A0A3Q0KNL6_SCHMA Loading...

Mitochondrial carrier protein-related

AlphaFold DB , UniProt , Accession A0A3Q0KNL6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 314 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
1M39.4Very low52.4Low243 Ų243120.6 Ų120.6100%1.19768%0.676SS**  0106.70-86.9169.5166.400108.2
2H40.2Very low53.9Low190 Ų190120.4 Ų120.488%0.8867%0.665SS**PPolyproline II helixtrans-65.8131.4163.5-96.2-74.7000107.4A4H2-A4 PolarHBondContact O-N 2.69Å
3P50.5Low55Low112 Ų112124.2 Ų124.273%0.72766%0.663SS**PPolyproline II helixtrans-61.8123.9177.824.4-30.7000108.1T5P3-T5 PolarHBondContact O-N 3.34Å; P3-T5 VanDerWaalsContact O-N 3.08Å
4A52.2Low56.2Low95 Ų95121.7 Ų121.779%0.78565%0.654SS**PPolyproline II helixtrans-52.3118.6171.500000107.6H2 K6H2-A4 PolarHBondContact O-N 2.69Å; A4-K6 PolarHBondContact O-N 2.91Å
5T50.3Low57.8Low93 Ų93117.2 Ų117.257%0.57164%0.636SS**PPolyproline II helixtrans-58126.9174.634.40000107.4P3P3-T5 PolarHBondContact O-N 3.34Å; P3-T5 VanDerWaalsContact O-N 3.08Å
6K51.5Low59.3Low137 Ų137114.4 Ų114.460%0.59662%0.62SS**PPolyproline II helixtrans-58.9140.2176.2-76.8-179.2177.9-176.10108.2A4 E8 D9 S10A4-K6 PolarHBondContact O-N 2.91Å; K6-E8 PolarHBondContact O-N 3.42Å; K6-E8 VanDerWaalsContact O-N 3.09Å; K6-D9 WeakPolarHBondContact O-CB 3.37Å; K6-D9 PolarHBondContact O-N 2.8Å; K6-S10 PolarHBondContact O-N 3.24Å
7P55.7Low60.7Low103 Ų103110.1 Ų110.167%0.66961%0.607SS**Hα-helixtrans-56.7-26.2177.519.3-29.9000113.1S10 S11P7-S10 PolarHBondContact O-OG 3.23Å; P7-S11 PolarHBondContact O-N 3.14Å; P7-S11 VanDerWaalsContact O-N 3.12Å; P7-S11 PolarHBondContact O-OG 3.29Å
8E56.2Low62Low143 Ų143106.4 Ų106.467%0.66859%0.586SS**Hα-helixtrans-67.4-35.4172.4-65.4-179.8160.200113.2K6 S11 H12K6-E8 PolarHBondContact O-N 3.42Å; K6-E8 VanDerWaalsContact O-N 3.09Å; E8-S11 PolarHBondContact O-OG 2.94Å; E8-S11 VanDerWaalsContact O-OG 3.09Å; E8-H12 VanDerWaalsContact O-CB 3.24Å; E8-H12 WeakPolarHBondContact O-CB 3.29Å; E8-H12 PolarHBondContact O-N 2.87Å; E8-H12 VanDerWaalsContact O-N 3.07Å
9D57.1Low63.2Low82 Ų82103.4 Ų103.444%0.43957%0.569SS.*Hα-helixtrans-72.9-35.7178.7-74.4-35.3000111.4K6 R13K6-D9 WeakPolarHBondContact O-CB 3.37Å; K6-D9 PolarHBondContact O-N 2.8Å; D9-R13 WeakPolarHBondContact O-CB 3.46Å; D9-R13 VanDerWaalsContact O-CG 3.22Å; D9-R13 WeakPolarHBondContact O-CG 3.42Å; D9-R13 PolarHBondContact O-N 3.38Å
10S58.2Low64.4Low55 Ų55104.4 Ų104.439%0.38557%0.572SS.*Hα-helixtrans-70.2-45.5177.259.70000111.3K6 P7 H12 R13 V14K6-S10 PolarHBondContact O-N 3.24Å; P7-S10 PolarHBondContact O-OG 3.23Å; S10-H12 VanDerWaalsContact C-N 3.33Å; S10-H12 PolarHBondContact O-N 3.32Å; S10-R13 PolarHBondContact O-N 3.2Å; S10-V14 WeakPolarHBondContact O-CB 3.23Å; S10-V14 VanDerWaalsContact O-CG2 3.3Å; S10-V14 WeakPolarHBondContact O-CG2 2.95Å; S10-V14 PolarHBondContact O-N 3.46Å
11S65.6Low65.5Low74 Ų74104.8 Ų104.852%0.51757%0.573SS.*Hα-helixtrans-61.9-41176.571.20000111.8P7 E8 V14 S15P7-S11 PolarHBondContact O-N 3.14Å; P7-S11 VanDerWaalsContact O-N 3.12Å; P7-S11 PolarHBondContact O-OG 3.29Å; E8-S11 PolarHBondContact O-OG 2.94Å; E8-S11 VanDerWaalsContact O-OG 3.09Å; S11-V14 PolarHBondContact O-N 3.04Å; S11-S15 WeakPolarHBondContact O-CB 3.35Å; S11-S15 PolarHBondContact O-N 2.8Å
12H69.9Low67.8Low118 Ų11893.4 Ų93.455%0.54652%0.518SS..Hα-helixtrans-66.2-41.3176.7-171.6-102.2000112.5E8 S10 S15 I16E8-H12 VanDerWaalsContact O-CB 3.24Å; E8-H12 WeakPolarHBondContact O-CB 3.29Å; E8-H12 PolarHBondContact O-N 2.87Å; E8-H12 VanDerWaalsContact O-N 3.07Å; S10-H12 VanDerWaalsContact C-N 3.33Å; S10-H12 PolarHBondContact O-N 3.32Å; H12-S15 PolarHBondContact O-N 3.33Å; H12-I16 WeakPolarHBondContact CE1-CD1 3.31Å; H12-I16 WeakPolarHBondContact ND1-CD1 3.33Å; H12-I16 VanDerWaalsContact O-CG1 3.32Å; H12-I16 WeakPolarHBondContact O-CG1 3.45Å; H12-I16 PolarHBondContact O-N 3.47Å
13R68.6Low70.1Confident170 Ų17085.8 Ų85.864%0.64249%0.49SS*.Hα-helixtrans-65.2-42.8175.6-76.3176.4-173-158.23.8112.5D9 S10 S15 I16 G17D9-R13 WeakPolarHBondContact O-CB 3.46Å; D9-R13 VanDerWaalsContact O-CG 3.22Å; D9-R13 WeakPolarHBondContact O-CG 3.42Å; D9-R13 PolarHBondContact O-N 3.38Å; S10-R13 PolarHBondContact O-N 3.2Å; R13-S15 VanDerWaalsContact C-N 3.33Å; R13-I16 PolarHBondContact O-N 3.03Å; R13-G17 PolarHBondContact O-N 2.74Å
14V71.9Confident71.9Confident89 Ų8982.5 Ų82.554%0.53948%0.476SS..Hα-helixtrans-61.3-45.2175.2171.10000109.8S10 S11 I16 G17 I18S10-V14 WeakPolarHBondContact O-CB 3.23Å; S10-V14 VanDerWaalsContact O-CG2 3.3Å; S10-V14 WeakPolarHBondContact O-CG2 2.95Å; S10-V14 PolarHBondContact O-N 3.46Å; S11-V14 PolarHBondContact O-N 3.04Å; V14-I16 PolarHBondContact O-N 3.43Å; V14-G17 PolarHBondContact O-N 2.95Å; V14-I18 HydrophobicContact CG1-CD1 3.63Å; V14-I18 HydrophobicContact CG1-CG1 4.36Å; V14-I18 WeakPolarHBondContact O-CB 3.49Å; V14-I18 VanDerWaalsContact O-CG1 3.24Å; V14-I18 WeakPolarHBondContact O-CG1 3.25Å; V14-I18 PolarHBondContact O-N 3.09Å
15S79.2Confident73.8Confident54 Ų5481.4 Ų81.438%0.37846%0.457SS..Hα-helixtrans-59.1-45.1175.4-176.20000112.6S11 H12 R13 I18 N19S11-S15 WeakPolarHBondContact O-CB 3.35Å; S11-S15 PolarHBondContact O-N 2.8Å; H12-S15 PolarHBondContact O-N 3.33Å; R13-S15 VanDerWaalsContact C-N 3.33Å; S15-I18 PolarHBondContact O-N 3.37Å; S15-N19 WeakPolarHBondContact O-CB 3.5Å; S15-N19 PolarHBondContact O-N 2.88Å; S15-N19 PolarHBondContact O-ND2 2.83Å; S15-N19 VanDerWaalsContact O-ND2 3.07Å
16I82.4Confident75.8Confident73 Ų7377 Ų7737%0.37443%0.43SS..Hα-helixtrans-61.1-47.9175.6-68.7164.1000111.3H12 R13 V14 I18 N19 I20H12-I16 WeakPolarHBondContact CE1-CD1 3.31Å; H12-I16 WeakPolarHBondContact ND1-CD1 3.33Å; H12-I16 VanDerWaalsContact O-CG1 3.32Å; H12-I16 WeakPolarHBondContact O-CG1 3.45Å; H12-I16 PolarHBondContact O-N 3.47Å; R13-I16 PolarHBondContact O-N 3.03Å; V14-I16 PolarHBondContact O-N 3.43Å; I16-I18 VanDerWaalsContact C-N 3.31Å; I16-I18 PolarHBondContact O-N 3.02Å; I16-N19 PolarHBondContact O-N 3.38Å; I16-I20 HydrophobicContact CG2-CD1 3.76Å; I16-I20 HydrophobicContact CG2-CG1 4.38Å; I16-I20 WeakPolarHBondContact O-CG1 3.45Å; I16-I20 PolarHBondContact O-N 2.8Å
17G82.8Confident77.7Confident40 Ų4071.6 Ų71.641%0.41241%0.413SS..Hα-helixtrans-59.4-43179.500000112.2R13 V14 I20 L21R13-G17 PolarHBondContact O-N 2.74Å; V14-G17 PolarHBondContact O-N 2.95Å; G17-I20 PolarHBondContact O-N 3.23Å; G17-L21 PolarHBondContact O-N 2.77Å
18I84.2Confident79.5Confident44 Ų4468.1 Ų68.123%0.22639%0.391CS..Hα-helixtrans-63.9-45.1175.3-69.8171.1000110.9V14 S15 I16 I20 L21 T22 L306V14-I18 HydrophobicContact CG1-CD1 3.63Å; V14-I18 HydrophobicContact CG1-CG1 4.36Å; V14-I18 WeakPolarHBondContact O-CB 3.49Å; V14-I18 VanDerWaalsContact O-CG1 3.24Å; V14-I18 WeakPolarHBondContact O-CG1 3.25Å; V14-I18 PolarHBondContact O-N 3.09Å; S15-I18 PolarHBondContact O-N 3.37Å; I16-I18 VanDerWaalsContact C-N 3.31Å; I16-I18 PolarHBondContact O-N 3.02Å; I18-I20 VanDerWaalsContact C-N 3.32Å; I18-I20 PolarHBondContact O-N 3.02Å; I18-L21 PolarHBondContact O-N 3.29Å; I18-T22 HydrophobicContact CG2-CG2 4.11Å; I18-T22 WeakPolarHBondContact O-CB 3.29Å; I18-T22 VanDerWaalsContact O-CG2 3.24Å; I18-T22 WeakPolarHBondContact O-CG2 3.47Å; I18-T22 PolarHBondContact O-N 3.39Å; I18-T22 PolarHBondContact O-OG1 2.76Å; I18-L306 HydrophobicContact CG2-CD1 3.38Å; I18-L306 HydrophobicContact CG2-CD2 4.34Å; I18-L306 HydrophobicContact CG2-CG 4.32Å
19N85.8Confident81.3Confident50 Ų5064.3 Ų64.327%0.26738%0.378SS..Hα-helixtrans-62.8-37.2178.5-71.8-31.7000112.1S15 I16 T22 G23 Q303S15-N19 WeakPolarHBondContact O-CB 3.5Å; S15-N19 PolarHBondContact O-N 2.88Å; S15-N19 PolarHBondContact O-ND2 2.83Å; S15-N19 VanDerWaalsContact O-ND2 3.07Å; I16-N19 PolarHBondContact O-N 3.38Å; N19-T22 VanDerWaalsContact CA-OG1 3.28Å; N19-T22 WeakPolarHBondContact CA-OG1 3.38Å; N19-T22 PolarHBondContact O-OG1 2.98Å; N19-G23 PolarHBondContact O-N 3.36Å; N19-Q303 PolarHBondContact OD1-NE2 3.15Å
20I86.9Confident83.2Confident122 Ų12260.6 Ų60.663%0.62636%0.358SS*.Hα-helixtrans-66.7-46.6175-68.2167.8000110.7I16 G17 I18 G24I16-I20 HydrophobicContact CG2-CD1 3.76Å; I16-I20 HydrophobicContact CG2-CG1 4.38Å; I16-I20 WeakPolarHBondContact O-CG1 3.45Å; I16-I20 PolarHBondContact O-N 2.8Å; G17-I20 PolarHBondContact O-N 3.23Å; I18-I20 VanDerWaalsContact C-N 3.32Å; I18-I20 PolarHBondContact O-N 3.02Å; I20-G24 PolarHBondContact O-N 2.76Å
21L86.7Confident84.9Confident114 Ų11461.8 Ų61.860%0.59736%0.357SS*.Hα-helixtrans-63.8-47.4-180-177.865.8000111.4G17 I18 G24 L25G17-L21 PolarHBondContact O-N 2.77Å; I18-L21 PolarHBondContact O-N 3.29Å; L21-G24 PolarHBondContact O-N 3.25Å; L21-L25 HydrophobicContact CD1-CD1 4.48Å; L21-L25 HydrophobicContact CG-CD1 4.22Å; L21-L25 WeakPolarHBondContact O-CB 3.33Å; L21-L25 WeakPolarHBondContact O-CG 3.35Å; L21-L25 PolarHBondContact O-N 2.82Å
22T87.6Confident86.4Confident4 Ų460.7 Ų60.73%0.02535%0.347CS..Hα-helixtrans-63.6-43.7178.351.30000111.8I18 N19 G24 L25 A26 F302 L306I18-T22 HydrophobicContact CG2-CG2 4.11Å; I18-T22 WeakPolarHBondContact O-CB 3.29Å; I18-T22 VanDerWaalsContact O-CG2 3.24Å; I18-T22 WeakPolarHBondContact O-CG2 3.47Å; I18-T22 PolarHBondContact O-N 3.39Å; I18-T22 PolarHBondContact O-OG1 2.76Å; N19-T22 VanDerWaalsContact CA-OG1 3.28Å; N19-T22 WeakPolarHBondContact CA-OG1 3.38Å; N19-T22 PolarHBondContact O-OG1 2.98Å; T22-G24 VanDerWaalsContact C-N 3.35Å; T22-G24 PolarHBondContact O-N 3.43Å; T22-L25 PolarHBondContact O-N 3.29Å; T22-A26 WeakPolarHBondContact O-CB 3.33Å; T22-A26 PolarHBondContact O-N 3.32Å; T22-F302 HydrophobicContact CG2-CB 3.9Å; T22-L306 HydrophobicContact CG2-CD1 3.23Å
23G88.6Confident87.6Confident30 Ų3057.5 Ų57.531%0.30934%0.341SS..Hα-helixtrans-61.4-41.6173.700000112.5N19 A26 G27N19-G23 PolarHBondContact O-N 3.36Å; G23-A26 PolarHBondContact O-N 3.08Å; G23-G27 PolarHBondContact O-N 2.82Å
24G89.3Confident88.8Confident42 Ų4250 Ų5043%0.43331%0.313SS..Hα-helixtrans-62.3-47.5175.300000112.8I20 L21 T22 G27 C28I20-G24 PolarHBondContact O-N 2.76Å; L21-G24 PolarHBondContact O-N 3.25Å; T22-G24 VanDerWaalsContact C-N 3.35Å; T22-G24 PolarHBondContact O-N 3.43Å; G24-G27 PolarHBondContact O-N 3.44Å; G24-C28 PolarHBondContact O-N 3.44Å; G24-C28 PolarHBondContact O-SG 3.04Å; G24-C28 VanDerWaalsContact O-SG 3.41Å
25L90.9Very high90Very high72 Ų7246 Ų4638%0.37729%0.29SS..Hα-helixtrans-63.7-44.5176.2-71.9174.5000111.7L21 T22 G27 C28 V29 F302L21-L25 HydrophobicContact CD1-CD1 4.48Å; L21-L25 HydrophobicContact CG-CD1 4.22Å; L21-L25 WeakPolarHBondContact O-CB 3.33Å; L21-L25 WeakPolarHBondContact O-CG 3.35Å; L21-L25 PolarHBondContact O-N 2.82Å; T22-L25 PolarHBondContact O-N 3.29Å; L25-G27 VanDerWaalsContact C-N 3.31Å; L25-G27 PolarHBondContact O-N 3.41Å; L25-C28 WeakPolarHBondContact O-CB 3.47Å; L25-C28 PolarHBondContact O-N 3.26Å; L25-C28 VanDerWaalsContact O-N 3.11Å; L25-V29 WeakPolarHBondContact O-CG2 3.34Å; L25-V29 PolarHBondContact O-N 2.96Å; L25-F302 HydrophobicContact CD1-CE1 4.31Å
26A92.8Very high90.8Very high0 Ų044.3 Ų44.30%028%0.277CS..Hα-helixtrans-58-43.617600000111.9T22 G23 C28 V29 A30 S295 V298T22-A26 WeakPolarHBondContact O-CB 3.33Å; T22-A26 PolarHBondContact O-N 3.32Å; G23-A26 PolarHBondContact O-N 3.08Å; A26-C28 PolarHBondContact O-N 3.21Å; A26-V29 PolarHBondContact O-N 3.28Å; A26-A30 WeakPolarHBondContact O-CB 3.38Å; A26-A30 PolarHBondContact O-N 2.61Å; A26-S295 WeakPolarHBondContact CB-O 3.28Å; A26-V298 HydrophobicContact CB-CB 4.02Å; A26-V298 HydrophobicContact CB-CG1 3.84Å
27G91.7Very high91.4Very high24 Ų2442.3 Ų42.325%0.24727%0.267CS..Hα-helixtrans-63.1-39.3174.200000113.3G23 G24 L25 K31G23-G27 PolarHBondContact O-N 2.82Å; G24-G27 PolarHBondContact O-N 3.44Å; L25-G27 VanDerWaalsContact C-N 3.31Å; L25-G27 PolarHBondContact O-N 3.41Å; G27-K31 WeakPolarHBondContact O-CB 3.5Å; G27-K31 WeakPolarHBondContact O-CG 3.31Å; G27-K31 PolarHBondContact O-N 3.29Å
28C93.4Very high92Very high31 Ų3141.2 Ų41.221%0.20925%0.252CS..Hα-helixtrans-65.9-42.8175-750000112.3G24 L25 A26 K31 T32 L80G24-C28 PolarHBondContact O-N 3.44Å; G24-C28 PolarHBondContact O-SG 3.04Å; G24-C28 VanDerWaalsContact O-SG 3.41Å; L25-C28 WeakPolarHBondContact O-CB 3.47Å; L25-C28 PolarHBondContact O-N 3.26Å; L25-C28 VanDerWaalsContact O-N 3.11Å; A26-C28 PolarHBondContact O-N 3.21Å; C28-K31 PolarHBondContact O-N 3.33Å; C28-T32 WeakPolarHBondContact O-CB 3.32Å; C28-T32 PolarHBondContact O-N 3.42Å; C28-T32 PolarHBondContact O-OG1 3.02Å; C28-L80 HydrophobicContact CB-CD2 4.28Å
29V94.7Very high92.5Very high63 Ų6339.6 Ų39.638%0.38224%0.243SC..Hα-helixtrans-63.8-47.7176.3173.90000110.3L25 A26 K31 T32 A33 I294 V298L25-V29 WeakPolarHBondContact O-CG2 3.34Å; L25-V29 PolarHBondContact O-N 2.96Å; A26-V29 PolarHBondContact O-N 3.28Å; V29-K31 PolarHBondContact O-N 3.44Å; V29-T32 CarbonylContact O-C 3.58Å; V29-T32 WeakPolarHBondContact O-CA 2.98Å; V29-T32 WeakPolarHBondContact O-CB 3.46Å; V29-T32 PolarHBondContact O-N 3.48Å; V29-T32 VanDerWaalsContact O-N 3.07Å; V29-A33 PolarHBondContact O-N 2.87Å; V29-I294 HydrophobicContact CG1-CG2 4.23Å; V29-V298 HydrophobicContact CB-CG1 4.31Å; V29-V298 HydrophobicContact CB-CG2 4.26Å; V29-V298 HydrophobicContact CG1-CG2 3.73Å; V29-V298 HydrophobicContact CG2-CG1 4.34Å
30A95.4Very high93Very high4 Ų437.2 Ų37.23%0.03323%0.23CC..Hα-helixtrans-57.1-47.9176.400000112.2A26 T32 A33 I34 A291 I294A26-A30 WeakPolarHBondContact O-CB 3.38Å; A26-A30 PolarHBondContact O-N 2.61Å; A30-T32 VanDerWaalsContact C-N 3.28Å; A30-T32 PolarHBondContact O-N 3.11Å; A30-A33 PolarHBondContact O-N 3.32Å; A30-I34 WeakPolarHBondContact O-CG1 3.49Å; A30-I34 PolarHBondContact O-N 2.92Å; A30-I34 VanDerWaalsContact O-N 3.13Å; A30-A291 HydrophobicContact CB-CB 4.42Å; A30-A291 VanDerWaalsContact CB-O 3.29Å; A30-A291 WeakPolarHBondContact CB-O 3.49Å; A30-I294 HydrophobicContact CB-CB 4.26Å; A30-I294 HydrophobicContact CB-CG2 4.14Å
31K94.5Very high93.4Very high80 Ų8032.2 Ų32.235%0.34820%0.204SC..Hα-helixtrans-61.6-36.7175.3-77.8-174.4178.3178.70112.5G27 C28 V29 A35 T79 I83G27-K31 WeakPolarHBondContact O-CB 3.5Å; G27-K31 WeakPolarHBondContact O-CG 3.31Å; G27-K31 PolarHBondContact O-N 3.29Å; C28-K31 PolarHBondContact O-N 3.33Å; V29-K31 PolarHBondContact O-N 3.44Å; K31-A35 WeakPolarHBondContact O-CB 3.49Å; K31-A35 PolarHBondContact O-N 3.03Å; K31-T79 HydrophobicContact CD-CG2 4.2Å; K31-I83 HydrophobicContact CD-CD1 4.24Å
32T96.1Very high93.8Very high51 Ų5127 Ų2731%0.31318%0.176SC..Hα-helixtrans-66.8-42.8176.6-55.60000110.8C28 V29 A30 I34 A35 W73 H76C28-T32 WeakPolarHBondContact O-CB 3.32Å; C28-T32 PolarHBondContact O-N 3.42Å; C28-T32 PolarHBondContact O-OG1 3.02Å; V29-T32 CarbonylContact O-C 3.58Å; V29-T32 WeakPolarHBondContact O-CA 2.98Å; V29-T32 WeakPolarHBondContact O-CB 3.46Å; V29-T32 PolarHBondContact O-N 3.48Å; V29-T32 VanDerWaalsContact O-N 3.07Å; A30-T32 VanDerWaalsContact C-N 3.28Å; A30-T32 PolarHBondContact O-N 3.11Å; T32-I34 PolarHBondContact O-N 2.73Å; T32-A35 WeakPolarHBondContact O-CB 3.29Å; T32-A35 PolarHBondContact O-N 3.27Å; T32-W73 PolarHBondContact O-NE1 3.27Å; T32-H76 VanDerWaalsContact CA-NE2 3.34Å; T32-H76 WeakPolarHBondContact CA-NE2 3.36Å; T32-H76 PolarHBondContact OG1-NE2 3.31Å
33A95.2Very high94.2Very high51 Ų5127.4 Ų27.442%0.42118%0.179SC..Hα-helixtrans-62.1-40.4177.800000112.8V29 A30 I294V29-A33 PolarHBondContact O-N 2.87Å; A30-A33 PolarHBondContact O-N 3.32Å; A33-I294 HydrophobicContact CB-CD1 3.41Å; A33-I294 VanDerWaalsContact CB-CD1 3.41Å; A33-I294 HydrophobicContact CB-CG2 4.46Å
34I95.5Very high94.5Very high12 Ų1226.1 Ų26.16%0.06217%0.165CC..Hα-helixtrans-87.2-2.9179.166.1151.9000114.4A30 T32 P36 L37 D38 K287 V290 A291A30-I34 WeakPolarHBondContact O-CG1 3.49Å; A30-I34 PolarHBondContact O-N 2.92Å; A30-I34 VanDerWaalsContact O-N 3.13Å; T32-I34 PolarHBondContact O-N 2.73Å; I34-P36 VanDerWaalsContact C-CD 3.48Å; I34-L37 WeakPolarHBondContact O-CB 3.13Å; I34-L37 PolarHBondContact O-N 3.29Å; I34-L37 VanDerWaalsContact O-N 3.1Å; I34-D38 PolarHBondContact O-N 2.88Å; I34-K287 HydrophobicContact CD1-CB 4.15Å; I34-K287 HydrophobicContact CD1-CG 4.37Å; I34-V290 HydrophobicContact CG2-CB 4.28Å; I34-V290 HydrophobicContact CG2-CG1 3.83Å; I34-A291 HydrophobicContact CD1-CB 3.96Å; I34-A291 HydrophobicContact CG1-CB 4.35Å; I34-A291 HydrophobicContact CG2-CB 4.08Å
35A95.9Very high94.8Very high5 Ų524.2 Ų24.24%0.04114%0.144CC..Hα-helixtrans-58.1-39-174.400000114.7K31 T32 L37 D38 R39 W73 H76K31-A35 WeakPolarHBondContact O-CB 3.49Å; K31-A35 PolarHBondContact O-N 3.03Å; T32-A35 WeakPolarHBondContact O-CB 3.29Å; T32-A35 PolarHBondContact O-N 3.27Å; A35-L37 VanDerWaalsContact C-N 3.28Å; A35-L37 PolarHBondContact O-N 2.94Å; A35-D38 WeakPolarHBondContact O-CB 3.44Å; A35-D38 PolarHBondContact O-N 3.47Å; A35-R39 PolarHBondContact O-N 2.85Å; A35-W73 VanDerWaalsContact CB-CD1 3.43Å; A35-W73 HydrophobicContact CB-CG 4.34Å; A35-H76 HydrophobicContact CB-CB 4.06Å
36P95.6Very high94.9Very high18 Ų1820.8 Ų20.812%0.11713%0.127CC..Hα-helixtrans-56.9-41.9174.1-29.138.5000113I34 R39 A40 L60 L72 W73I34-P36 VanDerWaalsContact C-CD 3.48Å; P36-R39 PolarHBondContact O-N 2.91Å; P36-A40 PolarHBondContact O-N 3.41Å; P36-L60 HydrophobicContact CB-CD2 4.29Å; P36-L72 HydrophobicContact CB-CB 3.93Å; P36-L72 HydrophobicContact CB-CD1 4.35Å; P36-L72 HydrophobicContact CB-CD2 4.44Å; P36-L72 HydrophobicContact CB-CG 4.5Å; P36-L72 HydrophobicContact CG-CB 3.96Å; P36-L72 HydrophobicContact CG-CD1 4.49Å; P36-W73 HydrophobicContact CG-CD2 4.1Å; P36-W73 HydrophobicContact CG-CE3 4.4Å; P36-W73 HydrophobicContact CG-CH2 3.93Å; P36-W73 HydrophobicContact CG-CZ2 3.59Å; P36-W73 HydrophobicContact CG-CZ3 4.32Å
37L95.4Very high94.9Very high31 Ų3121.9 Ų21.916%0.16213%0.133CC..Hα-helixtrans-71.4-39.4179.7-177.160.1000111.1I34 A35 A40 K41 L56 V283 I286 K287I34-L37 WeakPolarHBondContact O-CB 3.13Å; I34-L37 PolarHBondContact O-N 3.29Å; I34-L37 VanDerWaalsContact O-N 3.1Å; A35-L37 VanDerWaalsContact C-N 3.28Å; A35-L37 PolarHBondContact O-N 2.94Å; L37-A40 PolarHBondContact O-N 3Å; L37-K41 WeakPolarHBondContact O-CB 3.02Å; L37-K41 PolarHBondContact O-N 2.88Å; L37-L56 HydrophobicContact CD1-CD1 4.13Å; L37-L56 HydrophobicContact CD1-CD2 3.89Å; L37-V283 HydrophobicContact CD1-CB 4.41Å; L37-V283 HydrophobicContact CD1-CG1 3.4Å; L37-V283 HydrophobicContact CD1-CG2 4.27Å; L37-V283 HydrophobicContact CD2-CG1 3.87Å; L37-V283 HydrophobicContact CG-CG1 3.34Å; L37-I286 HydrophobicContact CD2-CG2 4.21Å; L37-K287 HydrophobicContact CD2-CB 3.87Å
38D94.9Very high94.7Very high18 Ų1824.5 Ų24.510%0.09614%0.136CC..Hα-helixtrans-61.8-40.4172.1-105.610.9000111.8I34 A35 I42 R140 K287I34-D38 PolarHBondContact O-N 2.88Å; A35-D38 WeakPolarHBondContact O-CB 3.44Å; A35-D38 PolarHBondContact O-N 3.47Å; D38-I42 WeakPolarHBondContact O-CG1 3.32Å; D38-I42 PolarHBondContact O-N 2.9Å; D38-I42 VanDerWaalsContact O-N 3.07Å; D38-R140 IonicContact OD2-CZ 3.89Å; D38-R140 IonicContact OD2-NH2 2.72Å; D38-R140 PolarHBondContact OD2-NH2 2.88Å; D38-K287 WeakPolarHBondContact OD1-CD 3.48Å; D38-K287 IonicContact OD1-NZ 3.83Å; D38-K287 PolarHBondContact OD1-NZ 3.42Å
39R95.8Very high94.4Very high9 Ų927 Ų273%0.03415%0.145CC..Hα-helixtrans-63.5-50.1174.6-179.1-174.8173.7-157.6-6.9110.6A35 P36 K41 I42 N43 R71 L72 A144A35-R39 PolarHBondContact O-N 2.85Å; P36-R39 PolarHBondContact O-N 2.91Å; R39-K41 VanDerWaalsContact C-N 3.3Å; R39-K41 PolarHBondContact O-N 3.36Å; R39-I42 PolarHBondContact O-N 3.43Å; R39-N43 PolarHBondContact O-N 3.44Å; R39-R71 PolarHBondContact NH1-O 2.87Å; R39-L72 VanDerWaalsContact CD-O 3.29Å; R39-L72 WeakPolarHBondContact CD-O 3.38Å; R39-A144 HydrophobicContact CG-CB 4.05Å; R39-A144 PolarHBondContact NE-O 2.69Å
40A95.4Very high94.1Very high0 Ų028.4 Ų28.40%016%0.155CC..Hα-helixtrans-58.4-45.1178.900000111.2P36 L37 I42 N43 F44 L56 F59 L60P36-A40 PolarHBondContact O-N 3.41Å; L37-A40 PolarHBondContact O-N 3Å; A40-I42 PolarHBondContact O-N 3.19Å; A40-N43 WeakPolarHBondContact O-CB 3.31Å; A40-N43 PolarHBondContact O-N 3.49Å; A40-N43 VanDerWaalsContact O-N 3.16Å; A40-F44 WeakPolarHBondContact O-CD2 3.35Å; A40-F44 PolarHBondContact O-N 3.09Å; A40-L56 HydrophobicContact CB-CD1 3.43Å; A40-L56 VanDerWaalsContact CB-CD1 3.43Å; A40-F59 VanDerWaalsContact CA-CE1 3.5Å; A40-F59 HydrophobicContact CB-CD1 3.56Å; A40-F59 HydrophobicContact CB-CE1 3.62Å; A40-L60 HydrophobicContact CB-CD2 4.31Å
41K95.3Very high94Very high17 Ų1729.9 Ų29.97%0.07416%0.161CC..Hα-helixtrans-53.8-53.9174.7-173.5-167.3173.5-1620111.3L37 R39 N43 F44 Q45 Y236 V283 N284L37-K41 WeakPolarHBondContact O-CB 3.02Å; L37-K41 PolarHBondContact O-N 2.88Å; R39-K41 VanDerWaalsContact C-N 3.3Å; R39-K41 PolarHBondContact O-N 3.36Å; K41-N43 PolarHBondContact O-N 3.01Å; K41-F44 PolarHBondContact O-N 3.41Å; K41-Q45 VanDerWaalsContact CE-CD 3.45Å; K41-Q45 HydrophobicContact CG-CG 4.17Å; K41-Q45 WeakPolarHBondContact O-CB 3.43Å; K41-Q45 VanDerWaalsContact O-CG 3.26Å; K41-Q45 WeakPolarHBondContact O-CG 3.48Å; K41-Q45 PolarHBondContact O-N 3.45Å; K41-Y236 VanDerWaalsContact CE-OH 3.3Å; K41-Y236 WeakPolarHBondContact CE-OH 3.4Å; K41-V283 HydrophobicContact CB-CB 4.36Å; K41-V283 HydrophobicContact CB-CG1 3.89Å; K41-V283 HydrophobicContact CD-CB 4.48Å; K41-V283 HydrophobicContact CD-CG1 4.33Å; K41-V283 HydrophobicContact CG-CB 4.26Å; K41-V283 HydrophobicContact CG-CG1 4.22Å; K41-N284 VanDerWaalsContact CE-OD1 3.24Å; K41-N284 WeakPolarHBondContact CE-OD1 3.28Å; K41-N284 PolarHBondContact NZ-ND2 3.46Å; K41-N284 PolarHBondContact NZ-OD1 2.96Å
42I95.8Very high93.9Very high4 Ų429.4 Ų29.42%0.02116%0.162CC..Hα-helixtrans-58.4-41.7-179.4-69.4166.8000110.5D38 R39 A40 Q45 S46 R140 A141 A144 V145D38-I42 WeakPolarHBondContact O-CG1 3.32Å; D38-I42 PolarHBondContact O-N 2.9Å; D38-I42 VanDerWaalsContact O-N 3.07Å; R39-I42 PolarHBondContact O-N 3.43Å; A40-I42 PolarHBondContact O-N 3.19Å; I42-Q45 PolarHBondContact O-N 2.82Å; I42-S46 VanDerWaalsContact O-CB 3.24Å; I42-S46 WeakPolarHBondContact O-CB 3.4Å; I42-S46 PolarHBondContact O-N 2.83Å; I42-S46 PolarHBondContact O-OG 3.37Å; I42-R140 HydrophobicContact CD1-CG 4.36Å; I42-A141 HydrophobicContact CG2-CB 4.43Å; I42-A144 HydrophobicContact CB-CB 4.01Å; I42-A144 HydrophobicContact CD1-CB 4.39Å; I42-A144 HydrophobicContact CG2-CB 3.68Å; I42-V145 HydrophobicContact CG2-CG2 4.4Å
43N95.4Very high93.8Very high13 Ų1331.4 Ų31.47%0.0718%0.175CC..Hα-helixtrans-60.4-49.6178.3-168-70.5000112.4R39 A40 K41 Q45 S46 T47 M49 F59R39-N43 PolarHBondContact O-N 3.44Å; A40-N43 WeakPolarHBondContact O-CB 3.31Å; A40-N43 PolarHBondContact O-N 3.49Å; A40-N43 VanDerWaalsContact O-N 3.16Å; K41-N43 PolarHBondContact O-N 3.01Å; N43-Q45 PolarHBondContact O-N 3.16Å; N43-S46 PolarHBondContact O-N 3.42Å; N43-T47 WeakPolarHBondContact O-CB 3.2Å; N43-T47 VanDerWaalsContact O-CG2 3.32Å; N43-T47 WeakPolarHBondContact O-CG2 3.47Å; N43-T47 PolarHBondContact O-N 2.84Å; N43-T47 PolarHBondContact O-OG1 3.45Å; N43-M49 WeakPolarHBondContact OD1-CE 3.31Å; N43-F59 HydrophobicContact CB-CE2 3.92Å; N43-F59 HydrophobicContact CB-CZ 3.88Å
