CS..SBendtrans-73.8-9.3174.3-61.8178.7000113.7V292 V316 D319 N323L273-V292 HydrophobicContact CD2-CG1 4.2Å; L273-V316 HydrophobicContact CD2-CG1 4.03Å; L273-D319 HydrophobicContact CD1-CB 4.4Å; L273-N323 HydrophobicContact CD1-CB 4.32Å
274Y93Very high88.4Confident142 Ų14279.5 Ų79.556%0.55745%0.45SS*.SBendtrans-134.7146.1-178.5-53.2-78000109.4S272 R276 N323S272-Y274 WeakPolarHBondContact CB-O 3.47Å; S272-Y274 PolarHBondContact O-N 2.93Å; S272-Y274 PolarHBondContact OG-O 3.47Å; Y274-R276 PolarHBondContact O-N 2.88Å; Y274-N323 PolarHBondContact OH-ND2 2.94Å
275S93.2Very high89.1Confident61 Ų6175 Ų7543%0.42742%0.424SS..  trans-58.5126.9177.2-174.40000111Y295S275-Y295 VanDerWaalsContact N-CD2 3.35Å
276R91.4Very high90.1Very high125 Ų12572.1 Ų72.147%0.47241%0.409SS..BIsolated β-bridgetrans-12989.1178.9-71.4179.9177.4-158.20.5110Y274 S278 T279 G280 Q281Y274-R276 PolarHBondContact O-N 2.88Å; R276-S278 PolarHBondContact O-N 2.92Å; R276-T279 VanDerWaalsContact CB-OG1 3.23Å; R276-T279 WeakPolarHBondContact CB-OG1 3.38Å; R276-T279 PolarHBondContact O-N 3.48Å; R276-T279 PolarHBondContact O-OG1 3.47Å; R276-G280 PolarHBondContact O-N 3.17Å; R276-Q281 HydrophobicContact CB-CB 4.23Å; R276-Q281 PolarHBondContact N-O 3.38Å; R276-Q281 PolarHBondContact O-N 3.46Å; R276-Q281 VanDerWaalsContact O-N 3.13Å
277P90.3Very high90.8Very high101 Ų10166.9 Ų66.966%0.65638%0.377SS*.G310 helixtrans-58.6-33.3178-26.235.7000113.6T279 G280 T282P277-T279 VanDerWaalsContact C-N 3.3Å; P277-T279 PolarHBondContact O-N 3.48Å; P277-G280 PolarHBondContact O-N 3.38Å; P277-G280 VanDerWaalsContact O-N 3.16Å; P277-T282 HydrophobicContact CB-CG2 4.46Å
278S88.4Confident91.5Very high117 Ų11768.6 Ų68.682%0.81838%0.379SS*.G310 helixtrans-65-27.1-179.651.50000114.5R276R276-S278 PolarHBondContact O-N 2.92Å
279T86.4Confident91.9Very high55 Ų5570.5 Ų70.534%0.33738%0.383SS..G310 helixtrans-103.17.9176.553.50000112.4R276 P277 Q281R276-T279 VanDerWaalsContact CB-OG1 3.23Å; R276-T279 WeakPolarHBondContact CB-OG1 3.38Å; R276-T279 PolarHBondContact O-N 3.48Å; R276-T279 PolarHBondContact O-OG1 3.47Å; P277-T279 VanDerWaalsContact C-N 3.3Å; P277-T279 PolarHBondContact O-N 3.48Å; T279-Q281 PolarHBondContact O-N 3.02Å; T279-Q281 PolarHBondContact OG1-OE1 3.48Å
280G88.5Confident92Very high33 Ų3369 Ų6934%0.3437%0.371SS..THydrogen-bonded Turntrans71.8-1.5-17500000115.1R276 P277 T282R276-G280 PolarHBondContact O-N 3.17Å; P277-G280 PolarHBondContact O-N 3.38Å; P277-G280 VanDerWaalsContact O-N 3.16Å; G280-T282 VanDerWaalsContact C-N 3.28Å; G280-T282 PolarHBondContact O-N 3.37Å; G280-T282 PolarHBondContact O-OG1 3.36Å
281Q91.4Very high92.1Very high1 Ų175.7 Ų75.71%0.00539%0.391CS..BIsolated β-bridgetrans-73.580.3179.9-68169.6-34.100110.4P269 Y271 S272 R276 T279 V296 T297P269-Q281 PolarHBondContact O-NE2 3.13Å; Y271-Q281 VanDerWaalsContact C-NE2 3.28Å; Y271-Q281 PolarHBondContact O-NE2 3.15Å; Y271-Q281 VanDerWaalsContact O-NE2 3.12Å; S272-Q281 PolarHBondContact OG-OE1 3.26Å; R276-Q281 HydrophobicContact CB-CB 4.23Å; R276-Q281 PolarHBondContact N-O 3.38Å; R276-Q281 PolarHBondContact O-N 3.46Å; R276-Q281 VanDerWaalsContact O-N 3.13Å; T279-Q281 PolarHBondContact O-N 3.02Å; T279-Q281 PolarHBondContact OG1-OE1 3.48Å; Q281-V296 WeakPolarHBondContact CA-O 3.36Å; Q281-T297 HydrophobicContact CG-CG2 4.26Å
282T93.5Very high92.2Very high60 Ų6074.5 Ų74.537%0.36839%0.386SS..  trans-125.4-18.3-170.550.70000112.8P277 G280 K284 V296P277-T282 HydrophobicContact CB-CG2 4.46Å; G280-T282 VanDerWaalsContact C-N 3.28Å; G280-T282 PolarHBondContact O-N 3.37Å; G280-T282 PolarHBondContact O-OG1 3.36Å; T282-K284 PolarHBondContact O-N 3.47Å; T282-V296 PolarHBondContact N-O 2.58Å; T282-V296 VanDerWaalsContact N-O 3.15Å
283V93.7Very high92.2Very high51 Ų5176.9 Ų76.931%0.30940%0.398SS..EExtended strand (participates in β ladder)trans-82.7111.7180-178.60000108.6Y295 V296 R298V283-Y295 WeakPolarHBondContact O-CA 3.49Å; V283-V296 HydrophobicContact CB-CG2 4.02Å; V283-V296 WeakPolarHBondContact CB-O 3.43Å; V283-V296 HydrophobicContact CG1-CG2 4.28Å; V283-V296 PolarHBondContact N-O 3.32Å; V283-V296 PolarHBondContact O-N 3.05Å; V283-R298 HydrophobicContact CG2-CG 4.11Å
284K95.4Very high92.2Very high108 Ų10875.3 Ų75.347%0.4739%0.39SS..EExtended strand (participates in β ladder)trans-71.6135.8176.1-169.9-178-178.4-175.60111T282 D293 Y294 Y295T282-K284 PolarHBondContact O-N 3.47Å; K284-D293 WeakPolarHBondContact CE-OD1 3.49Å; K284-D293 WeakPolarHBondContact CE-OD2 3.33Å; K284-D293 IonicContact NZ-OD1 3.81Å; K284-D293 PolarHBondContact NZ-OD1 2.98Å; K284-D293 IonicContact NZ-OD2 2.75Å; K284-D293 PolarHBondContact NZ-OD2 2.87Å; K284-Y294 CarbonylContact C-O 3.57Å; K284-Y294 WeakPolarHBondContact CA-O 3.18Å; K284-Y295 HydrophobicContact CB-CD1 4.34Å; K284-Y295 HydrophobicContact CB-CE1 4.08Å; K284-Y295 HydrophobicContact CG-CE1 4.24Å
285R94.3Very high92.4Very high57 Ų5771 Ų7122%0.21537%0.373CS..EExtended strand (participates in β ladder)trans-133.9166.8171.1-72.8-174.157.89110109.9D293 Y294 V296 E313R285-D293 WeakPolarHBondContact O-CA 3.39Å; R285-Y294 HydrophobicContact CB-CD1 4Å; R285-Y294 HydrophobicContact CB-CD2 4.27Å; R285-Y294 HydrophobicContact CB-CE1 3.6Å; R285-Y294 HydrophobicContact CB-CE2 3.9Å; R285-Y294 HydrophobicContact CB-CG 4.33Å; R285-Y294 PolarHBondContact N-O 3.11Å; R285-Y294 PolarHBondContact NE-OH 3.37Å; R285-Y294 PolarHBondContact O-N 2.61Å; R285-V296 HydrophobicContact CG-CG2 4.08Å; R285-E313 IonicContact CZ-OE1 3.25Å; R285-E313 IonicContact NE-OE1 3.21Å; R285-E313 IonicContact NH2-OE1 2.93Å; R285-E313 PolarHBondContact NH2-OE1 3.43Å
286Q95.6Very high92.5Very high102 Ų10268.2 Ų68.248%0.47735%0.354SS..EExtended strand (participates in β ladder)trans-126.8148.4171.7-77-178.7-15.300109.4V292 D293Q286-V292 WeakPolarHBondContact CA-O 3.32Å; Q286-D293 WeakPolarHBondContact CG-OD1 3.45Å; Q286-D293 PolarHBondContact NE2-OD1 3.18Å
287T94.6Very high92.6Very high3 Ų364 Ų642%0.01834%0.342CS..  trans-82.6152.9173.665.30000111.5R291 V292 Y294 E313 V316 E317T287-R291 WeakPolarHBondContact O-CA 3.3Å; T287-R291 PolarHBondContact O-N 3.41Å; T287-R291 PolarHBondContact OG1-N 3.08Å; T287-V292 HydrophobicContact CG2-CB 4.25Å; T287-V292 PolarHBondContact N-O 3.08Å; T287-V292 PolarHBondContact OG1-N 2.86Å; T287-V292 VanDerWaalsContact OG1-N 3.09Å; T287-Y294 HydrophobicContact CG2-CD1 3.76Å; T287-Y294 HydrophobicContact CG2-CE1 3.68Å; T287-E313 HydrophobicContact CG2-CB 3.98Å; T287-E313 HydrophobicContact CG2-CG 4.21Å; T287-V316 HydrophobicContact CG2-CB 3.95Å; T287-V316 HydrophobicContact CG2-CG1 3.53Å; T287-E317 WeakPolarHBondContact CB-OE1 3.19Å; T287-E317 HydrophobicContact CG2-CG 4.01Å; T287-E317 WeakPolarHBondContact OG1-CG 3.48Å; T287-E317 PolarHBondContact OG1-OE1 3.46Å
288D90Very high92.6Very high138 Ų13868.8 Ų68.874%0.73835%0.347SS*.THydrogen-bonded Turntrans-69.8-36.3-175-77-20.8000114.5
289N87.9Confident92.7Very high130 Ų13068.2 Ų68.270%0.69534%0.335SS*.THydrogen-bonded Turntrans-85.4-63.6-173.3-45.9-56.5000112.3E317N289-E317 WeakPolarHBondContact CB-OE1 3.43Å; N289-E317 PolarHBondContact N-OE1 3.35Å; N289-E317 PolarHBondContact ND2-OE2 3.05Å
290L90.3Very high93Very high42 Ų4265.7 Ų65.722%0.2232%0.319CS..THydrogen-bonded Turntrans-89.5-7.4-174.3-65.6-177000113.1V292 E317 V321 L368 L371 F372L290-V292 HydrophobicContact CB-CG2 3.75Å; L290-V292 HydrophobicContact CD1-CG2 4.5Å; L290-V292 PolarHBondContact O-N 3.37Å; L290-E317 HydrophobicContact CB-CG 4.1Å; L290-E317 HydrophobicContact CD1-CB 3.98Å; L290-E317 HydrophobicContact CD1-CG 4.03Å; L290-E317 HydrophobicContact CG-CG 4.2Å; L290-E317 PolarHBondContact N-OE1 3.22Å; L290-V321 HydrophobicContact CD1-CG2 3.91Å; L290-L368 HydrophobicContact CD1-CD2 4.08Å; L290-L368 HydrophobicContact CD2-CD2 4.09Å; L290-L371 HydrophobicContact CD2-CD1 4.48Å; L290-F372 HydrophobicContact CD1-CZ 4.22Å; L290-F372 HydrophobicContact CD2-CZ 4.29Å
291R93.6Very high93Very high188 Ų18870.9 Ų70.971%0.70933%0.332SS*.  trans55.638-175.7-55.7-175.9-177.6-179.50.3112.9T287 D293T287-R291 WeakPolarHBondContact O-CA 3.3Å; T287-R291 PolarHBondContact O-N 3.41Å; T287-R291 PolarHBondContact OG1-N 3.08Å; R291-D293 PolarHBondContact O-N 3.14Å
292V94.6Very high92.9Very high7 Ų774.5 Ų74.54%0.04236%0.358CS..  trans-71.1125.8179.1172.80000109.2L273 Q286 T287 L290 Y294 V316 E317 Y320L273-V292 HydrophobicContact CD2-CG1 4.2Å; Q286-V292 WeakPolarHBondContact CA-O 3.32Å; T287-V292 HydrophobicContact CG2-CB 4.25Å; T287-V292 PolarHBondContact N-O 3.08Å; T287-V292 PolarHBondContact OG1-N 2.86Å; T287-V292 VanDerWaalsContact OG1-N 3.09Å; L290-V292 HydrophobicContact CB-CG2 3.75Å; L290-V292 HydrophobicContact CD1-CG2 4.5Å; L290-V292 PolarHBondContact O-N 3.37Å; V292-Y294 PolarHBondContact O-N 2.97Å; V292-V316 HydrophobicContact CB-CG1 4.31Å; V292-V316 HydrophobicContact CG1-CG1 3.84Å; V292-E317 HydrophobicContact CG2-CG 4.37Å; V292-Y320 HydrophobicContact CB-CG 4.36Å; V292-Y320 HydrophobicContact CG1-CD1 4.3Å; V292-Y320 HydrophobicContact CG1-CD2 3.73Å; V292-Y320 HydrophobicContact CG1-CE2 4.42Å; V292-Y320 HydrophobicContact CG1-CG 3.66Å; V292-Y320 HydrophobicContact CG2-CD1 3.44Å; V292-Y320 VanDerWaalsContact CG2-CD1 3.44Å; V292-Y320 HydrophobicContact CG2-CD2 4.32Å; V292-Y320 HydrophobicContact CG2-CE1 3.9Å; V292-Y320 HydrophobicContact CG2-CG 3.68Å
293D95.4Very high92.6Very high60 Ų6077.9 Ų77.932%0.32137%0.369SS..EExtended strand (participates in β ladder)trans-68.9123.3172.9-75.6-27000110.6K284 R285 Q286 R291K284-D293 WeakPolarHBondContact CE-OD1 3.49Å; K284-D293 WeakPolarHBondContact CE-OD2 3.33Å; K284-D293 IonicContact NZ-OD1 3.81Å; K284-D293 PolarHBondContact NZ-OD1 2.98Å; K284-D293 IonicContact NZ-OD2 2.75Å; K284-D293 PolarHBondContact NZ-OD2 2.87Å; R285-D293 WeakPolarHBondContact O-CA 3.39Å; Q286-D293 WeakPolarHBondContact CG-OD1 3.45Å; Q286-D293 PolarHBondContact NE2-OD1 3.18Å; R291-D293 PolarHBondContact O-N 3.14Å
294Y95.6Very high92.4Very high0 Ų077.5 Ų77.50%036%0.364CS..EExtended strand (participates in β ladder)trans-135.9159.4174.372.4-83000112K284 R285 T287 V292 V296 F300 E313 V316K284-Y294 CarbonylContact C-O 3.57Å; K284-Y294 WeakPolarHBondContact CA-O 3.18Å; R285-Y294 HydrophobicContact CB-CD1 4Å; R285-Y294 HydrophobicContact CB-CD2 4.27Å; R285-Y294 HydrophobicContact CB-CE1 3.6Å; R285-Y294 HydrophobicContact CB-CE2 3.9Å; R285-Y294 HydrophobicContact CB-CG 4.33Å; R285-Y294 PolarHBondContact N-O 3.11Å; R285-Y294 PolarHBondContact NE-OH 3.37Å; R285-Y294 PolarHBondContact O-N 2.61Å; T287-Y294 HydrophobicContact CG2-CD1 3.76Å; T287-Y294 HydrophobicContact CG2-CE1 3.68Å; V292-Y294 PolarHBondContact O-N 2.97Å; Y294-V296 HydrophobicContact CD2-CG1 3.58Å; Y294-V296 HydrophobicContact CE2-CG1 3.45Å; Y294-V296 VanDerWaalsContact CE2-CG1 3.45Å; Y294-F300 HydrophobicContact CE2-CE1 4.38Å; Y294-F300 HydrophobicContact CE2-CZ 4.15Å; Y294-E313 HydrophobicContact CE1-CG 4.12Å; Y294-E313 VanDerWaalsContact OH-CG 3.29Å; Y294-E313 WeakPolarHBondContact OH-CG 3.38Å; Y294-E313 PolarHBondContact OH-OE1 2.94Å; Y294-V316 HydrophobicContact CD1-CG1 3.93Å; Y294-V316 HydrophobicContact CD1-CG2 4.42Å; Y294-V316 HydrophobicContact CD2-CG2 4.04Å; Y294-V316 HydrophobicContact CE2-CG2 4.45Å; Y294-V316 HydrophobicContact CG-CG1 3.95Å; Y294-V316 HydrophobicContact CG-CG2 4.02Å
295Y95.9Very high92.3Very high52 Ų5279 Ų7920%0.20437%0.37CS..EExtended strand (participates in β ladder)trans-120.1133.2-172.9-62.8-94.5000110.5Y271 S272 S275 V283 K284Y271-Y295 CarbonylContact C-O 3.51Å; Y271-Y295 WeakPolarHBondContact CA-O 3.22Å; S272-Y295 PolarHBondContact N-O 2.87Å; S272-Y295 PolarHBondContact O-N 3.41Å; S275-Y295 VanDerWaalsContact N-CD2 3.35Å; V283-Y295 WeakPolarHBondContact O-CA 3.49Å; K284-Y295 HydrophobicContact CB-CD1 4.34Å; K284-Y295 HydrophobicContact CB-CE1 4.08Å; K284-Y295 HydrophobicContact CG-CE1 4.24Å
296V95.3Very high92.2Very high2 Ų279 Ų791%0.01239%0.388CS..EExtended strand (participates in β ladder)trans-132166.2-176.5-60.40000112Q281 T282 V283 R285 Y294 F300Q281-V296 WeakPolarHBondContact CA-O 3.36Å; T282-V296 PolarHBondContact N-O 2.58Å; T282-V296 VanDerWaalsContact N-O 3.15Å; V283-V296 HydrophobicContact CB-CG2 4.02Å; V283-V296 WeakPolarHBondContact CB-O 3.43Å; V283-V296 HydrophobicContact CG1-CG2 4.28Å; V283-V296 PolarHBondContact N-O 3.32Å; V283-V296 PolarHBondContact O-N 3.05Å; R285-V296 HydrophobicContact CG-CG2 4.08Å; Y294-V296 HydrophobicContact CD2-CG1 3.58Å; Y294-V296 HydrophobicContact CE2-CG1 3.45Å; Y294-V296 VanDerWaalsContact CE2-CG1 3.45Å; V296-F300 HydrophobicContact CB-CB 3.76Å; V296-F300 HydrophobicContact CB-CD1 4.1Å; V296-F300 HydrophobicContact CB-CD2 3.77Å; V296-F300 HydrophobicContact CB-CE2 4.39Å; V296-F300 HydrophobicContact CB-CG 3.61Å; V296-F300 HydrophobicContact CG1-CB 4.46Å; V296-F300 HydrophobicContact CG1-CD1 4Å; V296-F300 HydrophobicContact CG1-CD2 3.61Å; V296-F300 HydrophobicContact CG1-CE1 4.09Å; V296-F300 HydrophobicContact CG1-CE2 3.72Å; V296-F300 HydrophobicContact CG1-CG 3.76Å; V296-F300 HydrophobicContact CG1-CZ 3.97Å; V296-F300 HydrophobicContact CG2-CB 3.79Å; V296-F300 HydrophobicContact CG2-CD1 3.91Å; V296-F300 HydrophobicContact CG2-CD2 4.45Å; V296-F300 HydrophobicContact CG2-CG 3.8Å
297T93.8Very high92Very high36 Ų3678.8 Ų78.822%0.22140%0.398CS..  trans-68.9167.517058.40000111Q281 D299 F300Q281-T297 HydrophobicContact CG-CG2 4.26Å; T297-D299 VanDerWaalsContact C-N 3.3Å; T297-D299 PolarHBondContact O-N 3.18Å; T297-F300 WeakPolarHBondContact O-CB 3.49Å
298R91.5Very high91.9Very high202 Ų20280.5 Ų80.576%0.76241%0.413SS*.THydrogen-bonded Turntrans-66.3-35.1-179.8-65-179.6-180-179.4-0.1112.1V283 F300V283-R298 HydrophobicContact CG2-CG 4.11Å; R298-F300 VanDerWaalsContact C-N 3.34Å; R298-F300 PolarHBondContact O-N 3.14Å
299D89.8Confident92Very high106 Ų10675.8 Ų75.857%0.56739%0.387SS*.THydrogen-bonded Turntrans-85.4-5.8-172.8-46.9-67.2000113.6T297 K301 S302 E303T297-D299 VanDerWaalsContact C-N 3.3Å; T297-D299 PolarHBondContact O-N 3.18Å; D299-K301 VanDerWaalsContact C-N 3.27Å; D299-K301 PolarHBondContact O-N 3.34Å; D299-K301 VanDerWaalsContact O-N 3.16Å; D299-S302 WeakPolarHBondContact O-CA 3.45Å; D299-S302 WeakPolarHBondContact O-CB 3.46Å; D299-S302 PolarHBondContact O-N 3.13Å; D299-S302 PolarHBondContact O-OG 3.14Å; D299-E303 PolarHBondContact O-N 3.32Å; D299-E303 VanDerWaalsContact O-N 3.12Å
300F91.4Very high92.2Very high1 Ų176.6 Ų76.60%0.00439%0.387CS..Hα-helixtrans-51.9-39.2-179.2-179.3-89.6000113.8P270 Y294 V296 T297 R298 S302 E303 F304 L309 I312P270-F300 HydrophobicContact CB-CE2 4.31Å; P270-F300 WeakPolarHBondContact O-CD2 3.41Å; Y294-F300 HydrophobicContact CE2-CE1 4.38Å; Y294-F300 HydrophobicContact CE2-CZ 4.15Å; V296-F300 HydrophobicContact CB-CB 3.76Å; V296-F300 HydrophobicContact CB-CD1 4.1Å; V296-F300 HydrophobicContact CB-CD2 3.77Å; V296-F300 HydrophobicContact CB-CE2 4.39Å; V296-F300 HydrophobicContact CB-CG 3.61Å; V296-F300 HydrophobicContact CG1-CB 4.46Å; V296-F300 HydrophobicContact CG1-CD1 4Å; V296-F300 HydrophobicContact CG1-CD2 3.61Å; V296-F300 HydrophobicContact CG1-CE1 4.09Å; V296-F300 HydrophobicContact CG1-CE2 3.72Å; V296-F300 HydrophobicContact CG1-CG 3.76Å; V296-F300 HydrophobicContact CG1-CZ 3.97Å; V296-F300 HydrophobicContact CG2-CB 3.79Å; V296-F300 HydrophobicContact CG2-CD1 3.91Å; V296-F300 HydrophobicContact CG2-CD2 4.45Å; V296-F300 HydrophobicContact CG2-CG 3.8Å; T297-F300 WeakPolarHBondContact O-CB 3.49Å; R298-F300 VanDerWaalsContact C-N 3.34Å; R298-F300 PolarHBondContact O-N 3.14Å; F300-S302 VanDerWaalsContact C-N 3.27Å; F300-S302 PolarHBondContact O-N 3.29Å; F300-E303 PolarHBondContact O-N 2.86Å; F300-F304 AromaticContact CD2-CD2 3.48Å; F300-F304 HydrophobicContact CD2-CD2 3.48Å; F300-F304 VanDerWaalsContact CD2-CD2 3.48Å; F300-F304 AromaticContact CD2-CE2 3.98Å; F300-F304 HydrophobicContact CD2-CE2 3.98Å; F300-F304 HydrophobicContact CD2-CG 4.47Å; F300-F304 HydrophobicContact CE2-CB 4.45Å; F300-F304 AromaticContact CE2-CD2 3.6Å; F300-F304 HydrophobicContact CE2-CD2 3.6Å; F300-F304 HydrophobicContact CE2-CE2 4.21Å; F300-F304 HydrophobicContact CE2-CG 4.25Å; F300-F304 HydrophobicContact CG-CD2 4.11Å; F300-F304 HydrophobicContact CZ-CB 4.35Å; F300-F304 HydrophobicContact CZ-CD2 4.32Å; F300-F304 PolarHBondContact O-N 2.93Å; F300-L309 HydrophobicContact CE1-CD1 3.62Å; F300-L309 HydrophobicContact CZ-CD1 3.92Å; F300-I312 HydrophobicContact CE2-CD1 4.03Å; F300-I312 HydrophobicContact CE2-CG2 4.08Å; F300-I312 HydrophobicContact CZ-CD1 4.23Å; F300-I312 HydrophobicContact CZ-CG2 3.85Å