44F95.5Very high93.7Very high4 Ų439.1 Ų39.12%0.01819%0.193CC..Hα-helixtrans-66.7-34.4176.2-74.8-70.5000113.2A40 K41 S46 M49 F51 S55 L56 F59 K279A40-F44 WeakPolarHBondContact O-CD2 3.35Å; A40-F44 PolarHBondContact O-N 3.09Å; K41-F44 PolarHBondContact O-N 3.41Å; F44-S46 VanDerWaalsContact C-N 3.31Å; F44-M49 HydrophobicContact CD1-CB 4.08Å; F44-M49 HydrophobicContact CD1-CE 4.36Å; F44-M49 HydrophobicContact CE1-CB 4.09Å; F44-M49 HydrophobicContact CE1-CE 4.18Å; F44-F51 HydrophobicContact CB-CD2 3.99Å; F44-F51 HydrophobicContact CD1-CB 4.48Å; F44-F51 HydrophobicContact CD1-CD2 4.25Å; F44-F51 AromaticContact CD2-CD2 3.79Å; F44-F51 HydrophobicContact CD2-CD2 3.79Å; F44-F51 HydrophobicContact CD2-CE2 4.18Å; F44-F51 HydrophobicContact CE2-CD2 4.37Å; F44-F51 AromaticContact CG-CD2 3.75Å; F44-F51 HydrophobicContact CG-CD2 3.75Å; F44-S55 WeakPolarHBondContact CZ-O 3.48Å; F44-L56 HydrophobicContact CE2-CB 4.46Å; F44-L56 HydrophobicContact CE2-CD1 4.29Å; F44-F59 HydrophobicContact CE2-CB 3.97Å; F44-F59 HydrophobicContact CE2-CG 4.2Å; F44-F59 HydrophobicContact CZ-CB 3.94Å; F44-F59 HydrophobicContact CZ-CG 4.46Å; F44-K279 WeakPolarHBondContact O-CD 3.28Å; F44-K279 WeakPolarHBondContact O-CE 3.38Å
45Q95.3Very high93.7Very high2 Ų240.3 Ų40.31%0.00920%0.202CC..Hα-helixtrans-70-29.4176.4-73.3-169.4-54.500112.7K41 I42 N43 Y236 I240 R243 R244K41-Q45 VanDerWaalsContact CE-CD 3.45Å; K41-Q45 HydrophobicContact CG-CG 4.17Å; K41-Q45 WeakPolarHBondContact O-CB 3.43Å; K41-Q45 VanDerWaalsContact O-CG 3.26Å; K41-Q45 WeakPolarHBondContact O-CG 3.48Å; K41-Q45 PolarHBondContact O-N 3.45Å; I42-Q45 PolarHBondContact O-N 2.82Å; N43-Q45 PolarHBondContact O-N 3.16Å; Q45-Y236 PolarHBondContact NE2-OH 3.36Å; Q45-I240 HydrophobicContact CB-CD1 3.82Å; Q45-I240 HydrophobicContact CG-CD1 3.54Å; Q45-R243 HydrophobicContact CB-CB 4.07Å; Q45-R243 HydrophobicContact CB-CG 4.02Å; Q45-R244 PolarHBondContact O-NE 3.36Å
46S94Very high93.6Very high0 Ų040.9 Ų40.90%020%0.204CC..Hα-helixtrans-88.7-26.7-179.3-80.10000113.7I42 N43 F44 R243 R244 T247 T251I42-S46 VanDerWaalsContact O-CB 3.24Å; I42-S46 WeakPolarHBondContact O-CB 3.4Å; I42-S46 PolarHBondContact O-N 2.83Å; I42-S46 PolarHBondContact O-OG 3.37Å; N43-S46 PolarHBondContact O-N 3.42Å; F44-S46 VanDerWaalsContact C-N 3.31Å; S46-R243 PolarHBondContact OG-O 3.42Å; S46-R244 VanDerWaalsContact C-NE 3.35Å; S46-R244 WeakPolarHBondContact O-CD 3.3Å; S46-R244 PolarHBondContact O-NE 2.94Å; S46-T247 WeakPolarHBondContact CB-OG1 3.47Å; S46-T247 VanDerWaalsContact OG-CG2 3.29Å; S46-T247 WeakPolarHBondContact OG-CG2 3.45Å; S46-T247 PolarHBondContact OG-OG1 2.89Å; S46-T251 WeakPolarHBondContact O-CG2 3.16Å
47T91.3Very high93.6Very high23 Ų2344.9 Ų44.914%0.14122%0.224CC..SBendtrans-108.4159.7-175.463.70000111.7N43 M49 V145 R244 T251 K279N43-T47 WeakPolarHBondContact O-CB 3.2Å; N43-T47 VanDerWaalsContact O-CG2 3.32Å; N43-T47 WeakPolarHBondContact O-CG2 3.47Å; N43-T47 PolarHBondContact O-N 2.84Å; N43-T47 PolarHBondContact O-OG1 3.45Å; T47-M49 HydrophobicContact CG2-CE 4.48Å; T47-M49 PolarHBondContact O-N 2.88Å; T47-M49 WeakPolarHBondContact OG1-CE 3.48Å; T47-V145 HydrophobicContact CG2-CG1 4.18Å; T47-R244 VanDerWaalsContact C-NH1 3.32Å; T47-R244 VanDerWaalsContact O-CZ 3.26Å; T47-R244 PolarHBondContact O-NH1 2.74Å; T47-R244 PolarHBondContact O-NH2 2.81Å; T47-T251 HydrophobicContact CG2-CG2 4.45Å; T47-K279 PolarHBondContact O-NZ 3.07Å
48R88.2Confident93.6Very high79 Ų7947.8 Ų47.830%0.29824%0.236SC..  trans-74.3-7.5177.3-55.9-166.3-167.7-165.94.5114.2H253 Y266 D270 E271 K279R48-H253 VanDerWaalsContact CZ-CE1 3.46Å; R48-H253 PolarHBondContact NE-CE1 3.03Å; R48-H253 VanDerWaalsContact NE-CE1 3.26Å; R48-H253 PolarHBondContact NE-NE2 2.76Å; R48-H253 PolarHBondContact NH2-CE1 3.3Å; R48-H253 PolarHBondContact NH2-ND1 2.87Å; R48-Y266 PolarHBondContact NH1-OH 2.92Å; R48-Y266 VanDerWaalsContact NH2-CE1 3.31Å; R48-Y266 VanDerWaalsContact NH2-CZ 3.31Å; R48-Y266 PolarHBondContact NH2-OH 3.4Å; R48-D270 IonicContact CZ-OD2 3.13Å; R48-D270 IonicContact NE-OD2 2.77Å; R48-D270 IonicContact NH1-OD1 2.78Å; R48-D270 IonicContact NH1-OD2 3.93Å; R48-D270 PolarHBondContact NH1-OD2 2.97Å; R48-E271 WeakPolarHBondContact CG-OE1 3.12Å; R48-K279 PolarHBondContact O-NZ 2.89Å
49M87.7Confident93.6Very high83 Ų8348.1 Ų48.141%0.40924%0.237SC..PPolyproline II helixtrans-53.9124.2-178.2-64.3-167.4-65.200112N43 F44 T47 F51 K279N43-M49 WeakPolarHBondContact OD1-CE 3.31Å; F44-M49 HydrophobicContact CD1-CB 4.08Å; F44-M49 HydrophobicContact CD1-CE 4.36Å; F44-M49 HydrophobicContact CE1-CB 4.09Å; F44-M49 HydrophobicContact CE1-CE 4.18Å; T47-M49 HydrophobicContact CG2-CE 4.48Å; T47-M49 PolarHBondContact O-N 2.88Å; T47-M49 WeakPolarHBondContact OG1-CE 3.48Å; M49-F51 PolarHBondContact O-N 3.47Å; M49-K279 WeakPolarHBondContact O-CE 3.34Å; M49-K279 PolarHBondContact O-NZ 3.28Å
50P88.8Confident93.7Very high92 Ų9250 Ų5060%0.59725%0.247SC*.PPolyproline II helixtrans-61.5136.7-177.725.3-34.1000110.8
51F92.4Very high93.7Very high35 Ų3555.1 Ų55.115%0.15427%0.27CS..PPolyproline II helixtrans-89.9122.1179.9179.7-90.6000110.7F44 M49 L56 K279 S282 V283F44-F51 HydrophobicContact CB-CD2 3.99Å; F44-F51 HydrophobicContact CD1-CB 4.48Å; F44-F51 HydrophobicContact CD1-CD2 4.25Å; F44-F51 AromaticContact CD2-CD2 3.79Å; F44-F51 HydrophobicContact CD2-CD2 3.79Å; F44-F51 HydrophobicContact CD2-CE2 4.18Å; F44-F51 HydrophobicContact CE2-CD2 4.37Å; F44-F51 AromaticContact CG-CD2 3.75Å; F44-F51 HydrophobicContact CG-CD2 3.75Å; M49-F51 PolarHBondContact O-N 3.47Å; F51-L56 HydrophobicContact CE2-CB 4.27Å; F51-L56 HydrophobicContact CE2-CD2 4.47Å; F51-L56 HydrophobicContact CZ-CD2 4.4Å; F51-K279 HydrophobicContact CB-CG 3.79Å; F51-S282 VanDerWaalsContact CE1-OG 3.27Å; F51-S282 WeakPolarHBondContact CE1-OG 3.33Å; F51-V283 HydrophobicContact CE1-CG2 4.4Å; F51-V283 HydrophobicContact CE2-CG2 3.55Å; F51-V283 HydrophobicContact CZ-CG2 3.37Å
52N92.8Very high93.7Very high70 Ų7056.6 Ų56.637%0.37428%0.278SS..  trans-148.9167.8163.366.360.1000108.9R54 S55 L56N52-R54 VanDerWaalsContact C-N 3.27Å; N52-R54 PolarHBondContact O-N 2.95Å; N52-R54 WeakPolarHBondContact OD1-CA 3.17Å; N52-R54 WeakPolarHBondContact OD1-CB 3.12Å; N52-R54 PolarHBondContact OD1-N 2.99Å; N52-S55 PolarHBondContact ND2-OG 3.44Å; N52-S55 VanDerWaalsContact ND2-OG 3.08Å; N52-S55 PolarHBondContact O-N 2.97Å; N52-S55 PolarHBondContact OD1-N 3.16Å; N52-S55 PolarHBondContact OD1-OG 3.4Å; N52-L56 PolarHBondContact O-N 3.08Å
53V92.7Very high93.7Very high94 Ų9456.7 Ų56.757%0.5728%0.279SS*.Hα-helixtrans-62-35.2-176.91790000112L56 I57V53-L56 WeakPolarHBondContact O-CB 3.39Å; V53-L56 PolarHBondContact O-N 3.26Å; V53-I57 HydrophobicContact CG1-CD1 3.98Å; V53-I57 WeakPolarHBondContact O-CG1 3.18Å; V53-I57 PolarHBondContact O-N 2.71Å
54R94.4Very high93.6Very high213 Ų21358.1 Ų58.180%0.80429%0.29SS*.Hα-helixtrans-67-45.5177-61.9-178.3179.8176.1-0.4111.3N52 L56 I57 Q58N52-R54 VanDerWaalsContact C-N 3.27Å; N52-R54 PolarHBondContact O-N 2.95Å; N52-R54 WeakPolarHBondContact OD1-CA 3.17Å; N52-R54 WeakPolarHBondContact OD1-CB 3.12Å; N52-R54 PolarHBondContact OD1-N 2.99Å; R54-L56 VanDerWaalsContact C-N 3.28Å; R54-L56 PolarHBondContact O-N 2.99Å; R54-I57 PolarHBondContact O-N 2.87Å; R54-Q58 WeakPolarHBondContact O-CB 2.73Å; R54-Q58 PolarHBondContact O-N 3.42Å
55S94.4Very high93.6Very high36 Ų3664.3 Ų64.325%0.25232%0.319SS..Hα-helixtrans-60.4-38.5174.3-59.70000111.4F44 N52 Q58 F59F44-S55 WeakPolarHBondContact CZ-O 3.48Å; N52-S55 PolarHBondContact ND2-OG 3.44Å; N52-S55 VanDerWaalsContact ND2-OG 3.08Å; N52-S55 PolarHBondContact O-N 2.97Å; N52-S55 PolarHBondContact OD1-N 3.16Å; N52-S55 PolarHBondContact OD1-OG 3.4Å; S55-Q58 PolarHBondContact O-N 2.85Å; S55-F59 VanDerWaalsContact O-CB 3.31Å; S55-F59 WeakPolarHBondContact O-CB 3.36Å; S55-F59 PolarHBondContact O-N 3.32Å
56L94.8Very high93.5Very high17 Ų1771.1 Ų71.19%0.08935%0.35CS..Hα-helixtrans-62.3-50.4174.6173.662.5000111.4L37 A40 F44 F51 N52 V53 R54 Q58 F59 L60L37-L56 HydrophobicContact CD1-CD1 4.13Å; L37-L56 HydrophobicContact CD1-CD2 3.89Å; A40-L56 HydrophobicContact CB-CD1 3.43Å; A40-L56 VanDerWaalsContact CB-CD1 3.43Å; F44-L56 HydrophobicContact CE2-CB 4.46Å; F44-L56 HydrophobicContact CE2-CD1 4.29Å; F51-L56 HydrophobicContact CE2-CB 4.27Å; F51-L56 HydrophobicContact CE2-CD2 4.47Å; F51-L56 HydrophobicContact CZ-CD2 4.4Å; N52-L56 PolarHBondContact O-N 3.08Å; V53-L56 WeakPolarHBondContact O-CB 3.39Å; V53-L56 PolarHBondContact O-N 3.26Å; R54-L56 VanDerWaalsContact C-N 3.28Å; R54-L56 PolarHBondContact O-N 2.99Å; L56-Q58 VanDerWaalsContact C-N 3.3Å; L56-Q58 PolarHBondContact O-N 3.27Å; L56-F59 PolarHBondContact O-N 2.98Å; L56-L60 HydrophobicContact CD1-CD1 4.31Å; L56-L60 HydrophobicContact CD1-CG 4.43Å; L56-L60 HydrophobicContact CG-CD1 4.37Å; L56-L60 WeakPolarHBondContact O-CG 3.44Å; L56-L60 PolarHBondContact O-N 2.97Å
57I95.6Very high93.3Very high102 Ų10273.9 Ų73.952%0.52336%0.364SS..Hα-helixtrans-61.4-42177.5-67166.7000110.4V53 R54 L60 K61V53-I57 HydrophobicContact CG1-CD1 3.98Å; V53-I57 WeakPolarHBondContact O-CG1 3.18Å; V53-I57 PolarHBondContact O-N 2.71Å; R54-I57 PolarHBondContact O-N 2.87Å; I57-L60 PolarHBondContact O-N 3.47Å; I57-K61 WeakPolarHBondContact O-CB 3.41Å; I57-K61 PolarHBondContact O-N 3.31Å
58Q96Very high93.3Very high92 Ų9274.2 Ų74.243%0.4337%0.372SS..Hα-helixtrans-63.2-43177.2-168.566.438.800111.7R54 S55 L56 L60 K61 N62R54-Q58 WeakPolarHBondContact O-CB 2.73Å; R54-Q58 PolarHBondContact O-N 3.42Å; S55-Q58 PolarHBondContact O-N 2.85Å; L56-Q58 VanDerWaalsContact C-N 3.3Å; L56-Q58 PolarHBondContact O-N 3.27Å; Q58-L60 VanDerWaalsContact C-N 3.34Å; Q58-L60 PolarHBondContact O-N 2.78Å; Q58-K61 PolarHBondContact O-N 2.97Å; Q58-N62 PolarHBondContact NE2-OD1 3.03Å; Q58-N62 VanDerWaalsContact O-CB 3.31Å; Q58-N62 WeakPolarHBondContact O-CB 3.47Å; Q58-N62 VanDerWaalsContact O-CG 3.22Å; Q58-N62 PolarHBondContact O-N 3.29Å; Q58-N62 PolarHBondContact O-OD1 3.24Å
59F94.9Very high93.5Very high26 Ų2676.2 Ų76.211%0.11438%0.382CS..Hα-helixtrans-60-44.7176172.7-91.5000111.5A40 N43 F44 S55 L56 T63A40-F59 VanDerWaalsContact CA-CE1 3.5Å; A40-F59 HydrophobicContact CB-CD1 3.56Å; A40-F59 HydrophobicContact CB-CE1 3.62Å; N43-F59 HydrophobicContact CB-CE2 3.92Å; N43-F59 HydrophobicContact CB-CZ 3.88Å; F44-F59 HydrophobicContact CE2-CB 3.97Å; F44-F59 HydrophobicContact CE2-CG 4.2Å; F44-F59 HydrophobicContact CZ-CB 3.94Å; F44-F59 HydrophobicContact CZ-CG 4.46Å; S55-F59 VanDerWaalsContact O-CB 3.31Å; S55-F59 WeakPolarHBondContact O-CB 3.36Å; S55-F59 PolarHBondContact O-N 3.32Å; L56-F59 PolarHBondContact O-N 2.98Å; F59-T63 VanDerWaalsContact O-CB 3.25Å; F59-T63 WeakPolarHBondContact O-CB 3.18Å; F59-T63 PolarHBondContact O-N 3.22Å; F59-T63 PolarHBondContact O-OG1 3.13Å
60L96.1Very high93.7Very high47 Ų4779.4 Ų79.425%0.24640%0.398CS..Hα-helixtrans-64.6-45.4177.4-65.5171.8000111P36 A40 L56 I57 Q58 T63 C64 L72P36-L60 HydrophobicContact CB-CD2 4.29Å; A40-L60 HydrophobicContact CB-CD2 4.31Å; L56-L60 HydrophobicContact CD1-CD1 4.31Å; L56-L60 HydrophobicContact CD1-CG 4.43Å; L56-L60 HydrophobicContact CG-CD1 4.37Å; L56-L60 WeakPolarHBondContact O-CG 3.44Å; L56-L60 PolarHBondContact O-N 2.97Å; I57-L60 PolarHBondContact O-N 3.47Å; Q58-L60 VanDerWaalsContact C-N 3.34Å; Q58-L60 PolarHBondContact O-N 2.78Å; L60-T63 PolarHBondContact O-N 3.27Å; L60-C64 PolarHBondContact O-N 3.41Å; L60-C64 PolarHBondContact O-SG 2.98Å; L60-L72 HydrophobicContact CB-CD2 4.45Å; L60-L72 HydrophobicContact CD2-CD2 3.63Å
61K96.8Very high93.9Very high109 Ų10979.9 Ų79.947%0.47439%0.388SS..Hα-helixtrans-61.7-51.1177.9-176.1-179174.6-177.50111.8I57 Q58 T63 C64 Q65I57-K61 WeakPolarHBondContact O-CB 3.41Å; I57-K61 PolarHBondContact O-N 3.31Å; Q58-K61 PolarHBondContact O-N 2.97Å; K61-T63 VanDerWaalsContact C-N 3.31Å; K61-T63 PolarHBondContact O-N 2.91Å; K61-C64 WeakPolarHBondContact O-CB 3.24Å; K61-C64 PolarHBondContact O-N 3.24Å; K61-C64 VanDerWaalsContact O-N 3.14Å; K61-Q65 HydrophobicContact CG-CG 4.43Å; K61-Q65 WeakPolarHBondContact O-CG 3.39Å; K61-Q65 PolarHBondContact O-N 3.36Å
62N95.5Very high94Very high48 Ų4878.9 Ų78.926%0.25738%0.384SS..Hα-helixtrans-61.1-41.9178.4-71.54.9000111.1Q58 C64 Q65 E66Q58-N62 PolarHBondContact NE2-OD1 3.03Å; Q58-N62 VanDerWaalsContact O-CB 3.31Å; Q58-N62 WeakPolarHBondContact O-CB 3.47Å; Q58-N62 VanDerWaalsContact O-CG 3.22Å; Q58-N62 PolarHBondContact O-N 3.29Å; Q58-N62 PolarHBondContact O-OD1 3.24Å; N62-C64 VanDerWaalsContact C-N 3.31Å; N62-C64 PolarHBondContact O-N 3.07Å; N62-Q65 PolarHBondContact O-N 3.1Å; N62-E66 VanDerWaalsContact O-CB 3.29Å; N62-E66 WeakPolarHBondContact O-CB 3.5Å; N62-E66 WeakPolarHBondContact O-CG 3.35Å; N62-E66 PolarHBondContact O-N 3.39Å
63T94.3Very high94.2Very high5 Ų578.7 Ų78.73%0.03138%0.378CS..Iπ-helixtrans-59.3-43.7175.7-63.30000111.5F59 L60 K61 Q67 G68 R71 L72F59-T63 VanDerWaalsContact O-CB 3.25Å; F59-T63 WeakPolarHBondContact O-CB 3.18Å; F59-T63 PolarHBondContact O-N 3.22Å; F59-T63 PolarHBondContact O-OG1 3.13Å; L60-T63 PolarHBondContact O-N 3.27Å; K61-T63 VanDerWaalsContact C-N 3.31Å; K61-T63 PolarHBondContact O-N 2.91Å; T63-Q67 WeakPolarHBondContact O-CA 3.38Å; T63-Q67 WeakPolarHBondContact O-CB 3.16Å; T63-Q67 PolarHBondContact O-N 2.84Å; T63-G68 PolarHBondContact O-N 3.03Å; T63-R71 HydrophobicContact CG2-CB 4.2Å; T63-L72 HydrophobicContact CG2-CD2 3.75Å; T63-L72 HydrophobicContact CG2-CG 4.29Å
64C94.8Very high94.1Very high44 Ų4475.2 Ų75.230%0.29736%0.355SS..Iπ-helixtrans-65.3-41.6176.4-76.10000112.7L60 K61 N62 G68 L72L60-C64 PolarHBondContact O-N 3.41Å; L60-C64 PolarHBondContact O-SG 2.98Å; K61-C64 WeakPolarHBondContact O-CB 3.24Å; K61-C64 PolarHBondContact O-N 3.24Å; K61-C64 VanDerWaalsContact O-N 3.14Å; N62-C64 VanDerWaalsContact C-N 3.31Å; N62-C64 PolarHBondContact O-N 3.07Å; C64-G68 VanDerWaalsContact O-CA 3.23Å; C64-G68 WeakPolarHBondContact O-CA 3.5Å; C64-G68 PolarHBondContact O-N 3.25Å; C64-L72 WeakPolarHBondContact SG-CD1 3.5Å
65Q94.5Very high94Very high134 Ų13465.2 Ų65.263%0.62632%0.318SS*.Iπ-helixtrans-75.4-44.4-176.1-70.9-179.1-39.300112.7K61 N62K61-Q65 HydrophobicContact CG-CG 4.43Å; K61-Q65 WeakPolarHBondContact O-CG 3.39Å; K61-Q65 PolarHBondContact O-N 3.36Å; N62-Q65 PolarHBondContact O-N 3.1Å
66E92.8Very high94Very high144 Ų14464.3 Ų64.367%0.67331%0.31SS*.Iπ-helixtrans-88.3-37.2-174.2-63.2170-169.700112.8N62N62-E66 VanDerWaalsContact O-CB 3.29Å; N62-E66 WeakPolarHBondContact O-CB 3.5Å; N62-E66 WeakPolarHBondContact O-CG 3.35Å; N62-E66 PolarHBondContact O-N 3.39Å
67Q89.7Confident93.8Very high59 Ų5967.4 Ų67.428%0.27633%0.33SS..Iπ-helixtrans-110.4-16.4-171.5-43.6-178.2-3.400112.7T63 R71T63-Q67 WeakPolarHBondContact O-CA 3.38Å; T63-Q67 WeakPolarHBondContact O-CB 3.16Å; T63-Q67 PolarHBondContact O-N 2.84Å; Q67-R71 HydrophobicContact CB-CB 3.83Å; Q67-R71 HydrophobicContact CB-CG 3.64Å; Q67-R71 WeakPolarHBondContact O-CG 3.29Å
68G91.7Very high93.7Very high30 Ų3062.6 Ų62.631%0.30931%0.305SS..  trans93.3153.3-175.500000113.6T63 C64 M70 R71T63-G68 PolarHBondContact O-N 3.03Å; C64-G68 VanDerWaalsContact O-CA 3.23Å; C64-G68 WeakPolarHBondContact O-CA 3.5Å; C64-G68 PolarHBondContact O-N 3.25Å; G68-M70 PolarHBondContact O-N 3.26Å; G68-R71 VanDerWaalsContact O-CB 3.29Å; G68-R71 WeakPolarHBondContact O-CB 3.41Å; G68-R71 PolarHBondContact O-N 2.97Å
69F92.4Very high93.6Very high120 Ų12058.5 Ų58.553%0.52629%0.286SS..G310 helixtrans-53.2-46.9-173.7178.3-104.8000114.3R71 L72 W73F69-R71 PolarHBondContact O-N 2.93Å; F69-L72 HydrophobicContact CD2-CD1 4.22Å; F69-L72 HydrophobicContact CE2-CD1 4.25Å; F69-L72 WeakPolarHBondContact O-CB 3.48Å; F69-L72 WeakPolarHBondContact O-CG 3.44Å; F69-L72 PolarHBondContact O-N 3.25Å; F69-L72 VanDerWaalsContact O-N 3.09Å; F69-W73 HydrophobicContact CD1-CZ3 4.13Å; F69-W73 AromaticContact CE1-CH2 3.91Å; F69-W73 HydrophobicContact CE1-CH2 3.91Å; F69-W73 AromaticContact CE1-CZ3 3.61Å; F69-W73 HydrophobicContact CE1-CZ3 3.61Å; F69-W73 HydrophobicContact CE2-CH2 4.25Å; F69-W73 HydrophobicContact CE2-CZ3 4.12Å; F69-W73 AromaticContact CZ-CH2 3.59Å; F69-W73 HydrophobicContact CZ-CH2 3.59Å; F69-W73 AromaticContact CZ-CZ3 3.62Å; F69-W73 HydrophobicContact CZ-CZ3 3.62Å
70M92.2Very high93.6Very high150 Ų15060 Ų6074%0.73930%0.295SS*.G310 helixtrans-61.9-18.1-178.7-68.5-61.6175.900113.3G68 L72 W73G68-M70 PolarHBondContact O-N 3.26Å; M70-L72 VanDerWaalsContact C-N 3.25Å; M70-L72 PolarHBondContact O-N 3.19Å; M70-W73 PolarHBondContact O-N 3.26Å
71R93.7Very high93.5Very high103 Ų10359.8 Ų59.839%0.38930%0.3SS..G310 helixtrans-69.6-23.1178-60.6-60.5-169.7-177.41.6112.3R39 T63 Q67 G68 F69 W73 R74 A148R39-R71 PolarHBondContact NH1-O 2.87Å; T63-R71 HydrophobicContact CG2-CB 4.2Å; Q67-R71 HydrophobicContact CB-CB 3.83Å; Q67-R71 HydrophobicContact CB-CG 3.64Å; Q67-R71 WeakPolarHBondContact O-CG 3.29Å; G68-R71 VanDerWaalsContact O-CB 3.29Å; G68-R71 WeakPolarHBondContact O-CB 3.41Å; G68-R71 PolarHBondContact O-N 2.97Å; F69-R71 PolarHBondContact O-N 2.93Å; R71-W73 PolarHBondContact O-N 2.91Å; R71-R74 WeakPolarHBondContact O-CB 3.5Å; R71-R74 PolarHBondContact O-N 3.34Å; R71-A148 VanDerWaalsContact CZ-CB 3.44Å; R71-A148 VanDerWaalsContact NH1-CB 3.3Å
72L94.8Very high93.4Very high13 Ų1356.9 Ų56.97%0.06829%0.286CS..G310 helixtrans-51.8-31.7175-72.1177.3000113.1P36 R39 L60 T63 C64 F69 M70 R74P36-L72 HydrophobicContact CB-CB 3.93Å; P36-L72 HydrophobicContact CB-CD1 4.35Å; P36-L72 HydrophobicContact CB-CD2 4.44Å; P36-L72 HydrophobicContact CB-CG 4.5Å; P36-L72 HydrophobicContact CG-CB 3.96Å; P36-L72 HydrophobicContact CG-CD1 4.49Å; R39-L72 VanDerWaalsContact CD-O 3.29Å; R39-L72 WeakPolarHBondContact CD-O 3.38Å; L60-L72 HydrophobicContact CB-CD2 4.45Å; L60-L72 HydrophobicContact CD2-CD2 3.63Å; T63-L72 HydrophobicContact CG2-CD2 3.75Å; T63-L72 HydrophobicContact CG2-CG 4.29Å; C64-L72 WeakPolarHBondContact SG-CD1 3.5Å; F69-L72 HydrophobicContact CD2-CD1 4.22Å; F69-L72 HydrophobicContact CE2-CD1 4.25Å; F69-L72 WeakPolarHBondContact O-CB 3.48Å; F69-L72 WeakPolarHBondContact O-CG 3.44Å; F69-L72 PolarHBondContact O-N 3.25Å; F69-L72 VanDerWaalsContact O-N 3.09Å; M70-L72 VanDerWaalsContact C-N 3.25Å; M70-L72 PolarHBondContact O-N 3.19Å; L72-R74 VanDerWaalsContact C-N 3.32Å; L72-R74 PolarHBondContact O-N 3.22Å
73W95.7Very high93.2Very high67 Ų6756.6 Ų56.625%0.25428%0.284SS..G310 helixtrans-86.811.3177-73.6-94.7000114.9T32 A35 P36 F69 M70 R71 G75 H76T32-W73 PolarHBondContact O-NE1 3.27Å; A35-W73 VanDerWaalsContact CB-CD1 3.43Å; A35-W73 HydrophobicContact CB-CG 4.34Å; P36-W73 HydrophobicContact CG-CD2 4.1Å; P36-W73 HydrophobicContact CG-CE3 4.4Å; P36-W73 HydrophobicContact CG-CH2 3.93Å; P36-W73 HydrophobicContact CG-CZ2 3.59Å; P36-W73 HydrophobicContact CG-CZ3 4.32Å; F69-W73 HydrophobicContact CD1-CZ3 4.13Å; F69-W73 AromaticContact CE1-CH2 3.91Å; F69-W73 HydrophobicContact CE1-CH2 3.91Å; F69-W73 AromaticContact CE1-CZ3 3.61Å; F69-W73 HydrophobicContact CE1-CZ3 3.61Å; F69-W73 HydrophobicContact CE2-CH2 4.25Å; F69-W73 HydrophobicContact CE2-CZ3 4.12Å; F69-W73 AromaticContact CZ-CH2 3.59Å; F69-W73 HydrophobicContact CZ-CH2 3.59Å; F69-W73 AromaticContact CZ-CZ3 3.62Å; F69-W73 HydrophobicContact CZ-CZ3 3.62Å; M70-W73 PolarHBondContact O-N 3.26Å; R71-W73 PolarHBondContact O-N 2.91Å; W73-G75 PolarHBondContact O-N 3.07Å; W73-H76 HydrophobicContact CB-CB 4.2Å; W73-H76 AromaticContact CD1-CD2 3.97Å; W73-H76 WeakPolarHBondContact O-CB 3.39Å; W73-H76 PolarHBondContact O-N 3.14Å
74R91.6Very high93Very high20 Ų2064.3 Ų64.38%0.07532%0.318CS..THydrogen-bonded Turntrans-61.7127.9-178.7-177.5173.6168.470.73.9111.2R71 L72 H76 M143 T146 T147 Y151R71-R74 WeakPolarHBondContact O-CB 3.5Å; R71-R74 PolarHBondContact O-N 3.34Å; L72-R74 VanDerWaalsContact C-N 3.32Å; L72-R74 PolarHBondContact O-N 3.22Å; R74-H76 VanDerWaalsContact C-N 3.28Å; R74-M143 WeakPolarHBondContact CD-O 3.45Å; R74-M143 HydrophobicContact CG-CB 4.39Å; R74-M143 WeakPolarHBondContact CG-O 3.34Å; R74-M143 PolarHBondContact NE-O 3.22Å; R74-T146 WeakPolarHBondContact CD-O 3.36Å; R74-T146 PolarHBondContact NE-O 3.49Å; R74-T146 PolarHBondContact NH2-OG1 2.86Å; R74-T147 PolarHBondContact NH2-O 3.08Å; R74-Y151 VanDerWaalsContact CZ-O 3.22Å; R74-Y151 PolarHBondContact NH1-O 3.12Å; R74-Y151 PolarHBondContact NH2-O 3.24Å
75G91.7Very high93Very high3 Ų364.7 Ų64.73%0.03132%0.32CS..THydrogen-bonded Turntrans84.8-7.3-173.800000114.1W73 T77 A78 T79W73-G75 PolarHBondContact O-N 3.07Å; G75-T77 VanDerWaalsContact C-N 3.26Å; G75-T77 PolarHBondContact O-N 3.43Å; G75-A78 WeakPolarHBondContact O-CB 3.38Å; G75-A78 PolarHBondContact O-N 3.36Å; G75-T79 PolarHBondContact O-N 3.38Å
76H93.7Very high93.1Very high18 Ų1861.3 Ų61.38%0.08330%0.302CS..Hα-helixtrans-63.5-33.9174.1-174.250.3000112.2T32 A35 W73 R74 A78 T79 L80T32-H76 VanDerWaalsContact CA-NE2 3.34Å; T32-H76 WeakPolarHBondContact CA-NE2 3.36Å; T32-H76 PolarHBondContact OG1-NE2 3.31Å; A35-H76 HydrophobicContact CB-CB 4.06Å; W73-H76 HydrophobicContact CB-CB 4.2Å; W73-H76 AromaticContact CD1-CD2 3.97Å; W73-H76 WeakPolarHBondContact O-CB 3.39Å; W73-H76 PolarHBondContact O-N 3.14Å; R74-H76 VanDerWaalsContact C-N 3.28Å; H76-A78 PolarHBondContact O-N 2.91Å; H76-T79 WeakPolarHBondContact O-CA 3.38Å; H76-T79 VanDerWaalsContact O-CB 3.26Å; H76-T79 WeakPolarHBondContact O-CB 3.27Å; H76-T79 PolarHBondContact O-N 3.42Å; H76-L80 PolarHBondContact O-N 3.15Å
77T92Very high93.1Very high82 Ų8256.6 Ų56.650%0.50329%0.285SS..Hα-helixtrans-55.4-39.1173.752.60000112.3G75 T79 L80 A81G75-T77 VanDerWaalsContact C-N 3.26Å; G75-T77 PolarHBondContact O-N 3.43Å; T77-T79 VanDerWaalsContact C-N 3.31Å; T77-T79 PolarHBondContact O-N 3.09Å; T77-L80 PolarHBondContact O-N 2.93Å; T77-A81 WeakPolarHBondContact O-CB 3.36Å; T77-A81 PolarHBondContact O-N 3.42Å
78A93.6Very high93.4Very high1 Ų156.4 Ų56.41%0.00829%0.293CS..Hα-helixtrans-65.8-34.4174.300000112.3G75 H76 R82 R140 L154G75-A78 WeakPolarHBondContact O-CB 3.38Å; G75-A78 PolarHBondContact O-N 3.36Å; H76-A78 PolarHBondContact O-N 2.91Å; A78-R82 WeakPolarHBondContact O-CB 3.38Å; A78-R82 PolarHBondContact O-N 2.91Å; A78-R140 HydrophobicContact CB-CB 3.77Å; A78-R140 HydrophobicContact CB-CG 4.46Å; A78-L154 HydrophobicContact CB-CD1 3.69Å; A78-L154 HydrophobicContact CB-CD2 4.29Å
79T93.6Very high93.6Very high5 Ų557.4 Ų57.43%0.03129%0.291CS..Hα-helixtrans-67.7-44.3176.5-56.40000111.2K31 G75 H76 T77 R82 I83 R140K31-T79 HydrophobicContact CD-CG2 4.2Å; G75-T79 PolarHBondContact O-N 3.38Å; H76-T79 WeakPolarHBondContact O-CA 3.38Å; H76-T79 VanDerWaalsContact O-CB 3.26Å; H76-T79 WeakPolarHBondContact O-CB 3.27Å; H76-T79 PolarHBondContact O-N 3.42Å; T77-T79 VanDerWaalsContact C-N 3.31Å; T77-T79 PolarHBondContact O-N 3.09Å; T79-R82 PolarHBondContact O-N 3.12Å; T79-I83 WeakPolarHBondContact O-CG1 3.37Å; T79-R140 VanDerWaalsContact OG1-CD 3.26Å; T79-R140 WeakPolarHBondContact OG1-CD 3.49Å; T79-R140 PolarHBondContact OG1-NE 3.46Å; T79-R140 VanDerWaalsContact OG1-NE 3.16Å; T79-R140 PolarHBondContact OG1-NH1 2.9Å
80L94.2Very high93.9Very high57 Ų5754.8 Ų54.830%0.29828%0.28SS..Hα-helixtrans-69.1-44.7177.5-64.9-179.1000111.7C28 H76 T77 R82 I83C28-L80 HydrophobicContact CB-CD2 4.28Å; H76-L80 PolarHBondContact O-N 3.15Å; T77-L80 PolarHBondContact O-N 2.93Å; L80-R82 PolarHBondContact O-N 3.04Å; L80-R82 VanDerWaalsContact O-N 3.1Å; L80-I83 HydrophobicContact CD2-CD1 3.89Å; L80-I83 PolarHBondContact O-N 2.77Å
81A94Very high94Very high43 Ų4355.8 Ų55.836%0.35528%0.277SS..Hα-helixtrans-59.3-23.217700000112.8T77 P85 L136 L154T77-A81 WeakPolarHBondContact O-CB 3.36Å; T77-A81 PolarHBondContact O-N 3.42Å; A81-P85 WeakPolarHBondContact O-CD 3.43Å; A81-P85 VanDerWaalsContact O-CG 3.29Å; A81-P85 WeakPolarHBondContact O-CG 3.34Å; A81-L136 HydrophobicContact CB-CD2 4.38Å; A81-L154 HydrophobicContact CB-CD2 3.87Å