301K88.8Confident92.4Very high142 Ų14280.7 Ų80.762%0.61741%0.405SS*.Hα-helixtrans-68.2-24.1178.1-69.2-173.1-178.5-178.60113.5D299 K305D299-K301 VanDerWaalsContact C-N 3.27Å; D299-K301 PolarHBondContact O-N 3.34Å; D299-K301 VanDerWaalsContact O-N 3.16Å; K301-K305 WeakPolarHBondContact O-CE 3.26Å
302S89.3Confident92.4Very high78 Ų7872.4 Ų72.455%0.54537%0.374SS..Hα-helixtrans-81.7-41.3175.460000111.1D299 F300 K305D299-S302 WeakPolarHBondContact O-CA 3.45Å; D299-S302 WeakPolarHBondContact O-CB 3.46Å; D299-S302 PolarHBondContact O-N 3.13Å; D299-S302 PolarHBondContact O-OG 3.14Å; F300-S302 VanDerWaalsContact C-N 3.27Å; F300-S302 PolarHBondContact O-N 3.29Å; S302-K305 WeakPolarHBondContact O-CE 3.5Å
303E87.7Confident92.4Very high130 Ų13072.6 Ų72.661%0.60738%0.375SS*.Hα-helixtrans-76.9-44.9-173.8-167.7178-176.200113D299 F300D299-E303 PolarHBondContact O-N 3.32Å; D299-E303 VanDerWaalsContact O-N 3.12Å; F300-E303 PolarHBondContact O-N 2.86Å
304F90.3Very high92.4Very high43 Ų4375.7 Ų75.719%0.18939%0.385CS..  trans-114.7117.2-173.8-56.7-73.7000112.2P270 F300 A308 I312P270-F304 HydrophobicContact CB-CE2 3.8Å; P270-F304 HydrophobicContact CB-CZ 3.93Å; F300-F304 AromaticContact CD2-CD2 3.48Å; F300-F304 HydrophobicContact CD2-CD2 3.48Å; F300-F304 VanDerWaalsContact CD2-CD2 3.48Å; F300-F304 AromaticContact CD2-CE2 3.98Å; F300-F304 HydrophobicContact CD2-CE2 3.98Å; F300-F304 HydrophobicContact CD2-CG 4.47Å; F300-F304 HydrophobicContact CE2-CB 4.45Å; F300-F304 AromaticContact CE2-CD2 3.6Å; F300-F304 HydrophobicContact CE2-CD2 3.6Å; F300-F304 HydrophobicContact CE2-CE2 4.21Å; F300-F304 HydrophobicContact CE2-CG 4.25Å; F300-F304 HydrophobicContact CG-CD2 4.11Å; F300-F304 HydrophobicContact CZ-CB 4.35Å; F300-F304 HydrophobicContact CZ-CD2 4.32Å; F300-F304 PolarHBondContact O-N 2.93Å; F304-A308 HydrophobicContact CD1-CB 4.47Å; F304-I312 HydrophobicContact CB-CD1 3.88Å; F304-I312 HydrophobicContact CD1-CD1 3.31Å; F304-I312 HydrophobicContact CD2-CD1 3.9Å; F304-I312 HydrophobicContact CE1-CD1 3.75Å; F304-I312 HydrophobicContact CE2-CD1 4.29Å; F304-I312 HydrophobicContact CG-CD1 3.39Å; F304-I312 HydrophobicContact CZ-CD1 4.22Å
305K92.1Very high92.4Very high139 Ų13978.8 Ų78.860%0.60440%0.402SS*.  trans-142.6158-177.9-62.6177.2-173.8165.20111.1K301 S302 S307 A308K301-K305 WeakPolarHBondContact O-CE 3.26Å; S302-K305 WeakPolarHBondContact O-CE 3.5Å; K305-S307 PolarHBondContact O-N 3.47Å; K305-A308 PolarHBondContact O-N 3.19Å
306G92.3Very high92.4Very high58 Ų5876.3 Ų76.360%0.59839%0.392SS*.THydrogen-bonded Turntrans59.6-132.3176.200000112.6A308 L309 Q310G306-A308 VanDerWaalsContact C-N 3.27Å; G306-A308 PolarHBondContact O-N 3.41Å; G306-L309 WeakPolarHBondContact O-CB 3.35Å; G306-L309 PolarHBondContact O-N 2.99Å; G306-L309 VanDerWaalsContact O-N 3.1Å; G306-Q310 PolarHBondContact O-N 2.85Å; G306-Q310 VanDerWaalsContact O-N 3.16Å
307S91.8Very high92.4Very high98 Ų9876.9 Ų76.969%0.68540%0.395SS*.Hα-helixtrans-58.1-34.4-179.650.90000113.8K305 L309 Q310 Q311K305-S307 PolarHBondContact O-N 3.47Å; S307-L309 VanDerWaalsContact C-N 3.34Å; S307-L309 PolarHBondContact O-N 3.34Å; S307-Q310 PolarHBondContact O-N 3.41Å; S307-Q311 WeakPolarHBondContact O-CB 3.44Å; S307-Q311 PolarHBondContact O-N 3.02Å
308A91.8Very high92.4Very high39 Ų3979.2 Ų79.232%0.32241%0.406SS..Hα-helixtrans-65.9-36.7177.300000112.1F304 K305 G306 I312F304-A308 HydrophobicContact CD1-CB 4.47Å; K305-A308 PolarHBondContact O-N 3.19Å; G306-A308 VanDerWaalsContact C-N 3.27Å; G306-A308 PolarHBondContact O-N 3.41Å; A308-I312 WeakPolarHBondContact O-CG1 3.44Å; A308-I312 PolarHBondContact O-N 3.4Å; A308-I312 VanDerWaalsContact O-N 3.11Å
309L93.2Very high92.6Very high39 Ų3973.2 Ų73.220%0.20439%0.389CS..Hα-helixtrans-67.1-45.9173.9178.362.8000110.8F300 G306 S307 Q311 I312 E313F300-L309 HydrophobicContact CE1-CD1 3.62Å; F300-L309 HydrophobicContact CZ-CD1 3.92Å; G306-L309 WeakPolarHBondContact O-CB 3.35Å; G306-L309 PolarHBondContact O-N 2.99Å; G306-L309 VanDerWaalsContact O-N 3.1Å; S307-L309 VanDerWaalsContact C-N 3.34Å; S307-L309 PolarHBondContact O-N 3.34Å; L309-Q311 VanDerWaalsContact C-N 3.29Å; L309-Q311 PolarHBondContact O-N 3.21Å; L309-I312 PolarHBondContact O-N 2.6Å; L309-I312 VanDerWaalsContact O-N 3.13Å; L309-E313 HydrophobicContact CD1-CG 4.19Å; L309-E313 PolarHBondContact O-N 3.4Å
310Q92.7Very high92.9Very high147 Ų14771 Ų7169%0.68737%0.373SS*.Hα-helixtrans-60.8-38.2178.1-169.2-17915.600112.2G306 S307 K314G306-Q310 PolarHBondContact O-N 2.85Å; G306-Q310 VanDerWaalsContact O-N 3.16Å; S307-Q310 PolarHBondContact O-N 3.41Å; Q310-K314 WeakPolarHBondContact O-CB 3.46Å; Q310-K314 PolarHBondContact O-N 3.44Å
311Q93.7Very high93.1Very high128 Ų12871.6 Ų71.660%0.59838%0.377SS*.Hα-helixtrans-66.4-40.1174.9-172.7173.95.100111.9S307 L309 N315S307-Q311 WeakPolarHBondContact O-CB 3.44Å; S307-Q311 PolarHBondContact O-N 3.02Å; L309-Q311 VanDerWaalsContact C-N 3.29Å; L309-Q311 PolarHBondContact O-N 3.21Å; Q311-N315 PolarHBondContact O-N 2.95Å; Q311-N315 PolarHBondContact O-ND2 3.34Å; Q311-N315 PolarHBondContact O-OD1 2.95Å
312I94.1Very high93.4Very high13 Ų1367.7 Ų67.77%0.06737%0.365CS..Hα-helixtrans-65.9-45.3175.3-72.1167.3000111.1P270 Y271 F300 F304 A308 L309 K314 N315 V316P270-I312 HydrophobicContact CB-CD1 4.38Å; P270-I312 HydrophobicContact CG-CD1 4.47Å; Y271-I312 HydrophobicContact CD1-CG2 3.64Å; Y271-I312 HydrophobicContact CE1-CG2 4.06Å; F300-I312 HydrophobicContact CE2-CD1 4.03Å; F300-I312 HydrophobicContact CE2-CG2 4.08Å; F300-I312 HydrophobicContact CZ-CD1 4.23Å; F300-I312 HydrophobicContact CZ-CG2 3.85Å; F304-I312 HydrophobicContact CB-CD1 3.88Å; F304-I312 HydrophobicContact CD1-CD1 3.31Å; F304-I312 HydrophobicContact CD2-CD1 3.9Å; F304-I312 HydrophobicContact CE1-CD1 3.75Å; F304-I312 HydrophobicContact CE2-CD1 4.29Å; F304-I312 HydrophobicContact CG-CD1 3.39Å; F304-I312 HydrophobicContact CZ-CD1 4.22Å; A308-I312 WeakPolarHBondContact O-CG1 3.44Å; A308-I312 PolarHBondContact O-N 3.4Å; A308-I312 VanDerWaalsContact O-N 3.11Å; L309-I312 PolarHBondContact O-N 2.6Å; L309-I312 VanDerWaalsContact O-N 3.13Å; I312-K314 VanDerWaalsContact C-N 3.32Å; I312-K314 PolarHBondContact O-N 3.41Å; I312-N315 PolarHBondContact O-N 2.99Å; I312-N315 VanDerWaalsContact O-N 3.12Å; I312-V316 HydrophobicContact CG2-CG2 4.35Å; I312-V316 WeakPolarHBondContact O-CG2 3.47Å; I312-V316 PolarHBondContact O-N 3.42Å
313E94.9Very high93.7Very high11 Ų1166.1 Ų66.15%0.05135%0.35CS..Hα-helixtrans-66-35.2179.8-68.9-170.9174.800112R285 T287 Y294 L309 V316 E317R285-E313 IonicContact CZ-OE1 3.25Å; R285-E313 IonicContact NE-OE1 3.21Å; R285-E313 IonicContact NH2-OE1 2.93Å; R285-E313 PolarHBondContact NH2-OE1 3.43Å; T287-E313 HydrophobicContact CG2-CB 3.98Å; T287-E313 HydrophobicContact CG2-CG 4.21Å; Y294-E313 HydrophobicContact CE1-CG 4.12Å; Y294-E313 VanDerWaalsContact OH-CG 3.29Å; Y294-E313 WeakPolarHBondContact OH-CG 3.38Å; Y294-E313 PolarHBondContact OH-OE1 2.94Å; L309-E313 HydrophobicContact CD1-CG 4.19Å; L309-E313 PolarHBondContact O-N 3.4Å; E313-V316 WeakPolarHBondContact O-CB 3.29Å; E313-V316 PolarHBondContact O-N 3.25Å; E313-E317 WeakPolarHBondContact O-CG 3.29Å; E313-E317 PolarHBondContact O-N 3.26Å