82R94.3Very high94.2Very high49 Ų4954.9 Ų54.919%0.18529%0.287CS..Hα-helixtrans-80.3-25.9176.5-173.1164.372.774.8-3113.8A78 T79 L80 F84 Y86 T133 L136 D137A78-R82 WeakPolarHBondContact O-CB 3.38Å; A78-R82 PolarHBondContact O-N 2.91Å; T79-R82 PolarHBondContact O-N 3.12Å; L80-R82 PolarHBondContact O-N 3.04Å; L80-R82 VanDerWaalsContact O-N 3.1Å; R82-F84 PolarHBondContact O-N 3.11Å; R82-Y86 WeakPolarHBondContact O-CB 3.35Å; R82-Y86 PolarHBondContact O-N 2.97Å; R82-T133 HydrophobicContact CG-CG2 4.33Å; R82-L136 HydrophobicContact CB-CB 4.39Å; R82-L136 HydrophobicContact CB-CD1 3.86Å; R82-L136 HydrophobicContact CG-CD1 4.27Å; R82-D137 WeakPolarHBondContact CD-OD1 3.3Å; R82-D137 IonicContact CZ-OD1 2.76Å; R82-D137 IonicContact NE-OD1 2.77Å; R82-D137 PolarHBondContact NE-OD1 3.22Å; R82-D137 IonicContact NE-OD2 2.77Å; R82-D137 IonicContact NH2-OD1 3.91Å
83I92.1Very high94.3Very high41 Ų4154.9 Ų54.921%0.2129%0.289CS..Hα-helixtrans-59-55.4-170.4-65.5172.9000111.2K31 T79 L80 S87K31-I83 HydrophobicContact CD-CD1 4.24Å; T79-I83 WeakPolarHBondContact O-CG1 3.37Å; L80-I83 HydrophobicContact CD2-CD1 3.89Å; L80-I83 PolarHBondContact O-N 2.77Å; I83-S87 PolarHBondContact O-N 2.86Å; I83-S87 PolarHBondContact O-OG 3.05Å
84F90.3Very high94.3Very high168 Ų16854.6 Ų54.674%0.73729%0.29SS*.Hα-helixtrans-66.9-51.5-177.3-69.8-77.6000113.4R82 Y86 S87 A88R82-F84 PolarHBondContact O-N 3.11Å; F84-Y86 VanDerWaalsContact C-N 3.3Å; F84-Y86 PolarHBondContact O-N 2.9Å; F84-S87 PolarHBondContact O-N 3.2Å; F84-A88 WeakPolarHBondContact O-CB 3.26Å; F84-A88 PolarHBondContact O-N 2.84Å
85P94.6Very high94.4Very high52 Ų5258.1 Ų58.134%0.33831%0.31SS..Hα-helixtrans-62-37.7179.5-24.636.2000112.8A81 A88 I89 T133A81-P85 WeakPolarHBondContact O-CD 3.43Å; A81-P85 VanDerWaalsContact O-CG 3.29Å; A81-P85 WeakPolarHBondContact O-CG 3.34Å; P85-A88 PolarHBondContact O-N 2.71Å; P85-I89 WeakPolarHBondContact O-CB 3.38Å; P85-I89 WeakPolarHBondContact O-CD1 3.19Å; P85-I89 WeakPolarHBondContact O-CG1 3.37Å; P85-I89 PolarHBondContact O-N 2.84Å; P85-T133 HydrophobicContact CB-CG2 4.15Å
86Y95.4Very high94.6Very high62 Ų6263.7 Ų63.724%0.24334%0.335CS..Hα-helixtrans-59.9-52.2177.4178.3-96.5000111R82 F84 Q90 S129 V130R82-Y86 WeakPolarHBondContact O-CB 3.35Å; R82-Y86 PolarHBondContact O-N 2.97Å; F84-Y86 VanDerWaalsContact C-N 3.3Å; F84-Y86 PolarHBondContact O-N 2.9Å; Y86-Q90 WeakPolarHBondContact O-CB 3.45Å; Y86-Q90 PolarHBondContact O-N 3.26Å; Y86-S129 WeakPolarHBondContact CE2-OG 3.32Å; Y86-V130 HydrophobicContact CE2-CG2 4Å
87S93.4Very high94.7Very high46 Ų4666.1 Ų66.132%0.32234%0.344SS..Hα-helixtrans-62.8-46.7178.4-66.90000111.9I83 F84 I89 Q90 Y91I83-S87 PolarHBondContact O-N 2.86Å; I83-S87 PolarHBondContact O-OG 3.05Å; F84-S87 PolarHBondContact O-N 3.2Å; S87-I89 PolarHBondContact O-N 3.46Å; S87-Q90 PolarHBondContact O-N 2.86Å; S87-Y91 WeakPolarHBondContact O-CD2 3.15Å; S87-Y91 PolarHBondContact O-N 3.4Å
88A95.7Very high94.8Very high55 Ų5564.9 Ų64.946%0.45533%0.332SS..Hα-helixtrans-57.6-51.5179.700000111.7F84 P85 Q90 Y91 S92F84-A88 WeakPolarHBondContact O-CB 3.26Å; F84-A88 PolarHBondContact O-N 2.84Å; P85-A88 PolarHBondContact O-N 2.71Å; A88-Q90 VanDerWaalsContact C-N 3.34Å; A88-Q90 PolarHBondContact O-N 3Å; A88-Y91 PolarHBondContact O-N 3.4Å; A88-S92 WeakPolarHBondContact O-CB 3.35Å; A88-S92 PolarHBondContact O-N 3.47Å; A88-S92 PolarHBondContact O-OG 2.87Å; A88-S92 VanDerWaalsContact O-OG 3.11Å
89I97.3Very high94.7Very high50 Ų5071.9 Ų71.926%0.25636%0.364SS..Hα-helixtrans-64.9-40.7179.8-64.1167.7000110.6P85 S87 Y91 A93 T128 C132 T133P85-I89 WeakPolarHBondContact O-CB 3.38Å; P85-I89 WeakPolarHBondContact O-CD1 3.19Å; P85-I89 WeakPolarHBondContact O-CG1 3.37Å; P85-I89 PolarHBondContact O-N 2.84Å; S87-I89 PolarHBondContact O-N 3.46Å; I89-Y91 PolarHBondContact O-N 2.95Å; I89-A93 WeakPolarHBondContact O-CB 3.48Å; I89-A93 PolarHBondContact O-N 3.06Å; I89-T128 HydrophobicContact CG2-CG2 4.13Å; I89-C132 HydrophobicContact CD1-CB 3.58Å; I89-C132 HydrophobicContact CG2-CB 4.41Å; I89-T133 HydrophobicContact CD1-CG2 4.26Å
90Q96.9Very high94.6Very high65 Ų6577.2 Ų77.230%0.30439%0.392SS..Hα-helixtrans-61.5-46.1178.8-173.4178.8-1.800111.4Y86 S87 A88 H94 A125Y86-Q90 WeakPolarHBondContact O-CB 3.45Å; Y86-Q90 PolarHBondContact O-N 3.26Å; S87-Q90 PolarHBondContact O-N 2.86Å; A88-Q90 VanDerWaalsContact C-N 3.34Å; A88-Q90 PolarHBondContact O-N 3Å; Q90-H94 WeakPolarHBondContact O-CB 3.49Å; Q90-H94 PolarHBondContact O-N 3.37Å; Q90-A125 HydrophobicContact CG-CB 4.47Å
91Y95.3Very high94.5Very high171 Ų17177 Ų7767%0.67139%0.39SS*.Hα-helixtrans-67.6-46.4178.4-73.6-64000112.2S87 A88 I89 H94 D95S87-Y91 WeakPolarHBondContact O-CD2 3.15Å; S87-Y91 PolarHBondContact O-N 3.4Å; A88-Y91 PolarHBondContact O-N 3.4Å; I89-Y91 PolarHBondContact O-N 2.95Å; Y91-H94 PolarHBondContact O-N 3.1Å; Y91-D95 PolarHBondContact O-N 3.28Å
92S96.9Very high94.1Very high85 Ų8576 Ų7659%0.59439%0.385SS*.Hα-helixtrans-62.1-45.1177.9-62.70000112.2A88 D95 H96A88-S92 WeakPolarHBondContact O-CB 3.35Å; A88-S92 PolarHBondContact O-N 3.47Å; A88-S92 PolarHBondContact O-OG 2.87Å; A88-S92 VanDerWaalsContact O-OG 3.11Å; S92-D95 PolarHBondContact O-N 2.96Å; S92-H96 WeakPolarHBondContact O-CB 3.44Å; S92-H96 PolarHBondContact O-N 3.32Å
93A97.2Very high93.5Very high13 Ų1374.8 Ų74.811%0.10738%0.382CS..Hα-helixtrans-65.7-40.6177.100000111.3I89 D95 H96 Y97 A125 T128I89-A93 WeakPolarHBondContact O-CB 3.48Å; I89-A93 PolarHBondContact O-N 3.06Å; A93-D95 VanDerWaalsContact C-N 3.31Å; A93-D95 PolarHBondContact O-N 2.89Å; A93-H96 PolarHBondContact O-N 3.13Å; A93-Y97 HydrophobicContact CB-CD2 4.31Å; A93-Y97 HydrophobicContact CB-CE2 4.06Å; A93-Y97 WeakPolarHBondContact O-CD2 3.46Å; A93-Y97 PolarHBondContact O-N 3.17Å; A93-A125 HydrophobicContact CB-CB 4.17Å; A93-T128 HydrophobicContact CB-CG2 4.15Å
94H96.2Very high92.5Very high60 Ų6077.7 Ų77.728%0.27841%0.405SS..Hα-helixtrans-61.1-42.3176.4-173.662.2000111.7Q90 Y91 Y97 K98 A121 A125Q90-H94 WeakPolarHBondContact O-CB 3.49Å; Q90-H94 PolarHBondContact O-N 3.37Å; Y91-H94 PolarHBondContact O-N 3.1Å; H94-Y97 PolarHBondContact O-N 3.46Å; H94-K98 WeakPolarHBondContact O-CE 3.48Å; H94-K98 VanDerWaalsContact O-CG 3.32Å; H94-K98 WeakPolarHBondContact O-CG 3.49Å; H94-K98 PolarHBondContact O-N 3.21Å; H94-A121 PolarHBondContact ND1-O 3.32Å; H94-A125 HydrophobicContact CB-CB 3.64Å
95D94.6Very high91.4Very high94 Ų9474.9 Ų74.950%0.50341%0.407SS..Hα-helixtrans-65.1-44.1177.1-154.255.6000112.4Y91 S92 A93 Y97 K98 H99Y91-D95 PolarHBondContact O-N 3.28Å; S92-D95 PolarHBondContact O-N 2.96Å; A93-D95 VanDerWaalsContact C-N 3.31Å; A93-D95 PolarHBondContact O-N 2.89Å; D95-Y97 PolarHBondContact O-N 3.4Å; D95-K98 PolarHBondContact O-N 3.2Å; D95-K98 VanDerWaalsContact OD1-CE 3.22Å; D95-K98 WeakPolarHBondContact OD1-CE 3.31Å; D95-K98 IonicContact OD1-NZ 2.84Å; D95-K98 PolarHBondContact OD1-NZ 2.91Å; D95-H99 PolarHBondContact O-N 3.13Å
96H95.6Very high89.8Confident121 Ų12174.6 Ų74.656%0.5640%0.404SS*.Hα-helixtrans-59.2-47.3174.7-17375.2000112.6S92 A93 K98 H99 L100S92-H96 WeakPolarHBondContact O-CB 3.44Å; S92-H96 PolarHBondContact O-N 3.32Å; A93-H96 PolarHBondContact O-N 3.13Å; H96-K98 PolarHBondContact O-N 3.24Å; H96-H99 PolarHBondContact O-N 2.99Å; H96-L100 WeakPolarHBondContact O-CB 3.36Å; H96-L100 PolarHBondContact O-N 3.24Å
97Y96Very high88.2Confident68 Ų6882.9 Ų82.927%0.26744%0.435SS..Hα-helixtrans-68.2-33.9178.7-70.1-57.3000113.1A93 H94 D95 H99 L100 L101 A125 T128A93-Y97 HydrophobicContact CB-CD2 4.31Å; A93-Y97 HydrophobicContact CB-CE2 4.06Å; A93-Y97 WeakPolarHBondContact O-CD2 3.46Å; A93-Y97 PolarHBondContact O-N 3.17Å; H94-Y97 PolarHBondContact O-N 3.46Å; D95-Y97 PolarHBondContact O-N 3.4Å; Y97-H99 VanDerWaalsContact C-N 3.32Å; Y97-L100 HydrophobicContact CD1-CD2 4.3Å; Y97-L100 PolarHBondContact O-N 3.26Å; Y97-L101 WeakPolarHBondContact O-CB 3.5Å; Y97-L101 VanDerWaalsContact O-CG 3.3Å; Y97-L101 WeakPolarHBondContact O-CG 3.27Å; Y97-L101 PolarHBondContact O-N 3.36Å; Y97-A125 HydrophobicContact CD2-CB 4.38Å; Y97-T128 PolarHBondContact OH-OG1 3.39Å
98K93Very high86.4Confident56 Ų5689.4 Ų89.424%0.24346%0.46CS..Hα-helixtrans-61.9-42.3172.7-76.9-178.5-64.3163.10111.3H94 D95 H96 G102 I103 A121H94-K98 WeakPolarHBondContact O-CE 3.48Å; H94-K98 VanDerWaalsContact O-CG 3.32Å; H94-K98 WeakPolarHBondContact O-CG 3.49Å; H94-K98 PolarHBondContact O-N 3.21Å; D95-K98 PolarHBondContact O-N 3.2Å; D95-K98 VanDerWaalsContact OD1-CE 3.22Å; D95-K98 WeakPolarHBondContact OD1-CE 3.31Å; D95-K98 IonicContact OD1-NZ 2.84Å; D95-K98 PolarHBondContact OD1-NZ 2.91Å; H96-K98 PolarHBondContact O-N 3.24Å; K98-G102 PolarHBondContact O-N 2.61Å; K98-I103 HydrophobicContact CB-CB 4.3Å; K98-I103 HydrophobicContact CB-CD1 4.33Å; K98-I103 HydrophobicContact CG-CD1 4.07Å; K98-I103 PolarHBondContact O-N 3.5Å; K98-A121 HydrophobicContact CG-CB 4.28Å
99H91.5Very high84.7Confident149 Ų14988.2 Ų88.269%0.6945%0.448SS*.Hα-helixtrans-65.7-48.7176.4-175.1-87.9000111.1D95 H96 Y97 L101 G102D95-H99 PolarHBondContact O-N 3.13Å; H96-H99 PolarHBondContact O-N 2.99Å; Y97-H99 VanDerWaalsContact C-N 3.32Å; H99-L101 VanDerWaalsContact C-N 3.29Å; H99-L101 PolarHBondContact O-N 3.27Å; H99-G102 PolarHBondContact O-N 2.79Å
100L92Very high83.5Confident117 Ų11792.2 Ų92.261%0.61347%0.466SS*.Hα-helixtrans-58.3-38.7178.5-175.364.5000112.8H96 Y97 G102H96-L100 WeakPolarHBondContact O-CB 3.36Å; H96-L100 PolarHBondContact O-N 3.24Å; Y97-L100 HydrophobicContact CD1-CD2 4.3Å; Y97-L100 PolarHBondContact O-N 3.26Å; L100-G102 VanDerWaalsContact C-N 3.29Å; L100-G102 PolarHBondContact O-N 2.77Å
101L91.1Very high82.6Confident51 Ų5194.9 Ų94.927%0.26748%0.481SS..THydrogen-bonded Turntrans-85.94.7178.1-64.2172.9000113.4Y97 H99 I103 R117 L120 A121Y97-L101 WeakPolarHBondContact O-CB 3.5Å; Y97-L101 VanDerWaalsContact O-CG 3.3Å; Y97-L101 WeakPolarHBondContact O-CG 3.27Å; Y97-L101 PolarHBondContact O-N 3.36Å; H99-L101 VanDerWaalsContact C-N 3.29Å; H99-L101 PolarHBondContact O-N 3.27Å; L101-I103 VanDerWaalsContact C-N 3.26Å; L101-I103 HydrophobicContact CB-CD1 4.27Å; L101-I103 HydrophobicContact CB-CG1 4.03Å; L101-I103 PolarHBondContact O-N 3.31Å; L101-R117 HydrophobicContact CB-CB 4.26Å; L101-R117 HydrophobicContact CB-CG 4.38Å; L101-R117 HydrophobicContact CD1-CB 4.39Å; L101-R117 VanDerWaalsContact CD1-O 3.31Å; L101-R117 WeakPolarHBondContact CD1-O 3.25Å; L101-R117 WeakPolarHBondContact O-CD 3.43Å; L101-R117 PolarHBondContact O-NH1 3.41Å; L101-L120 HydrophobicContact CD1-CB 3.94Å; L101-A121 HydrophobicContact CD1-CB 4.14Å
102G85.7Confident81.8Confident23 Ų2389.6 Ų89.624%0.23747%0.469CS..THydrogen-bonded Turntrans64.525.1177.200000114.4K98 H99 L100 S104 S105 T106K98-G102 PolarHBondContact O-N 2.61Å; H99-G102 PolarHBondContact O-N 2.79Å; L100-G102 VanDerWaalsContact C-N 3.29Å; L100-G102 PolarHBondContact O-N 2.77Å; G102-S104 VanDerWaalsContact C-N 3.3Å; G102-S104 PolarHBondContact O-N 2.92Å; G102-S105 PolarHBondContact O-N 2.71Å; G102-T106 PolarHBondContact O-OG1 3.14Å
103I82.3Confident81.2Confident24 Ų2492.2 Ų92.212%0.12347%0.467CS..THydrogen-bonded Turntrans-65.6-34.8-176.2-58.9-179.9000111.2K98 L101 R117 R118 A121K98-I103 HydrophobicContact CB-CB 4.3Å; K98-I103 HydrophobicContact CB-CD1 4.33Å; K98-I103 HydrophobicContact CG-CD1 4.07Å; K98-I103 PolarHBondContact O-N 3.5Å; L101-I103 VanDerWaalsContact C-N 3.26Å; L101-I103 HydrophobicContact CB-CD1 4.27Å; L101-I103 HydrophobicContact CB-CG1 4.03Å; L101-I103 PolarHBondContact O-N 3.31Å; I103-R117 VanDerWaalsContact CD1-C 3.49Å; I103-R117 HydrophobicContact CD1-CB 3.81Å; I103-R117 WeakPolarHBondContact CD1-O 3.48Å; I103-R117 HydrophobicContact CG1-CB 3.82Å; I103-R118 HydrophobicContact CD1-CB 4.49Å; I103-R118 HydrophobicContact CD1-CG 3.98Å; I103-R118 HydrophobicContact CG2-CG 4.03Å; I103-A121 HydrophobicContact CD1-CB 4.11Å
104S71.5Confident80.8Confident101 Ų10193.1 Ų93.171%0.70647%0.47SS*.THydrogen-bonded Turntrans-72.9-26.2179.8-53.50000113.5G102G102-S104 VanDerWaalsContact C-N 3.3Å; G102-S104 PolarHBondContact O-N 2.92Å
105S66.6Low80.4Confident109 Ų10997.2 Ų97.276%0.76248%0.483SS*.THydrogen-bonded Turntrans-92.8-12.6-171.7-166.50000114G102 R107G102-S105 PolarHBondContact O-N 2.71Å; S105-R107 PolarHBondContact O-N 3.44Å
106T61.8Low80.3Confident47 Ų4796.5 Ų96.529%0.28848%0.482SS..  trans-102.886.9-164.2-37.90000111.7G102 H108 S109G102-T106 PolarHBondContact O-OG1 3.14Å; T106-H108 VanDerWaalsContact C-N 3.26Å; T106-H108 PolarHBondContact O-N 3.2Å; T106-S109 WeakPolarHBondContact CG2-OG 3.2Å
107R61.7Low80.1Confident235 Ų23594.9 Ų94.989%0.88747%0.471SS*.SBendtrans-75.2-13.9175.5-151.4172.7-172.3163.90.6113S105S105-R107 PolarHBondContact O-N 3.44Å
108H55.3Low79.9Confident184 Ų18499 Ų9985%0.85249%0.485SS*.SBendtrans-130.810.9-168.8-72.6-18.2000116.3T106T106-H108 VanDerWaalsContact C-N 3.26Å; T106-H108 PolarHBondContact O-N 3.2Å
109S60.1Low79.9Confident30 Ų30103.2 Ų103.221%0.2150%0.504CS..SBendtrans-77.4146.9170.449.40000110.7T106 I111 I114T106-S109 WeakPolarHBondContact CG2-OG 3.2Å; S109-I111 PolarHBondContact O-N 3.27Å; S109-I114 VanDerWaalsContact OG-CD1 3.25Å; S109-I114 WeakPolarHBondContact OG-CD1 3.33Å; S109-I114 WeakPolarHBondContact OG-CG1 3.35Å
110E71.4Confident80.1Confident134 Ų134100.3 Ų100.363%0.62649%0.493SS*.  trans-50.9136.4172.4-49-178.3155.900110.3S112 Y113 I114E110-S112 PolarHBondContact O-N 3.45Å; E110-Y113 HydrophobicContact CB-CD2 4.03Å; E110-Y113 HydrophobicContact CG-CD2 4.4Å; E110-Y113 PolarHBondContact O-N 2.92Å; E110-Y113 WeakPolarHBondContact OE2-CE2 3.22Å; E110-I114 PolarHBondContact O-N 2.78Å
111I77.9Confident80.2Confident121 Ų12194.8 Ų94.862%0.62146%0.464SS*.Hα-helixtrans-52.4-30.7-174.5-57.2173.6000111.2S109 I114 R115S109-I111 PolarHBondContact O-N 3.27Å; I111-I114 PolarHBondContact O-N 3.07Å; I111-R115 VanDerWaalsContact CG2-NH1 3.25Å; I111-R115 WeakPolarHBondContact O-CG 3.19Å; I111-R115 PolarHBondContact O-N 3Å; I111-R115 VanDerWaalsContact O-N 3.14Å
112S79.3Confident80.4Confident59 Ų5993.9 Ų93.941%0.41347%0.467SS..Hα-helixtrans-62.8-48.5178.6-152.70000113.4E110 I114 R115 V116E110-S112 PolarHBondContact O-N 3.45Å; S112-I114 VanDerWaalsContact C-N 3.31Å; S112-I114 PolarHBondContact O-N 3.41Å; S112-R115 PolarHBondContact O-N 3.25Å; S112-R115 PolarHBondContact OG-NH2 3.38Å; S112-V116 PolarHBondContact O-N 2.96Å; S112-V116 VanDerWaalsContact O-N 3.15Å
113Y85Confident80.8Confident140 Ų14096 Ų9655%0.54948%0.475SS..Hα-helixtrans-63.6-38.1179-72.6-76.3000112E110 R115 V116 R117E110-Y113 HydrophobicContact CB-CD2 4.03Å; E110-Y113 HydrophobicContact CG-CD2 4.4Å; E110-Y113 PolarHBondContact O-N 2.92Å; E110-Y113 WeakPolarHBondContact OE2-CE2 3.22Å; Y113-R115 VanDerWaalsContact C-N 3.34Å; Y113-R115 PolarHBondContact O-N 3.48Å; Y113-V116 PolarHBondContact O-N 3.41Å; Y113-R117 WeakPolarHBondContact O-CG 3.42Å; Y113-R117 PolarHBondContact O-N 2.92Å
114I88Confident81.4Confident33 Ų3395.6 Ų95.617%0.16948%0.478CS..Hα-helixtrans-62.1-42.8176.5-59.4173.8000110.5S109 E110 I111 S112 R117 R118S109-I114 VanDerWaalsContact OG-CD1 3.25Å; S109-I114 WeakPolarHBondContact OG-CD1 3.33Å; S109-I114 WeakPolarHBondContact OG-CG1 3.35Å; E110-I114 PolarHBondContact O-N 2.78Å; I111-I114 PolarHBondContact O-N 3.07Å; S112-I114 VanDerWaalsContact C-N 3.31Å; S112-I114 PolarHBondContact O-N 3.41Å; I114-R117 PolarHBondContact O-N 2.82Å; I114-R118 HydrophobicContact CG2-CG 4.37Å; I114-R118 WeakPolarHBondContact O-CB 3.31Å; I114-R118 WeakPolarHBondContact O-CG 3.24Å; I114-R118 PolarHBondContact O-N 2.9Å
115R88.9Confident82.6Confident146 Ų14690.9 Ų90.955%0.55144%0.444SS*.Hα-helixtrans-61.5-45.8178.1-73.3-174.1-60.6-113.31.2111.8I111 S112 Y113 R118 F119I111-R115 VanDerWaalsContact CG2-NH1 3.25Å; I111-R115 WeakPolarHBondContact O-CG 3.19Å; I111-R115 PolarHBondContact O-N 3Å; I111-R115 VanDerWaalsContact O-N 3.14Å; S112-R115 PolarHBondContact O-N 3.25Å; S112-R115 PolarHBondContact OG-NH2 3.38Å; Y113-R115 VanDerWaalsContact C-N 3.34Å; Y113-R115 PolarHBondContact O-N 3.48Å; R115-R118 PolarHBondContact O-N 3.31Å; R115-F119 WeakPolarHBondContact O-CB 3.3Å; R115-F119 PolarHBondContact O-N 3.24Å
116V91.6Very high83.9Confident79 Ų7986.6 Ų86.648%0.47942%0.417SS..Hα-helixtrans-62-45.5177.4176.70000110.9S112 Y113 R118 F119 L120S112-V116 PolarHBondContact O-N 2.96Å; S112-V116 VanDerWaalsContact O-N 3.15Å; Y113-V116 PolarHBondContact O-N 3.41Å; V116-R118 PolarHBondContact O-N 2.94Å; V116-F119 WeakPolarHBondContact O-CB 3.26Å; V116-F119 PolarHBondContact O-N 2.96Å; V116-L120 HydrophobicContact CG1-CD1 4.16Å; V116-L120 HydrophobicContact CG1-CG 4.4Å; V116-L120 WeakPolarHBondContact O-CG 3.49Å; V116-L120 PolarHBondContact O-N 3.41Å
117R92Very high85.5Confident87 Ų8786.8 Ų86.833%0.32842%0.419SS..Hα-helixtrans-61.7-42.4177.1-70.5173.9178.9-166.811.3112.4L101 I103 Y113 I114 F119 L120 A121L101-R117 HydrophobicContact CB-CB 4.26Å; L101-R117 HydrophobicContact CB-CG 4.38Å; L101-R117 HydrophobicContact CD1-CB 4.39Å; L101-R117 VanDerWaalsContact CD1-O 3.31Å; L101-R117 WeakPolarHBondContact CD1-O 3.25Å; L101-R117 WeakPolarHBondContact O-CD 3.43Å; L101-R117 PolarHBondContact O-NH1 3.41Å; I103-R117 VanDerWaalsContact CD1-C 3.49Å; I103-R117 HydrophobicContact CD1-CB 3.81Å; I103-R117 WeakPolarHBondContact CD1-O 3.48Å; I103-R117 HydrophobicContact CG1-CB 3.82Å; Y113-R117 WeakPolarHBondContact O-CG 3.42Å; Y113-R117 PolarHBondContact O-N 2.92Å; I114-R117 PolarHBondContact O-N 2.82Å; R117-F119 VanDerWaalsContact C-N 3.33Å; R117-F119 PolarHBondContact O-N 3.4Å; R117-L120 PolarHBondContact O-N 3.38Å; R117-A121 WeakPolarHBondContact O-CB 3.24Å; R117-A121 PolarHBondContact O-N 2.9Å
118R92.1Very high87.2Confident153 Ų15377.5 Ų77.558%0.57739%0.388SS*.Hα-helixtrans-62.2-41.2175.2-75177.9-179.3-179.81.6111.8I103 I114 R115 V116 A121 G122I103-R118 HydrophobicContact CD1-CB 4.49Å; I103-R118 HydrophobicContact CD1-CG 3.98Å; I103-R118 HydrophobicContact CG2-CG 4.03Å; I114-R118 HydrophobicContact CG2-CG 4.37Å; I114-R118 WeakPolarHBondContact O-CB 3.31Å; I114-R118 WeakPolarHBondContact O-CG 3.24Å; I114-R118 PolarHBondContact O-N 2.9Å; R115-R118 PolarHBondContact O-N 3.31Å; V116-R118 PolarHBondContact O-N 2.94Å; R118-A121 PolarHBondContact O-N 3.44Å; R118-G122 PolarHBondContact O-N 3.36Å
119F92.3Very high89.2Confident145 Ų14568.8 Ų68.864%0.63635%0.348SS*.Hα-helixtrans-61.1-49.3174.6177.2-98000111.2R115 V116 R117 A121 G122 V123R115-F119 WeakPolarHBondContact O-CB 3.3Å; R115-F119 PolarHBondContact O-N 3.24Å; V116-F119 WeakPolarHBondContact O-CB 3.26Å; V116-F119 PolarHBondContact O-N 2.96Å; R117-F119 VanDerWaalsContact C-N 3.33Å; R117-F119 PolarHBondContact O-N 3.4Å; F119-A121 PolarHBondContact O-N 2.88Å; F119-G122 WeakPolarHBondContact O-CA 3.38Å; F119-G122 PolarHBondContact O-N 3.48Å; F119-G122 VanDerWaalsContact O-N 3.09Å; F119-V123 HydrophobicContact CD1-CG2 4.17Å; F119-V123 HydrophobicContact CD2-CG2 4.46Å; F119-V123 HydrophobicContact CE1-CG2 3.73Å; F119-V123 HydrophobicContact CE2-CG2 4.05Å; F119-V123 HydrophobicContact CZ-CG2 3.67Å; F119-V123 WeakPolarHBondContact O-CG2 3.41Å; F119-V123 PolarHBondContact O-N 2.99Å
120L94.9Very high90.8Very high89 Ų8968.6 Ų68.647%0.46635%0.345SS..Hα-helixtrans-60.7-41.8177.1-68.3175.9000112.4L101 V116 R117 G122 V123 G124L101-L120 HydrophobicContact CD1-CB 3.94Å; V116-L120 HydrophobicContact CG1-CD1 4.16Å; V116-L120 HydrophobicContact CG1-CG 4.4Å; V116-L120 WeakPolarHBondContact O-CG 3.49Å; V116-L120 PolarHBondContact O-N 3.41Å; R117-L120 PolarHBondContact O-N 3.38Å; L120-G122 VanDerWaalsContact C-N 3.3Å; L120-G122 PolarHBondContact O-N 3.49Å; L120-V123 PolarHBondContact O-N 3.47Å; L120-G124 PolarHBondContact O-N 2.97Å
121A94.9Very high92Very high0 Ų064.3 Ų64.30%033%0.328CS..Hα-helixtrans-62.1-37.5174.100000112.3H94 K98 L101 I103 R117 R118 F119 A125H94-A121 PolarHBondContact ND1-O 3.32Å; K98-A121 HydrophobicContact CG-CB 4.28Å; L101-A121 HydrophobicContact CD1-CB 4.14Å; I103-A121 HydrophobicContact CD1-CB 4.11Å; R117-A121 WeakPolarHBondContact O-CB 3.24Å; R117-A121 PolarHBondContact O-N 2.9Å; R118-A121 PolarHBondContact O-N 3.44Å; F119-A121 PolarHBondContact O-N 2.88Å; A121-A125 VanDerWaalsContact O-CB 3.22Å; A121-A125 WeakPolarHBondContact O-CB 3.36Å; A121-A125 PolarHBondContact O-N 3.42Å
122G94.4Very high92.9Very high32 Ų3261.9 Ų61.933%0.3332%0.321SS..Hα-helixtrans-66.9-47.9174.900000112.6R118 F119 L120 A125 G126R118-G122 PolarHBondContact O-N 3.36Å; F119-G122 WeakPolarHBondContact O-CA 3.38Å; F119-G122 PolarHBondContact O-N 3.48Å; F119-G122 VanDerWaalsContact O-N 3.09Å; L120-G122 VanDerWaalsContact C-N 3.3Å; L120-G122 PolarHBondContact O-N 3.49Å; G122-A125 PolarHBondContact O-N 3.35Å; G122-G126 PolarHBondContact O-N 3.36Å
123V94.6Very high93.7Very high67 Ų6759.2 Ų59.241%0.40630%0.303SS..Hα-helixtrans-62.8-45.1177.5172.30000111.2F119 L120 G126 T127F119-V123 HydrophobicContact CD1-CG2 4.17Å; F119-V123 HydrophobicContact CD2-CG2 4.46Å; F119-V123 HydrophobicContact CE1-CG2 3.73Å; F119-V123 HydrophobicContact CE2-CG2 4.05Å; F119-V123 HydrophobicContact CZ-CG2 3.67Å; F119-V123 WeakPolarHBondContact O-CG2 3.41Å; F119-V123 PolarHBondContact O-N 2.99Å; L120-V123 PolarHBondContact O-N 3.47Å; V123-G126 PolarHBondContact O-N 3.25Å; V123-T127 WeakPolarHBondContact O-CB 3.28Å; V123-T127 PolarHBondContact O-N 3.41Å; V123-T127 PolarHBondContact O-OG1 3.16Å
124G95.7Very high94.3Very high17 Ų1752.6 Ų52.618%0.17528%0.277CS..Hα-helixtrans-58.9-49.7175.700000111.5L120 G126 T127 T128L120-G124 PolarHBondContact O-N 2.97Å; G124-G126 PolarHBondContact O-N 2.99Å; G124-T127 PolarHBondContact O-N 3.33Å; G124-T128 WeakPolarHBondContact O-CB 3.22Å; G124-T128 PolarHBondContact O-N 2.9Å; G124-T128 PolarHBondContact O-OG1 3.23Å
125A96.4Very high94.7Very high1 Ų152 Ų521%0.00828%0.275CS..Hα-helixtrans-61.9-43.3178.200000113.3Q90 A93 H94 Y97 A121 G122 S129Q90-A125 HydrophobicContact CG-CB 4.47Å; A93-A125 HydrophobicContact CB-CB 4.17Å; H94-A125 HydrophobicContact CB-CB 3.64Å; Y97-A125 HydrophobicContact CD2-CB 4.38Å; A121-A125 VanDerWaalsContact O-CB 3.22Å; A121-A125 WeakPolarHBondContact O-CB 3.36Å; A121-A125 PolarHBondContact O-N 3.42Å; G122-A125 PolarHBondContact O-N 3.35Å; A125-S129 WeakPolarHBondContact O-CB 3.39Å; A125-S129 PolarHBondContact O-N 2.86Å; A125-S129 PolarHBondContact O-OG 3.41Å
126G94.2Very high95.1Very high19 Ų1946.4 Ų46.420%0.19626%0.256CS..Hα-helixtrans-62-45.1175.900000111.8G122 V123 G124 S129 V130G122-G126 PolarHBondContact O-N 3.36Å; V123-G126 PolarHBondContact O-N 3.25Å; G124-G126 PolarHBondContact O-N 2.99Å; G126-S129 PolarHBondContact O-OG 2.95Å; G126-V130 WeakPolarHBondContact O-CB 3.45Å; G126-V130 VanDerWaalsContact O-CG2 3.25Å; G126-V130 WeakPolarHBondContact O-CG2 3.37Å; G126-V130 PolarHBondContact O-N 3.33Å
127T95.6Very high95.3Very high52 Ų5243.1 Ų43.132%0.31924%0.236SC..Hα-helixtrans-64.9-48.1178.8-54.10000110.9V123 G124 S129 V130 T131 L178V123-T127 WeakPolarHBondContact O-CB 3.28Å; V123-T127 PolarHBondContact O-N 3.41Å; V123-T127 PolarHBondContact O-OG1 3.16Å; G124-T127 PolarHBondContact O-N 3.33Å; T127-S129 PolarHBondContact O-N 3.11Å; T127-V130 PolarHBondContact O-N 3.01Å; T127-T131 WeakPolarHBondContact O-CB 3.13Å; T127-T131 PolarHBondContact O-N 3.13Å; T127-T131 PolarHBondContact O-OG1 3.17Å; T127-L178 HydrophobicContact CG2-CD2 4.42Å