314K94.6Very high94.1Very high126 Ų12660.1 Ų60.155%0.54832%0.323SS..Hα-helixtrans-61-47.5168.1-177.1-179.2175-1770112.1Q310 I312 V316 E317 D318Q310-K314 WeakPolarHBondContact O-CB 3.46Å; Q310-K314 PolarHBondContact O-N 3.44Å; I312-K314 VanDerWaalsContact C-N 3.32Å; I312-K314 PolarHBondContact O-N 3.41Å; K314-V316 VanDerWaalsContact C-N 3.29Å; K314-V316 PolarHBondContact O-N 3.28Å; K314-E317 WeakPolarHBondContact O-CB 3.45Å; K314-E317 PolarHBondContact O-N 2.99Å; K314-E317 VanDerWaalsContact O-N 3.12Å; K314-D318 WeakPolarHBondContact CE-OD2 3.38Å; K314-D318 PolarHBondContact O-N 3.36Å
315N95.1Very high94.4Very high65 Ų6563.6 Ų63.635%0.34834%0.335SS..Hα-helixtrans-62.2-37.5178.8-65.8-12.2000111.7Y271 Q311 I312 E317 D318 D319Y271-N315 HydrophobicContact CE1-CB 4.36Å; Y271-N315 WeakPolarHBondContact OH-CB 3.22Å; Q311-N315 PolarHBondContact O-N 2.95Å; Q311-N315 PolarHBondContact O-ND2 3.34Å; Q311-N315 PolarHBondContact O-OD1 2.95Å; I312-N315 PolarHBondContact O-N 2.99Å; I312-N315 VanDerWaalsContact O-N 3.12Å; N315-E317 VanDerWaalsContact C-N 3.34Å; N315-D318 PolarHBondContact O-N 2.99Å; N315-D319 VanDerWaalsContact O-CB 3.28Å; N315-D319 WeakPolarHBondContact O-CB 3.4Å; N315-D319 PolarHBondContact O-N 3.41Å
316V96.2Very high94.6Very high0 Ų061 Ų610%033%0.327CS..Hα-helixtrans-59.4-43.9172.4167.60000111.2Y271 L273 T287 V292 Y294 I312 E313 K314 Y320Y271-V316 HydrophobicContact CD1-CG2 3.87Å; Y271-V316 HydrophobicContact CD2-CG2 3.51Å; Y271-V316 HydrophobicContact CE1-CG2 3.99Å; Y271-V316 HydrophobicContact CE2-CB 4.47Å; Y271-V316 HydrophobicContact CE2-CG2 3.66Å; Y271-V316 HydrophobicContact CG-CG2 3.63Å; L273-V316 HydrophobicContact CD2-CG1 4.03Å; T287-V316 HydrophobicContact CG2-CB 3.95Å; T287-V316 HydrophobicContact CG2-CG1 3.53Å; V292-V316 HydrophobicContact CB-CG1 4.31Å; V292-V316 HydrophobicContact CG1-CG1 3.84Å; Y294-V316 HydrophobicContact CD1-CG1 3.93Å; Y294-V316 HydrophobicContact CD1-CG2 4.42Å; Y294-V316 HydrophobicContact CD2-CG2 4.04Å; Y294-V316 HydrophobicContact CE2-CG2 4.45Å; Y294-V316 HydrophobicContact CG-CG1 3.95Å; Y294-V316 HydrophobicContact CG-CG2 4.02Å; I312-V316 HydrophobicContact CG2-CG2 4.35Å; I312-V316 WeakPolarHBondContact O-CG2 3.47Å; I312-V316 PolarHBondContact O-N 3.42Å; E313-V316 WeakPolarHBondContact O-CB 3.29Å; E313-V316 PolarHBondContact O-N 3.25Å; K314-V316 VanDerWaalsContact C-N 3.29Å; K314-V316 PolarHBondContact O-N 3.28Å; V316-Y320 WeakPolarHBondContact O-CB 3.42Å; V316-Y320 PolarHBondContact O-N 3.43Å
317E95.1Very high94.8Very high14 Ų1459.9 Ų59.97%0.06531%0.309CS..Hα-helixtrans-66.8-45.9177.7-72.1179.9165.800112T287 N289 L290 V292 E313 K314 N315 Y320 V321T287-E317 WeakPolarHBondContact CB-OE1 3.19Å; T287-E317 HydrophobicContact CG2-CG 4.01Å; T287-E317 WeakPolarHBondContact OG1-CG 3.48Å; T287-E317 PolarHBondContact OG1-OE1 3.46Å; N289-E317 WeakPolarHBondContact CB-OE1 3.43Å; N289-E317 PolarHBondContact N-OE1 3.35Å; N289-E317 PolarHBondContact ND2-OE2 3.05Å; L290-E317 HydrophobicContact CB-CG 4.1Å; L290-E317 HydrophobicContact CD1-CB 3.98Å; L290-E317 HydrophobicContact CD1-CG 4.03Å; L290-E317 HydrophobicContact CG-CG 4.2Å; L290-E317 PolarHBondContact N-OE1 3.22Å; V292-E317 HydrophobicContact CG2-CG 4.37Å; E313-E317 WeakPolarHBondContact O-CG 3.29Å; E313-E317 PolarHBondContact O-N 3.26Å; K314-E317 WeakPolarHBondContact O-CB 3.45Å; K314-E317 PolarHBondContact O-N 2.99Å; K314-E317 VanDerWaalsContact O-N 3.12Å; N315-E317 VanDerWaalsContact C-N 3.34Å; E317-Y320 PolarHBondContact O-N 3.49Å; E317-V321 VanDerWaalsContact O-CG2 3.29Å; E317-V321 WeakPolarHBondContact O-CG2 3.39Å; E317-V321 PolarHBondContact O-N 3.12Å
318D94.6Very high95.1Very high84 Ų8455.9 Ų55.945%0.44928%0.28SS..Hα-helixtrans-62.6-42.7177.2-75.9-30.7000111.8K314 N315 T322K314-D318 WeakPolarHBondContact CE-OD2 3.38Å; K314-D318 PolarHBondContact O-N 3.36Å; N315-D318 PolarHBondContact O-N 2.99Å; D318-T322 VanDerWaalsContact O-CB 3.24Å; D318-T322 WeakPolarHBondContact O-CB 3.45Å; D318-T322 PolarHBondContact O-N 2.84Å; D318-T322 PolarHBondContact O-OG1 3.12Å
319D95.5Very high95.3Very high76 Ų7660.9 Ų60.941%0.40629%0.291SS..Hα-helixtrans-64.3-43.1174.2-83.6-19000111.8Y271 L273 N315 T322 N323Y271-D319 WeakPolarHBondContact CE2-OD2 3.35Å; Y271-D319 PolarHBondContact OH-OD2 2.95Å; L273-D319 HydrophobicContact CD1-CB 4.4Å; N315-D319 VanDerWaalsContact O-CB 3.28Å; N315-D319 WeakPolarHBondContact O-CB 3.4Å; N315-D319 PolarHBondContact O-N 3.41Å; D319-T322 PolarHBondContact O-N 3.34Å; D319-N323 VanDerWaalsContact O-CB 3.31Å; D319-N323 WeakPolarHBondContact O-CB 3.48Å; D319-N323 PolarHBondContact O-N 3.24Å
320Y95.6Very high95.5Very high60 Ų6065.2 Ų65.224%0.23531%0.308CS..Hα-helixtrans-63.7-50.2178.9174.4-99.1000111.7V292 V316 E317 T322 N323 V324 L368V292-Y320 HydrophobicContact CB-CG 4.36Å; V292-Y320 HydrophobicContact CG1-CD1 4.3Å; V292-Y320 HydrophobicContact CG1-CD2 3.73Å; V292-Y320 HydrophobicContact CG1-CE2 4.42Å; V292-Y320 HydrophobicContact CG1-CG 3.66Å; V292-Y320 HydrophobicContact CG2-CD1 3.44Å; V292-Y320 VanDerWaalsContact CG2-CD1 3.44Å; V292-Y320 HydrophobicContact CG2-CD2 4.32Å; V292-Y320 HydrophobicContact CG2-CE1 3.9Å; V292-Y320 HydrophobicContact CG2-CG 3.68Å; V316-Y320 WeakPolarHBondContact O-CB 3.42Å; V316-Y320 PolarHBondContact O-N 3.43Å; E317-Y320 PolarHBondContact O-N 3.49Å; Y320-T322 PolarHBondContact O-N 3.48Å; Y320-N323 WeakPolarHBondContact O-CB 3.45Å; Y320-N323 PolarHBondContact O-N 3.06Å; Y320-N323 VanDerWaalsContact O-N 3.16Å; Y320-V324 HydrophobicContact CD1-CG2 4.34Å; Y320-V324 HydrophobicContact CD2-CG2 4.34Å; Y320-V324 HydrophobicContact CE1-CG2 3.93Å; Y320-V324 HydrophobicContact CE2-CG2 3.93Å; Y320-V324 WeakPolarHBondContact O-CG2 3.43Å; Y320-V324 PolarHBondContact O-N 3.07Å; Y320-L368 HydrophobicContact CE1-CD1 4.05Å; Y320-L368 HydrophobicContact CE1-CD2 4.49Å
321V95.1Very high95.7Very high13 Ų1359.5 Ų59.58%0.07928%0.282CS..Hα-helixtrans-59.2-39.4176.2172.90000110.6L290 E317 R325 L368 F372L290-V321 HydrophobicContact CD1-CG2 3.91Å; E317-V321 VanDerWaalsContact O-CG2 3.29Å; E317-V321 WeakPolarHBondContact O-CG2 3.39Å; E317-V321 PolarHBondContact O-N 3.12Å; V321-R325 VanDerWaalsContact O-CB 3.3Å; V321-R325 WeakPolarHBondContact O-CB 3.47Å; V321-R325 PolarHBondContact O-N 3.13Å; V321-L368 HydrophobicContact CG2-CD1 4.27Å; V321-L368 HydrophobicContact CG2-CD2 4.48Å; V321-F372 HydrophobicContact CG2-CE2 4.34Å
322T95.4Very high95.8Very high60 Ų6060.7 Ų60.737%0.36828%0.281SS..Hα-helixtrans-67.4-40.9176.9-62.40000112.2D318 D319 Y320 R325 N326D318-T322 VanDerWaalsContact O-CB 3.24Å; D318-T322 WeakPolarHBondContact O-CB 3.45Å; D318-T322 PolarHBondContact O-N 2.84Å; D318-T322 PolarHBondContact O-OG1 3.12Å; D319-T322 PolarHBondContact O-N 3.34Å; Y320-T322 PolarHBondContact O-N 3.48Å; T322-R325 PolarHBondContact O-N 3.02Å; T322-N326 WeakPolarHBondContact O-CB 3.5Å; T322-N326 PolarHBondContact O-N 3.22Å; T322-N326 PolarHBondContact O-ND2 3.18Å
323N96.1Very high95.9Very high45 Ų4563.5 Ų63.524%0.24129%0.293CS..Hα-helixtrans-62.7-50.1174.7-172.319.7000111.2L273 Y274 D319 Y320 R325 N326 T327L273-N323 HydrophobicContact CD1-CB 4.32Å; Y274-N323 PolarHBondContact OH-ND2 2.94Å; D319-N323 VanDerWaalsContact O-CB 3.31Å; D319-N323 WeakPolarHBondContact O-CB 3.48Å; D319-N323 PolarHBondContact O-N 3.24Å; Y320-N323 WeakPolarHBondContact O-CB 3.45Å; Y320-N323 PolarHBondContact O-N 3.06Å; Y320-N323 VanDerWaalsContact O-N 3.16Å; N323-R325 VanDerWaalsContact C-N 3.31Å; N323-R325 PolarHBondContact O-N 3.24Å; N323-N326 PolarHBondContact O-N 3.37Å; N323-N326 VanDerWaalsContact O-N 3.1Å; N323-T327 PolarHBondContact O-N 3.2Å; N323-T327 PolarHBondContact O-OG1 3.1Å; N323-T327 VanDerWaalsContact O-OG1 3.05Å
324V95.9Very high96Very high5 Ų565.9 Ų65.93%0.0331%0.309CS..Hα-helixtrans-59-40.3177173.20000111.8Y320 T327 C328 N361 E364 L365 L368Y320-V324 HydrophobicContact CD1-CG2 4.34Å; Y320-V324 HydrophobicContact CD2-CG2 4.34Å; Y320-V324 HydrophobicContact CE1-CG2 3.93Å; Y320-V324 HydrophobicContact CE2-CG2 3.93Å; Y320-V324 WeakPolarHBondContact O-CG2 3.43Å; Y320-V324 PolarHBondContact O-N 3.07Å; V324-T327 WeakPolarHBondContact CA-OG1 3.47Å; V324-T327 PolarHBondContact O-OG1 3.38Å; V324-T327 VanDerWaalsContact O-OG1 3.06Å; V324-C328 VanDerWaalsContact O-CB 3.25Å; V324-C328 WeakPolarHBondContact O-CB 3.42Å; V324-C328 PolarHBondContact O-N 3.25Å; V324-N361 VanDerWaalsContact CG1-O 3.32Å; V324-N361 WeakPolarHBondContact CG1-O 3.26Å; V324-E364 HydrophobicContact CG1-CB 4.25Å; V324-L365 HydrophobicContact CG1-CB 3.97Å; V324-L365 HydrophobicContact CG1-CD1 4.39Å; V324-L368 HydrophobicContact CB-CD1 4.38Å; V324-L368 HydrophobicContact CG1-CD1 4.09Å
325R95.9Very high96.1Very high116 Ų11662.4 Ų62.444%0.43829%0.294SS..Hα-helixtrans-62.6-44.9174-171.8-177.1-63.7116.9-0.8112V321 T322 N323 W329 L365V321-R325 VanDerWaalsContact O-CB 3.3Å; V321-R325 WeakPolarHBondContact O-CB 3.47Å; V321-R325 PolarHBondContact O-N 3.13Å; T322-R325 PolarHBondContact O-N 3.02Å; N323-R325 VanDerWaalsContact C-N 3.31Å; N323-R325 PolarHBondContact O-N 3.24Å; R325-W329 WeakPolarHBondContact O-CB 3.45Å; R325-W329 PolarHBondContact O-N 2.93Å; R325-L365 HydrophobicContact CB-CD1 3.95Å; R325-L365 HydrophobicContact CB-CD2 4.48Å; R325-L365 HydrophobicContact CG-CD1 4.38Å; R325-L365 HydrophobicContact CG-CD2 4.32Å
326N96.7Very high96.1Very high85 Ų8562.8 Ų62.846%0.45530%0.299SS..Hα-helixtrans-70.4-37.1-179.4-72.1-24000112.7T322 N323 K330T322-N326 WeakPolarHBondContact O-CB 3.5Å; T322-N326 PolarHBondContact O-N 3.22Å; T322-N326 PolarHBondContact O-ND2 3.18Å; N323-N326 PolarHBondContact O-N 3.37Å; N323-N326 VanDerWaalsContact O-N 3.1Å; N326-K330 WeakPolarHBondContact O-CG 3.48Å; N326-K330 PolarHBondContact O-N 3.15Å
327T96.7Very high96.1Very high34 Ų3466.5 Ų66.521%0.20932%0.318CS..Hα-helixtrans-70.7-44.8174.850.70000111.2N323 V324 W329 K330 E331 N361N323-T327 PolarHBondContact O-N 3.2Å; N323-T327 PolarHBondContact O-OG1 3.1Å; N323-T327 VanDerWaalsContact O-OG1 3.05Å; V324-T327 WeakPolarHBondContact CA-OG1 3.47Å; V324-T327 PolarHBondContact O-OG1 3.38Å; V324-T327 VanDerWaalsContact O-OG1 3.06Å; T327-W329 VanDerWaalsContact C-N 3.3Å; T327-W329 PolarHBondContact O-N 3.44Å; T327-K330 WeakPolarHBondContact O-CB 3.34Å; T327-K330 PolarHBondContact O-N 2.91Å; T327-K330 VanDerWaalsContact O-N 3.1Å; T327-E331 WeakPolarHBondContact O-CG 3.31Å; T327-E331 PolarHBondContact O-N 3.13Å; T327-N361 VanDerWaalsContact OG1-CB 3.24Å; T327-N361 WeakPolarHBondContact OG1-CB 3.45Å; T327-N361 PolarHBondContact OG1-OD1 3.18Å
328C97.4Very high96.2Very high13 Ų1367.6 Ų67.69%0.08833%0.325CS..Hα-helixtrans-55.5-43.5171.7169.10000112.3V324 K330 E331 R332 N361 C362 L365V324-C328 VanDerWaalsContact O-CB 3.25Å; V324-C328 WeakPolarHBondContact O-CB 3.42Å; V324-C328 PolarHBondContact O-N 3.25Å; C328-K330 VanDerWaalsContact C-N 3.32Å; C328-K330 PolarHBondContact O-N 2.87Å; C328-E331 PolarHBondContact O-N 3.12Å; C328-R332 WeakPolarHBondContact O-CB 3.43Å; C328-R332 PolarHBondContact O-N 3.25Å; C328-N361 HydrophobicContact CB-CB 4.35Å; C328-C362 WeakPolarHBondContact CA-SG 3.45Å; C328-C362 HydrophobicContact CB-CB 3.94Å; C328-C362 WeakPolarHBondContact CB-SG 3.44Å; C328-C362 PolarHBondContact O-SG 3.2Å; C328-C362 WeakPolarHBondContact SG-CA 3.22Å; C328-C362 WeakPolarHBondContact SG-CB 3.17Å; C328-C362 CovalentContact SG-SG 2.04Å; C328-C362 PolarHBondContact SG-SG 3.13Å; C328-L365 HydrophobicContact CB-CB 4.5Å; C328-L365 HydrophobicContact CB-CD2 4.06Å
329W96.9Very high96.2Very high145 Ų14567.2 Ų67.255%0.54932%0.322SS..Hα-helixtrans-59.8-42.6176.7-177.191.4000111.9R325 T327 R332 Q333R325-W329 WeakPolarHBondContact O-CB 3.45Å; R325-W329 PolarHBondContact O-N 2.93Å; T327-W329 VanDerWaalsContact C-N 3.3Å; T327-W329 PolarHBondContact O-N 3.44Å; W329-R332 PolarHBondContact O-N 3.39Å; W329-Q333 HydrophobicContact CH2-CG 4.46Å; W329-Q333 WeakPolarHBondContact O-CB 3.37Å; W329-Q333 PolarHBondContact O-N 3.06Å
330K97.3Very high96.2Very high130 Ų13071.3 Ų71.357%0.56533%0.333SS*.Hα-helixtrans-65.3-43.3175-69.2171.3-176.9177.10112.6N326 T327 C328 R332 Q333 T334N326-K330 WeakPolarHBondContact O-CG 3.48Å; N326-K330 PolarHBondContact O-N 3.15Å; T327-K330 WeakPolarHBondContact O-CB 3.34Å; T327-K330 PolarHBondContact O-N 2.91Å; T327-K330 VanDerWaalsContact O-N 3.1Å; C328-K330 VanDerWaalsContact C-N 3.32Å; C328-K330 PolarHBondContact O-N 2.87Å; K330-R332 VanDerWaalsContact C-N 3.32Å; K330-R332 PolarHBondContact O-N 3.27Å; K330-Q333 PolarHBondContact O-N 3.39Å; K330-T334 WeakPolarHBondContact O-CB 3.49Å; K330-T334 WeakPolarHBondContact O-CG2 3.38Å; K330-T334 PolarHBondContact O-N 3.42Å; K330-T334 PolarHBondContact O-OG1 2.91Å
331E96.4Very high96.3Very high27 Ų2769.5 Ų69.513%0.12633%0.331CS..Hα-helixtrans-57.6-45.9173.9-71.9178.2170.500110.9T327 C328 T334 K335 M357 M359 E360 N361 C362T327-E331 WeakPolarHBondContact O-CG 3.31Å; T327-E331 PolarHBondContact O-N 3.13Å; C328-E331 PolarHBondContact O-N 3.12Å; E331-T334 PolarHBondContact O-OG1 2.91Å; E331-K335 WeakPolarHBondContact O-CB 3.46Å; E331-K335 PolarHBondContact O-N 3.12Å; E331-M357 HydrophobicContact CB-CE 4.15Å; E331-M357 HydrophobicContact CG-CE 4.33Å; E331-M359 HydrophobicContact CB-CE 3.77Å; E331-M359 HydrophobicContact CB-SD 3.79Å; E331-M359 WeakPolarHBondContact OE2-CA 3.45Å; E331-E360 PolarHBondContact OE2-N 2.93Å; E331-N361 WeakPolarHBondContact OE1-CB 3.31Å; E331-N361 PolarHBondContact OE1-N 3.22Å; E331-N361 PolarHBondContact OE1-ND2 2.97Å; E331-N361 PolarHBondContact OE2-N 3.35Å; E331-C362 PolarHBondContact OE2-N 3.32Å
332R96.3Very high96.4Very high152 Ų15269.3 Ų69.357%0.57433%0.33SS*.Hα-helixtrans-68.6-39.9-179.5-166178.173.4177.44112.1C328 W329 K330 T336 M359C328-R332 WeakPolarHBondContact O-CB 3.43Å; C328-R332 PolarHBondContact O-N 3.25Å; W329-R332 PolarHBondContact O-N 3.39Å; K330-R332 VanDerWaalsContact C-N 3.32Å; K330-R332 PolarHBondContact O-N 3.27Å; R332-T336 WeakPolarHBondContact O-CB 3.5Å; R332-T336 PolarHBondContact O-N 3.25Å; R332-T336 PolarHBondContact O-OG1 3.24Å; R332-M359 VanDerWaalsContact CA-CE 3.47Å; R332-M359 HydrophobicContact CB-CE 3.78Å; R332-M359 HydrophobicContact CG-CE 4.32Å
333Q96.8Very high96.4Very high72 Ų7274.7 Ų74.734%0.33635%0.349SS..Hα-helixtrans-63.1-53.7176.4-17258.443.400110.5W329 K330 K335 T336 D337W329-Q333 HydrophobicContact CH2-CG 4.46Å; W329-Q333 WeakPolarHBondContact O-CB 3.37Å; W329-Q333 PolarHBondContact O-N 3.06Å; K330-Q333 PolarHBondContact O-N 3.39Å; Q333-K335 VanDerWaalsContact C-N 3.34Å; Q333-K335 PolarHBondContact O-N 3Å; Q333-T336 CarbonylContact O-C 3.56Å; Q333-T336 WeakPolarHBondContact O-CA 3.32Å; Q333-T336 WeakPolarHBondContact O-CB 3.37Å; Q333-T336 PolarHBondContact O-N 3.44Å; Q333-D337 PolarHBondContact NE2-OD1 2.95Å; Q333-D337 PolarHBondContact NE2-OD2 2.9Å; Q333-D337 PolarHBondContact O-N 3.35Å
334T96.1Very high96.4Very high62 Ų6276.1 Ų76.138%0.3836%0.359SS..Hα-helixtrans-59.9-38.6179.348.20000113.3K330 E331 D337 L338 M357K330-T334 WeakPolarHBondContact O-CB 3.49Å; K330-T334 WeakPolarHBondContact O-CG2 3.38Å; K330-T334 PolarHBondContact O-N 3.42Å; K330-T334 PolarHBondContact O-OG1 2.91Å; E331-T334 PolarHBondContact O-OG1 2.91Å; T334-D337 PolarHBondContact O-N 3.29Å; T334-L338 WeakPolarHBondContact O-CB 3.44Å; T334-L338 VanDerWaalsContact O-CG 3.29Å; T334-L338 WeakPolarHBondContact O-CG 3.45Å; T334-L338 PolarHBondContact O-N 3.4Å; T334-M357 VanDerWaalsContact OG1-CE 3.29Å; T334-M357 WeakPolarHBondContact OG1-CE 3.43Å