128T97Very high95.5Very high40 Ų4039 Ų3925%0.24522%0.22CC..Hα-helixtrans-60.8-46179.3-61.50000112.1I89 A93 Y97 G124 V130 T131 C132I89-T128 HydrophobicContact CG2-CG2 4.13Å; A93-T128 HydrophobicContact CB-CG2 4.15Å; Y97-T128 PolarHBondContact OH-OG1 3.39Å; G124-T128 WeakPolarHBondContact O-CB 3.22Å; G124-T128 PolarHBondContact O-N 2.9Å; G124-T128 PolarHBondContact O-OG1 3.23Å; T128-V130 PolarHBondContact O-N 3.44Å; T128-T131 PolarHBondContact O-N 3.39Å; T128-C132 PolarHBondContact O-N 3.49Å; T128-C132 PolarHBondContact O-SG 2.83Å
129S96.6Very high95.8Very high0 Ų031.7 Ų31.70%019%0.193CC..Hα-helixtrans-63.4-40.617756.20000112.8Y86 A125 G126 T127 T133Y86-S129 WeakPolarHBondContact CE2-OG 3.32Å; A125-S129 WeakPolarHBondContact O-CB 3.39Å; A125-S129 PolarHBondContact O-N 2.86Å; A125-S129 PolarHBondContact O-OG 3.41Å; G126-S129 PolarHBondContact O-OG 2.95Å; T127-S129 PolarHBondContact O-N 3.11Å; S129-T133 WeakPolarHBondContact O-CB 3.35Å; S129-T133 WeakPolarHBondContact O-CG2 3.44Å; S129-T133 PolarHBondContact O-N 3.45Å; S129-T133 VanDerWaalsContact O-N 3.16Å; S129-T133 PolarHBondContact O-OG1 3.27Å
130V95.3Very high96Very high26 Ų2626.1 Ų26.116%0.15817%0.167CC..Hα-helixtrans-63.4-49.3173.5173.80000110.3Y86 G126 T127 T128 C132 T133 Y134 F174Y86-V130 HydrophobicContact CE2-CG2 4Å; G126-V130 WeakPolarHBondContact O-CB 3.45Å; G126-V130 VanDerWaalsContact O-CG2 3.25Å; G126-V130 WeakPolarHBondContact O-CG2 3.37Å; G126-V130 PolarHBondContact O-N 3.33Å; T127-V130 PolarHBondContact O-N 3.01Å; T128-V130 PolarHBondContact O-N 3.44Å; V130-C132 PolarHBondContact O-N 3.19Å; V130-T133 CarbonylContact O-C 3.6Å; V130-T133 PolarHBondContact O-N 2.78Å; V130-Y134 HydrophobicContact CG1-CD2 4.17Å; V130-Y134 WeakPolarHBondContact O-CA 3.35Å; V130-Y134 VanDerWaalsContact O-CB 3.25Å; V130-Y134 WeakPolarHBondContact O-CB 3.33Å; V130-Y134 PolarHBondContact O-N 2.92Å; V130-F174 HydrophobicContact CG1-CE2 4.06Å
131T96.7Very high96Very high44 Ų4421.9 Ų21.927%0.2715%0.145SC..Hα-helixtrans-55.3-53.1179.1-58.30000111.7T127 T128 T133 Y134 Y171 F174T127-T131 WeakPolarHBondContact O-CB 3.13Å; T127-T131 PolarHBondContact O-N 3.13Å; T127-T131 PolarHBondContact O-OG1 3.17Å; T128-T131 PolarHBondContact O-N 3.39Å; T131-T133 VanDerWaalsContact C-N 3.27Å; T131-T133 PolarHBondContact O-N 3.03Å; T131-Y134 WeakPolarHBondContact O-CB 3.39Å; T131-Y134 PolarHBondContact O-N 3.25Å; T131-Y171 HydrophobicContact CG2-CE1 4.05Å; T131-Y171 WeakPolarHBondContact O-CE1 3.31Å; T131-F174 WeakPolarHBondContact OG1-CZ 3.48Å
132C96.6Very high96.1Very high70 Ų7021.9 Ų21.947%0.47315%0.145SC..Hα-helixtrans-65.6-29.9-177-65.30000113.3I89 T128 V130I89-C132 HydrophobicContact CD1-CB 3.58Å; I89-C132 HydrophobicContact CG2-CB 4.41Å; T128-C132 PolarHBondContact O-N 3.49Å; T128-C132 PolarHBondContact O-SG 2.83Å; V130-C132 PolarHBondContact O-N 3.19Å
133T96.3Very high96.2Very high4 Ų420.7 Ų20.73%0.02513%0.131CC..Hα-helixtrans-99.5-1.1-178.863.10000113.9R82 P85 I89 S129 V130 T131 P135 L136R82-T133 HydrophobicContact CG-CG2 4.33Å; P85-T133 HydrophobicContact CB-CG2 4.15Å; I89-T133 HydrophobicContact CD1-CG2 4.26Å; S129-T133 WeakPolarHBondContact O-CB 3.35Å; S129-T133 WeakPolarHBondContact O-CG2 3.44Å; S129-T133 PolarHBondContact O-N 3.45Å; S129-T133 VanDerWaalsContact O-N 3.16Å; S129-T133 PolarHBondContact O-OG1 3.27Å; V130-T133 CarbonylContact O-C 3.6Å; V130-T133 PolarHBondContact O-N 2.78Å; T131-T133 VanDerWaalsContact C-N 3.27Å; T131-T133 PolarHBondContact O-N 3.03Å; T133-P135 VanDerWaalsContact C-CD 3.44Å; T133-L136 WeakPolarHBondContact O-CB 3.26Å; T133-L136 PolarHBondContact O-N 3.4Å; T133-L136 VanDerWaalsContact O-N 3.13Å
134Y96.7Very high96.2Very high0 Ų017.6 Ų17.60%011%0.113CC..Hα-helixtrans-60.8-35.3-177.1-159.5-98.7000114.5V130 T131 L136 D137 V138 L170 Y171 R172 G173 F174 A177 Q246V130-Y134 HydrophobicContact CG1-CD2 4.17Å; V130-Y134 WeakPolarHBondContact O-CA 3.35Å; V130-Y134 VanDerWaalsContact O-CB 3.25Å; V130-Y134 WeakPolarHBondContact O-CB 3.33Å; V130-Y134 PolarHBondContact O-N 2.92Å; T131-Y134 WeakPolarHBondContact O-CB 3.39Å; T131-Y134 PolarHBondContact O-N 3.25Å; Y134-L136 PolarHBondContact O-N 3.16Å; Y134-L136 VanDerWaalsContact O-N 3.17Å; Y134-D137 HydrophobicContact CD2-CB 4.5Å; Y134-D137 WeakPolarHBondContact O-CA 3.26Å; Y134-D137 WeakPolarHBondContact O-CB 3.39Å; Y134-D137 PolarHBondContact O-N 3.22Å; Y134-V138 HydrophobicContact CD1-CG2 3.76Å; Y134-V138 HydrophobicContact CE1-CG2 3.39Å; Y134-V138 PolarHBondContact O-N 3.32Å; Y134-L170 VanDerWaalsContact CD1-O 3.31Å; Y134-L170 WeakPolarHBondContact CD1-O 3.27Å; Y134-Y171 HydrophobicContact CD1-CD1 4.18Å; Y134-R172 VanDerWaalsContact CE1-O 3.26Å; Y134-R172 WeakPolarHBondContact CE1-O 3.26Å; Y134-R172 PolarHBondContact OH-O 3.19Å; Y134-G173 PolarHBondContact OH-O 3.39Å; Y134-F174 HydrophobicContact CD1-CB 4.29Å; Y134-F174 HydrophobicContact CD1-CD2 4.17Å; Y134-F174 AromaticContact CD2-CD2 3.67Å; Y134-F174 HydrophobicContact CD2-CD2 3.67Å; Y134-F174 HydrophobicContact CD2-CE2 4.39Å; Y134-F174 HydrophobicContact CE1-CB 3.93Å; Y134-F174 HydrophobicContact CE1-CD2 4.47Å; Y134-F174 HydrophobicContact CE2-CB 4.36Å; Y134-F174 HydrophobicContact CE2-CD2 4Å; Y134-F174 AromaticContact CG-CD2 3.78Å; Y134-F174 HydrophobicContact CG-CD2 3.78Å; Y134-F174 PolarHBondContact OH-N 3.11Å; Y134-F174 VanDerWaalsContact OH-N 3.16Å; Y134-A177 HydrophobicContact CE2-CB 3.95Å; Y134-Q246 PolarHBondContact OH-NE2 3.3Å
135P96.9Very high96.1Very high21 Ų2118 Ų1814%0.13611%0.112CC..Hα-helixtrans-54.1-35.1173.7-29.937.6000113.7T133 V138 A139 L170T133-P135 VanDerWaalsContact C-CD 3.44Å; P135-V138 PolarHBondContact O-N 2.99Å; P135-A139 WeakPolarHBondContact O-CB 3.28Å; P135-A139 PolarHBondContact O-N 2.88Å; P135-L170 HydrophobicContact CB-CB 4.29Å; P135-L170 HydrophobicContact CB-CD2 4.25Å; P135-L170 HydrophobicContact CG-CB 4.26Å
136L96.5Very high96Very high28 Ų2818.5 Ų18.515%0.14711%0.114CC..Hα-helixtrans-67.9-36.6175.5-64.8168.1000111.7A81 R82 T133 Y134 R140 L154 I158A81-L136 HydrophobicContact CB-CD2 4.38Å; R82-L136 HydrophobicContact CB-CB 4.39Å; R82-L136 HydrophobicContact CB-CD1 3.86Å; R82-L136 HydrophobicContact CG-CD1 4.27Å; T133-L136 WeakPolarHBondContact O-CB 3.26Å; T133-L136 PolarHBondContact O-N 3.4Å; T133-L136 VanDerWaalsContact O-N 3.13Å; Y134-L136 PolarHBondContact O-N 3.16Å; Y134-L136 VanDerWaalsContact O-N 3.17Å; L136-R140 VanDerWaalsContact O-CB 3.27Å; L136-R140 WeakPolarHBondContact O-CB 3.45Å; L136-R140 PolarHBondContact O-N 3.23Å; L136-L154 HydrophobicContact CD2-CD1 4.15Å; L136-L154 HydrophobicContact CD2-CD2 3.88Å; L136-L154 HydrophobicContact CD2-CG 4.37Å; L136-I158 HydrophobicContact CD2-CD1 4.03Å
137D96Very high95.8Very high10 Ų1020.6 Ų20.65%0.05312%0.124CC..Hα-helixtrans-69-37.2177.1-88.4-6.4000112R82 Y134 A141 R242R82-D137 WeakPolarHBondContact CD-OD1 3.3Å; R82-D137 IonicContact CZ-OD1 2.76Å; R82-D137 IonicContact NE-OD1 2.77Å; R82-D137 PolarHBondContact NE-OD1 3.22Å; R82-D137 IonicContact NE-OD2 2.77Å; R82-D137 IonicContact NH2-OD1 3.91Å; Y134-D137 HydrophobicContact CD2-CB 4.5Å; Y134-D137 WeakPolarHBondContact O-CA 3.26Å; Y134-D137 WeakPolarHBondContact O-CB 3.39Å; Y134-D137 PolarHBondContact O-N 3.22Å; D137-A141 PolarHBondContact O-N 3.34Å; D137-A141 VanDerWaalsContact O-N 3.15Å; D137-R242 IonicContact OD2-CZ 3.12Å; D137-R242 IonicContact OD2-NH2 3.81Å; D137-R242 PolarHBondContact OD2-NH2 3Å
138V97.1Very high95.5Very high0 Ų019.2 Ų19.20%012%0.118CC..Hα-helixtrans-68.2-47.9173.2179.20000110.7Y134 P135 R140 A141 R142 L161 L170 Q246Y134-V138 HydrophobicContact CD1-CG2 3.76Å; Y134-V138 HydrophobicContact CE1-CG2 3.39Å; Y134-V138 PolarHBondContact O-N 3.32Å; P135-V138 PolarHBondContact O-N 2.99Å; V138-R140 VanDerWaalsContact C-N 3.29Å; V138-R140 PolarHBondContact O-N 3.48Å; V138-A141 PolarHBondContact O-N 2.88Å; V138-A141 VanDerWaalsContact O-N 3.09Å; V138-R142 HydrophobicContact CG1-CG 4.21Å; V138-R142 WeakPolarHBondContact O-CG 3.43Å; V138-R142 PolarHBondContact O-N 3.1Å; V138-L161 HydrophobicContact CG1-CD1 4.25Å; V138-L161 HydrophobicContact CG1-CD2 3.96Å; V138-L170 WeakPolarHBondContact CG2-O 3.35Å; V138-Q246 HydrophobicContact CG2-CG 4.26Å
139A96.8Very high95.1Very high0 Ų022.6 Ų22.60%014%0.143CC..Hα-helixtrans-58.2-42.8177.400000111.5P135 A141 R142 M143 L154 A157 I158 L161P135-A139 WeakPolarHBondContact O-CB 3.28Å; P135-A139 PolarHBondContact O-N 2.88Å; A139-A141 PolarHBondContact O-N 3.03Å; A139-R142 PolarHBondContact O-N 3.16Å; A139-M143 VanDerWaalsContact O-CB 3.31Å; A139-M143 WeakPolarHBondContact O-CB 3.39Å; A139-M143 WeakPolarHBondContact O-CG 3.21Å; A139-M143 PolarHBondContact O-N 3.27Å; A139-L154 HydrophobicContact CB-CD1 3.71Å; A139-A157 HydrophobicContact CB-CB 4.26Å; A139-I158 HydrophobicContact CB-CG1 3.84Å; A139-L161 HydrophobicContact CB-CD1 4.26Å
140R96.2Very high94.9Very high29 Ų2926.3 Ų26.311%0.10916%0.159CC..Hα-helixtrans-53.9-51.2172.3-179.9-172.7172.6171.81.1111.5D38 I42 A78 T79 L136 V138 M143 A144D38-R140 IonicContact OD2-CZ 3.89Å; D38-R140 IonicContact OD2-NH2 2.72Å; D38-R140 PolarHBondContact OD2-NH2 2.88Å; I42-R140 HydrophobicContact CD1-CG 4.36Å; A78-R140 HydrophobicContact CB-CB 3.77Å; A78-R140 HydrophobicContact CB-CG 4.46Å; T79-R140 VanDerWaalsContact OG1-CD 3.26Å; T79-R140 WeakPolarHBondContact OG1-CD 3.49Å; T79-R140 PolarHBondContact OG1-NE 3.46Å; T79-R140 VanDerWaalsContact OG1-NE 3.16Å; T79-R140 PolarHBondContact OG1-NH1 2.9Å; L136-R140 VanDerWaalsContact O-CB 3.27Å; L136-R140 WeakPolarHBondContact O-CB 3.45Å; L136-R140 PolarHBondContact O-N 3.23Å; V138-R140 VanDerWaalsContact C-N 3.29Å; V138-R140 PolarHBondContact O-N 3.48Å; R140-M143 PolarHBondContact O-N 3.1Å; R140-A144 WeakPolarHBondContact O-CB 3.31Å; R140-A144 PolarHBondContact O-N 2.96Å
141A96.7Very high94.7Very high0 Ų025.1 Ų25.10%015%0.151CC..Hα-helixtrans-63.6-46.3-17700000111.7I42 D137 V138 A139 M143 A144 V145 Q246 T247I42-A141 HydrophobicContact CG2-CB 4.43Å; D137-A141 PolarHBondContact O-N 3.34Å; D137-A141 VanDerWaalsContact O-N 3.15Å; V138-A141 PolarHBondContact O-N 2.88Å; V138-A141 VanDerWaalsContact O-N 3.09Å; A139-A141 PolarHBondContact O-N 3.03Å; A141-M143 PolarHBondContact O-N 2.8Å; A141-A144 PolarHBondContact O-N 2.99Å; A141-V145 WeakPolarHBondContact O-CG2 3.44Å; A141-V145 PolarHBondContact O-N 3.19Å; A141-Q246 HydrophobicContact CB-CB 3.94Å; A141-T247 HydrophobicContact CB-CG2 4.09Å
142R95.7Very high94.5Very high0 Ų026.9 Ų26.90%017%0.166CC..Hα-helixtrans-60.9-43.7176.3-67.9-74.4-163.6-168.52.3112.1V138 A139 V145 T146 Y151 L161 E165 Q246 T247 N249 I250V138-R142 HydrophobicContact CG1-CG 4.21Å; V138-R142 WeakPolarHBondContact O-CG 3.43Å; V138-R142 PolarHBondContact O-N 3.1Å; A139-R142 PolarHBondContact O-N 3.16Å; R142-V145 PolarHBondContact O-N 3.48Å; R142-T146 WeakPolarHBondContact O-CB 3.23Å; R142-T146 VanDerWaalsContact O-CG2 3.28Å; R142-T146 WeakPolarHBondContact O-CG2 3.33Å; R142-T146 PolarHBondContact O-N 3.41Å; R142-T146 VanDerWaalsContact O-N 3.11Å; R142-T146 PolarHBondContact O-OG1 2.9Å; R142-Y151 HydrophobicContact CB-CD2 4.45Å; R142-Y151 HydrophobicContact CB-CE2 3.85Å; R142-L161 HydrophobicContact CG-CD1 4.34Å; R142-L161 HydrophobicContact CG-CD2 4.18Å; R142-E165 IonicContact CZ-OE1 2.82Å; R142-E165 IonicContact CZ-OE2 3.83Å; R142-E165 IonicContact NH2-OE1 3.7Å; R142-E165 PolarHBondContact NH2-OE1 3.48Å; R142-E165 VanDerWaalsContact NH2-OE1 3.12Å; R142-E165 IonicContact NH2-OE2 3.52Å; R142-E165 PolarHBondContact NH2-OE2 3.27Å; R142-Q246 WeakPolarHBondContact CD-O 3.43Å; R142-Q246 PolarHBondContact NE-O 2.86Å; R142-T247 PolarHBondContact NH1-O 2.78Å; R142-T247 VanDerWaalsContact NH1-O 3.14Å; R142-N249 VanDerWaalsContact NH1-N 3.19Å; R142-I250 VanDerWaalsContact NH1-N 3.1Å
143M96Very high94.4Very high7 Ų726 Ų263%0.03416%0.16CC..Hα-helixtrans-67.9-35.1177.9-71.317976.400112.8R74 A139 R140 A141 V145 T146 L154 A157R74-M143 WeakPolarHBondContact CD-O 3.45Å; R74-M143 HydrophobicContact CG-CB 4.39Å; R74-M143 WeakPolarHBondContact CG-O 3.34Å; R74-M143 PolarHBondContact NE-O 3.22Å; A139-M143 VanDerWaalsContact O-CB 3.31Å; A139-M143 WeakPolarHBondContact O-CB 3.39Å; A139-M143 WeakPolarHBondContact O-CG 3.21Å; A139-M143 PolarHBondContact O-N 3.27Å; R140-M143 PolarHBondContact O-N 3.1Å; A141-M143 PolarHBondContact O-N 2.8Å; M143-V145 VanDerWaalsContact C-N 3.29Å; M143-V145 PolarHBondContact O-N 3.42Å; M143-T146 VanDerWaalsContact O-O 3.1Å; M143-L154 HydrophobicContact SD-CD1 4.37Å; M143-A157 HydrophobicContact CG-CB 3.96Å; M143-A157 HydrophobicContact SD-CB 3.97Å
144A94.7Very high94.3Very high2 Ų227.3 Ų27.32%0.01717%0.167CC..Hα-helixtrans-65.7-32.7179.300000112.9R39 I42 R140 A141R39-A144 HydrophobicContact CG-CB 4.05Å; R39-A144 PolarHBondContact NE-O 2.69Å; I42-A144 HydrophobicContact CB-CB 4.01Å; I42-A144 HydrophobicContact CD1-CB 4.39Å; I42-A144 HydrophobicContact CG2-CB 3.68Å; R140-A144 WeakPolarHBondContact O-CB 3.31Å; R140-A144 PolarHBondContact O-N 2.96Å; A141-A144 PolarHBondContact O-N 2.99Å
145V93.8Very high94.2Very high25 Ų2534.6 Ų34.615%0.15220%0.199CC..Hα-helixtrans-89.5-25.5-178.7-176.80000113I42 T47 A141 R142 M143 T247 I250I42-V145 HydrophobicContact CG2-CG2 4.4Å; T47-V145 HydrophobicContact CG2-CG1 4.18Å; A141-V145 WeakPolarHBondContact O-CG2 3.44Å; A141-V145 PolarHBondContact O-N 3.19Å; R142-V145 PolarHBondContact O-N 3.48Å; M143-V145 VanDerWaalsContact C-N 3.29Å; M143-V145 PolarHBondContact O-N 3.42Å; V145-T247 HydrophobicContact CG2-CG2 3.88Å; V145-I250 HydrophobicContact CG1-CG2 3.99Å
146T93.9Very high94.2Very high11 Ų1137.2 Ų37.27%0.06721%0.209CC..SBendtrans-98.1161.3-177.155.60000113.3R74 R142 M143 K150 Y151 I250R74-T146 WeakPolarHBondContact CD-O 3.36Å; R74-T146 PolarHBondContact NE-O 3.49Å; R74-T146 PolarHBondContact NH2-OG1 2.86Å; R142-T146 WeakPolarHBondContact O-CB 3.23Å; R142-T146 VanDerWaalsContact O-CG2 3.28Å; R142-T146 WeakPolarHBondContact O-CG2 3.33Å; R142-T146 PolarHBondContact O-N 3.41Å; R142-T146 VanDerWaalsContact O-N 3.11Å; R142-T146 PolarHBondContact O-OG1 2.9Å; M143-T146 VanDerWaalsContact O-O 3.1Å; T146-K150 HydrophobicContact CG2-CB 4.43Å; T146-K150 HydrophobicContact CG2-CG 4.27Å; T146-Y151 HydrophobicContact CG2-CD2 4.26Å; T146-Y151 HydrophobicContact CG2-CE2 4.02Å; T146-Y151 WeakPolarHBondContact OG1-CD2 3.3Å; T146-I250 HydrophobicContact CG2-CB 4.37Å; T146-I250 HydrophobicContact CG2-CD1 3.67Å; T146-I250 HydrophobicContact CG2-CG1 3.83Å; T146-I250 HydrophobicContact CG2-CG2 3.58Å
147T90.4Very high94.1Very high64 Ų6435.9 Ų35.939%0.39320%0.202SC..  trans-79167.516858.80000111.4R74 S149 K150R74-T147 PolarHBondContact NH2-O 3.08Å; T147-S149 PolarHBondContact O-N 3.41Å; T147-S149 PolarHBondContact OG1-OG 2.95Å; T147-K150 PolarHBondContact O-N 3.08Å
148A89.4Confident94.2Very high23 Ų2337.7 Ų37.719%0.1921%0.211CC..THydrogen-bonded Turntrans-67-18.918000000114.5R71 Y151 S152R71-A148 VanDerWaalsContact CZ-CB 3.44Å; R71-A148 VanDerWaalsContact NH1-CB 3.3Å; A148-Y151 CarbonylContact O-C 3.55Å; A148-Y151 VanDerWaalsContact O-C 3.32Å; A148-S152 PolarHBondContact O-N 2.97Å
149S89.3Confident94.2Very high111 Ų11145.2 Ų45.278%0.77624%0.24SC*.THydrogen-bonded Turntrans-68.5-35.1176.8550000112.6T147T147-S149 PolarHBondContact O-N 3.41Å; T147-S149 PolarHBondContact OG1-OG 2.95Å
150K91.7Very high94.1Very high78 Ų7845.4 Ų45.434%0.33924%0.242SC..THydrogen-bonded Turntrans-76.7-42.6177.3-176.860.5179164.30112.4T146 T147 E164 I250T146-K150 HydrophobicContact CG2-CB 4.43Å; T146-K150 HydrophobicContact CG2-CG 4.27Å; T147-K150 PolarHBondContact O-N 3.08Å; K150-E164 IonicContact NZ-OE1 2.79Å; K150-E164 PolarHBondContact NZ-OE1 3.36Å; K150-E164 IonicContact NZ-OE2 3.29Å; K150-E164 PolarHBondContact NZ-OE2 3.4Å; K150-I250 HydrophobicContact CG-CD1 4.46Å
151Y92.5Very high94.1Very high0 Ų044 Ų440%024%0.237CC..  trans-134109.1174.7-52.2-65.4000111.3R74 R142 T146 A148 A157 A160 I250R74-Y151 VanDerWaalsContact CZ-O 3.22Å; R74-Y151 PolarHBondContact NH1-O 3.12Å; R74-Y151 PolarHBondContact NH2-O 3.24Å; R142-Y151 HydrophobicContact CB-CD2 4.45Å; R142-Y151 HydrophobicContact CB-CE2 3.85Å; T146-Y151 HydrophobicContact CG2-CD2 4.26Å; T146-Y151 HydrophobicContact CG2-CE2 4.02Å; T146-Y151 WeakPolarHBondContact OG1-CD2 3.3Å; A148-Y151 CarbonylContact O-C 3.55Å; A148-Y151 VanDerWaalsContact O-C 3.32Å; Y151-A157 HydrophobicContact CD1-CB 4.02Å; Y151-A157 HydrophobicContact CG-CB 3.93Å; Y151-A160 HydrophobicContact CD1-CB 4.02Å; Y151-A160 HydrophobicContact CE1-CB 3.69Å; Y151-I250 HydrophobicContact CE2-CD1 4.35Å
152S91.2Very high94.1Very high81 Ų8150.5 Ų50.557%0.56626%0.262SS*.SBendtrans-73.1-42.8-176.957.30000112.9A148A148-S152 PolarHBondContact O-N 2.97Å
153S93.9Very high94.1Very high52 Ų5254.8 Ų54.836%0.36429%0.288SS..SBendtrans-135.6168.8-178.173.90000111.9H156 A157S153-H156 PolarHBondContact O-N 3.44Å; S153-H156 WeakPolarHBondContact OG-CB 3.5Å; S153-H156 PolarHBondContact OG-N 3.35Å; S153-H156 VanDerWaalsContact OG-N 3.09Å; S153-A157 WeakPolarHBondContact O-CB 3.29Å; S153-A157 PolarHBondContact O-N 2.82Å
154L94.6Very high94Very high32 Ų3259.8 Ų59.817%0.16831%0.311CS..Hα-helixtrans-60.1-45.4174.5174.657.5000111.7A78 A81 L136 A139 M143 H156 A157 I158A78-L154 HydrophobicContact CB-CD1 3.69Å; A78-L154 HydrophobicContact CB-CD2 4.29Å; A81-L154 HydrophobicContact CB-CD2 3.87Å; L136-L154 HydrophobicContact CD2-CD1 4.15Å; L136-L154 HydrophobicContact CD2-CD2 3.88Å; L136-L154 HydrophobicContact CD2-CG 4.37Å; A139-L154 HydrophobicContact CB-CD1 3.71Å; M143-L154 HydrophobicContact SD-CD1 4.37Å; L154-H156 VanDerWaalsContact C-N 3.34Å; L154-H156 PolarHBondContact O-N 2.85Å; L154-A157 WeakPolarHBondContact O-CB 3.37Å; L154-A157 PolarHBondContact O-N 3.4Å; L154-I158 HydrophobicContact CD1-CD1 3.99Å; L154-I158 HydrophobicContact CD1-CG1 4.29Å; L154-I158 HydrophobicContact CG-CD1 4.19Å; L154-I158 WeakPolarHBondContact O-CG1 3.33Å; L154-I158 PolarHBondContact O-N 2.86Å
155F95.7Very high93.9Very high153 Ų15361.2 Ų61.267%0.67132%0.318SS*.Hα-helixtrans-62.7-43.4177.6-178.1-100.3000111.3A157 I158 R159F155-A157 VanDerWaalsContact C-N 3.31Å; F155-A157 PolarHBondContact O-N 3.14Å; F155-I158 PolarHBondContact O-N 3.41Å; F155-R159 VanDerWaalsContact O-CB 3.31Å; F155-R159 WeakPolarHBondContact O-CB 3.37Å; F155-R159 PolarHBondContact O-N 2.92Å
156H95.7Very high94Very high76 Ų7661.3 Ų61.335%0.35232%0.324SS..Hα-helixtrans-61-40.8174.3-175.4-93.5000111.6S153 L154 A160S153-H156 PolarHBondContact O-N 3.44Å; S153-H156 WeakPolarHBondContact OG-CB 3.5Å; S153-H156 PolarHBondContact OG-N 3.35Å; S153-H156 VanDerWaalsContact OG-N 3.09Å; L154-H156 VanDerWaalsContact C-N 3.34Å; L154-H156 PolarHBondContact O-N 2.85Å; H156-A160 WeakPolarHBondContact O-CB 3.04Å; H156-A160 PolarHBondContact O-N 3.35Å
157A95.9Very high94Very high0 Ų065.9 Ų65.90%035%0.347CS..Hα-helixtrans-60.2-51176.600000111.9A139 M143 Y151 S153 L154 F155 A160 L161A139-A157 HydrophobicContact CB-CB 4.26Å; M143-A157 HydrophobicContact CG-CB 3.96Å; M143-A157 HydrophobicContact SD-CB 3.97Å; Y151-A157 HydrophobicContact CD1-CB 4.02Å; Y151-A157 HydrophobicContact CG-CB 3.93Å; S153-A157 WeakPolarHBondContact O-CB 3.29Å; S153-A157 PolarHBondContact O-N 2.82Å; L154-A157 WeakPolarHBondContact O-CB 3.37Å; L154-A157 PolarHBondContact O-N 3.4Å; F155-A157 VanDerWaalsContact C-N 3.31Å; F155-A157 PolarHBondContact O-N 3.14Å; A157-A160 PolarHBondContact O-N 2.71Å; A157-L161 WeakPolarHBondContact O-CB 3.42Å; A157-L161 VanDerWaalsContact O-CD1 3.28Å; A157-L161 WeakPolarHBondContact O-CD1 3.26Å; A157-L161 WeakPolarHBondContact O-CG 3.45Å; A157-L161 PolarHBondContact O-N 3.32Å
158I96.5Very high94.1Very high47 Ų4766.6 Ų66.624%0.24136%0.355CS..Hα-helixtrans-62.9-45.4179.9-65.1168.9000110.9L136 A139 L154 F155 L161 Y162 L170L136-I158 HydrophobicContact CD2-CD1 4.03Å; A139-I158 HydrophobicContact CB-CG1 3.84Å; L154-I158 HydrophobicContact CD1-CD1 3.99Å; L154-I158 HydrophobicContact CD1-CG1 4.29Å; L154-I158 HydrophobicContact CG-CD1 4.19Å; L154-I158 WeakPolarHBondContact O-CG1 3.33Å; L154-I158 PolarHBondContact O-N 2.86Å; F155-I158 PolarHBondContact O-N 3.41Å; I158-L161 WeakPolarHBondContact O-CB 3.16Å; I158-L161 PolarHBondContact O-N 3.06Å; I158-Y162 WeakPolarHBondContact O-CB 3.46Å; I158-Y162 PolarHBondContact O-N 3.07Å; I158-L170 HydrophobicContact CG2-CD2 4.25Å
159R97.2Very high94.3Very high158 Ų15865.5 Ų65.560%0.59635%0.346SS*.Hα-helixtrans-60.1-50.5177.2-177.3179.4177.1-177.3-0.2110.8F155 L161 Y162 T163F155-R159 VanDerWaalsContact O-CB 3.31Å; F155-R159 WeakPolarHBondContact O-CB 3.37Å; F155-R159 PolarHBondContact O-N 2.92Å; R159-L161 PolarHBondContact O-N 3.43Å; R159-Y162 PolarHBondContact O-N 3.3Å; R159-Y162 VanDerWaalsContact O-N 3.16Å; R159-T163 HydrophobicContact CG-CG2 4.22Å; R159-T163 WeakPolarHBondContact O-CG2 3.29Å; R159-T163 PolarHBondContact O-N 2.93Å; R159-T163 PolarHBondContact O-OG1 3.32Å
160A95.7Very high94.7Very high5 Ų560.9 Ų60.94%0.04131%0.312CS..Hα-helixtrans-62.1-41179.700000112Y151 H156 A157 Y162 T163 E164Y151-A160 HydrophobicContact CD1-CB 4.02Å; Y151-A160 HydrophobicContact CE1-CB 3.69Å; H156-A160 WeakPolarHBondContact O-CB 3.04Å; H156-A160 PolarHBondContact O-N 3.35Å; A157-A160 PolarHBondContact O-N 2.71Å; A160-Y162 VanDerWaalsContact C-N 3.34Å; A160-Y162 PolarHBondContact O-N 2.97Å; A160-T163 WeakPolarHBondContact CA-OG1 3.38Å; A160-T163 PolarHBondContact O-N 3.11Å; A160-T163 PolarHBondContact O-OG1 3.15Å; A160-E164 WeakPolarHBondContact O-CB 3.36Å; A160-E164 VanDerWaalsContact O-CG 3.3Å; A160-E164 WeakPolarHBondContact O-CG 3.39Å; A160-E164 PolarHBondContact O-N 3.07Å
161L95.4Very high94.9Very high0 Ų061.3 Ų61.30%031%0.312CS..Hα-helixtrans-55.9-48.7172-86150.5000111.5V138 A139 R142 A157 I158 R159 E165 G166 A169 L170V138-L161 HydrophobicContact CG1-CD1 4.25Å; V138-L161 HydrophobicContact CG1-CD2 3.96Å; A139-L161 HydrophobicContact CB-CD1 4.26Å; R142-L161 HydrophobicContact CG-CD1 4.34Å; R142-L161 HydrophobicContact CG-CD2 4.18Å; A157-L161 WeakPolarHBondContact O-CB 3.42Å; A157-L161 VanDerWaalsContact O-CD1 3.28Å; A157-L161 WeakPolarHBondContact O-CD1 3.26Å; A157-L161 WeakPolarHBondContact O-CG 3.45Å; A157-L161 PolarHBondContact O-N 3.32Å; I158-L161 WeakPolarHBondContact O-CB 3.16Å; I158-L161 PolarHBondContact O-N 3.06Å; R159-L161 PolarHBondContact O-N 3.43Å; L161-E165 WeakPolarHBondContact O-CB 2.99Å; L161-E165 PolarHBondContact O-N 2.9Å; L161-G166 PolarHBondContact O-N 3.34Å; L161-A169 HydrophobicContact CD2-CB 4.16Å; L161-L170 HydrophobicContact CB-CD2 3.6Å; L161-L170 HydrophobicContact CB-CG 4.49Å; L161-L170 HydrophobicContact CD1-CD2 4.15Å; L161-L170 HydrophobicContact CG-CD2 4.36Å
162Y96.6Very high95Very high135 Ų13563.8 Ų63.853%0.52932%0.322SS..Hα-helixtrans-67.2-42-179.7-179.3-104.9000112.8I158 R159 A160 G166 L167 L170I158-Y162 WeakPolarHBondContact O-CB 3.46Å; I158-Y162 PolarHBondContact O-N 3.07Å; R159-Y162 PolarHBondContact O-N 3.3Å; R159-Y162 VanDerWaalsContact O-N 3.16Å; A160-Y162 VanDerWaalsContact C-N 3.34Å; A160-Y162 PolarHBondContact O-N 2.97Å; Y162-G166 WeakPolarHBondContact O-CA 3.27Å; Y162-G166 PolarHBondContact O-N 3.44Å; Y162-G166 VanDerWaalsContact O-N 3.13Å; Y162-L167 HydrophobicContact CD2-CB 4.39Å; Y162-L167 HydrophobicContact CD2-CD1 4.26Å; Y162-L167 HydrophobicContact CE2-CB 4.14Å; Y162-L167 HydrophobicContact CE2-CD1 4.15Å; Y162-L170 HydrophobicContact CD2-CD1 4.3Å