335K96.1Very high96.4Very high53 Ų5384.1 Ų84.123%0.2339%0.39CS..Hα-helixtrans-63.3-40.8171.5-174.3168.6-179.1121.30112.4E331 Q333 L339 A354 M357 M359E331-K335 WeakPolarHBondContact O-CB 3.46Å; E331-K335 PolarHBondContact O-N 3.12Å; Q333-K335 VanDerWaalsContact C-N 3.34Å; Q333-K335 PolarHBondContact O-N 3Å; K335-L339 WeakPolarHBondContact O-CG 3.46Å; K335-L339 PolarHBondContact O-N 3.22Å; K335-L339 VanDerWaalsContact O-N 3.11Å; K335-A354 WeakPolarHBondContact CE-O 3.43Å; K335-A354 HydrophobicContact CG-CB 4.34Å; K335-A354 PolarHBondContact NZ-O 3.33Å; K335-M357 HydrophobicContact CB-SD 4.1Å; K335-M357 PolarHBondContact NZ-O 2.9Å; K335-M359 HydrophobicContact CB-SD 4.19Å; K335-M359 HydrophobicContact CD-CG 4.11Å; K335-M359 HydrophobicContact CD-SD 3.66Å
336T95.7Very high96.4Very high73 Ų7389.6 Ų89.645%0.44841%0.41SS..Hα-helixtrans-66.7-42.8177.3-55.70000111.4R332 Q333 L339 Y340R332-T336 WeakPolarHBondContact O-CB 3.5Å; R332-T336 PolarHBondContact O-N 3.25Å; R332-T336 PolarHBondContact O-OG1 3.24Å; Q333-T336 CarbonylContact O-C 3.56Å; Q333-T336 WeakPolarHBondContact O-CA 3.32Å; Q333-T336 WeakPolarHBondContact O-CB 3.37Å; Q333-T336 PolarHBondContact O-N 3.44Å; T336-L339 PolarHBondContact O-N 3.14Å; T336-Y340 WeakPolarHBondContact O-CB 3.34Å; T336-Y340 PolarHBondContact O-N 2.97Å
337D96.6Very high96.3Very high77 Ų7788 Ų8841%0.41240%0.402SS..Hα-helixtrans-64.3-40.8178.2-63.1-27.7000111.4Q333 T334 Y340 A341Q333-D337 PolarHBondContact NE2-OD1 2.95Å; Q333-D337 PolarHBondContact NE2-OD2 2.9Å; Q333-D337 PolarHBondContact O-N 3.35Å; T334-D337 PolarHBondContact O-N 3.29Å; D337-Y340 PolarHBondContact O-N 3.11Å; D337-A341 VanDerWaalsContact O-CB 3.31Å; D337-A341 WeakPolarHBondContact O-CB 3.25Å; D337-A341 PolarHBondContact O-N 3.42Å
338L96.3Very high96.1Very high38 Ų3890.6 Ų90.620%0.19941%0.414CS..Hα-helixtrans-63.3-41173.6-73.9170000112.4T334 A342 K353 A354 M357T334-L338 WeakPolarHBondContact O-CB 3.44Å; T334-L338 VanDerWaalsContact O-CG 3.29Å; T334-L338 WeakPolarHBondContact O-CG 3.45Å; T334-L338 PolarHBondContact O-N 3.4Å; L338-A342 VanDerWaalsContact O-CB 3.28Å; L338-A342 WeakPolarHBondContact O-CB 3.41Å; L338-A342 PolarHBondContact O-N 2.62Å; L338-K353 HydrophobicContact CD1-CD 4.34Å; L338-K353 HydrophobicContact CD1-CG 4.25Å; L338-K353 HydrophobicContact CD2-CD 4.22Å; L338-A354 HydrophobicContact CB-CB 3.76Å; L338-A354 HydrophobicContact CD1-CB 4.49Å; L338-M357 HydrophobicContact CD1-SD 4.44Å
339L96.3Very high96.1Very high76 Ų7699.8 Ų99.840%0.39845%0.447SS..Hα-helixtrans-66.8-39.5175.2-71.4171.1000112.1K335 T336 K343 R351 A354K335-L339 WeakPolarHBondContact O-CG 3.46Å; K335-L339 PolarHBondContact O-N 3.22Å; K335-L339 VanDerWaalsContact O-N 3.11Å; T336-L339 PolarHBondContact O-N 3.14Å; L339-K343 WeakPolarHBondContact O-CB 3.45Å; L339-K343 PolarHBondContact O-N 2.95Å; L339-R351 HydrophobicContact CD2-CG 4.4Å; L339-A354 HydrophobicContact CD2-CB 3.67Å; L339-A354 HydrophobicContact CG-CB 3.69Å
340Y95.7Very high95.9Very high162 Ų16295.8 Ų95.864%0.63544%0.435SS*.Hα-helixtrans-64.7-48.8175.5178.5-101.1000111.3T336 D337 A342 K343 V344T336-Y340 WeakPolarHBondContact O-CB 3.34Å; T336-Y340 PolarHBondContact O-N 2.97Å; D337-Y340 PolarHBondContact O-N 3.11Å; Y340-A342 VanDerWaalsContact C-N 3.35Å; Y340-A342 PolarHBondContact O-N 3.39Å; Y340-K343 WeakPolarHBondContact O-CB 3.44Å; Y340-K343 PolarHBondContact O-N 2.97Å; Y340-K343 VanDerWaalsContact O-N 3.1Å; Y340-V344 HydrophobicContact CD1-CG2 4.18Å; Y340-V344 HydrophobicContact CD2-CG2 4.4Å; Y340-V344 HydrophobicContact CE1-CG2 3.71Å; Y340-V344 HydrophobicContact CE2-CG2 3.95Å; Y340-V344 HydrophobicContact CG-CG2 4.5Å; Y340-V344 WeakPolarHBondContact O-CG2 3.33Å; Y340-V344 PolarHBondContact O-N 3.16Å
341A96.2Very high95.8Very high22 Ų2294.6 Ų94.618%0.18243%0.427CS..Hα-helixtrans-58.6-45175.600000111.7D337 K343 V344 Y345 M350D337-A341 VanDerWaalsContact O-CB 3.31Å; D337-A341 WeakPolarHBondContact O-CB 3.25Å; D337-A341 PolarHBondContact O-N 3.42Å; A341-K343 VanDerWaalsContact C-N 3.27Å; A341-K343 PolarHBondContact O-N 3.13Å; A341-V344 PolarHBondContact O-N 2.97Å; A341-Y345 HydrophobicContact CB-CD2 4.25Å; A341-Y345 HydrophobicContact CB-CE2 4.44Å; A341-Y345 VanDerWaalsContact O-CD2 3.26Å; A341-Y345 WeakPolarHBondContact O-CD2 3.38Å; A341-Y345 PolarHBondContact O-N 2.85Å; A341-M350 HydrophobicContact CB-SD 3.77Å
342A97.1Very high95.8Very high9 Ų999.3 Ų99.37%0.07445%0.447CS..Hα-helixtrans-57-40174.700000112.6L338 Y340 R346 D347 M350 R351L338-A342 VanDerWaalsContact O-CB 3.28Å; L338-A342 WeakPolarHBondContact O-CB 3.41Å; L338-A342 PolarHBondContact O-N 2.62Å; Y340-A342 VanDerWaalsContact C-N 3.35Å; Y340-A342 PolarHBondContact O-N 3.39Å; A342-R346 CarbonylContact O-C 3.57Å; A342-R346 WeakPolarHBondContact O-CA 3.35Å; A342-R346 PolarHBondContact O-N 3.34Å; A342-D347 PolarHBondContact O-N 3.37Å; A342-M350 HydrophobicContact CB-CB 3.73Å; A342-R351 HydrophobicContact CB-CB 3.88Å
343K95.7Very high95.8Very high173 Ų17398.5 Ų98.575%0.75245%0.448SS*.Hα-helixtrans-71-39.9177.6-172.8178.7-179.6-179.40112.8L339 Y340 A341L339-K343 WeakPolarHBondContact O-CB 3.45Å; L339-K343 PolarHBondContact O-N 2.95Å; Y340-K343 WeakPolarHBondContact O-CB 3.44Å; Y340-K343 PolarHBondContact O-N 2.97Å; Y340-K343 VanDerWaalsContact O-N 3.1Å; A341-K343 VanDerWaalsContact C-N 3.27Å; A341-K343 PolarHBondContact O-N 3.13Å
344V97.2Very high95.7Very high74 Ų7495.1 Ų95.145%0.44843%0.432SS..Hα-helixtrans-69.9-50.3179.9170.50000111.2Y340 A341Y340-V344 HydrophobicContact CD1-CG2 4.18Å; Y340-V344 HydrophobicContact CD2-CG2 4.4Å; Y340-V344 HydrophobicContact CE1-CG2 3.71Å; Y340-V344 HydrophobicContact CE2-CG2 3.95Å; Y340-V344 HydrophobicContact CG-CG2 4.5Å; Y340-V344 WeakPolarHBondContact O-CG2 3.33Å; Y340-V344 PolarHBondContact O-N 3.16Å; A341-V344 PolarHBondContact O-N 2.97Å
345Y95.8Very high95.6Very high174 Ų17497.2 Ų97.268%0.68244%0.438SS*.Hα-helixtrans-87.1-5.7-177-61.1-67000113.9A341 D347A341-Y345 HydrophobicContact CB-CD2 4.25Å; A341-Y345 HydrophobicContact CB-CE2 4.44Å; A341-Y345 VanDerWaalsContact O-CD2 3.26Å; A341-Y345 WeakPolarHBondContact O-CD2 3.38Å; A341-Y345 PolarHBondContact O-N 2.85Å; Y345-D347 PolarHBondContact O-N 3.39Å
346R94.7Very high95.5Very high231 Ų231101.6 Ų101.687%0.87246%0.463SS*.THydrogen-bonded Turntrans56.334.5-175.1-56.8-180178.5-118.42.8113.3A342A342-R346 CarbonylContact O-C 3.57Å; A342-R346 WeakPolarHBondContact O-CA 3.35Å; A342-R346 PolarHBondContact O-N 3.34Å
347D94.9Very high95.4Very high51 Ų51100.6 Ų100.627%0.27345%0.454SS..  trans-97.3106.5179.8-175.96.9000112A342 Y345 R349 M350 R351A342-D347 PolarHBondContact O-N 3.37Å; Y345-D347 PolarHBondContact O-N 3.39Å; D347-R349 PolarHBondContact O-N 3.28Å; D347-R349 WeakPolarHBondContact OD1-CB 3.36Å; D347-R349 VanDerWaalsContact OD1-CG 3.32Å; D347-R349 WeakPolarHBondContact OD1-CG 3.21Å; D347-R349 PolarHBondContact OD1-N 3.4Å; D347-M350 HydrophobicContact CB-CG 4.26Å; D347-M350 PolarHBondContact O-N 3.45Å; D347-R351 PolarHBondContact O-N 3.16Å
348D93.9Very high95.2Very high88 Ų88100.9 Ų100.947%0.47146%0.458SS..Hα-helixtrans-62.6-20.7174.9-84.1-47.6000113.8R351 K352D348-R351 PolarHBondContact O-N 3.48Å; D348-R351 IonicContact OD1-CZ 2.68Å; D348-R351 VanDerWaalsContact OD1-CZ 3.25Å; D348-R351 IonicContact OD1-NE 2.58Å; D348-R351 PolarHBondContact OD1-NE 3.15Å; D348-R351 IonicContact OD1-NH2 2.86Å; D348-R351 PolarHBondContact OD1-NH2 2.96Å; D348-K352 WeakPolarHBondContact O-CG 3.5Å; D348-K352 PolarHBondContact O-N 3.21Å
349R95.7Very high95.1Very high207 Ų207100.7 Ų100.778%0.78146%0.457SS*.Hα-helixtrans-67.4-42.7175.9-58.6174.3176.5-170.1-0.5110.7D347 R351 K353D347-R349 PolarHBondContact O-N 3.28Å; D347-R349 WeakPolarHBondContact OD1-CB 3.36Å; D347-R349 VanDerWaalsContact OD1-CG 3.32Å; D347-R349 WeakPolarHBondContact OD1-CG 3.21Å; D347-R349 PolarHBondContact OD1-N 3.4Å; R349-R351 VanDerWaalsContact C-N 3.33Å; R349-K353 WeakPolarHBondContact O-CB 3.34Å; R349-K353 PolarHBondContact O-N 3.4Å
350M94Very high95.1Very high61 Ų61102.7 Ų102.730%0.346%0.464SS..Hα-helixtrans-65.2-38.7175.2-65.2-171.3-168.600111.4A341 A342 D347 K353 A354A341-M350 HydrophobicContact CB-SD 3.77Å; A342-M350 HydrophobicContact CB-CB 3.73Å; D347-M350 HydrophobicContact CB-CG 4.26Å; D347-M350 PolarHBondContact O-N 3.45Å; M350-K353 PolarHBondContact O-N 2.95Å; M350-A354 PolarHBondContact O-N 3.12Å
351R94.6Very high95.1Very high105 Ų10597.6 Ų97.640%0.39645%0.448SS..Hα-helixtrans-61.8-51.3175.7-171.31666593.9-13.2111.9L339 A342 D347 D348 R349 K353 A354 E355L339-R351 HydrophobicContact CD2-CG 4.4Å; A342-R351 HydrophobicContact CB-CB 3.88Å; D347-R351 PolarHBondContact O-N 3.16Å; D348-R351 PolarHBondContact O-N 3.48Å; D348-R351 IonicContact OD1-CZ 2.68Å; D348-R351 VanDerWaalsContact OD1-CZ 3.25Å; D348-R351 IonicContact OD1-NE 2.58Å; D348-R351 PolarHBondContact OD1-NE 3.15Å; D348-R351 IonicContact OD1-NH2 2.86Å; D348-R351 PolarHBondContact OD1-NH2 2.96Å; R349-R351 VanDerWaalsContact C-N 3.33Å; R351-K353 VanDerWaalsContact C-N 3.3Å; R351-K353 PolarHBondContact O-N 3.31Å; R351-A354 WeakPolarHBondContact O-CB 3.27Å; R351-A354 PolarHBondContact O-N 3.31Å; R351-A354 VanDerWaalsContact O-N 3.11Å; R351-E355 WeakPolarHBondContact CG-OE1 3.34Å; R351-E355 IonicContact CZ-OE1 2.65Å; R351-E355 IonicContact NH1-OE1 2.96Å; R351-E355 PolarHBondContact NH1-OE1 3.16Å; R351-E355 WeakPolarHBondContact O-CG 3.29Å; R351-E355 PolarHBondContact O-N 2.92Å
352K96.4Very high95Very high126 Ų12697.3 Ų97.355%0.54844%0.444SS..Hα-helixtrans-59.5-38.6175-72.6178180-177.40112.3D348 A354 E355 L356D348-K352 WeakPolarHBondContact O-CG 3.5Å; D348-K352 PolarHBondContact O-N 3.21Å; K352-A354 PolarHBondContact O-N 3.17Å; K352-E355 PolarHBondContact O-N 3.25Å; K352-L356 WeakPolarHBondContact O-CB 3.49Å; K352-L356 VanDerWaalsContact O-CG 3.3Å; K352-L356 WeakPolarHBondContact O-CG 3.37Å; K352-L356 PolarHBondContact O-N 3.37Å
353K95.6Very high95Very high135 Ų135103.7 Ų103.759%0.58747%0.47SS*.Hα-helixtrans-61.7-41.3174.7-173.9179.9178.2-178.30112L338 R349 M350 R351 M357L338-K353 HydrophobicContact CD1-CD 4.34Å; L338-K353 HydrophobicContact CD1-CG 4.25Å; L338-K353 HydrophobicContact CD2-CD 4.22Å; R349-K353 WeakPolarHBondContact O-CB 3.34Å; R349-K353 PolarHBondContact O-N 3.4Å; M350-K353 PolarHBondContact O-N 2.95Å; R351-K353 VanDerWaalsContact C-N 3.3Å; R351-K353 PolarHBondContact O-N 3.31Å; K353-M357 PolarHBondContact O-N 3.03Å; K353-M357 VanDerWaalsContact O-N 3.08Å
354A95Very high94.9Very high0 Ų097.8 Ų97.80%045%0.445CS..Hα-helixtrans-69.3-38175.800000112.7K335 L338 L339 M350 R351 K352 M357K335-A354 WeakPolarHBondContact CE-O 3.43Å; K335-A354 HydrophobicContact CG-CB 4.34Å; K335-A354 PolarHBondContact NZ-O 3.33Å; L338-A354 HydrophobicContact CB-CB 3.76Å; L338-A354 HydrophobicContact CD1-CB 4.49Å; L339-A354 HydrophobicContact CD2-CB 3.67Å; L339-A354 HydrophobicContact CG-CB 3.69Å; M350-A354 PolarHBondContact O-N 3.12Å; R351-A354 WeakPolarHBondContact O-CB 3.27Å; R351-A354 PolarHBondContact O-N 3.31Å; R351-A354 VanDerWaalsContact O-N 3.11Å; K352-A354 PolarHBondContact O-N 3.17Å; A354-M357 PolarHBondContact O-N 2.78Å
355E93.4Very high94.8Very high107 Ų10795.2 Ų95.250%0.543%0.429SS..Hα-helixtrans-62.6-46.7175.3-72165.8-174.900111R351 K352 M357R351-E355 WeakPolarHBondContact CG-OE1 3.34Å; R351-E355 IonicContact CZ-OE1 2.65Å; R351-E355 IonicContact NH1-OE1 2.96Å; R351-E355 PolarHBondContact NH1-OE1 3.16Å; R351-E355 WeakPolarHBondContact O-CG 3.29Å; R351-E355 PolarHBondContact O-N 2.92Å; K352-E355 PolarHBondContact O-N 3.25Å; E355-M357 VanDerWaalsContact C-N 3.33Å; E355-M357 PolarHBondContact O-N 3.08Å
356L95.4Very high94.8Very high145 Ų14591.3 Ų91.376%0.75942%0.42SS*.Hα-helixtrans-74.2-13.9178.5-68.2171.6000114.9K352 T358K352-L356 WeakPolarHBondContact O-CB 3.49Å; K352-L356 VanDerWaalsContact O-CG 3.3Å; K352-L356 WeakPolarHBondContact O-CG 3.37Å; K352-L356 PolarHBondContact O-N 3.37Å; L356-T358 PolarHBondContact O-N 3.25Å; L356-T358 VanDerWaalsContact O-N 3.16Å
357M93.4Very high94.7Very high52 Ų5287.3 Ų87.326%0.25641%0.405SS..  trans-64116.2178.8-179.6166178.300110.9E331 T334 K335 L338 K353 A354 E355E331-M357 HydrophobicContact CB-CE 4.15Å; E331-M357 HydrophobicContact CG-CE 4.33Å; T334-M357 VanDerWaalsContact OG1-CE 3.29Å; T334-M357 WeakPolarHBondContact OG1-CE 3.43Å; K335-M357 HydrophobicContact CB-SD 4.1Å; K335-M357 PolarHBondContact NZ-O 2.9Å; L338-M357 HydrophobicContact CD1-SD 4.44Å; K353-M357 PolarHBondContact O-N 3.03Å; K353-M357 VanDerWaalsContact O-N 3.08Å; A354-M357 PolarHBondContact O-N 2.78Å; E355-M357 VanDerWaalsContact C-N 3.33Å; E355-M357 PolarHBondContact O-N 3.08Å
358T92.7Very high94.6Very high83 Ų8385.1 Ų85.151%0.50939%0.393SS..  trans-71.4143.8173.861.70000110.3L356 E360L356-T358 PolarHBondContact O-N 3.25Å; L356-T358 VanDerWaalsContact O-N 3.16Å; T358-E360 VanDerWaalsContact CB-OE1 3.25Å; T358-E360 WeakPolarHBondContact CB-OE1 3.42Å; T358-E360 PolarHBondContact OG1-OE1 3.5Å
359M94.3Very high94.5Very high34 Ų3484 Ų8417%0.16739%0.387CS..  trans-120.455.1-174.5-62.7-70.2-64.200108.3E331 R332 K335 C362 K363E331-M359 HydrophobicContact CB-CE 3.77Å; E331-M359 HydrophobicContact CB-SD 3.79Å; E331-M359 WeakPolarHBondContact OE2-CA 3.45Å; R332-M359 VanDerWaalsContact CA-CE 3.47Å; R332-M359 HydrophobicContact CB-CE 3.78Å; R332-M359 HydrophobicContact CG-CE 4.32Å; K335-M359 HydrophobicContact CB-SD 4.19Å; K335-M359 HydrophobicContact CD-CG 4.11Å; K335-M359 HydrophobicContact CD-SD 3.66Å; M359-C362 HydrophobicContact CB-CB 4.22Å; M359-C362 HydrophobicContact CE-CB 4.35Å; M359-C362 WeakPolarHBondContact CE-SG 3.49Å; M359-C362 PolarHBondContact O-N 3.18Å; M359-K363 WeakPolarHBondContact O-CG 3.44Å; M359-K363 PolarHBondContact O-N 2.73Å
360E95.1Very high94.3Very high117 Ų11779.2 Ų79.255%0.54738%0.377SS..Hα-helixtrans-69.8-40.6-166.9-75.3163.4-13900111.7E331 T358 C362 K363 E364E331-E360 PolarHBondContact OE2-N 2.93Å; T358-E360 VanDerWaalsContact CB-OE1 3.25Å; T358-E360 WeakPolarHBondContact CB-OE1 3.42Å; T358-E360 PolarHBondContact OG1-OE1 3.5Å; E360-C362 VanDerWaalsContact C-N 3.29Å; E360-C362 PolarHBondContact O-N 2.81Å; E360-K363 PolarHBondContact O-N 3.25Å; E360-E364 PolarHBondContact O-N 3.29Å
361N95.5Very high94Very high56 Ų5681.1 Ų81.130%0.29939%0.388SS..Hα-helixtrans-67.6-32.1175.7-67.8-90.3000111.5V324 T327 C328 E331 E364 L365V324-N361 VanDerWaalsContact CG1-O 3.32Å; V324-N361 WeakPolarHBondContact CG1-O 3.26Å; T327-N361 VanDerWaalsContact OG1-CB 3.24Å; T327-N361 WeakPolarHBondContact OG1-CB 3.45Å; T327-N361 PolarHBondContact OG1-OD1 3.18Å; C328-N361 HydrophobicContact CB-CB 4.35Å; E331-N361 WeakPolarHBondContact OE1-CB 3.31Å; E331-N361 PolarHBondContact OE1-N 3.22Å; E331-N361 PolarHBondContact OE1-ND2 2.97Å; E331-N361 PolarHBondContact OE2-N 3.35Å; N361-E364 PolarHBondContact O-N 2.92Å; N361-L365 WeakPolarHBondContact O-CB 3.34Å; N361-L365 PolarHBondContact O-N 3.17Å
362C95.8Very high93.3Very high15 Ų1582.6 Ų82.610%0.10140%0.398CS..Hα-helixtrans-68.2-38.3171.9-67.10000113.4C328 E331 M359 E360 E364 L365 D366C328-C362 WeakPolarHBondContact CA-SG 3.45Å; C328-C362 HydrophobicContact CB-CB 3.94Å; C328-C362 WeakPolarHBondContact CB-SG 3.44Å; C328-C362 PolarHBondContact O-SG 3.2Å; C328-C362 WeakPolarHBondContact SG-CA 3.22Å; C328-C362 WeakPolarHBondContact SG-CB 3.17Å; C328-C362 CovalentContact SG-SG 2.04Å; C328-C362 PolarHBondContact SG-SG 3.13Å; E331-C362 PolarHBondContact OE2-N 3.32Å; M359-C362 HydrophobicContact CB-CB 4.22Å; M359-C362 HydrophobicContact CE-CB 4.35Å; M359-C362 WeakPolarHBondContact CE-SG 3.49Å; M359-C362 PolarHBondContact O-N 3.18Å; E360-C362 VanDerWaalsContact C-N 3.29Å; E360-C362 PolarHBondContact O-N 2.81Å; C362-E364 VanDerWaalsContact C-N 3.31Å; C362-E364 PolarHBondContact O-N 3.3Å; C362-L365 WeakPolarHBondContact O-CB 3.37Å; C362-L365 PolarHBondContact O-N 3.25Å; C362-D366 PolarHBondContact O-N 3.45Å