163T96.6Very high95.2Very high91 Ų9160.1 Ų60.156%0.55830%0.297SS*.Hα-helixtrans-80.7-36-176.256.50000113.6R159 A160R159-T163 HydrophobicContact CG-CG2 4.22Å; R159-T163 WeakPolarHBondContact O-CG2 3.29Å; R159-T163 PolarHBondContact O-N 2.93Å; R159-T163 PolarHBondContact O-OG1 3.32Å; A160-T163 WeakPolarHBondContact CA-OG1 3.38Å; A160-T163 PolarHBondContact O-N 3.11Å; A160-T163 PolarHBondContact O-OG1 3.15Å
164E94.5Very high95.3Very high111 Ų11159.5 Ų59.552%0.51929%0.288SS..Hα-helixtrans-87-38.5-177.9-62.2178.6-171.300112.3K150 A160K150-E164 IonicContact NZ-OE1 2.79Å; K150-E164 PolarHBondContact NZ-OE1 3.36Å; K150-E164 IonicContact NZ-OE2 3.29Å; K150-E164 PolarHBondContact NZ-OE2 3.4Å; A160-E164 WeakPolarHBondContact O-CB 3.36Å; A160-E164 VanDerWaalsContact O-CG 3.3Å; A160-E164 WeakPolarHBondContact O-CG 3.39Å; A160-E164 PolarHBondContact O-N 3.07Å
165E92.7Very high95.4Very high33 Ų3362 Ų6215%0.15430%0.304CS..Hα-helixtrans-117.3-7-172.3-55.3-175.6-169.300113.7R142 L161 A169 R172 N249R142-E165 IonicContact CZ-OE1 2.82Å; R142-E165 IonicContact CZ-OE2 3.83Å; R142-E165 IonicContact NH2-OE1 3.7Å; R142-E165 PolarHBondContact NH2-OE1 3.48Å; R142-E165 VanDerWaalsContact NH2-OE1 3.12Å; R142-E165 IonicContact NH2-OE2 3.52Å; R142-E165 PolarHBondContact NH2-OE2 3.27Å; L161-E165 WeakPolarHBondContact O-CB 2.99Å; L161-E165 PolarHBondContact O-N 2.9Å; E165-A169 HydrophobicContact CB-CB 3.31Å; E165-A169 HydrophobicContact CG-CB 4.27Å; E165-A169 WeakPolarHBondContact OE2-CB 3.29Å; E165-R172 IonicContact OE2-CZ 2.87Å; E165-R172 IonicContact OE2-NH1 2.74Å; E165-R172 PolarHBondContact OE2-NH1 2.89Å; E165-N249 WeakPolarHBondContact CG-ND2 3.37Å; E165-N249 WeakPolarHBondContact OE1-CB 3.31Å; E165-N249 PolarHBondContact OE1-ND2 2.85Å; E165-N249 PolarHBondContact OE2-ND2 3.04Å; E165-N249 VanDerWaalsContact OE2-ND2 3.11Å
166G94Very high95.4Very high27 Ų2754.7 Ų54.728%0.27827%0.272SS..  trans81.8179.4-179.300000114.8L161 Y162 S168 A169L161-G166 PolarHBondContact O-N 3.34Å; Y162-G166 WeakPolarHBondContact O-CA 3.27Å; Y162-G166 PolarHBondContact O-N 3.44Å; Y162-G166 VanDerWaalsContact O-N 3.13Å; G166-S168 VanDerWaalsContact C-N 3.29Å; G166-S168 PolarHBondContact O-N 2.94Å; G166-A169 WeakPolarHBondContact O-CB 3.5Å; G166-A169 PolarHBondContact O-N 3.35Å
167L94.7Very high95.4Very high107 Ų10751.6 Ų51.656%0.5626%0.26SS*.G310 helixtrans-62.1-34.7-177.3-174.464.6000113Y162 A169 L170 Y171Y162-L167 HydrophobicContact CD2-CB 4.39Å; Y162-L167 HydrophobicContact CD2-CD1 4.26Å; Y162-L167 HydrophobicContact CE2-CB 4.14Å; Y162-L167 HydrophobicContact CE2-CD1 4.15Å; L167-A169 PolarHBondContact O-N 2.58Å; L167-L170 HydrophobicContact CD1-CD1 4.24Å; L167-L170 PolarHBondContact O-N 2.93Å; L167-L170 VanDerWaalsContact O-N 3.16Å; L167-Y171 HydrophobicContact CD1-CE2 4.29Å
168S93Very high95.4Very high79 Ų7953.9 Ų53.955%0.55227%0.272SS*.G310 helixtrans-60.3-31.1-179.866.10000112.1G166 L170 Y171 R172G166-S168 VanDerWaalsContact C-N 3.29Å; G166-S168 PolarHBondContact O-N 2.94Å; S168-L170 VanDerWaalsContact C-N 3.32Å; S168-L170 PolarHBondContact O-N 3.27Å; S168-Y171 CarbonylContact O-C 3.32Å; S168-Y171 PolarHBondContact O-N 3.46Å; S168-Y171 VanDerWaalsContact O-N 3.11Å; S168-R172 PolarHBondContact O-N 3.22Å
169A94Very high95.3Very high0 Ų055.3 Ų55.30%028%0.28CS..G310 helixtrans-63.5-35.9178.700000113.3L161 E165 G166 L167 Y171 R172L161-A169 HydrophobicContact CD2-CB 4.16Å; E165-A169 HydrophobicContact CB-CB 3.31Å; E165-A169 HydrophobicContact CG-CB 4.27Å; E165-A169 WeakPolarHBondContact OE2-CB 3.29Å; G166-A169 WeakPolarHBondContact O-CB 3.5Å; G166-A169 PolarHBondContact O-N 3.35Å; L167-A169 PolarHBondContact O-N 2.58Å; A169-Y171 PolarHBondContact O-N 2.9Å; A169-R172 PolarHBondContact O-N 2.92Å
170L95.9Very high95.3Very high13 Ų1348.1 Ų48.17%0.06826%0.255CS..G310 helixtrans-66.5-15.9177-64.6178.4000113.1Y134 P135 V138 I158 L161 Y162 L167 S168Y134-L170 VanDerWaalsContact CD1-O 3.31Å; Y134-L170 WeakPolarHBondContact CD1-O 3.27Å; P135-L170 HydrophobicContact CB-CB 4.29Å; P135-L170 HydrophobicContact CB-CD2 4.25Å; P135-L170 HydrophobicContact CG-CB 4.26Å; V138-L170 WeakPolarHBondContact CG2-O 3.35Å; I158-L170 HydrophobicContact CG2-CD2 4.25Å; L161-L170 HydrophobicContact CB-CD2 3.6Å; L161-L170 HydrophobicContact CB-CG 4.49Å; L161-L170 HydrophobicContact CD1-CD2 4.15Å; L161-L170 HydrophobicContact CG-CD2 4.36Å; Y162-L170 HydrophobicContact CD2-CD1 4.3Å; L167-L170 HydrophobicContact CD1-CD1 4.24Å; L167-L170 PolarHBondContact O-N 2.93Å; L167-L170 VanDerWaalsContact O-N 3.16Å; S168-L170 VanDerWaalsContact C-N 3.32Å; S168-L170 PolarHBondContact O-N 3.27Å
171Y96.7Very high95.2Very high87 Ų8752 Ų5234%0.34127%0.273SS..G310 helixtrans-115.611.7179.6-66.6-87.1000113.5T131 Y134 L167 S168 A169 G173 F174T131-Y171 HydrophobicContact CG2-CE1 4.05Å; T131-Y171 WeakPolarHBondContact O-CE1 3.31Å; Y134-Y171 HydrophobicContact CD1-CD1 4.18Å; L167-Y171 HydrophobicContact CD1-CE2 4.29Å; S168-Y171 CarbonylContact O-C 3.32Å; S168-Y171 PolarHBondContact O-N 3.46Å; S168-Y171 VanDerWaalsContact O-N 3.11Å; A169-Y171 PolarHBondContact O-N 2.9Å; Y171-G173 PolarHBondContact O-N 3.18Å; Y171-F174 WeakPolarHBondContact O-CB 3.34Å; Y171-F174 PolarHBondContact O-N 3.13Å; Y171-F174 VanDerWaalsContact O-N 3.1Å
172R94.9Very high95.1Very high53 Ų5357.8 Ų57.820%0.230%0.303CS..THydrogen-bonded Turntrans-63.5134.3177.3-78.9175.3-179.8-171.2-16.4112Y134 E165 S168 A169 F174 Q246 N249 L257Y134-R172 VanDerWaalsContact CE1-O 3.26Å; Y134-R172 WeakPolarHBondContact CE1-O 3.26Å; Y134-R172 PolarHBondContact OH-O 3.19Å; E165-R172 IonicContact OE2-CZ 2.87Å; E165-R172 IonicContact OE2-NH1 2.74Å; E165-R172 PolarHBondContact OE2-NH1 2.89Å; S168-R172 PolarHBondContact O-N 3.22Å; A169-R172 PolarHBondContact O-N 2.92Å; R172-F174 VanDerWaalsContact C-N 3.26Å; R172-F174 PolarHBondContact O-N 2.95Å; R172-Q246 VanDerWaalsContact O-CG 3.26Å; R172-Q246 WeakPolarHBondContact O-CG 3.25Å; R172-N249 PolarHBondContact NH1-ND2 3.02Å; R172-N249 PolarHBondContact NH1-OD1 3.03Å; R172-L257 VanDerWaalsContact CZ-CD2 3.42Å
173G95.8Very high95.1Very high4 Ų453 Ų534%0.04129%0.289CS..THydrogen-bonded Turntrans74.89.8-174.900000114.5Y134 Y171 P176 A177Y134-G173 PolarHBondContact OH-O 3.39Å; Y171-G173 PolarHBondContact O-N 3.18Å; G173-P176 VanDerWaalsContact C-CD 3.44Å; G173-P176 WeakPolarHBondContact O-CD 2.88Å; G173-P176 WeakPolarHBondContact O-CG 3.4Å; G173-A177 WeakPolarHBondContact O-CB 3.48Å; G173-A177 PolarHBondContact O-N 2.83Å
174F96Very high95.1Very high39 Ų3953.5 Ų53.517%0.17128%0.281CS..Hα-helixtrans-62.7-44.2177.7-179.8-103.2000112V130 T131 Y134 Y171 R172 A177 L178V130-F174 HydrophobicContact CG1-CE2 4.06Å; T131-F174 WeakPolarHBondContact OG1-CZ 3.48Å; Y134-F174 HydrophobicContact CD1-CB 4.29Å; Y134-F174 HydrophobicContact CD1-CD2 4.17Å; Y134-F174 AromaticContact CD2-CD2 3.67Å; Y134-F174 HydrophobicContact CD2-CD2 3.67Å; Y134-F174 HydrophobicContact CD2-CE2 4.39Å; Y134-F174 HydrophobicContact CE1-CB 3.93Å; Y134-F174 HydrophobicContact CE1-CD2 4.47Å; Y134-F174 HydrophobicContact CE2-CB 4.36Å; Y134-F174 HydrophobicContact CE2-CD2 4Å; Y134-F174 AromaticContact CG-CD2 3.78Å; Y134-F174 HydrophobicContact CG-CD2 3.78Å; Y134-F174 PolarHBondContact OH-N 3.11Å; Y134-F174 VanDerWaalsContact OH-N 3.16Å; Y171-F174 WeakPolarHBondContact O-CB 3.34Å; Y171-F174 PolarHBondContact O-N 3.13Å; Y171-F174 VanDerWaalsContact O-N 3.1Å; R172-F174 VanDerWaalsContact C-N 3.26Å; R172-F174 PolarHBondContact O-N 2.95Å; F174-A177 WeakPolarHBondContact O-CA 3.43Å; F174-A177 VanDerWaalsContact O-CB 3.29Å; F174-A177 WeakPolarHBondContact O-CB 3.47Å; F174-A177 PolarHBondContact O-N 2.93Å; F174-A177 VanDerWaalsContact O-N 3.13Å; F174-L178 HydrophobicContact CD1-CD1 4.01Å; F174-L178 HydrophobicContact CD1-CG 4.35Å; F174-L178 HydrophobicContact CE1-CD1 3.28Å; F174-L178 HydrophobicContact CE1-CG 3.9Å; F174-L178 HydrophobicContact CE2-CD1 4.44Å; F174-L178 HydrophobicContact CE2-CD2 4.36Å; F174-L178 HydrophobicContact CE2-CG 4.31Å; F174-L178 HydrophobicContact CZ-CD1 3.53Å; F174-L178 HydrophobicContact CZ-CD2 4.07Å; F174-L178 HydrophobicContact CZ-CG 3.87Å; F174-L178 PolarHBondContact O-N 2.99Å
175T95.4Very high95.2Very high83 Ų8349.5 Ų49.551%0.50927%0.267SS..Hα-helixtrans-56.4-54.4177.5-48.10000113.5A177 L178 L179 V260T175-A177 PolarHBondContact O-N 2.72Å; T175-L178 PolarHBondContact O-N 3.17Å; T175-L179 HydrophobicContact CG2-CD1 4.03Å; T175-L179 HydrophobicContact CG2-CG 4.37Å; T175-L179 WeakPolarHBondContact O-CG 3.29Å; T175-L179 PolarHBondContact O-N 3.4Å; T175-V260 HydrophobicContact CG2-CG2 4.27Å
176P96.6Very high95.3Very high0 Ų050 Ų500%028%0.281CS..Hα-helixtrans-65.6-27176.827.3-35.6000112.5G173 G180 L238 V241 R242 M245 V260G173-P176 VanDerWaalsContact C-CD 3.44Å; G173-P176 WeakPolarHBondContact O-CD 2.88Å; G173-P176 WeakPolarHBondContact O-CG 3.4Å; P176-G180 PolarHBondContact O-N 3.29Å; P176-L238 HydrophobicContact CB-CD2 4.27Å; P176-V241 HydrophobicContact CB-CB 4.37Å; P176-V241 HydrophobicContact CB-CG1 4.04Å; P176-V241 HydrophobicContact CG-CG1 4.16Å; P176-R242 HydrophobicContact CB-CB 4.28Å; P176-R242 HydrophobicContact CG-CB 4Å; P176-M245 HydrophobicContact CG-SD 3.7Å; P176-V260 HydrophobicContact CB-CG1 4.27Å; P176-V260 HydrophobicContact CB-CG2 4.29Å; P176-V260 HydrophobicContact CG-CG2 4.22Å
177A95.6Very high95.5Very high11 Ų1150.9 Ų50.99%0.09128%0.281CS..Hα-helixtrans-63.3-43.9172.700000111.9Y134 G173 F174 T175 R242Y134-A177 HydrophobicContact CE2-CB 3.95Å; G173-A177 WeakPolarHBondContact O-CB 3.48Å; G173-A177 PolarHBondContact O-N 2.83Å; F174-A177 WeakPolarHBondContact O-CA 3.43Å; F174-A177 VanDerWaalsContact O-CB 3.29Å; F174-A177 WeakPolarHBondContact O-CB 3.47Å; F174-A177 PolarHBondContact O-N 2.93Å; F174-A177 VanDerWaalsContact O-N 3.13Å; T175-A177 PolarHBondContact O-N 2.72Å; A177-R242 HydrophobicContact CB-CG 4.21Å
178L94.8Very high95.7Very high49 Ų4946.5 Ų46.526%0.25726%0.26SS..Hα-helixtrans-69.9-46.4175.4-69-173000112.1T127 F174 T175 G180 I181T127-L178 HydrophobicContact CG2-CD2 4.42Å; F174-L178 HydrophobicContact CD1-CD1 4.01Å; F174-L178 HydrophobicContact CD1-CG 4.35Å; F174-L178 HydrophobicContact CE1-CD1 3.28Å; F174-L178 HydrophobicContact CE1-CG 3.9Å; F174-L178 HydrophobicContact CE2-CD1 4.44Å; F174-L178 HydrophobicContact CE2-CD2 4.36Å; F174-L178 HydrophobicContact CE2-CG 4.31Å; F174-L178 HydrophobicContact CZ-CD1 3.53Å; F174-L178 HydrophobicContact CZ-CD2 4.07Å; F174-L178 HydrophobicContact CZ-CG 3.87Å; F174-L178 PolarHBondContact O-N 2.99Å; T175-L178 PolarHBondContact O-N 3.17Å; L178-G180 PolarHBondContact O-N 3.16Å; L178-I181 HydrophobicContact CD2-CD1 4.12Å; L178-I181 WeakPolarHBondContact O-CB 3.08Å; L178-I181 PolarHBondContact O-N 2.79Å
179L95.7Very high95.8Very high77 Ų7749.4 Ų49.440%0.40326%0.263SS..Hα-helixtrans-58.8-33.7177.8-70.7175.8000111.5T175 I181 I182 P183 L238T175-L179 HydrophobicContact CG2-CD1 4.03Å; T175-L179 HydrophobicContact CG2-CG 4.37Å; T175-L179 WeakPolarHBondContact O-CG 3.29Å; T175-L179 PolarHBondContact O-N 3.4Å; L179-I181 VanDerWaalsContact C-N 3.26Å; L179-I181 PolarHBondContact O-N 3.45Å; L179-I182 PolarHBondContact O-N 3.1Å; L179-P183 WeakPolarHBondContact O-CD 3.26Å; L179-L238 HydrophobicContact CB-CD1 3.92Å; L179-L238 HydrophobicContact CB-CD2 4.42Å
180G95.6Very high96Very high7 Ų756.4 Ų56.47%0.07229%0.294CS..Hα-helixtrans-66.6-22178.100000114.5P176 L178 I182 P183 Y184 S235P176-G180 PolarHBondContact O-N 3.29Å; L178-G180 PolarHBondContact O-N 3.16Å; G180-I182 VanDerWaalsContact C-N 3.33Å; G180-I182 PolarHBondContact O-N 3.43Å; G180-P183 WeakPolarHBondContact O-CD 2.92Å; G180-P183 WeakPolarHBondContact O-CG 3.45Å; G180-Y184 VanDerWaalsContact O-CB 3.32Å; G180-Y184 WeakPolarHBondContact O-CB 3.22Å; G180-Y184 PolarHBondContact O-N 3.45Å; G180-S235 VanDerWaalsContact O-CB 3.28Å; G180-S235 WeakPolarHBondContact O-CB 3.33Å
181I93.8Very high96.1Very high85 Ų8556.6 Ų56.644%0.43630%0.295SS..Hα-helixtrans-66.7-37177.2-61.8171.2000110.7L178 L179 A185L178-I181 HydrophobicContact CD2-CD1 4.12Å; L178-I181 WeakPolarHBondContact O-CB 3.08Å; L178-I181 PolarHBondContact O-N 2.79Å; L179-I181 VanDerWaalsContact C-N 3.26Å; L179-I181 PolarHBondContact O-N 3.45Å; I181-A185 WeakPolarHBondContact O-CB 3.28Å; I181-A185 PolarHBondContact O-N 2.94Å
182I94.7Very high96.2Very high123 Ų12354.5 Ų54.563%0.63129%0.288SS*.Hα-helixtrans-62.7-57-177-59.6172.2000112.2L179 G180 Y184 A185 G186L179-I182 PolarHBondContact O-N 3.1Å; G180-I182 VanDerWaalsContact C-N 3.33Å; G180-I182 PolarHBondContact O-N 3.43Å; I182-Y184 VanDerWaalsContact C-N 3.32Å; I182-Y184 PolarHBondContact O-N 3.4Å; I182-A185 PolarHBondContact O-N 2.96Å; I182-G186 PolarHBondContact O-N 3.37Å
183P96.6Very high96.2Very high35 Ų3555.4 Ų55.423%0.22730%0.295CS..Hα-helixtrans-66-36.3178.426.2-33000111.5L179 G180 T187 A234 L238L179-P183 WeakPolarHBondContact O-CD 3.26Å; G180-P183 WeakPolarHBondContact O-CD 2.92Å; G180-P183 WeakPolarHBondContact O-CG 3.45Å; P183-T187 WeakPolarHBondContact O-CB 3.29Å; P183-T187 WeakPolarHBondContact O-CG2 3.16Å; P183-T187 PolarHBondContact O-N 2.94Å; P183-T187 PolarHBondContact O-OG1 3.4Å; P183-A234 HydrophobicContact CB-CB 4.24Å; P183-L238 HydrophobicContact CG-CD1 4.16Å
184Y96.3Very high96.3Very high101 Ų10157.9 Ų57.940%0.39631%0.309SS..Hα-helixtrans-58.5-58175.5174.9-95.8000111.2G180 I182 A188 Q232G180-Y184 VanDerWaalsContact O-CB 3.32Å; G180-Y184 WeakPolarHBondContact O-CB 3.22Å; G180-Y184 PolarHBondContact O-N 3.45Å; I182-Y184 VanDerWaalsContact C-N 3.32Å; I182-Y184 PolarHBondContact O-N 3.4Å; Y184-A188 WeakPolarHBondContact O-CB 3.21Å; Y184-A188 PolarHBondContact O-N 2.84Å; Y184-Q232 HydrophobicContact CD2-CG 4.26Å; Y184-Q232 HydrophobicContact CE2-CG 3.88Å
185A95.3Very high96.4Very high27 Ų2758.8 Ų58.822%0.22332%0.316CS..Hα-helixtrans-65-48.1-177.300000110.7I181 I182 T187 A188 F189I181-A185 WeakPolarHBondContact O-CB 3.28Å; I181-A185 PolarHBondContact O-N 2.94Å; I182-A185 PolarHBondContact O-N 2.96Å; A185-T187 PolarHBondContact O-N 3.48Å; A185-A188 PolarHBondContact O-N 3.27Å; A185-F189 HydrophobicContact CB-CD2 4.12Å; A185-F189 HydrophobicContact CB-CE2 4.17Å; A185-F189 WeakPolarHBondContact O-CB 3.17Å; A185-F189 WeakPolarHBondContact O-CD2 3.26Å; A185-F189 PolarHBondContact O-N 3.46Å
186G96.8Very high96.4Very high43 Ų4357.5 Ų57.544%0.44330%0.303SS..Hα-helixtrans-57.3-51.1-178.500000112.5I182 F190I182-G186 PolarHBondContact O-N 3.37Å; G186-F190 WeakPolarHBondContact O-CB 3.46Å; G186-F190 PolarHBondContact O-N 2.94Å
187T97.9Very high96.3Very high45 Ų4562.9 Ų62.928%0.27633%0.328SS..Hα-helixtrans-73.2-36.1-179.158.80000112.7P183 A185 T191 G231 A234P183-T187 WeakPolarHBondContact O-CB 3.29Å; P183-T187 WeakPolarHBondContact O-CG2 3.16Å; P183-T187 PolarHBondContact O-N 2.94Å; P183-T187 PolarHBondContact O-OG1 3.4Å; A185-T187 PolarHBondContact O-N 3.48Å; T187-T191 WeakPolarHBondContact O-CB 3.43Å; T187-T191 PolarHBondContact O-N 3.47Å; T187-T191 PolarHBondContact O-OG1 3.41Å; T187-G231 VanDerWaalsContact OG1-CA 3.25Å; T187-G231 WeakPolarHBondContact OG1-CA 3.18Å; T187-A234 HydrophobicContact CG2-CB 3.67Å; T187-A234 WeakPolarHBondContact OG1-CB 3.44Å
188A97.4Very high96.3Very high15 Ų1566.1 Ų66.112%0.12435%0.347CS..Hα-helixtrans-65.5-47.8175.400000111.7Y184 A185 F192 A227Y184-A188 WeakPolarHBondContact O-CB 3.21Å; Y184-A188 PolarHBondContact O-N 2.84Å; A185-A188 PolarHBondContact O-N 3.27Å; A188-F192 WeakPolarHBondContact O-CB 3.41Å; A188-F192 PolarHBondContact O-N 3.03Å; A188-A227 WeakPolarHBondContact O-CB 3.5Å
189F97Very high96.2Very high141 Ų14164.4 Ų64.462%0.61834%0.339SS*.Hα-helixtrans-64.6-46177.9-79.6-63.7000111.9A185 T191 F192 E193A185-F189 HydrophobicContact CB-CD2 4.12Å; A185-F189 HydrophobicContact CB-CE2 4.17Å; A185-F189 WeakPolarHBondContact O-CB 3.17Å; A185-F189 WeakPolarHBondContact O-CD2 3.26Å; A185-F189 PolarHBondContact O-N 3.46Å; F189-T191 PolarHBondContact O-N 3.23Å; F189-F192 PolarHBondContact O-N 2.87Å; F189-E193 WeakPolarHBondContact O-CB 3.22Å; F189-E193 WeakPolarHBondContact O-CG 3.21Å; F189-E193 PolarHBondContact O-N 2.79Å
190F97.8Very high96.2Very high146 Ų14662.2 Ų62.264%0.6433%0.327SS*.Hα-helixtrans-56.6-53176.2176.3-98.6000111.2G186 F192 E193 T194G186-F190 WeakPolarHBondContact O-CB 3.46Å; G186-F190 PolarHBondContact O-N 2.94Å; F190-F192 PolarHBondContact O-N 2.91Å; F190-E193 PolarHBondContact O-N 3.03Å; F190-T194 WeakPolarHBondContact O-CB 3.47Å; F190-T194 PolarHBondContact O-N 2.84Å; F190-T194 PolarHBondContact O-OG1 2.89Å
191T97.9Very high96Very high17 Ų1766.1 Ų66.110%0.10435%0.347CS..Hα-helixtrans-60.4-45.7179.9-56.80000111.5T187 F189 L195 V226 A227 L230T187-T191 WeakPolarHBondContact O-CB 3.43Å; T187-T191 PolarHBondContact O-N 3.47Å; T187-T191 PolarHBondContact O-OG1 3.41Å; F189-T191 PolarHBondContact O-N 3.23Å; T191-L195 HydrophobicContact CG2-CD1 3.72Å; T191-L195 HydrophobicContact CG2-CG 4.21Å; T191-L195 WeakPolarHBondContact O-CB 3.43Å; T191-L195 VanDerWaalsContact O-CG 3.24Å; T191-L195 WeakPolarHBondContact O-CG 3.23Å; T191-L195 PolarHBondContact O-N 3.02Å; T191-V226 HydrophobicContact CG2-CG1 4.12Å; T191-A227 HydrophobicContact CG2-CB 4.07Å; T191-L230 HydrophobicContact CG2-CD1 3.78Å
192F97.7Very high95.8Very high44 Ų4469.3 Ų69.319%0.19335%0.353CS..Hα-helixtrans-62.5-48.3-178.2-179.6-96.2000111.6A188 F189 F190 K196 N220 C223 A227A188-F192 WeakPolarHBondContact O-CB 3.41Å; A188-F192 PolarHBondContact O-N 3.03Å; F189-F192 PolarHBondContact O-N 2.87Å; F190-F192 PolarHBondContact O-N 2.91Å; F192-K196 HydrophobicContact CD1-CD 4.38Å; F192-K196 HydrophobicContact CE1-CD 3.67Å; F192-K196 HydrophobicContact CZ-CD 4.13Å; F192-K196 WeakPolarHBondContact O-CB 3.44Å; F192-K196 PolarHBondContact O-N 3.18Å; F192-N220 WeakPolarHBondContact CZ-OD1 3.24Å; F192-C223 HydrophobicContact CD2-CB 3.94Å; F192-C223 HydrophobicContact CE2-CB 4.01Å; F192-A227 HydrophobicContact CB-CB 3.77Å
193E96.3Very high95.7Very high71 Ų7165.6 Ų65.633%0.33233%0.334SS..Hα-helixtrans-67.1-42.9-179.5-68.7-61156.100111.5F189 F190 L195 K196 E197F189-E193 WeakPolarHBondContact O-CB 3.22Å; F189-E193 WeakPolarHBondContact O-CG 3.21Å; F189-E193 PolarHBondContact O-N 2.79Å; F190-E193 PolarHBondContact O-N 3.03Å; E193-L195 PolarHBondContact O-N 3.49Å; E193-K196 PolarHBondContact O-N 2.97Å; E193-K196 IonicContact OE1-NZ 3.95Å; E193-K196 PolarHBondContact OE1-NZ 3.35Å; E193-K196 IonicContact OE2-NZ 2.91Å; E193-K196 PolarHBondContact OE2-NZ 3.31Å; E193-E197 WeakPolarHBondContact O-CB 3.25Å; E193-E197 WeakPolarHBondContact O-CG 3.43Å; E193-E197 PolarHBondContact O-N 3.4Å
194T97.4Very high95.4Very high57 Ų5768.5 Ų68.535%0.3534%0.343SS..Hα-helixtrans-61.2-46.2176.1-58.70000112.4F190 K196 T198F190-T194 WeakPolarHBondContact O-CB 3.47Å; F190-T194 PolarHBondContact O-N 2.84Å; F190-T194 PolarHBondContact O-OG1 2.89Å; T194-K196 VanDerWaalsContact C-N 3.34Å; T194-T198 WeakPolarHBondContact O-CB 3.1Å; T194-T198 PolarHBondContact O-N 3.27Å; T194-T198 PolarHBondContact O-OG1 3.28Å
195L97.3Very high95Very high58 Ų5867 Ų6730%0.30434%0.342SS..Hα-helixtrans-66.3-39177.8-70.4177.5000111.7T191 E193 T198 C199 C223 V226T191-L195 HydrophobicContact CG2-CD1 3.72Å; T191-L195 HydrophobicContact CG2-CG 4.21Å; T191-L195 WeakPolarHBondContact O-CB 3.43Å; T191-L195 VanDerWaalsContact O-CG 3.24Å; T191-L195 WeakPolarHBondContact O-CG 3.23Å; T191-L195 PolarHBondContact O-N 3.02Å; E193-L195 PolarHBondContact O-N 3.49Å; L195-T198 PolarHBondContact O-N 3.34Å; L195-C199 WeakPolarHBondContact O-CB 3.31Å; L195-C199 PolarHBondContact O-N 3.16Å; L195-C199 PolarHBondContact O-SG 2.91Å; L195-C223 HydrophobicContact CB-CB 4.16Å; L195-V226 HydrophobicContact CD1-CB 3.91Å; L195-V226 HydrophobicContact CD1-CG1 3.82Å
196K96.1Very high94.6Very high55 Ų5572 Ų7224%0.23937%0.373CS..Hα-helixtrans-63.2-49.8177.1169.9170.5153.4-125.30111.4F192 E193 T194 T198 C199 L200 L215F192-K196 HydrophobicContact CD1-CD 4.38Å; F192-K196 HydrophobicContact CE1-CD 3.67Å; F192-K196 HydrophobicContact CZ-CD 4.13Å; F192-K196 WeakPolarHBondContact O-CB 3.44Å; F192-K196 PolarHBondContact O-N 3.18Å; E193-K196 PolarHBondContact O-N 2.97Å; E193-K196 IonicContact OE1-NZ 3.95Å; E193-K196 PolarHBondContact OE1-NZ 3.35Å; E193-K196 IonicContact OE2-NZ 2.91Å; E193-K196 PolarHBondContact OE2-NZ 3.31Å; T194-K196 VanDerWaalsContact C-N 3.34Å; K196-T198 VanDerWaalsContact C-N 3.33Å; K196-T198 PolarHBondContact O-N 2.69Å; K196-C199 PolarHBondContact O-N 3.29Å; K196-L200 HydrophobicContact CG-CD1 4.05Å; K196-L200 HydrophobicContact CG-CG 4.4Å; K196-L200 WeakPolarHBondContact O-CB 3.28Å; K196-L200 VanDerWaalsContact O-CG 3.24Å; K196-L200 WeakPolarHBondContact O-CG 3.24Å; K196-L200 PolarHBondContact O-N 2.94Å; K196-L215 HydrophobicContact CB-CD1 3.77Å; K196-L215 HydrophobicContact CD-CD1 4.17Å; K196-L215 HydrophobicContact CG-CD1 3.7Å; K196-L215 HydrophobicContact CG-CG 4.03Å
197E94.2Very high94.2Very high114 Ų11477.7 Ų77.753%0.53339%0.391SS..Hα-helixtrans-57-47.9175.8-74175.2175.100110.8E193 C199 L200 D201E193-E197 WeakPolarHBondContact O-CB 3.25Å; E193-E197 WeakPolarHBondContact O-CG 3.43Å; E193-E197 PolarHBondContact O-N 3.4Å; E197-C199 PolarHBondContact O-N 3.07Å; E197-L200 PolarHBondContact O-N 3.49Å; E197-D201 WeakPolarHBondContact O-CB 3.38Å; E197-D201 PolarHBondContact O-N 2.93Å
198T94.8Very high93.8Very high79 Ų7979.5 Ų79.549%0.48540%0.402SS..Hα-helixtrans-60.1-42.5178.3-53.50000112.7T194 L195 K196 R202T194-T198 WeakPolarHBondContact O-CB 3.1Å; T194-T198 PolarHBondContact O-N 3.27Å; T194-T198 PolarHBondContact O-OG1 3.28Å; L195-T198 PolarHBondContact O-N 3.34Å; K196-T198 VanDerWaalsContact C-N 3.33Å; K196-T198 PolarHBondContact O-N 2.69Å; T198-R202 WeakPolarHBondContact O-CB 3.45Å; T198-R202 PolarHBondContact O-N 3.47Å
199C94.3Very high93.3Very high13 Ų1381.1 Ų81.19%0.08842%0.42CS..Hα-helixtrans-72.1-38.8179.1-68.50000112L195 K196 E197 D201 R202 N203 L215L195-C199 WeakPolarHBondContact O-CB 3.31Å; L195-C199 PolarHBondContact O-N 3.16Å; L195-C199 PolarHBondContact O-SG 2.91Å; K196-C199 PolarHBondContact O-N 3.29Å; E197-C199 PolarHBondContact O-N 3.07Å; C199-D201 VanDerWaalsContact C-N 3.32Å; C199-R202 PolarHBondContact O-N 3.36Å; C199-R202 PolarHBondContact SG-NH2 3.13Å; C199-N203 WeakPolarHBondContact O-CB 3.44Å; C199-N203 PolarHBondContact O-N 3.01Å; C199-N203 PolarHBondContact O-ND2 3.01Å; C199-L215 HydrophobicContact CB-CD2 3.38Å
200L94Very high92.8Very high30 Ų3082.3 Ų82.316%0.15743%0.425CS..Hα-helixtrans-63.3-41.5174.6-70.5-179.2000111.1K196 E197 N203 K204 P212 L215K196-L200 HydrophobicContact CG-CD1 4.05Å; K196-L200 HydrophobicContact CG-CG 4.4Å; K196-L200 WeakPolarHBondContact O-CB 3.28Å; K196-L200 VanDerWaalsContact O-CG 3.24Å; K196-L200 WeakPolarHBondContact O-CG 3.24Å; K196-L200 PolarHBondContact O-N 2.94Å; E197-L200 PolarHBondContact O-N 3.49Å; L200-N203 PolarHBondContact O-N 3.42Å; L200-K204 PolarHBondContact O-N 2.72Å; L200-P212 HydrophobicContact CD2-CG 4.36Å; L200-P212 WeakPolarHBondContact CD2-O 3.27Å; L200-L215 HydrophobicContact CD2-CD2 3.93Å; L200-L215 HydrophobicContact CD2-CG 4.19Å; L200-L215 HydrophobicContact CG-CD2 4.03Å; L200-L215 HydrophobicContact CG-CG 4.41Å