363K96Very high92.3Very high143 Ų14387 Ų8762%0.62241%0.411SS*.Hα-helixtrans-62.2-40.5173.8-69.7175.2-177.2179.50111.7M359 E360 D366 R367M359-K363 WeakPolarHBondContact O-CG 3.44Å; M359-K363 PolarHBondContact O-N 2.73Å; E360-K363 PolarHBondContact O-N 3.25Å; K363-D366 PolarHBondContact O-N 3.41Å; K363-R367 PolarHBondContact O-N 3.16Å
364E94.5Very high90.5Very high49 Ų4984.1 Ų84.123%0.22942%0.419CS..Hα-helixtrans-70.2-36.7176.1-166.661.1-163.200111.5V324 E360 N361 C362 D366 R367 L368V324-E364 HydrophobicContact CG1-CB 4.25Å; E360-E364 PolarHBondContact O-N 3.29Å; N361-E364 PolarHBondContact O-N 2.92Å; C362-E364 VanDerWaalsContact C-N 3.31Å; C362-E364 PolarHBondContact O-N 3.3Å; E364-D366 VanDerWaalsContact C-N 3.34Å; E364-D366 PolarHBondContact O-N 3.05Å; E364-R367 WeakPolarHBondContact O-CB 3.41Å; E364-R367 PolarHBondContact O-N 2.89Å; E364-R367 WeakPolarHBondContact OE1-CD 3.24Å; E364-R367 IonicContact OE1-CZ 3.74Å; E364-R367 IonicContact OE1-NE 3.7Å; E364-R367 IonicContact OE1-NH1 3.04Å; E364-R367 PolarHBondContact OE1-NH1 2.95Å; E364-R367 VanDerWaalsContact OE2-CD 3.29Å; E364-R367 WeakPolarHBondContact OE2-CD 3.36Å; E364-R367 IonicContact OE2-NH1 3.28Å; E364-R367 PolarHBondContact OE2-NH1 3.48Å; E364-L368 HydrophobicContact CG-CD1 4.37Å; E364-L368 WeakPolarHBondContact O-CB 3.36Å; E364-L368 VanDerWaalsContact O-CG 3.25Å; E364-L368 WeakPolarHBondContact O-CG 3.26Å; E364-L368 PolarHBondContact O-N 3.16Å
365L95.3Very high88.2Confident20 Ų2090.5 Ų90.511%0.10549%0.485CS..Hα-helixtrans-59.7-43.2171.5-171.765.2000111.9V324 R325 C328 N361 C362 L368 N369V324-L365 HydrophobicContact CG1-CB 3.97Å; V324-L365 HydrophobicContact CG1-CD1 4.39Å; R325-L365 HydrophobicContact CB-CD1 3.95Å; R325-L365 HydrophobicContact CB-CD2 4.48Å; R325-L365 HydrophobicContact CG-CD1 4.38Å; R325-L365 HydrophobicContact CG-CD2 4.32Å; C328-L365 HydrophobicContact CB-CB 4.5Å; C328-L365 HydrophobicContact CB-CD2 4.06Å; N361-L365 WeakPolarHBondContact O-CB 3.34Å; N361-L365 PolarHBondContact O-N 3.17Å; C362-L365 WeakPolarHBondContact O-CB 3.37Å; C362-L365 PolarHBondContact O-N 3.25Å; L365-L368 PolarHBondContact O-N 3.05Å; L365-N369 WeakPolarHBondContact O-CB 3.41Å; L365-N369 PolarHBondContact O-N 3.07Å; L365-N369 PolarHBondContact O-ND2 3.17Å; L365-N369 VanDerWaalsContact O-ND2 3.13Å
366D94.4Very high87.9Confident93 Ų9389.7 Ų89.750%0.49749%0.485SS..Hα-helixtrans-65.9-39.6176.7-71.7-26.2000111.6C362 K363 E364 N369 N370C362-D366 PolarHBondContact O-N 3.45Å; K363-D366 PolarHBondContact O-N 3.41Å; E364-D366 VanDerWaalsContact C-N 3.34Å; E364-D366 PolarHBondContact O-N 3.05Å; D366-N369 PolarHBondContact O-N 3.36Å; D366-N370 WeakPolarHBondContact O-CB 3.45Å; D366-N370 PolarHBondContact O-N 3.31Å; D366-N370 PolarHBondContact O-ND2 3.12Å; D366-N370 VanDerWaalsContact O-ND2 3.09Å
367R93.8Very high87.5Confident146 Ų14686.8 Ų86.855%0.55147%0.47SS*.Hα-helixtrans-58.9-48171.5-178-167.6175.8-172-1.4111.8K363 E364 N370 L371K363-R367 PolarHBondContact O-N 3.16Å; E364-R367 WeakPolarHBondContact O-CB 3.41Å; E364-R367 PolarHBondContact O-N 2.89Å; E364-R367 WeakPolarHBondContact OE1-CD 3.24Å; E364-R367 IonicContact OE1-CZ 3.74Å; E364-R367 IonicContact OE1-NE 3.7Å; E364-R367 IonicContact OE1-NH1 3.04Å; E364-R367 PolarHBondContact OE1-NH1 2.95Å; E364-R367 VanDerWaalsContact OE2-CD 3.29Å; E364-R367 WeakPolarHBondContact OE2-CD 3.36Å; E364-R367 IonicContact OE2-NH1 3.28Å; E364-R367 PolarHBondContact OE2-NH1 3.48Å; R367-N370 PolarHBondContact O-N 3.45Å; R367-L371 WeakPolarHBondContact O-CG 3.38Å; R367-L371 PolarHBondContact O-N 2.92Å
368L92.3Very high87.2Confident5 Ų588.7 Ų88.73%0.02648%0.482CS..Hα-helixtrans-61.6-46177.5-69.3164.2000111L290 Y320 V321 V324 E364 L365 N370 L371 F372L290-L368 HydrophobicContact CD1-CD2 4.08Å; L290-L368 HydrophobicContact CD2-CD2 4.09Å; Y320-L368 HydrophobicContact CE1-CD1 4.05Å; Y320-L368 HydrophobicContact CE1-CD2 4.49Å; V321-L368 HydrophobicContact CG2-CD1 4.27Å; V321-L368 HydrophobicContact CG2-CD2 4.48Å; V324-L368 HydrophobicContact CB-CD1 4.38Å; V324-L368 HydrophobicContact CG1-CD1 4.09Å; E364-L368 HydrophobicContact CG-CD1 4.37Å; E364-L368 WeakPolarHBondContact O-CB 3.36Å; E364-L368 VanDerWaalsContact O-CG 3.25Å; E364-L368 WeakPolarHBondContact O-CG 3.26Å; E364-L368 PolarHBondContact O-N 3.16Å; L365-L368 PolarHBondContact O-N 3.05Å; L368-N370 VanDerWaalsContact C-N 3.26Å; L368-N370 PolarHBondContact O-N 3.3Å; L368-L371 WeakPolarHBondContact O-CB 3.31Å; L368-L371 PolarHBondContact O-N 3.2Å; L368-L371 VanDerWaalsContact O-N 3.15Å; L368-F372 WeakPolarHBondContact O-CD2 2.9Å; L368-F372 PolarHBondContact O-N 3.42Å; L368-F372 VanDerWaalsContact O-N 3.07Å
369N91.6Very high86.9Confident65 Ų6589.1 Ų89.135%0.34848%0.48SS..Hα-helixtrans-58.7-36.7175.7-71.5-32.5000112.5L365 D366 R373L365-N369 WeakPolarHBondContact O-CB 3.41Å; L365-N369 PolarHBondContact O-N 3.07Å; L365-N369 PolarHBondContact O-ND2 3.17Å; L365-N369 VanDerWaalsContact O-ND2 3.13Å; D366-N369 PolarHBondContact O-N 3.36Å; N369-R373 WeakPolarHBondContact O-CB 3.46Å; N369-R373 VanDerWaalsContact O-CG 3.3Å; N369-R373 WeakPolarHBondContact O-CG 3.36Å; N369-R373 PolarHBondContact O-N 3.28Å; N369-R373 VanDerWaalsContact O-N 3.15Å
370N90.5Very high86.4Confident107 Ų10792.5 Ų92.557%0.57250%0.5SS*.Hα-helixtrans-70.4-38.2176.7-70.2-30.5000112.2D366 R367 L368 R373 G374D366-N370 WeakPolarHBondContact O-CB 3.45Å; D366-N370 PolarHBondContact O-N 3.31Å; D366-N370 PolarHBondContact O-ND2 3.12Å; D366-N370 VanDerWaalsContact O-ND2 3.09Å; R367-N370 PolarHBondContact O-N 3.45Å; L368-N370 VanDerWaalsContact C-N 3.26Å; L368-N370 PolarHBondContact O-N 3.3Å; N370-R373 PolarHBondContact O-N 3.19Å; N370-G374 PolarHBondContact O-N 3.39Å
371L87.6Confident85.8Confident101 Ų10190.9 Ų90.953%0.52950%0.497SS..Hα-helixtrans-61-44.2173.6-70.5166.8000111.5L290 R367 L368 R373L290-L371 HydrophobicContact CD2-CD1 4.48Å; R367-L371 WeakPolarHBondContact O-CG 3.38Å; R367-L371 PolarHBondContact O-N 2.92Å; L368-L371 WeakPolarHBondContact O-CB 3.31Å; L368-L371 PolarHBondContact O-N 3.2Å; L368-L371 VanDerWaalsContact O-N 3.15Å; L371-R373 VanDerWaalsContact C-N 3.31Å; L371-R373 PolarHBondContact O-N 3.37Å
372F80.6Confident85.2Confident136 Ų13693.4 Ų93.460%0.59651%0.511SS*.Hα-helixtrans-75.4-12.2178.3-69.6-64.8000115L290 V321 L368L290-F372 HydrophobicContact CD1-CZ 4.22Å; L290-F372 HydrophobicContact CD2-CZ 4.29Å; V321-F372 HydrophobicContact CG2-CE2 4.34Å; L368-F372 WeakPolarHBondContact O-CD2 2.9Å; L368-F372 PolarHBondContact O-N 3.42Å; L368-F372 VanDerWaalsContact O-N 3.07Å
373R75.1Confident84.3Confident218 Ų21899.4 Ų99.482%0.82354%0.542SS*.Hα-helixtrans-96.3-11.8176.9-80.4179.5172-164.7-2.1114.3N369 N370 L371N369-R373 WeakPolarHBondContact O-CB 3.46Å; N369-R373 VanDerWaalsContact O-CG 3.3Å; N369-R373 WeakPolarHBondContact O-CG 3.36Å; N369-R373 PolarHBondContact O-N 3.28Å; N369-R373 VanDerWaalsContact O-N 3.15Å; N370-R373 PolarHBondContact O-N 3.19Å; L371-R373 VanDerWaalsContact C-N 3.31Å; L371-R373 PolarHBondContact O-N 3.37Å
374G58.2Low83.4Confident74 Ų7495.8 Ų95.876%0.76354%0.536SS*.  trans-110.117.1-17600000114.8N370N370-G374 PolarHBondContact O-N 3.39Å
375G46.6Very low82.4Confident135 Ų135100 Ų100100%1.39256%0.564SS**  trans-115.40179.500000112.9

Retrieved 375 of 375 residues in 115.1 ms (Link to these results)

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