201D91.8Very high92.2Very high90 Ų9077 Ų7748%0.48141%0.411SS..Hα-helixtrans-65.2-41.4176.5-75.8-14.5000112.1E197 C199 N203 K204E197-D201 WeakPolarHBondContact O-CB 3.38Å; E197-D201 PolarHBondContact O-N 2.93Å; C199-D201 VanDerWaalsContact C-N 3.32Å; D201-N203 PolarHBondContact O-N 3.45Å; D201-K204 WeakPolarHBondContact O-CB 3.24Å; D201-K204 PolarHBondContact O-N 3.34Å; D201-K204 WeakPolarHBondContact OD1-CE 2.99Å; D201-K204 IonicContact OD1-NZ 2.61Å; D201-K204 PolarHBondContact OD1-NZ 3.41Å
202R91.1Very high91.7Very high152 Ų15278.3 Ų78.357%0.57442%0.42SS*.Hα-helixtrans-60.4-34.8173.5-177.4-178.364.6-126.7-2.2112.6T198 C199 K204 E219T198-R202 WeakPolarHBondContact O-CB 3.45Å; T198-R202 PolarHBondContact O-N 3.47Å; C199-R202 PolarHBondContact O-N 3.36Å; C199-R202 PolarHBondContact SG-NH2 3.13Å; R202-K204 VanDerWaalsContact C-N 3.3Å; R202-E219 IonicContact CZ-OE1 2.73Å; R202-E219 IonicContact NH2-OE1 3.27Å; R202-E219 PolarHBondContact NH2-OE1 3.41Å
203N90.8Very high91.2Very high44 Ų4485.9 Ų85.924%0.23545%0.453CS..THydrogen-bonded Turntrans-88.95.8-177.9-64.2-19.6000113C199 L200 D201 P212 E219C199-N203 WeakPolarHBondContact O-CB 3.44Å; C199-N203 PolarHBondContact O-N 3.01Å; C199-N203 PolarHBondContact O-ND2 3.01Å; L200-N203 PolarHBondContact O-N 3.42Å; D201-N203 PolarHBondContact O-N 3.45Å; N203-P212 HydrophobicContact CB-CG 3.84Å; N203-P212 VanDerWaalsContact O-CD 3.28Å; N203-P212 WeakPolarHBondContact O-CD 3.39Å; N203-E219 VanDerWaalsContact ND2-CD 3.3Å; N203-E219 PolarHBondContact ND2-OE1 2.95Å; N203-E219 PolarHBondContact ND2-OE2 3.28Å
204K91.5Very high90.9Very high96 Ų9690.9 Ų90.942%0.41747%0.474SS..SBendtrans-72.6137.3170.6-73.7172.3-179.6168.30109.9L200 D201 R202L200-K204 PolarHBondContact O-N 2.72Å; D201-K204 WeakPolarHBondContact O-CB 3.24Å; D201-K204 PolarHBondContact O-N 3.34Å; D201-K204 WeakPolarHBondContact OD1-CE 2.99Å; D201-K204 IonicContact OD1-NZ 2.61Å; D201-K204 PolarHBondContact OD1-NZ 3.41Å; R202-K204 VanDerWaalsContact C-N 3.3Å
205D88.2Confident90.5Very high70 Ų7089.1 Ų89.137%0.37446%0.462SS..  trans-61.9125.8170.9177.3-81.1000109.8I207 T208 G209 K210D205-I207 PolarHBondContact O-N 3.36Å; D205-I207 WeakPolarHBondContact OD1-CA 3.33Å; D205-I207 WeakPolarHBondContact OD1-CB 3.18Å; D205-I207 PolarHBondContact OD1-N 3.43Å; D205-T208 VanDerWaalsContact CB-OG1 3.3Å; D205-T208 WeakPolarHBondContact CB-OG1 3.43Å; D205-T208 PolarHBondContact OD1-N 2.9Å; D205-T208 PolarHBondContact OD1-OG1 3.19Å; D205-G209 VanDerWaalsContact O-CA 3.27Å; D205-G209 WeakPolarHBondContact O-CA 3.44Å; D205-G209 PolarHBondContact O-N 3.32Å; D205-K210 WeakPolarHBondContact CB-O 3.37Å; D205-K210 PolarHBondContact N-O 3.14Å
206P87.1Confident90.3Very high132 Ų13292.9 Ų92.986%0.85747%0.473SS*.THydrogen-bonded Turntrans-62.3-24.2-174.9-24.333.2000114.7
207I87.1Confident90.1Very high162 Ų16295.7 Ų95.783%0.83150%0.497SS*.THydrogen-bonded Turntrans-93.6-44.9-173.4-58.8175.2000110.3D205D205-I207 PolarHBondContact O-N 3.36Å; D205-I207 WeakPolarHBondContact OD1-CA 3.33Å; D205-I207 WeakPolarHBondContact OD1-CB 3.18Å; D205-I207 PolarHBondContact OD1-N 3.43Å
208T89.3Confident90Very high84 Ų8497.5 Ų97.552%0.51550%0.503SS..THydrogen-bonded Turntrans-94.2-15.8-175.5650000113.4D205 K210D205-T208 VanDerWaalsContact CB-OG1 3.3Å; D205-T208 WeakPolarHBondContact CB-OG1 3.43Å; D205-T208 PolarHBondContact OD1-N 2.9Å; D205-T208 PolarHBondContact OD1-OG1 3.19Å; T208-K210 PolarHBondContact O-N 2.98Å; T208-K210 VanDerWaalsContact O-N 3.08Å; T208-K210 PolarHBondContact OG1-N 3.13Å
209G87Confident89.9Confident48 Ų4895.1 Ų95.150%0.49549%0.486SS..  trans654.1-172.600000114D205D205-G209 VanDerWaalsContact O-CA 3.27Å; D205-G209 WeakPolarHBondContact O-CA 3.44Å; D205-G209 PolarHBondContact O-N 3.32Å
210K86.4Confident89.9Confident167 Ų16798 Ų9873%0.72650%0.501SS*.  trans-84.8124.8179.9-68-179.7-178.8174.40108.8D205 T208D205-K210 WeakPolarHBondContact CB-O 3.37Å; D205-K210 PolarHBondContact N-O 3.14Å; T208-K210 PolarHBondContact O-N 2.98Å; T208-K210 VanDerWaalsContact O-N 3.08Å; T208-K210 PolarHBondContact OG1-N 3.13Å
211G85.6Confident89.8Confident33 Ų33102 Ų10234%0.3452%0.522SS..  trans-123.7171.6174.800000111.8
212P87.6Confident90Very high45 Ų45100.1 Ų100.129%0.29252%0.516SS..  trans-62.2144.7173.728.9-34.6000110.4L200 N203 K214L200-P212 HydrophobicContact CD2-CG 4.36Å; L200-P212 WeakPolarHBondContact CD2-O 3.27Å; N203-P212 HydrophobicContact CB-CG 3.84Å; N203-P212 VanDerWaalsContact O-CD 3.28Å; N203-P212 WeakPolarHBondContact O-CD 3.39Å; P212-K214 VanDerWaalsContact C-N 3.29Å
213K86.7Confident90.2Very high203 Ų20393.1 Ų93.188%0.88349%0.49SS*.SBendtrans-79.6-12.7175.9-68.1-174.3179.4-179.50113.4
214K90.4Very high90.4Very high177 Ų17792.6 Ų92.677%0.7750%0.495SS*.SBendtrans-137.4144.9-177.1-65.2-176.8-179.2179.90108.3P212P212-K214 VanDerWaalsContact C-N 3.29Å
215L89.9Confident90.5Very high20 Ų2090.5 Ų90.511%0.10550%0.495CS..  trans-62.8151.3174.9-69.8169.1000111K196 C199 L200 E219 N220 C223K196-L215 HydrophobicContact CB-CD1 3.77Å; K196-L215 HydrophobicContact CD-CD1 4.17Å; K196-L215 HydrophobicContact CG-CD1 3.7Å; K196-L215 HydrophobicContact CG-CG 4.03Å; C199-L215 HydrophobicContact CB-CD2 3.38Å; L200-L215 HydrophobicContact CD2-CD2 3.93Å; L200-L215 HydrophobicContact CD2-CG 4.19Å; L200-L215 HydrophobicContact CG-CD2 4.03Å; L200-L215 HydrophobicContact CG-CG 4.41Å; L215-E219 HydrophobicContact CB-CB 4.2Å; L215-E219 HydrophobicContact CD2-CB 4.17Å; L215-N220 HydrophobicContact CB-CB 3.93Å; L215-N220 HydrophobicContact CD1-CB 4.24Å; L215-C223 HydrophobicContact CD1-CB 4.47Å
216Y91.6Very high90.8Very high136 Ų13690.3 Ų90.353%0.53350%0.496SS..  trans-60.7148.4166.3-65.8-72.5000109.6F218 E219 N220Y216-F218 PolarHBondContact O-N 2.95Å; Y216-F218 VanDerWaalsContact O-N 3.12Å; Y216-E219 VanDerWaalsContact CD2-OE2 3.3Å; Y216-E219 WeakPolarHBondContact CD2-OE2 3.29Å; Y216-E219 PolarHBondContact N-OE2 3.32Å; Y216-E219 PolarHBondContact O-N 3.07Å; Y216-N220 PolarHBondContact O-N 2.89Å
217P92.1Very high91.3Very high114 Ų11484.2 Ų84.274%0.7446%0.457SS*.Hα-helixtrans-52.1-40.2-175.6-29.635.6000114.1L221P217-L221 WeakPolarHBondContact O-CB 3.41Å; P217-L221 PolarHBondContact O-N 3Å
218F92.5Very high91.6Very high153 Ų15377.1 Ų77.167%0.67142%0.424SS*.Hα-helixtrans-68.6-43.8177.4-175.3-102.1000112.5Y216 N220 L221 C222Y216-F218 PolarHBondContact O-N 2.95Å; Y216-F218 VanDerWaalsContact O-N 3.12Å; F218-N220 VanDerWaalsContact C-N 3.34Å; F218-N220 PolarHBondContact O-N 2.92Å; F218-L221 WeakPolarHBondContact O-CB 3.3Å; F218-L221 PolarHBondContact O-N 3.29Å; F218-C222 VanDerWaalsContact CE1-SG 3.59Å; F218-C222 PolarHBondContact O-N 3.3Å; F218-C222 PolarHBondContact O-SG 2.91Å; F218-C222 VanDerWaalsContact O-SG 3.36Å
219E93Very high91.8Very high28 Ų2876.5 Ų76.513%0.13142%0.417CS..Hα-helixtrans-61.8-43.4175.3-65.5-179.3140.200111.4R202 N203 L215 Y216 L221 C222 C223R202-E219 IonicContact CZ-OE1 2.73Å; R202-E219 IonicContact NH2-OE1 3.27Å; R202-E219 PolarHBondContact NH2-OE1 3.41Å; N203-E219 VanDerWaalsContact ND2-CD 3.3Å; N203-E219 PolarHBondContact ND2-OE1 2.95Å; N203-E219 PolarHBondContact ND2-OE2 3.28Å; L215-E219 HydrophobicContact CB-CB 4.2Å; L215-E219 HydrophobicContact CD2-CB 4.17Å; Y216-E219 VanDerWaalsContact CD2-OE2 3.3Å; Y216-E219 WeakPolarHBondContact CD2-OE2 3.29Å; Y216-E219 PolarHBondContact N-OE2 3.32Å; Y216-E219 PolarHBondContact O-N 3.07Å; E219-L221 VanDerWaalsContact C-N 3.31Å; E219-L221 PolarHBondContact O-N 2.84Å; E219-C222 PolarHBondContact O-N 2.94Å; E219-C223 WeakPolarHBondContact O-CB 3.38Å; E219-C223 PolarHBondContact O-N 3.22Å; E219-C223 PolarHBondContact O-SG 2.87Å
220N93.9Very high92.3Very high74 Ų7478.1 Ų78.140%0.39641%0.414SS..Hα-helixtrans-61-41.6176.5-170.963.7000111.7F192 L215 Y216 F218 G224F192-N220 WeakPolarHBondContact CZ-OD1 3.24Å; L215-N220 HydrophobicContact CB-CB 3.93Å; L215-N220 HydrophobicContact CD1-CB 4.24Å; Y216-N220 PolarHBondContact O-N 2.89Å; F218-N220 VanDerWaalsContact C-N 3.34Å; F218-N220 PolarHBondContact O-N 2.92Å; N220-G224 PolarHBondContact O-N 3.48Å
221L93Very high92.7Very high113 Ų11370.1 Ų70.159%0.59238%0.379SS*.Hα-helixtrans-63.2-46.9175.2-176.271.5000111.3P217 F218 E219 G224 A225P217-L221 WeakPolarHBondContact O-CB 3.41Å; P217-L221 PolarHBondContact O-N 3Å; F218-L221 WeakPolarHBondContact O-CB 3.3Å; F218-L221 PolarHBondContact O-N 3.29Å; E219-L221 VanDerWaalsContact C-N 3.31Å; E219-L221 PolarHBondContact O-N 2.84Å; L221-G224 PolarHBondContact O-N 2.97Å; L221-A225 VanDerWaalsContact O-CB 3.3Å; L221-A225 WeakPolarHBondContact O-CB 3.28Å; L221-A225 PolarHBondContact O-N 3.47Å
222C94.7Very high93.1Very high52 Ų5271.2 Ų71.235%0.35138%0.375SS..Hα-helixtrans-62.9-46.4177.7-71.10000112F218 E219 G224 A225 V226F218-C222 VanDerWaalsContact CE1-SG 3.59Å; F218-C222 PolarHBondContact O-N 3.3Å; F218-C222 PolarHBondContact O-SG 2.91Å; F218-C222 VanDerWaalsContact O-SG 3.36Å; E219-C222 PolarHBondContact O-N 2.94Å; C222-G224 VanDerWaalsContact C-N 3.32Å; C222-G224 PolarHBondContact O-N 3.32Å; C222-A225 PolarHBondContact O-N 2.9Å; C222-V226 WeakPolarHBondContact O-CG2 3.29Å; C222-V226 PolarHBondContact O-N 3.38Å
223C95.7Very high93.5Very high5 Ų570.7 Ų70.73%0.03437%0.371CS..Hα-helixtrans-59-45.7176-65.40000110.7F192 L195 L215 E219 A227F192-C223 HydrophobicContact CD2-CB 3.94Å; F192-C223 HydrophobicContact CE2-CB 4.01Å; L195-C223 HydrophobicContact CB-CB 4.16Å; L215-C223 HydrophobicContact CD1-CB 4.47Å; E219-C223 WeakPolarHBondContact O-CB 3.38Å; E219-C223 PolarHBondContact O-N 3.22Å; E219-C223 PolarHBondContact O-SG 2.87Å; C223-A227 WeakPolarHBondContact O-CB 3.31Å; C223-A227 PolarHBondContact O-N 2.93Å
224G94.6Very high94Very high33 Ų3362.9 Ų62.934%0.3434%0.344SS..Hα-helixtrans-63.4-39.9176.400000113.3N220 L221 C222 G228N220-G224 PolarHBondContact O-N 3.48Å; L221-G224 PolarHBondContact O-N 2.97Å; C222-G224 VanDerWaalsContact C-N 3.32Å; C222-G224 PolarHBondContact O-N 3.32Å; G224-G228 PolarHBondContact O-N 2.84Å
225A93.6Very high94.3Very high51 Ų5154.7 Ų54.742%0.42131%0.309SS..Hα-helixtrans-66.7-48.4178.200000111.7L221 C222 G228 I229L221-A225 VanDerWaalsContact O-CB 3.3Å; L221-A225 WeakPolarHBondContact O-CB 3.28Å; L221-A225 PolarHBondContact O-N 3.47Å; C222-A225 PolarHBondContact O-N 2.9Å; A225-G228 PolarHBondContact O-N 2.97Å; A225-I229 VanDerWaalsContact O-CG1 3.27Å; A225-I229 WeakPolarHBondContact O-CG1 3.21Å; A225-I229 PolarHBondContact O-N 3.35Å
226V95.5Very high94.6Very high66 Ų6653.7 Ų53.740%0.430%0.304SS..Hα-helixtrans-63.1-46.4177.6175.80000110.5T191 L195 C222 G228 I229 L230T191-V226 HydrophobicContact CG2-CG1 4.12Å; L195-V226 HydrophobicContact CD1-CB 3.91Å; L195-V226 HydrophobicContact CD1-CG1 3.82Å; C222-V226 WeakPolarHBondContact O-CG2 3.29Å; C222-V226 PolarHBondContact O-N 3.38Å; V226-G228 VanDerWaalsContact C-N 3.33Å; V226-G228 PolarHBondContact O-N 3.42Å; V226-I229 PolarHBondContact O-N 3.4Å; V226-L230 HydrophobicContact CG1-CD1 4.25Å; V226-L230 HydrophobicContact CG1-CG 4.42Å; V226-L230 WeakPolarHBondContact O-CG 3.34Å; V226-L230 PolarHBondContact O-N 3.28Å
227A96.9Very high94.8Very high4 Ų448.2 Ų48.23%0.03329%0.285CS..Hα-helixtrans-58.1-43.8174.800000112.6A188 T191 F192 C223 G231A188-A227 WeakPolarHBondContact O-CB 3.5Å; T191-A227 HydrophobicContact CG2-CB 4.07Å; F192-A227 HydrophobicContact CB-CB 3.77Å; C223-A227 WeakPolarHBondContact O-CB 3.31Å; C223-A227 PolarHBondContact O-N 2.93Å; A227-G231 WeakPolarHBondContact O-CA 3.45Å; A227-G231 PolarHBondContact O-N 3.27Å
228G93.7Very high95.1Very high13 Ų1344.4 Ų44.413%0.13426%0.258CS..Hα-helixtrans-66.1-35.817700000113.3G224 A225 V226 Q232G224-G228 PolarHBondContact O-N 2.84Å; A225-G228 PolarHBondContact O-N 2.97Å; V226-G228 VanDerWaalsContact C-N 3.33Å; V226-G228 PolarHBondContact O-N 3.42Å; G228-Q232 WeakPolarHBondContact O-CB 3.25Å; G228-Q232 VanDerWaalsContact O-CG 3.24Å; G228-Q232 WeakPolarHBondContact O-CG 3.47Å; G228-Q232 PolarHBondContact O-N 3.45Å; G228-Q232 PolarHBondContact O-NE2 2.94Å; G228-Q232 VanDerWaalsContact O-NE2 3.13Å
229I94.5Very high95.2Very high72 Ų7238.8 Ų38.837%0.36924%0.236SC..Hα-helixtrans-69.1-48.4176.3-71.7165.7000110.5A225 V226 Q232 T233A225-I229 VanDerWaalsContact O-CG1 3.27Å; A225-I229 WeakPolarHBondContact O-CG1 3.21Å; A225-I229 PolarHBondContact O-N 3.35Å; V226-I229 PolarHBondContact O-N 3.4Å; I229-Q232 PolarHBondContact O-N 2.92Å; I229-T233 WeakPolarHBondContact O-CB 3.46Å; I229-T233 PolarHBondContact O-N 2.94Å; I229-T233 PolarHBondContact O-OG1 3.41Å
230L95.9Very high95.4Very high81 Ų8137.5 Ų37.542%0.42423%0.229SC..Hα-helixtrans-65.7-41.1178-66.2-173.1000111.3T191 V226 Q232 T233 A234T191-L230 HydrophobicContact CG2-CD1 3.78Å; V226-L230 HydrophobicContact CG1-CD1 4.25Å; V226-L230 HydrophobicContact CG1-CG 4.42Å; V226-L230 WeakPolarHBondContact O-CG 3.34Å; V226-L230 PolarHBondContact O-N 3.28Å; L230-Q232 PolarHBondContact O-N 3.47Å; L230-T233 PolarHBondContact O-N 3.45Å; L230-A234 WeakPolarHBondContact O-CB 3.38Å; L230-A234 PolarHBondContact O-N 2.82Å
231G96.3Very high95.5Very high0 Ų034 Ų340%021%0.21CC..Hα-helixtrans-47.8-5916900000113.1T187 A227 T233 A234 S235T187-G231 VanDerWaalsContact OG1-CA 3.25Å; T187-G231 WeakPolarHBondContact OG1-CA 3.18Å; A227-G231 WeakPolarHBondContact O-CA 3.45Å; A227-G231 PolarHBondContact O-N 3.27Å; G231-T233 VanDerWaalsContact C-N 3.3Å; G231-T233 PolarHBondContact O-N 3.36Å; G231-A234 PolarHBondContact O-N 3.2Å; G231-S235 PolarHBondContact O-N 3.5Å; G231-S235 VanDerWaalsContact O-N 3.14Å; G231-S235 PolarHBondContact O-OG 2.88Å
232Q94.2Very high95.7Very high55 Ų5530 Ų3026%0.25719%0.188SC..Hα-helixtrans-63.3-37.8179.7-75.1173.569.800112.3Y184 G228 I229 L230 S235 Y236 N284Y184-Q232 HydrophobicContact CD2-CG 4.26Å; Y184-Q232 HydrophobicContact CE2-CG 3.88Å; G228-Q232 WeakPolarHBondContact O-CB 3.25Å; G228-Q232 VanDerWaalsContact O-CG 3.24Å; G228-Q232 WeakPolarHBondContact O-CG 3.47Å; G228-Q232 PolarHBondContact O-N 3.45Å; G228-Q232 PolarHBondContact O-NE2 2.94Å; G228-Q232 VanDerWaalsContact O-NE2 3.13Å; I229-Q232 PolarHBondContact O-N 2.92Å; L230-Q232 PolarHBondContact O-N 3.47Å; Q232-S235 PolarHBondContact O-N 2.96Å; Q232-S235 PolarHBondContact O-OG 3.37Å; Q232-Y236 VanDerWaalsContact O-CB 3.3Å; Q232-Y236 WeakPolarHBondContact O-CB 3.37Å; Q232-Y236 PolarHBondContact O-N 3.11Å; Q232-N284 PolarHBondContact OE1-ND2 3.47Å
233T95.3Very high95.8Very high35 Ų3528.8 Ų28.822%0.21518%0.176CC..Hα-helixtrans-64.7-43.2179-56.80000110.3I229 L230 G231 S235 Y236 Y278 L281I229-T233 WeakPolarHBondContact O-CB 3.46Å; I229-T233 PolarHBondContact O-N 2.94Å; I229-T233 PolarHBondContact O-OG1 3.41Å; L230-T233 PolarHBondContact O-N 3.45Å; G231-T233 VanDerWaalsContact C-N 3.3Å; G231-T233 PolarHBondContact O-N 3.36Å; T233-S235 PolarHBondContact O-N 2.92Å; T233-Y236 PolarHBondContact O-N 3.2Å; T233-Y278 HydrophobicContact CG2-CD1 4.41Å; T233-Y278 HydrophobicContact CG2-CE1 3.85Å; T233-Y278 VanDerWaalsContact O-CE1 3.29Å; T233-Y278 WeakPolarHBondContact O-CE1 3.45Å; T233-L281 HydrophobicContact CG2-CD2 4.01Å
234A96.3Very high95.9Very high38 Ų3828.6 Ų28.631%0.31417%0.174SC..Hα-helixtrans-65.2-37.717800000113.1P183 T187 L230 G231P183-A234 HydrophobicContact CB-CB 4.24Å; T187-A234 HydrophobicContact CG2-CB 3.67Å; T187-A234 WeakPolarHBondContact OG1-CB 3.44Å; L230-A234 WeakPolarHBondContact O-CB 3.38Å; L230-A234 PolarHBondContact O-N 2.82Å; G231-A234 PolarHBondContact O-N 3.2Å
235S96.4Very high96Very high5 Ų528.1 Ų28.14%0.03516%0.163CC..Hα-helixtrans-83.9-10.6179.166.90000114.4G180 G231 Q232 T233 L238 D239G180-S235 VanDerWaalsContact O-CB 3.28Å; G180-S235 WeakPolarHBondContact O-CB 3.33Å; G231-S235 PolarHBondContact O-N 3.5Å; G231-S235 VanDerWaalsContact O-N 3.14Å; G231-S235 PolarHBondContact O-OG 2.88Å; Q232-S235 PolarHBondContact O-N 2.96Å; Q232-S235 PolarHBondContact O-OG 3.37Å; T233-S235 PolarHBondContact O-N 2.92Å; S235-L238 PolarHBondContact O-N 3.49Å; S235-L238 VanDerWaalsContact O-N 3.14Å; S235-D239 PolarHBondContact O-N 2.81Å; S235-D239 VanDerWaalsContact O-N 3.15Å
236Y96.3Very high96.1Very high0 Ų025.7 Ų25.70%014%0.143CC..Hα-helixtrans-60.9-39.1-168.5-151.4-95.6000115.2K41 Q45 Q232 T233 L238 D239 I240 L277 Y278 K279 G280 L281 N284K41-Y236 VanDerWaalsContact CE-OH 3.3Å; K41-Y236 WeakPolarHBondContact CE-OH 3.4Å; Q45-Y236 PolarHBondContact NE2-OH 3.36Å; Q232-Y236 VanDerWaalsContact O-CB 3.3Å; Q232-Y236 WeakPolarHBondContact O-CB 3.37Å; Q232-Y236 PolarHBondContact O-N 3.11Å; T233-Y236 PolarHBondContact O-N 3.2Å; Y236-L238 VanDerWaalsContact C-N 3.26Å; Y236-L238 PolarHBondContact O-N 3.33Å; Y236-D239 WeakPolarHBondContact O-CA 3.02Å; Y236-D239 WeakPolarHBondContact O-CB 3.3Å; Y236-D239 PolarHBondContact O-N 3.28Å; Y236-I240 HydrophobicContact CD1-CD1 4.37Å; Y236-I240 HydrophobicContact CD1-CG1 4.04Å; Y236-I240 HydrophobicContact CE1-CD1 3.78Å; Y236-I240 HydrophobicContact CE1-CG1 3.96Å; Y236-I240 PolarHBondContact O-N 2.89Å; Y236-L277 VanDerWaalsContact CD1-O 3.27Å; Y236-L277 WeakPolarHBondContact CD1-O 3.07Å; Y236-Y278 HydrophobicContact CD1-CD1 4.33Å; Y236-Y278 VanDerWaalsContact CE1-C 3.49Å; Y236-K279 WeakPolarHBondContact CE1-O 3.4Å; Y236-K279 PolarHBondContact OH-O 3.09Å; Y236-G280 PolarHBondContact OH-O 3.19Å; Y236-L281 HydrophobicContact CD1-CB 4.34Å; Y236-L281 HydrophobicContact CD2-CB 4.36Å; Y236-L281 HydrophobicContact CD2-CD1 3.46Å; Y236-L281 VanDerWaalsContact CD2-CD1 3.46Å; Y236-L281 HydrophobicContact CD2-CG 4.47Å; Y236-L281 HydrophobicContact CE1-CB 4.04Å; Y236-L281 HydrophobicContact CE2-CB 4.06Å; Y236-L281 HydrophobicContact CE2-CD1 3.68Å; Y236-L281 HydrophobicContact CE2-CG 4.49Å; Y236-L281 HydrophobicContact CG-CB 4.48Å; Y236-L281 HydrophobicContact CG-CD1 3.99Å; Y236-L281 VanDerWaalsContact CZ-CA 3.5Å; Y236-L281 WeakPolarHBondContact OH-CA 3.43Å; Y236-L281 PolarHBondContact OH-N 2.77Å; Y236-L281 VanDerWaalsContact OH-N 3.08Å; Y236-N284 WeakPolarHBondContact CE2-ND2 3.49Å
237P97.1Very high96.1Very high20 Ų2022.5 Ų22.513%0.1312%0.124CC..Hα-helixtrans-58.1-38.5175.6-27.636.9000113I240 V241 L264 L277 Y278P237-I240 PolarHBondContact O-N 2.92Å; P237-V241 WeakPolarHBondContact O-CG2 3.43Å; P237-V241 PolarHBondContact O-N 2.92Å; P237-L264 HydrophobicContact CB-CD1 4.21Å; P237-L277 HydrophobicContact CB-CB 4.2Å; P237-L277 HydrophobicContact CB-CD1 4.47Å; P237-L277 HydrophobicContact CB-CD2 4.39Å; P237-L277 HydrophobicContact CG-CB 4.26Å; P237-Y278 HydrophobicContact CG-CE1 4.38Å; P237-Y278 HydrophobicContact CG-CE2 4.22Å
238L97Very high96Very high34 Ų3422.4 Ų22.418%0.17812%0.123CC..Hα-helixtrans-72.4-31.5176.5-70.1169.6000111.8P176 L179 P183 S235 Y236 V241 R242 V260P176-L238 HydrophobicContact CB-CD2 4.27Å; L179-L238 HydrophobicContact CB-CD1 3.92Å; L179-L238 HydrophobicContact CB-CD2 4.42Å; P183-L238 HydrophobicContact CG-CD1 4.16Å; S235-L238 PolarHBondContact O-N 3.49Å; S235-L238 VanDerWaalsContact O-N 3.14Å; Y236-L238 VanDerWaalsContact C-N 3.26Å; Y236-L238 PolarHBondContact O-N 3.33Å; L238-V241 PolarHBondContact O-N 3.3Å; L238-R242 VanDerWaalsContact O-CB 3.26Å; L238-R242 WeakPolarHBondContact O-CB 3.5Å; L238-R242 PolarHBondContact O-N 2.81Å; L238-V260 HydrophobicContact CD2-CG1 4.17Å
239D96.3Very high95.8Very high36 Ų3624.9 Ų24.919%0.19313%0.133CC..Hα-helixtrans-62.8-41.9169.9-81.7-18000111.7S235 Y236 R242 R243S235-D239 PolarHBondContact O-N 2.81Å; S235-D239 VanDerWaalsContact O-N 3.15Å; Y236-D239 WeakPolarHBondContact O-CA 3.02Å; Y236-D239 WeakPolarHBondContact O-CB 3.3Å; Y236-D239 PolarHBondContact O-N 3.28Å; D239-R242 WeakPolarHBondContact O-CB 3.36Å; D239-R242 PolarHBondContact O-N 2.92Å; D239-R243 WeakPolarHBondContact O-CG 3.3Å; D239-R243 PolarHBondContact O-N 3.5Å
240I96.2Very high95.6Very high0 Ų024 Ų240%013%0.129CC..Hα-helixtrans-61.1-51174.7-64.8-62000110.4Q45 Y236 P237 R242 R243 R244 V267 L277 K279Q45-I240 HydrophobicContact CB-CD1 3.82Å; Q45-I240 HydrophobicContact CG-CD1 3.54Å; Y236-I240 HydrophobicContact CD1-CD1 4.37Å; Y236-I240 HydrophobicContact CD1-CG1 4.04Å; Y236-I240 HydrophobicContact CE1-CD1 3.78Å; Y236-I240 HydrophobicContact CE1-CG1 3.96Å; Y236-I240 PolarHBondContact O-N 2.89Å; P237-I240 PolarHBondContact O-N 2.92Å; I240-R242 VanDerWaalsContact C-N 3.29Å; I240-R242 PolarHBondContact O-N 3.23Å; I240-R243 PolarHBondContact O-N 2.86Å; I240-R243 VanDerWaalsContact O-N 3.11Å; I240-R244 HydrophobicContact CG2-CG 4.14Å; I240-R244 VanDerWaalsContact O-CG 3.24Å; I240-R244 WeakPolarHBondContact O-CG 3.46Å; I240-R244 PolarHBondContact O-N 3.44Å; I240-V267 HydrophobicContact CG2-CG1 4.15Å; I240-V267 HydrophobicContact CG2-CG2 4.47Å; I240-L277 WeakPolarHBondContact CG1-O 2.98Å; I240-K279 HydrophobicContact CD1-CB 4.09Å
241V97.1Very high95.3Very high0 Ų021.4 Ų21.40%012%0.117CC..Hα-helixtrans-57.1-45.4178.1173.60000110.7P176 P237 L238 R243 R244 M245 V260 T263 L264P176-V241 HydrophobicContact CB-CB 4.37Å; P176-V241 HydrophobicContact CB-CG1 4.04Å; P176-V241 HydrophobicContact CG-CG1 4.16Å; P237-V241 WeakPolarHBondContact O-CG2 3.43Å; P237-V241 PolarHBondContact O-N 2.92Å; L238-V241 PolarHBondContact O-N 3.3Å; V241-R243 PolarHBondContact O-N 2.84Å; V241-R244 PolarHBondContact O-N 3.46Å; V241-M245 HydrophobicContact CG1-CG 4.15Å; V241-M245 HydrophobicContact CG1-SD 3.81Å; V241-M245 WeakPolarHBondContact O-CB 3.38Å; V241-M245 WeakPolarHBondContact O-CG 3.45Å; V241-M245 PolarHBondContact O-N 3.23Å; V241-V260 HydrophobicContact CG1-CB 4.41Å; V241-V260 HydrophobicContact CG1-CG1 3.94Å; V241-T263 HydrophobicContact CB-CG2 4.26Å; V241-T263 HydrophobicContact CG1-CG2 3.82Å; V241-T263 HydrophobicContact CG2-CG2 4.21Å; V241-L264 HydrophobicContact CG2-CB 3.87Å; V241-L264 HydrophobicContact CG2-CD1 3.88Å
242R97.2Very high94.9Very high30 Ų3024.1 Ų24.111%0.11314%0.144CC..Hα-helixtrans-53.8-52174.2176.4-171.5-178.9-177.32.3111.5D137 P176 A177 L238 D239 I240 R244 M245 Q246D137-R242 IonicContact OD2-CZ 3.12Å; D137-R242 IonicContact OD2-NH2 3.81Å; D137-R242 PolarHBondContact OD2-NH2 3Å; P176-R242 HydrophobicContact CB-CB 4.28Å; P176-R242 HydrophobicContact CG-CB 4Å; A177-R242 HydrophobicContact CB-CG 4.21Å; L238-R242 VanDerWaalsContact O-CB 3.26Å; L238-R242 WeakPolarHBondContact O-CB 3.5Å; L238-R242 PolarHBondContact O-N 2.81Å; D239-R242 WeakPolarHBondContact O-CB 3.36Å; D239-R242 PolarHBondContact O-N 2.92Å; I240-R242 VanDerWaalsContact C-N 3.29Å; I240-R242 PolarHBondContact O-N 3.23Å; R242-R244 PolarHBondContact O-N 3.49Å; R242-M245 PolarHBondContact O-N 3.14Å; R242-Q246 HydrophobicContact CG-CG 4.43Å; R242-Q246 WeakPolarHBondContact O-CB 3.48Å; R242-Q246 VanDerWaalsContact O-CG 3.22Å; R242-Q246 WeakPolarHBondContact O-CG 3.47Å; R242-Q246 PolarHBondContact O-N 2.61Å
243R96.8Very high94.6Very high27 Ų2723.2 Ų23.210%0.10214%0.14CC..Hα-helixtrans-64-39.9-178.2-65.8-46.7177.7-177.9-1.4112.5Q45 S46 D239 I240 V241 Q246 T247Q45-R243 HydrophobicContact CB-CB 4.07Å; Q45-R243 HydrophobicContact CB-CG 4.02Å; S46-R243 PolarHBondContact OG-O 3.42Å; D239-R243 WeakPolarHBondContact O-CG 3.3Å; D239-R243 PolarHBondContact O-N 3.5Å; I240-R243 PolarHBondContact O-N 2.86Å; I240-R243 VanDerWaalsContact O-N 3.11Å; V241-R243 PolarHBondContact O-N 2.84Å; R243-Q246 PolarHBondContact O-N 3.3Å; R243-T247 PolarHBondContact O-N 3.02Å; R243-T247 VanDerWaalsContact O-N 3.12Å; R243-T247 PolarHBondContact O-OG1 3.46Å
244R96.2Very high94.2Very high0 Ų025.3 Ų25.30%015%0.154CC..Hα-helixtrans-64.1-45.2176.6-66.3-70172.7134.714.3112Q45 S46 T47 I240 V241 R242 T247 A248 Y256 T263 V267 E271Q45-R244 PolarHBondContact O-NE 3.36Å; S46-R244 VanDerWaalsContact C-NE 3.35Å; S46-R244 WeakPolarHBondContact O-CD 3.3Å; S46-R244 PolarHBondContact O-NE 2.94Å; T47-R244 VanDerWaalsContact C-NH1 3.32Å; T47-R244 VanDerWaalsContact O-CZ 3.26Å; T47-R244 PolarHBondContact O-NH1 2.74Å; T47-R244 PolarHBondContact O-NH2 2.81Å; I240-R244 HydrophobicContact CG2-CG 4.14Å; I240-R244 VanDerWaalsContact O-CG 3.24Å; I240-R244 WeakPolarHBondContact O-CG 3.46Å; I240-R244 PolarHBondContact O-N 3.44Å; V241-R244 PolarHBondContact O-N 3.46Å; R242-R244 PolarHBondContact O-N 3.49Å; R244-T247 CarbonylContact O-C 3.46Å; R244-T247 PolarHBondContact O-N 2.92Å; R244-A248 WeakPolarHBondContact O-CA 3.38Å; R244-A248 PolarHBondContact O-N 2.89Å; R244-Y256 HydrophobicContact CB-CD1 4.42Å; R244-Y256 HydrophobicContact CB-CD2 3.65Å; R244-Y256 HydrophobicContact CB-CE2 3.78Å; R244-Y256 HydrophobicContact CB-CG 4Å; R244-Y256 HydrophobicContact CG-CD2 4.41Å; R244-Y256 HydrophobicContact CG-CE2 4.04Å; R244-Y256 PolarHBondContact NH1-OH 3.06Å; R244-Y256 WeakPolarHBondContact O-CD2 3.36Å; R244-T263 HydrophobicContact CB-CG2 3.93Å; R244-V267 HydrophobicContact CG-CG2 4.41Å; R244-E271 IonicContact CZ-OE1 2.58Å; R244-E271 IonicContact CZ-OE2 3.64Å; R244-E271 IonicContact NH1-OE1 2.78Å; R244-E271 PolarHBondContact NH1-OE1 3.46Å; R244-E271 VanDerWaalsContact NH2-CD 3.28Å; R244-E271 IonicContact NH2-OE1 3.55Å; R244-E271 PolarHBondContact NH2-OE1 3.36Å; R244-E271 IonicContact NH2-OE2 3.53Å; R244-E271 PolarHBondContact NH2-OE2 2.84Å
245M96.7Very high93.7Very high23 Ų2326.3 Ų26.311%0.11315%0.152CC..Hα-helixtrans-64.6-40.1175.4-66.3-176.57600112.2P176 V241 R242 T247 Y256 V260 T263P176-M245 HydrophobicContact CG-SD 3.7Å; V241-M245 HydrophobicContact CG1-CG 4.15Å; V241-M245 HydrophobicContact CG1-SD 3.81Å; V241-M245 WeakPolarHBondContact O-CB 3.38Å; V241-M245 WeakPolarHBondContact O-CG 3.45Å; V241-M245 PolarHBondContact O-N 3.23Å; R242-M245 PolarHBondContact O-N 3.14Å; M245-T247 PolarHBondContact O-N 3.41Å; M245-Y256 WeakPolarHBondContact CG-O 3.37Å; M245-V260 HydrophobicContact CE-CG2 4.48Å; M245-V260 HydrophobicContact SD-CG2 4.01Å; M245-T263 HydrophobicContact CG-CG2 4.4Å
246Q96.5Very high93.5Very high0 Ų026 Ų260%015%0.151CC..Hα-helixtrans-64.5-27.5177.3-77.1-178.1-29.100112.9Y134 V138 A141 R142 R172 R242 R243Y134-Q246 PolarHBondContact OH-NE2 3.3Å; V138-Q246 HydrophobicContact CG2-CG 4.26Å; A141-Q246 HydrophobicContact CB-CB 3.94Å; R142-Q246 WeakPolarHBondContact CD-O 3.43Å; R142-Q246 PolarHBondContact NE-O 2.86Å; R172-Q246 VanDerWaalsContact O-CG 3.26Å; R172-Q246 WeakPolarHBondContact O-CG 3.25Å; R242-Q246 HydrophobicContact CG-CG 4.43Å; R242-Q246 WeakPolarHBondContact O-CB 3.48Å; R242-Q246 VanDerWaalsContact O-CG 3.22Å; R242-Q246 WeakPolarHBondContact O-CG 3.47Å; R242-Q246 PolarHBondContact O-N 2.61Å; R243-Q246 PolarHBondContact O-N 3.3Å
247T95.4Very high93.1Very high0 Ų029.3 Ų29.30%017%0.168CC..Hα-helixtrans-114.56.1-175.562.40000114.3S46 A141 R142 V145 R243 R244 M245 N249 I250 T251S46-T247 WeakPolarHBondContact CB-OG1 3.47Å; S46-T247 VanDerWaalsContact OG-CG2 3.29Å; S46-T247 WeakPolarHBondContact OG-CG2 3.45Å; S46-T247 PolarHBondContact OG-OG1 2.89Å; A141-T247 HydrophobicContact CB-CG2 4.09Å; R142-T247 PolarHBondContact NH1-O 2.78Å; R142-T247 VanDerWaalsContact NH1-O 3.14Å; V145-T247 HydrophobicContact CG2-CG2 3.88Å; R243-T247 PolarHBondContact O-N 3.02Å; R243-T247 VanDerWaalsContact O-N 3.12Å; R243-T247 PolarHBondContact O-OG1 3.46Å; R244-T247 CarbonylContact O-C 3.46Å; R244-T247 PolarHBondContact O-N 2.92Å; M245-T247 PolarHBondContact O-N 3.41Å; T247-N249 PolarHBondContact O-N 3.39Å; T247-I250 WeakPolarHBondContact O-CA 3.1Å; T247-I250 WeakPolarHBondContact O-CB 3.32Å; T247-I250 PolarHBondContact O-N 3.45Å; T247-T251 PolarHBondContact O-N 2.91Å; T247-T251 PolarHBondContact O-OG1 3.38Å
248A93.5Very high92.7Very high1 Ų133.9 Ų33.91%0.00819%0.187CC..Hα-helixtrans-48-50.4-173.100000114.3R244 I250 T251 G252 H253 Y256 L257R244-A248 WeakPolarHBondContact O-CA 3.38Å; R244-A248 PolarHBondContact O-N 2.89Å; A248-I250 VanDerWaalsContact C-N 3.28Å; A248-I250 PolarHBondContact O-N 3.32Å; A248-T251 PolarHBondContact O-N 2.96Å; A248-T251 PolarHBondContact O-OG1 3.09Å; A248-G252 PolarHBondContact O-N 2.92Å; A248-H253 PolarHBondContact O-N 3.12Å; A248-Y256 HydrophobicContact CB-CD2 4.42Å; A248-L257 HydrophobicContact CB-CD2 3.46Å; A248-L257 VanDerWaalsContact CB-CD2 3.46Å; A248-L257 HydrophobicContact CB-CG 3.85Å
249N90.5Very high92.5Very high65 Ų6534.7 Ų34.735%0.34820%0.196SC..Hα-helixtrans-65.7-25.6178.1-70.116.8000114.7R142 E165 R172 T247 L257R142-N249 VanDerWaalsContact NH1-N 3.19Å; E165-N249 WeakPolarHBondContact CG-ND2 3.37Å; E165-N249 WeakPolarHBondContact OE1-CB 3.31Å; E165-N249 PolarHBondContact OE1-ND2 2.85Å; E165-N249 PolarHBondContact OE2-ND2 3.04Å; E165-N249 VanDerWaalsContact OE2-ND2 3.11Å; R172-N249 PolarHBondContact NH1-ND2 3.02Å; R172-N249 PolarHBondContact NH1-OD1 3.03Å; T247-N249 PolarHBondContact O-N 3.39Å; N249-L257 WeakPolarHBondContact OD1-CD1 3.22Å
250I91.3Very high92.5Very high53 Ų5334.2 Ų34.227%0.27219%0.194SC..Hα-helixtrans-82.1-37.3178.3-67.4-58.3000109.6R142 V145 T146 K150 Y151 T247 A248 G252R142-I250 VanDerWaalsContact NH1-N 3.1Å; V145-I250 HydrophobicContact CG1-CG2 3.99Å; T146-I250 HydrophobicContact CG2-CB 4.37Å; T146-I250 HydrophobicContact CG2-CD1 3.67Å; T146-I250 HydrophobicContact CG2-CG1 3.83Å; T146-I250 HydrophobicContact CG2-CG2 3.58Å; K150-I250 HydrophobicContact CG-CD1 4.46Å; Y151-I250 HydrophobicContact CE2-CD1 4.35Å; T247-I250 WeakPolarHBondContact O-CA 3.1Å; T247-I250 WeakPolarHBondContact O-CB 3.32Å; T247-I250 PolarHBondContact O-N 3.45Å; A248-I250 VanDerWaalsContact C-N 3.28Å; A248-I250 PolarHBondContact O-N 3.32Å; I250-G252 VanDerWaalsContact C-N 3.31Å
251T89.4Confident92.4Very high28 Ų2841 Ų4117%0.17222%0.221CC..Hα-helixtrans-83.1-9.1179.656.40000113.1S46 T47 T247 A248S46-T251 WeakPolarHBondContact O-CG2 3.16Å; T47-T251 HydrophobicContact CG2-CG2 4.45Å; T247-T251 PolarHBondContact O-N 2.91Å; T247-T251 PolarHBondContact O-OG1 3.38Å; A248-T251 PolarHBondContact O-N 2.96Å; A248-T251 PolarHBondContact O-OG1 3.09Å
252G87.8Confident92.3Very high56 Ų5646.1 Ų46.158%0.57724%0.243SC*.THydrogen-bonded Turntrans68.735.4178.400000113.7A248 I250 P254A248-G252 PolarHBondContact O-N 2.92Å; I250-G252 VanDerWaalsContact C-N 3.31Å; G252-P254 WeakPolarHBondContact O-CD 3.22Å
253H87.2Confident92.2Very high36 Ų3644.7 Ų44.717%0.16724%0.238CC..  trans-115.792.8-177.7-65.9-37.4000110.4R48 A248 E255 Y256R48-H253 VanDerWaalsContact CZ-CE1 3.46Å; R48-H253 PolarHBondContact NE-CE1 3.03Å; R48-H253 VanDerWaalsContact NE-CE1 3.26Å; R48-H253 PolarHBondContact NE-NE2 2.76Å; R48-H253 PolarHBondContact NH2-CE1 3.3Å; R48-H253 PolarHBondContact NH2-ND1 2.87Å; A248-H253 PolarHBondContact O-N 3.12Å; H253-E255 PolarHBondContact O-N 3.44Å; H253-Y256 HydrophobicContact CB-CD1 4.28Å; H253-Y256 HydrophobicContact CB-CD2 3.48Å; H253-Y256 VanDerWaalsContact CB-CD2 3.48Å; H253-Y256 HydrophobicContact CB-CE1 4.29Å; H253-Y256 HydrophobicContact CB-CE2 3.5Å; H253-Y256 VanDerWaalsContact CB-CE2 3.5Å; H253-Y256 HydrophobicContact CB-CG 3.89Å; H253-Y256 AromaticContact CD2-CE2 3.39Å; H253-Y256 WeakPolarHBondContact CD2-CE2 2.93Å; H253-Y256 AromaticContact CD2-CZ 3.78Å; H253-Y256 AromaticContact CG-CE2 3.75Å; H253-Y256 WeakPolarHBondContact O-CB 3.37Å; H253-Y256 PolarHBondContact O-N 3.29Å
254P86.4Confident92.2Very high79 Ų7946 Ų4651%0.51325%0.246SC..THydrogen-bonded Turntrans-62.9-26.5-176.925.9-34.2000112.7G252 Y256 L257G252-P254 WeakPolarHBondContact O-CD 3.22Å; P254-Y256 PolarHBondContact O-N 3.29Å; P254-Y256 VanDerWaalsContact O-N 3.14Å; P254-L257 WeakPolarHBondContact O-CB 3.36Å; P254-L257 PolarHBondContact O-N 3.02Å
255E87.4Confident92.2Very high59 Ų5952 Ų5228%0.27627%0.269SS..Hα-helixtrans-61.5-26179.1-51.387.5165.100112.2H253 L257 Y266H253-E255 PolarHBondContact O-N 3.44Å; E255-L257 PolarHBondContact O-N 3.07Å; E255-Y266 HydrophobicContact CB-CD2 3.99Å; E255-Y266 HydrophobicContact CB-CE2 4.35Å; E255-Y266 HydrophobicContact CB-CG 4.39Å; E255-Y266 HydrophobicContact CG-CD2 3.85Å; E255-Y266 HydrophobicContact CG-CE2 3.8Å
256Y91.2Very high92Very high0 Ų053.5 Ų53.50%027%0.274CS..Hα-helixtrans-76.6-11.4177.5-59.1-11.5000112.9R244 M245 A248 H253 P254 T263 Y266 V267R244-Y256 HydrophobicContact CB-CD1 4.42Å; R244-Y256 HydrophobicContact CB-CD2 3.65Å; R244-Y256 HydrophobicContact CB-CE2 3.78Å; R244-Y256 HydrophobicContact CB-CG 4Å; R244-Y256 HydrophobicContact CG-CD2 4.41Å; R244-Y256 HydrophobicContact CG-CE2 4.04Å; R244-Y256 PolarHBondContact NH1-OH 3.06Å; R244-Y256 WeakPolarHBondContact O-CD2 3.36Å; M245-Y256 WeakPolarHBondContact CG-O 3.37Å; A248-Y256 HydrophobicContact CB-CD2 4.42Å; H253-Y256 HydrophobicContact CB-CD1 4.28Å; H253-Y256 HydrophobicContact CB-CD2 3.48Å; H253-Y256 VanDerWaalsContact CB-CD2 3.48Å; H253-Y256 HydrophobicContact CB-CE1 4.29Å; H253-Y256 HydrophobicContact CB-CE2 3.5Å; H253-Y256 VanDerWaalsContact CB-CE2 3.5Å; H253-Y256 HydrophobicContact CB-CG 3.89Å; H253-Y256 AromaticContact CD2-CE2 3.39Å; H253-Y256 WeakPolarHBondContact CD2-CE2 2.93Å; H253-Y256 AromaticContact CD2-CZ 3.78Å; H253-Y256 AromaticContact CG-CE2 3.75Å; H253-Y256 WeakPolarHBondContact O-CB 3.37Å; H253-Y256 PolarHBondContact O-N 3.29Å; P254-Y256 PolarHBondContact O-N 3.29Å; P254-Y256 VanDerWaalsContact O-N 3.14Å; Y256-T263 WeakPolarHBondContact CA-OG1 3.43Å; Y256-T263 HydrophobicContact CD1-CG2 3.72Å; Y256-T263 HydrophobicContact CE1-CG2 4.29Å; Y256-T263 HydrophobicContact CG-CG2 4.19Å; Y256-Y266 AromaticContact CE1-CD1 3.69Å; Y256-Y266 HydrophobicContact CE1-CD1 3.69Å; Y256-Y266 HydrophobicContact CE1-CE1 4.2Å; Y256-Y266 HydrophobicContact CE1-CG 4.33Å; Y256-V267 HydrophobicContact CE1-CG2 4.42Å
257L87.7Confident91.9Very high69 Ų6953.5 Ų53.536%0.36127%0.274SS..Hα-helixtrans-89.4-19.4179.9-63.4175.8000113R172 A248 N249 P254 E255R172-L257 VanDerWaalsContact CZ-CD2 3.42Å; A248-L257 HydrophobicContact CB-CD2 3.46Å; A248-L257 VanDerWaalsContact CB-CD2 3.46Å; A248-L257 HydrophobicContact CB-CG 3.85Å; N249-L257 WeakPolarHBondContact OD1-CD1 3.22Å; P254-L257 WeakPolarHBondContact O-CB 3.36Å; P254-L257 PolarHBondContact O-N 3.02Å; E255-L257 PolarHBondContact O-N 3.07Å
258E88.9Confident91.9Very high115 Ų11559.5 Ų59.554%0.53730%0.297SS..Hα-helixtrans-81-53-167.9-61.8-176.5-166.200113.2K262E258-K262 HydrophobicContact CB-CD 3.9Å; E258-K262 WeakPolarHBondContact OE2-CD 3.4Å; E258-K262 VanDerWaalsContact OE2-CE 3.29Å; E258-K262 WeakPolarHBondContact OE2-CE 3.24Å; E258-K262 IonicContact OE2-NZ 3.54Å; E258-K262 PolarHBondContact OE2-NZ 3.12Å
259S93.2Very high92Very high51 Ų5166.2 Ų66.236%0.35733%0.326SS..  trans-163.5153.8-175177.90000112.1Y261 K262 T263S259-Y261 VanDerWaalsContact C-N 3.3Å; S259-Y261 PolarHBondContact O-N 2.99Å; S259-Y261 PolarHBondContact OG-N 2.68Å; S259-K262 PolarHBondContact O-N 3.02Å; S259-T263 WeakPolarHBondContact O-CB 3.38Å; S259-T263 PolarHBondContact O-N 2.99Å; S259-T263 PolarHBondContact O-OG1 3.44Å
260V95Very high92Very high26 Ų2667.2 Ų67.216%0.15833%0.331CS..Hα-helixtrans-55-47.1171.71780000110.7T175 P176 L238 V241 M245 T263 L264T175-V260 HydrophobicContact CG2-CG2 4.27Å; P176-V260 HydrophobicContact CB-CG1 4.27Å; P176-V260 HydrophobicContact CB-CG2 4.29Å; P176-V260 HydrophobicContact CG-CG2 4.22Å; L238-V260 HydrophobicContact CD2-CG1 4.17Å; V241-V260 HydrophobicContact CG1-CB 4.41Å; V241-V260 HydrophobicContact CG1-CG1 3.94Å; M245-V260 HydrophobicContact CE-CG2 4.48Å; M245-V260 HydrophobicContact SD-CG2 4.01Å; V260-T263 PolarHBondContact O-N 2.9Å; V260-L264 VanDerWaalsContact O-CB 3.31Å; V260-L264 WeakPolarHBondContact O-CB 3.32Å; V260-L264 PolarHBondContact O-N 3.24Å
261Y95.6Very high92Very high144 Ų14466 Ų6657%0.56533%0.325SS*.Hα-helixtrans-65.9-42.4-178.3176.7-99.6000112S259 L264 R265S259-Y261 VanDerWaalsContact C-N 3.3Å; S259-Y261 PolarHBondContact O-N 2.99Å; S259-Y261 PolarHBondContact OG-N 2.68Å; Y261-L264 PolarHBondContact O-N 2.92Å; Y261-R265 VanDerWaalsContact O-CB 3.26Å; Y261-R265 WeakPolarHBondContact O-CB 3.15Å; Y261-R265 PolarHBondContact O-N 2.84Å
262K94.6Very high92.2Very high107 Ų10766 Ų6647%0.46533%0.33SS..Hα-helixtrans-65.2-43.8177.9-72.7-174.6174178.30111.3E258 S259 L264 R265 Y266E258-K262 HydrophobicContact CB-CD 3.9Å; E258-K262 WeakPolarHBondContact OE2-CD 3.4Å; E258-K262 VanDerWaalsContact OE2-CE 3.29Å; E258-K262 WeakPolarHBondContact OE2-CE 3.24Å; E258-K262 IonicContact OE2-NZ 3.54Å; E258-K262 PolarHBondContact OE2-NZ 3.12Å; S259-K262 PolarHBondContact O-N 3.02Å; K262-L264 PolarHBondContact O-N 3.46Å; K262-R265 PolarHBondContact O-N 2.87Å; K262-Y266 WeakPolarHBondContact O-CB 3.22Å; K262-Y266 PolarHBondContact O-N 3.4Å
263T95.7Very high92.5Very high0 Ų068.6 Ų68.60%033%0.325CS..Hα-helixtrans-59.1-47.4174.1-53.20000111.2V241 R244 M245 Y256 S259 V260 Y266 V267V241-T263 HydrophobicContact CB-CG2 4.26Å; V241-T263 HydrophobicContact CG1-CG2 3.82Å; V241-T263 HydrophobicContact CG2-CG2 4.21Å; R244-T263 HydrophobicContact CB-CG2 3.93Å; M245-T263 HydrophobicContact CG-CG2 4.4Å; Y256-T263 WeakPolarHBondContact CA-OG1 3.43Å; Y256-T263 HydrophobicContact CD1-CG2 3.72Å; Y256-T263 HydrophobicContact CE1-CG2 4.29Å; Y256-T263 HydrophobicContact CG-CG2 4.19Å; S259-T263 WeakPolarHBondContact O-CB 3.38Å; S259-T263 PolarHBondContact O-N 2.99Å; S259-T263 PolarHBondContact O-OG1 3.44Å; V260-T263 PolarHBondContact O-N 2.9Å; T263-Y266 PolarHBondContact O-N 3.36Å; T263-V267 WeakPolarHBondContact O-CG2 3.4Å; T263-V267 PolarHBondContact O-N 2.96Å
264L96.3Very high92.7Very high53 Ų5372.4 Ų72.428%0.27735%0.346SS..Hα-helixtrans-60.4-50178.6-177.470000111.6P237 V241 V260 Y261 K262 Y266 V267 Y268 L277P237-L264 HydrophobicContact CB-CD1 4.21Å; V241-L264 HydrophobicContact CG2-CB 3.87Å; V241-L264 HydrophobicContact CG2-CD1 3.88Å; V260-L264 VanDerWaalsContact O-CB 3.31Å; V260-L264 WeakPolarHBondContact O-CB 3.32Å; V260-L264 PolarHBondContact O-N 3.24Å; Y261-L264 PolarHBondContact O-N 2.92Å; K262-L264 PolarHBondContact O-N 3.46Å; L264-Y266 VanDerWaalsContact C-N 3.3Å; L264-Y266 PolarHBondContact O-N 3.11Å; L264-V267 PolarHBondContact O-N 3.45Å; L264-Y268 WeakPolarHBondContact O-CB 3.46Å; L264-Y268 PolarHBondContact O-N 2.97Å; L264-L277 HydrophobicContact CD1-CD1 4.26Å; L264-L277 HydrophobicContact CD1-CD2 3.54Å
265R95.7Very high92.9Very high126 Ų12675.3 Ų75.348%0.47535%0.352SS..Hα-helixtrans-62.2-39.7178.9-172.7-178.1-172.3-162.82111.4Y261 K262 K269Y261-R265 VanDerWaalsContact O-CB 3.26Å; Y261-R265 WeakPolarHBondContact O-CB 3.15Å; Y261-R265 PolarHBondContact O-N 2.84Å; K262-R265 PolarHBondContact O-N 2.87Å; R265-K269 HydrophobicContact CG-CD 4.29Å; R265-K269 WeakPolarHBondContact O-CB 3.24Å; R265-K269 WeakPolarHBondContact O-CG 3.4Å; R265-K269 PolarHBondContact O-N 2.84Å
266Y93.8Very high93.2Very high55 Ų5572.5 Ų72.522%0.21634%0.339CS..Hα-helixtrans-62.2-53.1177.1-171-83.6000111R48 E255 Y256 K262 T263 L264 Y268 K269 D270R48-Y266 PolarHBondContact NH1-OH 2.92Å; R48-Y266 VanDerWaalsContact NH2-CE1 3.31Å; R48-Y266 VanDerWaalsContact NH2-CZ 3.31Å; R48-Y266 PolarHBondContact NH2-OH 3.4Å; E255-Y266 HydrophobicContact CB-CD2 3.99Å; E255-Y266 HydrophobicContact CB-CE2 4.35Å; E255-Y266 HydrophobicContact CB-CG 4.39Å; E255-Y266 HydrophobicContact CG-CD2 3.85Å; E255-Y266 HydrophobicContact CG-CE2 3.8Å; Y256-Y266 AromaticContact CE1-CD1 3.69Å; Y256-Y266 HydrophobicContact CE1-CD1 3.69Å; Y256-Y266 HydrophobicContact CE1-CE1 4.2Å; Y256-Y266 HydrophobicContact CE1-CG 4.33Å; K262-Y266 WeakPolarHBondContact O-CB 3.22Å; K262-Y266 PolarHBondContact O-N 3.4Å; T263-Y266 PolarHBondContact O-N 3.36Å; L264-Y266 VanDerWaalsContact C-N 3.3Å; L264-Y266 PolarHBondContact O-N 3.11Å; Y266-Y268 VanDerWaalsContact C-N 3.3Å; Y266-Y268 PolarHBondContact O-N 3.5Å; Y266-K269 PolarHBondContact O-N 2.84Å; Y266-D270 HydrophobicContact CD1-CB 4.3Å; Y266-D270 HydrophobicContact CE1-CB 4.01Å; Y266-D270 VanDerWaalsContact O-CB 3.31Å; Y266-D270 WeakPolarHBondContact O-CB 3.12Å; Y266-D270 PolarHBondContact O-N 3.39Å
267V94.5Very high93.4Very high0 Ų073 Ų730%034%0.342CS..Hα-helixtrans-59.9-42.3179174.50000111I240 R244 Y256 T263 L264 K269 E271 G272 L277I240-V267 HydrophobicContact CG2-CG1 4.15Å; I240-V267 HydrophobicContact CG2-CG2 4.47Å; R244-V267 HydrophobicContact CG-CG2 4.41Å; Y256-V267 HydrophobicContact CE1-CG2 4.42Å; T263-V267 WeakPolarHBondContact O-CG2 3.4Å; T263-V267 PolarHBondContact O-N 2.96Å; L264-V267 PolarHBondContact O-N 3.45Å; V267-K269 PolarHBondContact O-N 2.87Å; V267-E271 WeakPolarHBondContact O-CB 3.33Å; V267-E271 PolarHBondContact O-N 3.43Å; V267-G272 PolarHBondContact O-N 2.76Å; V267-L277 HydrophobicContact CB-CD2 4.16Å; V267-L277 HydrophobicContact CG1-CD2 3.78Å
268Y95.2Very high93.8Very high127 Ų12772.3 Ų72.350%0.49834%0.335SS..Hα-helixtrans-62.6-41.2177.5177.5-98.9000112.9L264 Y266 G272 F273 L277L264-Y268 WeakPolarHBondContact O-CB 3.46Å; L264-Y268 PolarHBondContact O-N 2.97Å; Y266-Y268 VanDerWaalsContact C-N 3.3Å; Y266-Y268 PolarHBondContact O-N 3.5Å; Y268-G272 WeakPolarHBondContact O-CA 3.21Å; Y268-G272 PolarHBondContact O-N 3.36Å; Y268-F273 HydrophobicContact CD2-CB 4.22Å; Y268-F273 HydrophobicContact CD2-CD2 4.02Å; Y268-F273 HydrophobicContact CE2-CB 3.89Å; Y268-F273 AromaticContact CE2-CD2 3.8Å; Y268-F273 HydrophobicContact CE2-CD2 3.8Å; Y268-F273 HydrophobicContact CE2-CG 4.3Å; Y268-L277 HydrophobicContact CD2-CD1 4.08Å
269K94.2Very high94Very high142 Ų14267.1 Ų67.162%0.61731%0.31SS*.Hα-helixtrans-76.7-40-178.7-76.9-174169.5-165.70113.5R265 Y266 V267R265-K269 HydrophobicContact CG-CD 4.29Å; R265-K269 WeakPolarHBondContact O-CB 3.24Å; R265-K269 WeakPolarHBondContact O-CG 3.4Å; R265-K269 PolarHBondContact O-N 2.84Å; Y266-K269 PolarHBondContact O-N 2.84Å; V267-K269 PolarHBondContact O-N 2.87Å
270D91.8Very high94Very high85 Ų8564.8 Ų64.846%0.45529%0.294SS..Hα-helixtrans-87.5-42.3-172.6-168.471.9000112.4R48 Y266R48-D270 IonicContact CZ-OD2 3.13Å; R48-D270 IonicContact NE-OD2 2.77Å; R48-D270 IonicContact NH1-OD1 2.78Å; R48-D270 IonicContact NH1-OD2 3.93Å; R48-D270 PolarHBondContact NH1-OD2 2.97Å; Y266-D270 HydrophobicContact CD1-CB 4.3Å; Y266-D270 HydrophobicContact CE1-CB 4.01Å; Y266-D270 VanDerWaalsContact O-CB 3.31Å; Y266-D270 WeakPolarHBondContact O-CB 3.12Å; Y266-D270 PolarHBondContact O-N 3.39Å
271E91.5Very high93.9Very high28 Ų2864.1 Ų64.113%0.13129%0.29CS..THydrogen-bonded Turntrans-106.2-11.2-176.5-62.5-177.1-139.200112.9R48 R244 V267 H275 G276 K279R48-E271 WeakPolarHBondContact CG-OE1 3.12Å; R244-E271 IonicContact CZ-OE1 2.58Å; R244-E271 IonicContact CZ-OE2 3.64Å; R244-E271 IonicContact NH1-OE1 2.78Å; R244-E271 PolarHBondContact NH1-OE1 3.46Å; R244-E271 VanDerWaalsContact NH2-CD 3.28Å; R244-E271 IonicContact NH2-OE1 3.55Å; R244-E271 PolarHBondContact NH2-OE1 3.36Å; R244-E271 IonicContact NH2-OE2 3.53Å; R244-E271 PolarHBondContact NH2-OE2 2.84Å; V267-E271 WeakPolarHBondContact O-CB 3.33Å; V267-E271 PolarHBondContact O-N 3.43Å; E271-H275 WeakPolarHBondContact O-CB 3.44Å; E271-G276 PolarHBondContact O-N 3.48Å; E271-K279 IonicContact OE2-NZ 2.76Å; E271-K279 PolarHBondContact OE2-NZ 3.26Å
272G93.2Very high93.7Very high27 Ų2759.3 Ų59.328%0.27828%0.277SS..  trans82.3175.5-178.800000114.3V267 Y268 G276V267-G272 PolarHBondContact O-N 2.76Å; Y268-G272 WeakPolarHBondContact O-CA 3.21Å; Y268-G272 PolarHBondContact O-N 3.36Å; G272-G276 VanDerWaalsContact O-CA 3.29Å; G272-G276 WeakPolarHBondContact O-CA 3.2Å; G272-G276 PolarHBondContact O-N 2.87Å; G272-G276 VanDerWaalsContact O-N 3.1Å
273F93Very high93.6Very high111 Ų11154.2 Ų54.249%0.48726%0.255SS..Iπ-helixtrans-66.1-60.8-175.4-172.5-107.1000112.6Y268 L277 Y278Y268-F273 HydrophobicContact CD2-CB 4.22Å; Y268-F273 HydrophobicContact CD2-CD2 4.02Å; Y268-F273 HydrophobicContact CE2-CB 3.89Å; Y268-F273 AromaticContact CE2-CD2 3.8Å; Y268-F273 HydrophobicContact CE2-CD2 3.8Å; Y268-F273 HydrophobicContact CE2-CG 4.3Å; F273-L277 HydrophobicContact CD2-CD1 3.88Å; F273-L277 HydrophobicContact CE2-CD1 4.18Å; F273-L277 WeakPolarHBondContact O-CA 3.16Å; F273-L277 VanDerWaalsContact O-CB 3.26Å; F273-L277 WeakPolarHBondContact O-CB 3.36Å; F273-L277 PolarHBondContact O-N 3.44Å; F273-Y278 HydrophobicContact CD1-CD2 4.42Å; F273-Y278 HydrophobicContact CD1-CE2 4.26Å; F273-Y278 HydrophobicContact CE1-CD2 4.19Å; F273-Y278 AromaticContact CE1-CE2 3.65Å; F273-Y278 HydrophobicContact CE1-CE2 3.65Å; F273-Y278 HydrophobicContact CE2-CE2 4.03Å; F273-Y278 HydrophobicContact CZ-CD2 4.43Å; F273-Y278 AromaticContact CZ-CE2 3.53Å; F273-Y278 HydrophobicContact CZ-CE2 3.53Å
274I91.5Very high93.3Very high117 Ų11754.7 Ų54.760%0.626%0.258SS*.Iπ-helixtrans-74.8-49.9-174.7-58.2177.9000111G276 Y278I274-G276 VanDerWaalsContact C-N 3.34Å; I274-G276 PolarHBondContact O-N 3.47Å; I274-Y278 CarbonylContact O-C 3.58Å; I274-Y278 WeakPolarHBondContact O-CA 3.09Å; I274-Y278 WeakPolarHBondContact O-CB 3.32Å; I274-Y278 PolarHBondContact O-N 2.97Å
275H91.7Very high92.9Very high140 Ų14058.1 Ų58.165%0.64827%0.267SS*.Iπ-helixtrans-73.8-24.4-175-61.2107.1000113.5E271 K279E271-H275 WeakPolarHBondContact O-CB 3.44Å; H275-K279 WeakPolarHBondContact O-CB 3.22Å; H275-K279 WeakPolarHBondContact O-CD 3.32Å; H275-K279 WeakPolarHBondContact O-CG 3.5Å
276G93.6Very high92.6Very high0 Ų056.6 Ų56.60%027%0.267CS..Iπ-helixtrans-92.4-66.6173.600000112.9E271 G272 I274 Y278 K279E271-G276 PolarHBondContact O-N 3.48Å; G272-G276 VanDerWaalsContact O-CA 3.29Å; G272-G276 WeakPolarHBondContact O-CA 3.2Å; G272-G276 PolarHBondContact O-N 2.87Å; G272-G276 VanDerWaalsContact O-N 3.1Å; I274-G276 VanDerWaalsContact C-N 3.34Å; I274-G276 PolarHBondContact O-N 3.47Å; G276-Y278 PolarHBondContact O-N 3.32Å; G276-K279 WeakPolarHBondContact O-CB 3.42Å
277L95.5Very high92.4Very high10 Ų1055.8 Ų55.85%0.05227%0.265CS..Iπ-helixtrans-74.8-20.6-170.3-58.3-179.4000114.4Y236 P237 I240 L264 V267 Y268 F273Y236-L277 VanDerWaalsContact CD1-O 3.27Å; Y236-L277 WeakPolarHBondContact CD1-O 3.07Å; P237-L277 HydrophobicContact CB-CB 4.2Å; P237-L277 HydrophobicContact CB-CD1 4.47Å; P237-L277 HydrophobicContact CB-CD2 4.39Å; P237-L277 HydrophobicContact CG-CB 4.26Å; I240-L277 WeakPolarHBondContact CG1-O 2.98Å; L264-L277 HydrophobicContact CD1-CD1 4.26Å; L264-L277 HydrophobicContact CD1-CD2 3.54Å; V267-L277 HydrophobicContact CB-CD2 4.16Å; V267-L277 HydrophobicContact CG1-CD2 3.78Å; Y268-L277 HydrophobicContact CD2-CD1 4.08Å; F273-L277 HydrophobicContact CD2-CD1 3.88Å; F273-L277 HydrophobicContact CE2-CD1 4.18Å; F273-L277 WeakPolarHBondContact O-CA 3.16Å; F273-L277 VanDerWaalsContact O-CB 3.26Å; F273-L277 WeakPolarHBondContact O-CB 3.36Å; F273-L277 PolarHBondContact O-N 3.44Å
278Y95.4Very high92.1Very high55 Ų5557.3 Ų57.322%0.21628%0.28CS..THydrogen-bonded Turntrans-114.918.6-179.9-67.4-85.2000113.5T233 Y236 P237 F273 I274 G276 G280 L281T233-Y278 HydrophobicContact CG2-CD1 4.41Å; T233-Y278 HydrophobicContact CG2-CE1 3.85Å; T233-Y278 VanDerWaalsContact O-CE1 3.29Å; T233-Y278 WeakPolarHBondContact O-CE1 3.45Å; Y236-Y278 HydrophobicContact CD1-CD1 4.33Å; Y236-Y278 VanDerWaalsContact CE1-C 3.49Å; P237-Y278 HydrophobicContact CG-CE1 4.38Å; P237-Y278 HydrophobicContact CG-CE2 4.22Å; F273-Y278 HydrophobicContact CD1-CD2 4.42Å; F273-Y278 HydrophobicContact CD1-CE2 4.26Å; F273-Y278 HydrophobicContact CE1-CD2 4.19Å; F273-Y278 AromaticContact CE1-CE2 3.65Å; F273-Y278 HydrophobicContact CE1-CE2 3.65Å; F273-Y278 HydrophobicContact CE2-CE2 4.03Å; F273-Y278 HydrophobicContact CZ-CD2 4.43Å; F273-Y278 AromaticContact CZ-CE2 3.53Å; F273-Y278 HydrophobicContact CZ-CE2 3.53Å; I274-Y278 CarbonylContact O-C 3.58Å; I274-Y278 WeakPolarHBondContact O-CA 3.09Å; I274-Y278 WeakPolarHBondContact O-CB 3.32Å; I274-Y278 PolarHBondContact O-N 2.97Å; G276-Y278 PolarHBondContact O-N 3.32Å; Y278-G280 PolarHBondContact O-N 3.08Å; Y278-L281 HydrophobicContact CD1-CD2 3.94Å; Y278-L281 VanDerWaalsContact O-CB 3.29Å; Y278-L281 WeakPolarHBondContact O-CB 3.3Å; Y278-L281 PolarHBondContact O-N 2.98Å; Y278-L281 VanDerWaalsContact O-N 3.08Å
279K93.3Very high91.9Very high5 Ų555.4 Ų55.42%0.02228%0.283CS..THydrogen-bonded Turntrans-60.2118.1-175.6-166.5171.4-168.5169.40113.6F44 T47 R48 M49 F51 Y236 I240 E271 H275 G276 L281F44-K279 WeakPolarHBondContact O-CD 3.28Å; F44-K279 WeakPolarHBondContact O-CE 3.38Å; T47-K279 PolarHBondContact O-NZ 3.07Å; R48-K279 PolarHBondContact O-NZ 2.89Å; M49-K279 WeakPolarHBondContact O-CE 3.34Å; M49-K279 PolarHBondContact O-NZ 3.28Å; F51-K279 HydrophobicContact CB-CG 3.79Å; Y236-K279 WeakPolarHBondContact CE1-O 3.4Å; Y236-K279 PolarHBondContact OH-O 3.09Å; I240-K279 HydrophobicContact CD1-CB 4.09Å; E271-K279 IonicContact OE2-NZ 2.76Å; E271-K279 PolarHBondContact OE2-NZ 3.26Å; H275-K279 WeakPolarHBondContact O-CB 3.22Å; H275-K279 WeakPolarHBondContact O-CD 3.32Å; H275-K279 WeakPolarHBondContact O-CG 3.5Å; G276-K279 WeakPolarHBondContact O-CB 3.42Å; K279-L281 VanDerWaalsContact C-N 3.3Å; K279-L281 PolarHBondContact O-N 2.88Å
280G92.5Very high91.8Very high2 Ų251.8 Ų51.82%0.02127%0.273CS..THydrogen-bonded Turntrans75.813.2-179.500000114.5Y236 Y278 S282 V283Y236-G280 PolarHBondContact OH-O 3.19Å; Y278-G280 PolarHBondContact O-N 3.08Å; G280-S282 PolarHBondContact O-N 2.89Å; G280-V283 WeakPolarHBondContact O-CB 3.4Å; G280-V283 WeakPolarHBondContact O-CG2 3.43Å; G280-V283 PolarHBondContact O-N 3.29Å
281L92.6Very high91.9Very high13 Ų1348.8 Ų48.87%0.06826%0.26CS..Hα-helixtrans-57-37.2177.8174.463.4000111.5T233 Y236 Y278 K279 V283 N284 W285T233-L281 HydrophobicContact CG2-CD2 4.01Å; Y236-L281 HydrophobicContact CD1-CB 4.34Å; Y236-L281 HydrophobicContact CD2-CB 4.36Å; Y236-L281 HydrophobicContact CD2-CD1 3.46Å; Y236-L281 VanDerWaalsContact CD2-CD1 3.46Å; Y236-L281 HydrophobicContact CD2-CG 4.47Å; Y236-L281 HydrophobicContact CE1-CB 4.04Å; Y236-L281 HydrophobicContact CE2-CB 4.06Å; Y236-L281 HydrophobicContact CE2-CD1 3.68Å; Y236-L281 HydrophobicContact CE2-CG 4.49Å; Y236-L281 HydrophobicContact CG-CB 4.48Å; Y236-L281 HydrophobicContact CG-CD1 3.99Å; Y236-L281 VanDerWaalsContact CZ-CA 3.5Å; Y236-L281 WeakPolarHBondContact OH-CA 3.43Å; Y236-L281 PolarHBondContact OH-N 2.77Å; Y236-L281 VanDerWaalsContact OH-N 3.08Å; Y278-L281 HydrophobicContact CD1-CD2 3.94Å; Y278-L281 VanDerWaalsContact O-CB 3.29Å; Y278-L281 WeakPolarHBondContact O-CB 3.3Å; Y278-L281 PolarHBondContact O-N 2.98Å; Y278-L281 VanDerWaalsContact O-N 3.08Å; K279-L281 VanDerWaalsContact C-N 3.3Å; K279-L281 PolarHBondContact O-N 2.88Å; L281-V283 PolarHBondContact O-N 2.91Å; L281-V283 VanDerWaalsContact O-N 3.13Å; L281-N284 VanDerWaalsContact O-CB 3.27Å; L281-N284 WeakPolarHBondContact O-CB 3.07Å; L281-N284 PolarHBondContact O-N 3.23Å; L281-W285 HydrophobicContact CD2-CH2 4.47Å; L281-W285 HydrophobicContact CD2-CZ2 3.66Å; L281-W285 HydrophobicContact CG-CZ2 3.87Å
282S91.2Very high91.8Very high42 Ų4250.4 Ų50.429%0.29428%0.275SS..Hα-helixtrans-59.8-25.1176.858.80000113.6F51 G280 N284 W285 I286F51-S282 VanDerWaalsContact CE1-OG 3.27Å; F51-S282 WeakPolarHBondContact CE1-OG 3.33Å; G280-S282 PolarHBondContact O-N 2.89Å; S282-N284 VanDerWaalsContact C-N 3.27Å; S282-N284 PolarHBondContact O-N 3.34Å; S282-W285 PolarHBondContact O-N 3.18Å; S282-W285 VanDerWaalsContact O-N 3.17Å; S282-I286 PolarHBondContact O-N 3.37Å
283V92.8Very high91.8Very high1 Ų150.8 Ų50.81%0.00628%0.278CS..Hα-helixtrans-63.1-35.5172.8179.60000111.3L37 K41 F51 G280 L281 W285 I286 K287L37-V283 HydrophobicContact CD1-CB 4.41Å; L37-V283 HydrophobicContact CD1-CG1 3.4Å; L37-V283 HydrophobicContact CD1-CG2 4.27Å; L37-V283 HydrophobicContact CD2-CG1 3.87Å; L37-V283 HydrophobicContact CG-CG1 3.34Å; K41-V283 HydrophobicContact CB-CB 4.36Å; K41-V283 HydrophobicContact CB-CG1 3.89Å; K41-V283 HydrophobicContact CD-CB 4.48Å; K41-V283 HydrophobicContact CD-CG1 4.33Å; K41-V283 HydrophobicContact CG-CB 4.26Å; K41-V283 HydrophobicContact CG-CG1 4.22Å; F51-V283 HydrophobicContact CE1-CG2 4.4Å; F51-V283 HydrophobicContact CE2-CG2 3.55Å; F51-V283 HydrophobicContact CZ-CG2 3.37Å; G280-V283 WeakPolarHBondContact O-CB 3.4Å; G280-V283 WeakPolarHBondContact O-CG2 3.43Å; G280-V283 PolarHBondContact O-N 3.29Å; L281-V283 PolarHBondContact O-N 2.91Å; L281-V283 VanDerWaalsContact O-N 3.13Å; V283-W285 VanDerWaalsContact C-N 3.32Å; V283-W285 PolarHBondContact O-N 2.74Å; V283-I286 PolarHBondContact O-N 3.03Å; V283-K287 HydrophobicContact CG1-CD 4.39Å; V283-K287 VanDerWaalsContact O-CB 3.31Å; V283-K287 WeakPolarHBondContact O-CB 3.46Å; V283-K287 WeakPolarHBondContact O-CG 3.33Å; V283-K287 PolarHBondContact O-N 3.28Å
284N90.2Very high91.8Very high9 Ų947.8 Ų47.85%0.04827%0.267CS..Hα-helixtrans-63.6-39.2174.3-78.8-7.5000112.2K41 Q232 Y236 L281 S282 I286 K287 G288K41-N284 VanDerWaalsContact CE-OD1 3.24Å; K41-N284 WeakPolarHBondContact CE-OD1 3.28Å; K41-N284 PolarHBondContact NZ-ND2 3.46Å; K41-N284 PolarHBondContact NZ-OD1 2.96Å; Q232-N284 PolarHBondContact OE1-ND2 3.47Å; Y236-N284 WeakPolarHBondContact CE2-ND2 3.49Å; L281-N284 VanDerWaalsContact O-CB 3.27Å; L281-N284 WeakPolarHBondContact O-CB 3.07Å; L281-N284 PolarHBondContact O-N 3.23Å; S282-N284 VanDerWaalsContact C-N 3.27Å; S282-N284 PolarHBondContact O-N 3.34Å; N284-I286 VanDerWaalsContact C-N 3.28Å; N284-I286 PolarHBondContact O-N 3.01Å; N284-K287 WeakPolarHBondContact OD1-CE 3.49Å; N284-G288 PolarHBondContact O-N 2.97Å; N284-G288 VanDerWaalsContact O-N 3.14Å
285W86.9Confident91.9Very high125 Ų12543.9 Ų43.947%0.47325%0.25SS..Hα-helixtrans-68.4-29.1-178.8-55.9-21000112.6L281 S282 V283 P289L281-W285 HydrophobicContact CD2-CH2 4.47Å; L281-W285 HydrophobicContact CD2-CZ2 3.66Å; L281-W285 HydrophobicContact CG-CZ2 3.87Å; S282-W285 PolarHBondContact O-N 3.18Å; S282-W285 VanDerWaalsContact O-N 3.17Å; V283-W285 VanDerWaalsContact C-N 3.32Å; V283-W285 PolarHBondContact O-N 2.74Å; W285-P289 WeakPolarHBondContact O-CD 3.42Å; W285-P289 VanDerWaalsContact O-CG 3.31Å; W285-P289 WeakPolarHBondContact O-CG 3.49Å
286I89.9Confident91.9Very high95 Ų9543.2 Ų43.249%0.48725%0.245SC..Hα-helixtrans-82.6-48.1175.1-62.1169.2000110.5L37 S282 V283 N284 G288 P289 V290L37-I286 HydrophobicContact CD2-CG2 4.21Å; S282-I286 PolarHBondContact O-N 3.37Å; V283-I286 PolarHBondContact O-N 3.03Å; N284-I286 VanDerWaalsContact C-N 3.28Å; N284-I286 PolarHBondContact O-N 3.01Å; I286-G288 VanDerWaalsContact C-N 3.3Å; I286-G288 PolarHBondContact O-N 3.26Å; I286-P289 WeakPolarHBondContact O-CD 3.45Å; I286-V290 HydrophobicContact CG2-CG2 4.27Å; I286-V290 VanDerWaalsContact O-CG2 3.25Å; I286-V290 WeakPolarHBondContact O-CG2 3.36Å; I286-V290 PolarHBondContact O-N 2.88Å
287K90.3Very high91.9Very high38 Ų3848 Ų4817%0.16528%0.275CS..Hα-helixtrans-66.3-31.5-172.284-162-163.789.40113.2I34 L37 D38 V283 N284 A291I34-K287 HydrophobicContact CD1-CB 4.15Å; I34-K287 HydrophobicContact CD1-CG 4.37Å; L37-K287 HydrophobicContact CD2-CB 3.87Å; D38-K287 WeakPolarHBondContact OD1-CD 3.48Å; D38-K287 IonicContact OD1-NZ 3.83Å; D38-K287 PolarHBondContact OD1-NZ 3.42Å; V283-K287 HydrophobicContact CG1-CD 4.39Å; V283-K287 VanDerWaalsContact O-CB 3.31Å; V283-K287 WeakPolarHBondContact O-CB 3.46Å; V283-K287 WeakPolarHBondContact O-CG 3.33Å; V283-K287 PolarHBondContact O-N 3.28Å; N284-K287 WeakPolarHBondContact OD1-CE 3.49Å; K287-A291 WeakPolarHBondContact O-CB 3.31Å; K287-A291 PolarHBondContact O-N 3.27Å
288G87.6Confident91.7Very high31 Ų3148.5 Ų48.532%0.3228%0.278SS..Hα-helixtrans-62.7-63.1-179.300000111.8N284 I286 V290 A291 S292N284-G288 PolarHBondContact O-N 2.97Å; N284-G288 VanDerWaalsContact O-N 3.14Å; I286-G288 VanDerWaalsContact C-N 3.3Å; I286-G288 PolarHBondContact O-N 3.26Å; G288-V290 VanDerWaalsContact C-N 3.32Å; G288-V290 PolarHBondContact O-N 2.94Å; G288-A291 PolarHBondContact O-N 2.93Å; G288-S292 PolarHBondContact O-N 3.22Å; G288-S292 PolarHBondContact O-OG 3.45Å
289P90.2Very high91.5Very high87 Ų8748.9 Ų48.957%0.56528%0.28SS*.Hα-helixtrans-55.4-42.4176.3-27.636.1000113.6W285 I286 S292 G293W285-P289 WeakPolarHBondContact O-CD 3.42Å; W285-P289 VanDerWaalsContact O-CG 3.31Å; W285-P289 WeakPolarHBondContact O-CG 3.49Å; I286-P289 WeakPolarHBondContact O-CD 3.45Å; P289-S292 PolarHBondContact O-N 2.83Å; P289-G293 PolarHBondContact O-N 3.42Å
290V93.1Very high91.3Very high67 Ų6753.9 Ų53.941%0.40630%0.303SS..Hα-helixtrans-63.2-47.1178.21740000111.3I34 I286 G288 G293 I294I34-V290 HydrophobicContact CG2-CB 4.28Å; I34-V290 HydrophobicContact CG2-CG1 3.83Å; I286-V290 HydrophobicContact CG2-CG2 4.27Å; I286-V290 VanDerWaalsContact O-CG2 3.25Å; I286-V290 WeakPolarHBondContact O-CG2 3.36Å; I286-V290 PolarHBondContact O-N 2.88Å; G288-V290 VanDerWaalsContact C-N 3.32Å; G288-V290 PolarHBondContact O-N 2.94Å; V290-G293 PolarHBondContact O-N 2.73Å; V290-I294 HydrophobicContact CG1-CD1 3.77Å; V290-I294 VanDerWaalsContact O-CG1 3.28Å; V290-I294 WeakPolarHBondContact O-CG1 3.41Å; V290-I294 PolarHBondContact O-N 3.33Å
291A93.6Very high91.1Very high21 Ų2158.7 Ų58.717%0.17433%0.325CS..Hα-helixtrans-64-42.2177.800000112A30 I34 K287 G288 S295A30-A291 HydrophobicContact CB-CB 4.42Å; A30-A291 VanDerWaalsContact CB-O 3.29Å; A30-A291 WeakPolarHBondContact CB-O 3.49Å; I34-A291 HydrophobicContact CD1-CB 3.96Å; I34-A291 HydrophobicContact CG1-CB 4.35Å; I34-A291 HydrophobicContact CG2-CB 4.08Å; K287-A291 WeakPolarHBondContact O-CB 3.31Å; K287-A291 PolarHBondContact O-N 3.27Å; G288-A291 PolarHBondContact O-N 2.93Å; A291-S295 VanDerWaalsContact O-CB 3.28Å; A291-S295 WeakPolarHBondContact O-CB 3.3Å; A291-S295 PolarHBondContact O-N 3.49Å
292S89.3Confident90.9Very high63 Ų6361.9 Ų61.944%0.44134%0.338SS..Hα-helixtrans-60.5-49.9175.9-64.90000111.1G288 P289 I294 S295 F296G288-S292 PolarHBondContact O-N 3.22Å; G288-S292 PolarHBondContact O-OG 3.45Å; P289-S292 PolarHBondContact O-N 2.83Å; S292-I294 PolarHBondContact O-N 2.89Å; S292-S295 PolarHBondContact O-N 3.43Å; S292-F296 WeakPolarHBondContact O-CD2 3.32Å; S292-F296 PolarHBondContact O-N 3.09Å
293G93.3Very high90.6Very high34 Ų3461.9 Ų61.935%0.35133%0.334SS..Hα-helixtrans-57.4-48.8178.900000112.5P289 V290 S295 F296 T297P289-G293 PolarHBondContact O-N 3.42Å; V290-G293 PolarHBondContact O-N 2.73Å; G293-S295 PolarHBondContact O-N 2.92Å; G293-F296 PolarHBondContact O-N 3.44Å; G293-T297 PolarHBondContact O-N 2.88Å; G293-T297 PolarHBondContact O-OG1 3.49Å; G293-T297 VanDerWaalsContact O-OG1 3.07Å
294I94.2Very high90.2Very high49 Ų4966.6 Ų66.625%0.25136%0.356SS..Hα-helixtrans-62.8-43.7177.4-64.7171000110.9V29 A30 A33 V290 S292 F296 T297 V298V29-I294 HydrophobicContact CG1-CG2 4.23Å; A30-I294 HydrophobicContact CB-CB 4.26Å; A30-I294 HydrophobicContact CB-CG2 4.14Å; A33-I294 HydrophobicContact CB-CD1 3.41Å; A33-I294 VanDerWaalsContact CB-CD1 3.41Å; A33-I294 HydrophobicContact CB-CG2 4.46Å; V290-I294 HydrophobicContact CG1-CD1 3.77Å; V290-I294 VanDerWaalsContact O-CG1 3.28Å; V290-I294 WeakPolarHBondContact O-CG1 3.41Å; V290-I294 PolarHBondContact O-N 3.33Å; S292-I294 PolarHBondContact O-N 2.89Å; I294-F296 VanDerWaalsContact C-N 3.31Å; I294-F296 PolarHBondContact O-N 2.93Å; I294-T297 PolarHBondContact O-N 3.24Å; I294-V298 HydrophobicContact CG2-CG2 3.99Å; I294-V298 VanDerWaalsContact O-CB 3.31Å; I294-V298 WeakPolarHBondContact O-CB 3.39Å; I294-V298 WeakPolarHBondContact O-CG2 3.42Å; I294-V298 PolarHBondContact O-N 2.94Å
295S92.4Very high89.9Confident35 Ų3570.3 Ų70.325%0.24538%0.375CS..Hα-helixtrans-60.9-41.7178.2-169.20000111.4A26 A291 S292 G293 Y299A26-S295 WeakPolarHBondContact CB-O 3.28Å; A291-S295 VanDerWaalsContact O-CB 3.28Å; A291-S295 WeakPolarHBondContact O-CB 3.3Å; A291-S295 PolarHBondContact O-N 3.49Å; S292-S295 PolarHBondContact O-N 3.43Å; G293-S295 PolarHBondContact O-N 2.92Å; S295-Y299 WeakPolarHBondContact O-CB 3.45Å; S295-Y299 PolarHBondContact O-N 3.45Å
296F91.3Very high89.6Confident125 Ų12566.4 Ų66.455%0.54836%0.363SS..Hα-helixtrans-65.4-49.6176.6-81.1-66.2000111.8S292 G293 I294 V298 Y299 H300S292-F296 WeakPolarHBondContact O-CD2 3.32Å; S292-F296 PolarHBondContact O-N 3.09Å; G293-F296 PolarHBondContact O-N 3.44Å; I294-F296 VanDerWaalsContact C-N 3.31Å; I294-F296 PolarHBondContact O-N 2.93Å; F296-V298 VanDerWaalsContact C-N 3.33Å; F296-V298 PolarHBondContact O-N 3.31Å; F296-Y299 PolarHBondContact O-N 3.48Å; F296-H300 PolarHBondContact O-CD2 3.25Å; F296-H300 PolarHBondContact O-N 2.98Å
297T93.3Very high89.1Confident100 Ų10067.4 Ų67.461%0.61337%0.366SS*.Hα-helixtrans-58.7-46.1179.1-58.30000111.5G293 I294 H300 Q301G293-T297 PolarHBondContact O-N 2.88Å; G293-T297 PolarHBondContact O-OG1 3.49Å; G293-T297 VanDerWaalsContact O-OG1 3.07Å; I294-T297 PolarHBondContact O-N 3.24Å; T297-H300 PolarHBondContact O-N 3.3Å; T297-Q301 WeakPolarHBondContact O-CB 3.24Å; T297-Q301 PolarHBondContact O-N 3.06Å
298V92.3Very high88.6Confident22 Ų2269.7 Ų69.713%0.13338%0.377CS..Hα-helixtrans-64.7-47.4179.4176.10000110A26 V29 I294 F296 H300 Q301 F302A26-V298 HydrophobicContact CB-CB 4.02Å; A26-V298 HydrophobicContact CB-CG1 3.84Å; V29-V298 HydrophobicContact CB-CG1 4.31Å; V29-V298 HydrophobicContact CB-CG2 4.26Å; V29-V298 HydrophobicContact CG1-CG2 3.73Å; V29-V298 HydrophobicContact CG2-CG1 4.34Å; I294-V298 HydrophobicContact CG2-CG2 3.99Å; I294-V298 VanDerWaalsContact O-CB 3.31Å; I294-V298 WeakPolarHBondContact O-CB 3.39Å; I294-V298 WeakPolarHBondContact O-CG2 3.42Å; I294-V298 PolarHBondContact O-N 2.94Å; F296-V298 VanDerWaalsContact C-N 3.33Å; F296-V298 PolarHBondContact O-N 3.31Å; V298-H300 PolarHBondContact O-N 3.34Å; V298-Q301 PolarHBondContact O-N 3.39Å; V298-F302 HydrophobicContact CG1-CD2 3.47Å; V298-F302 VanDerWaalsContact CG1-CD2 3.47Å; V298-F302 HydrophobicContact CG1-CE2 3.51Å; V298-F302 VanDerWaalsContact O-CD2 3.28Å; V298-F302 WeakPolarHBondContact O-CD2 3.36Å; V298-F302 PolarHBondContact O-N 3.27Å
299Y90.5Very high88.2Confident62 Ų6276.1 Ų76.124%0.24339%0.392CS..Hα-helixtrans-55-50.8177.5178.3-100.4000112.2S295 F296 Q301 F302 Q303S295-Y299 WeakPolarHBondContact O-CB 3.45Å; S295-Y299 PolarHBondContact O-N 3.45Å; F296-Y299 PolarHBondContact O-N 3.48Å; Y299-Q301 PolarHBondContact O-N 2.99Å; Y299-F302 PolarHBondContact O-N 2.88Å; Y299-Q303 HydrophobicContact CD1-CG 4.42Å; Y299-Q303 HydrophobicContact CE1-CG 4.08Å; Y299-Q303 HydrophobicContact CE2-CG 4.3Å; Y299-Q303 WeakPolarHBondContact O-CG 3.3Å; Y299-Q303 PolarHBondContact O-N 3.27Å; Y299-Q303 PolarHBondContact OH-NE2 3.38Å
300H88.9Confident87.6Confident111 Ų11174.8 Ų74.851%0.51438%0.379SS..Hα-helixtrans-63-40.4178.9-76-62.7000112.7F296 T297 V298 Q303 H304F296-H300 PolarHBondContact O-CD2 3.25Å; F296-H300 PolarHBondContact O-N 2.98Å; T297-H300 PolarHBondContact O-N 3.3Å; V298-H300 PolarHBondContact O-N 3.34Å; H300-Q303 PolarHBondContact O-N 3.45Å; H300-H304 WeakPolarHBondContact O-CB 3.42Å; H300-H304 PolarHBondContact O-N 3.34Å
301Q90Very high86.7Confident103 Ų10377.4 Ų77.448%0.48139%0.39SS..Hα-helixtrans-65.5-42.5178-171.761.923.900111.8T297 V298 Y299 H304 L305T297-Q301 WeakPolarHBondContact O-CB 3.24Å; T297-Q301 PolarHBondContact O-N 3.06Å; V298-Q301 PolarHBondContact O-N 3.39Å; Y299-Q301 PolarHBondContact O-N 2.99Å; Q301-H304 PolarHBondContact O-N 2.87Å; Q301-L305 HydrophobicContact CG-CD1 4.26Å; Q301-L305 VanDerWaalsContact O-CG 3.3Å; Q301-L305 WeakPolarHBondContact O-CG 3.25Å; Q301-L305 PolarHBondContact O-N 2.93Å
302F87.2Confident85.9Confident79 Ų7982.6 Ų82.635%0.34641%0.413SS..Hα-helixtrans-64-44.4175.9-91.2-87.7000111.5T22 L25 V298 Y299 H304 L305 L306T22-F302 HydrophobicContact CG2-CB 3.9Å; L25-F302 HydrophobicContact CD1-CE1 4.31Å; V298-F302 HydrophobicContact CG1-CD2 3.47Å; V298-F302 VanDerWaalsContact CG1-CD2 3.47Å; V298-F302 HydrophobicContact CG1-CE2 3.51Å; V298-F302 VanDerWaalsContact O-CD2 3.28Å; V298-F302 WeakPolarHBondContact O-CD2 3.36Å; V298-F302 PolarHBondContact O-N 3.27Å; Y299-F302 PolarHBondContact O-N 2.88Å; F302-H304 VanDerWaalsContact C-N 3.33Å; F302-H304 PolarHBondContact O-N 3.47Å; F302-L305 PolarHBondContact O-N 3.33Å; F302-L306 WeakPolarHBondContact O-CB 3.41Å; F302-L306 WeakPolarHBondContact O-CD1 3.33Å; F302-L306 VanDerWaalsContact O-CG 3.3Å; F302-L306 WeakPolarHBondContact O-CG 3.42Å; F302-L306 PolarHBondContact O-N 2.93Å
303Q84.5Confident85.2Confident42 Ų4284.4 Ų84.420%0.19642%0.418CS..Hα-helixtrans-59.8-43.5175.8-74.2-165.2-53.200112.1N19 Y299 H300 L306 H307N19-Q303 PolarHBondContact OD1-NE2 3.15Å; Y299-Q303 HydrophobicContact CD1-CG 4.42Å; Y299-Q303 HydrophobicContact CE1-CG 4.08Å; Y299-Q303 HydrophobicContact CE2-CG 4.3Å; Y299-Q303 WeakPolarHBondContact O-CG 3.3Å; Y299-Q303 PolarHBondContact O-N 3.27Å; Y299-Q303 PolarHBondContact OH-NE2 3.38Å; H300-Q303 PolarHBondContact O-N 3.45Å; Q303-L306 PolarHBondContact O-N 3.21Å; Q303-H307 WeakPolarHBondContact O-CB 3.1Å; Q303-H307 PolarHBondContact O-CD2 2.95Å; Q303-H307 VanDerWaalsContact O-CD2 3.23Å; Q303-H307 PolarHBondContact O-N 3.46Å
304H84.3Confident83.7Confident101 Ų10192.9 Ų92.947%0.46845%0.448SS..Hα-helixtrans-61.7-48177.2-176.9-83.8000112H300 Q301 F302 L306 H307 Q308H300-H304 WeakPolarHBondContact O-CB 3.42Å; H300-H304 PolarHBondContact O-N 3.34Å; Q301-H304 PolarHBondContact O-N 2.87Å; F302-H304 VanDerWaalsContact C-N 3.33Å; F302-H304 PolarHBondContact O-N 3.47Å; H304-L306 VanDerWaalsContact C-N 3.3Å; H304-L306 PolarHBondContact O-N 3.39Å; H304-H307 PolarHBondContact O-N 2.99Å; H304-Q308 PolarHBondContact CE1-NE2 3.37Å; H304-Q308 PolarHBondContact CE1-OE1 2.71Å; H304-Q308 PolarHBondContact ND1-OE1 3.49Å; H304-Q308 WeakPolarHBondContact O-CG 3.42Å; H304-Q308 PolarHBondContact O-N 3.27Å
305L85.4Confident83.2Confident86 Ų8695.1 Ų95.145%0.4546%0.458SS..Hα-helixtrans-61.8-38.5177.3-70.8172.9000112.1Q301 F302 Q308 W309Q301-L305 HydrophobicContact CG-CD1 4.26Å; Q301-L305 VanDerWaalsContact O-CG 3.3Å; Q301-L305 WeakPolarHBondContact O-CG 3.25Å; Q301-L305 PolarHBondContact O-N 2.93Å; F302-L305 PolarHBondContact O-N 3.33Å; L305-Q308 PolarHBondContact O-N 3.4Å; L305-W309 WeakPolarHBondContact O-CB 3.22Å; L305-W309 PolarHBondContact O-N 3.41Å
306L81Confident82.7Confident43 Ų4398.2 Ų98.223%0.22547%0.469CS..Hα-helixtrans-68.7-42.8177-79159.2000112.2I18 T22 F302 Q303 H304 Q308 W309 I310I18-L306 HydrophobicContact CG2-CD1 3.38Å; I18-L306 HydrophobicContact CG2-CD2 4.34Å; I18-L306 HydrophobicContact CG2-CG 4.32Å; T22-L306 HydrophobicContact CG2-CD1 3.23Å; F302-L306 WeakPolarHBondContact O-CB 3.41Å; F302-L306 WeakPolarHBondContact O-CD1 3.33Å; F302-L306 VanDerWaalsContact O-CG 3.3Å; F302-L306 WeakPolarHBondContact O-CG 3.42Å; F302-L306 PolarHBondContact O-N 2.93Å; Q303-L306 PolarHBondContact O-N 3.21Å; H304-L306 VanDerWaalsContact C-N 3.3Å; H304-L306 PolarHBondContact O-N 3.39Å; L306-Q308 VanDerWaalsContact C-N 3.31Å; L306-Q308 PolarHBondContact O-N 3.48Å; L306-W309 PolarHBondContact O-N 2.95Å; L306-I310 VanDerWaalsContact O-CG1 3.31Å; L306-I310 WeakPolarHBondContact O-CG1 2.99Å; L306-I310 PolarHBondContact O-N 2.61Å
307H78Confident82.2Confident117 Ų11796.7 Ų96.754%0.54247%0.465SS..Hα-helixtrans-60.4-43.4174-81.5-144.3000110.9Q303 H304 I310 I311Q303-H307 WeakPolarHBondContact O-CB 3.1Å; Q303-H307 PolarHBondContact O-CD2 2.95Å; Q303-H307 VanDerWaalsContact O-CD2 3.23Å; Q303-H307 PolarHBondContact O-N 3.46Å; H304-H307 PolarHBondContact O-N 2.99Å; H307-I310 PolarHBondContact O-N 3.38Å; H307-I311 WeakPolarHBondContact O-CD1 3.27Å; H307-I311 VanDerWaalsContact O-CG1 3.23Å; H307-I311 WeakPolarHBondContact O-CG1 3.48Å; H307-I311 PolarHBondContact O-N 3.18Å
308Q79.9Confident81.5Confident86 Ų8696.5 Ų96.540%0.40246%0.456SS..Hα-helixtrans-62.5-42.6174.2-73.1-175.3-43.900112.3H304 L305 L306 I310 I311 I312H304-Q308 PolarHBondContact CE1-NE2 3.37Å; H304-Q308 PolarHBondContact CE1-OE1 2.71Å; H304-Q308 PolarHBondContact ND1-OE1 3.49Å; H304-Q308 WeakPolarHBondContact O-CG 3.42Å; H304-Q308 PolarHBondContact O-N 3.27Å; L305-Q308 PolarHBondContact O-N 3.4Å; L306-Q308 VanDerWaalsContact C-N 3.31Å; L306-Q308 PolarHBondContact O-N 3.48Å; Q308-I310 VanDerWaalsContact C-N 3.35Å; Q308-I310 PolarHBondContact O-N 3.14Å; Q308-I311 PolarHBondContact O-N 3.49Å; Q308-I312 WeakPolarHBondContact O-CD1 3.35Å; Q308-I312 VanDerWaalsContact O-CG1 3.23Å; Q308-I312 WeakPolarHBondContact O-CG1 3.49Å; Q308-I312 PolarHBondContact O-N 3.04Å
309W79.2Confident80.9Confident166 Ų166101.2 Ų101.263%0.62948%0.476SS*.Hα-helixtrans-65.1-37.2178.8-174.879.3000112.6L305 L306 N313L305-W309 WeakPolarHBondContact O-CB 3.22Å; L305-W309 PolarHBondContact O-N 3.41Å; L306-W309 PolarHBondContact O-N 2.95Å; W309-N313 PolarHBondContact NE1-ND2 3.08Å; W309-N313 VanDerWaalsContact NE1-ND2 3.1Å; W309-N313 PolarHBondContact O-N 3.36Å; W309-N313 PolarHBondContact O-ND2 2.87Å
310I77.9Confident80.2Confident58 Ų58103.8 Ų103.830%0.29749%0.492SS..Hα-helixtrans-65.1-47.8173.6-67.6165.2000110.1L306 H307 Q308 I312 N313 E314L306-I310 VanDerWaalsContact O-CG1 3.31Å; L306-I310 WeakPolarHBondContact O-CG1 2.99Å; L306-I310 PolarHBondContact O-N 2.61Å; H307-I310 PolarHBondContact O-N 3.38Å; Q308-I310 VanDerWaalsContact C-N 3.35Å; Q308-I310 PolarHBondContact O-N 3.14Å; I310-I312 VanDerWaalsContact C-N 3.26Å; I310-I312 PolarHBondContact O-N 3Å; I310-N313 PolarHBondContact O-N 2.77Å; I310-N313 VanDerWaalsContact O-N 3.16Å; I310-E314 HydrophobicContact CG2-CG 4.4Å; I310-E314 PolarHBondContact O-N 3.19Å; I310-E314 VanDerWaalsContact O-N 3.07Å
311I73.5Confident79.6Confident123 Ų123103.3 Ų103.363%0.63149%0.49SS*.Hα-helixtrans-60.7-33.3179.1-67.9164.1000112.5H307 Q308H307-I311 WeakPolarHBondContact O-CD1 3.27Å; H307-I311 VanDerWaalsContact O-CG1 3.23Å; H307-I311 WeakPolarHBondContact O-CG1 3.48Å; H307-I311 PolarHBondContact O-N 3.18Å; Q308-I311 PolarHBondContact O-N 3.49Å
312I77.5Confident78.8Confident130 Ų130103.3 Ų103.367%0.66749%0.491SS*.Hα-helixtrans-77.9-25.9-179.6-69.1165.1000112.3Q308 I310Q308-I312 WeakPolarHBondContact O-CD1 3.35Å; Q308-I312 VanDerWaalsContact O-CG1 3.23Å; Q308-I312 WeakPolarHBondContact O-CG1 3.49Å; Q308-I312 PolarHBondContact O-N 3.04Å; I310-I312 VanDerWaalsContact C-N 3.26Å; I310-I312 PolarHBondContact O-N 3Å
313N74.6Confident78.1Confident101 Ų101105.3 Ų105.354%0.5450%0.503SS..Hα-helixtrans-106.10.2-175.4-66.3-63.9000114.3W309 I310W309-N313 PolarHBondContact NE1-ND2 3.08Å; W309-N313 VanDerWaalsContact NE1-ND2 3.1Å; W309-N313 PolarHBondContact O-N 3.36Å; W309-N313 PolarHBondContact O-ND2 2.87Å; I310-N313 PolarHBondContact O-N 2.77Å; I310-N313 VanDerWaalsContact O-N 3.16Å
314E61.6Low77.5Confident211 Ų211111.1 Ų111.199%0.98653%0.531SS*.  trans-93.70164.3-76.7-174.5164.300110.7I310I310-E314 HydrophobicContact CG2-CG 4.4Å; I310-E314 PolarHBondContact O-N 3.19Å; I310-E314 VanDerWaalsContact O-N 3.07Å

Retrieved 314 of 314 residues in 418.7 ms (Link to these results)

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