A0A077Z009_TRITR Loading...

Mob1 phocein domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z009, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 241 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
1M31Very low37.5Very low232 Ų232128.8 Ų128.8100%1.14369%0.691SS**  0119.70-66.3-161.2169.100107.8K3M1-K3 PolarHBondContact O-N 2.8Å
2P35.7Very low38.2Very low127 Ų127129.8 Ų129.883%0.82569%0.688SS**  trans-66.4124.4170.46.86.9000106.4S4P2-S4 PolarHBondContact O-N 3.31Å
3K35.7Very low39.3Very low196 Ų196126.9 Ų126.985%0.85268%0.679SS**  trans-49120.9173-73.7177.8176.2178.60106.8M1 M5M1-K3 PolarHBondContact O-N 2.8Å; K3-M5 PolarHBondContact O-N 2.71Å
4S33.7Very low41Very low111 Ų111121.7 Ų121.778%0.77665%0.647SS**  trans-36.1103.1170.31660000108.1P2 S6P2-S4 PolarHBondContact O-N 3.31Å; S4-S6 PolarHBondContact O-N 3.33Å
5M36Very low42.6Very low116 Ų116125 Ų12557%0.57165%0.647SS**  trans-64.795.9169.9-74.5-155.2-114.600103.9K3 F7K3-M5 PolarHBondContact O-N 2.71Å; M5-F7 HydrophobicContact CB-CD2 4.03Å; M5-F7 HydrophobicContact CB-CE2 4.4Å; M5-F7 PolarHBondContact O-N 3.09Å
6S33.5Very low44.3Very low94 Ų94120.1 Ų120.166%0.65763%0.626SS**  trans-66.279.2163.865.10000105S4 F8S4-S6 PolarHBondContact O-N 3.33Å; S6-F8 PolarHBondContact O-N 3.05Å
7F40.3Very low46.1Very low104 Ų104117.5 Ų117.546%0.45661%0.606SS.*  trans-45.3114.3168.8-106.2-98.8000105.6M5 I9 E83 V115M5-F7 HydrophobicContact CB-CD2 4.03Å; M5-F7 HydrophobicContact CB-CE2 4.4Å; M5-F7 PolarHBondContact O-N 3.09Å; F7-I9 PolarHBondContact O-N 2.81Å; F7-I9 VanDerWaalsContact O-N 3.09Å; F7-E83 WeakPolarHBondContact CZ-OE1 3.39Å; F7-V115 HydrophobicContact CE1-CG2 4.05Å; F7-V115 HydrophobicContact CE2-CG2 4.48Å; F7-V115 HydrophobicContact CZ-CG2 3.5Å
8F42.5Very low47.9Very low76 Ų76112.4 Ų112.433%0.33358%0.578SS.*  trans10.193.9164.3-79.1-97.7000111.9S6 L10 F14S6-F8 PolarHBondContact O-N 3.05Å; F8-L10 VanDerWaalsContact C-N 3.29Å; F8-L10 PolarHBondContact O-N 3.28Å; F8-F14 HydrophobicContact CD1-CZ 4.13Å; F8-F14 HydrophobicContact CE1-CE1 4.31Å; F8-F14 HydrophobicContact CE1-CZ 4.1Å
9I40.2Very low49.7Very low99 Ų99115.9 Ų115.951%0.50858%0.584SS.*  trans-49.1104.7167.5-66.8166000105.4F7 T11 Q12F7-I9 PolarHBondContact O-N 2.81Å; F7-I9 VanDerWaalsContact O-N 3.09Å; I9-T11 WeakPolarHBondContact CG2-OG1 3.49Å; I9-T11 PolarHBondContact O-N 2.8Å; I9-Q12 HydrophobicContact CB-CG 4.32Å; I9-Q12 HydrophobicContact CG2-CG 4.37Å; I9-Q12 PolarHBondContact O-N 3.44Å
10L42.3Very low51.5Low142 Ų142111.2 Ų111.274%0.74356%0.559SS**THydrogen-bonded Turntrans-60.3-1.4-172.7-73.4167.9000112.6F8F8-L10 VanDerWaalsContact C-N 3.29Å; F8-L10 PolarHBondContact O-N 3.28Å
11T41.1Very low53.2Low120 Ų120108.6 Ų108.674%0.73656%0.555SS**THydrogen-bonded Turntrans-99.5-4.3176.365.60000113.8I9 T13I9-T11 WeakPolarHBondContact CG2-OG1 3.49Å; I9-T11 PolarHBondContact O-N 2.8Å; T11-T13 PolarHBondContact O-N 3.28Å; T11-T13 VanDerWaalsContact O-N 3.15Å
12Q46.8Very low55.9Low141 Ų141102.5 Ų102.566%0.65953%0.533SS*.SBendtrans-77.5105.2172.1-68.4-151.3-7.300109.8I9 F14I9-Q12 HydrophobicContact CB-CG 4.32Å; I9-Q12 HydrophobicContact CG2-CG 4.37Å; I9-Q12 PolarHBondContact O-N 3.44Å; Q12-F14 PolarHBondContact O-N 2.7Å
13T52.6Low58.3Low92 Ų92100.3 Ų100.356%0.56453%0.533SS*.  trans-48.6119.3163.755.30000108T11 R15T11-T13 PolarHBondContact O-N 3.28Å; T11-T13 VanDerWaalsContact O-N 3.15Å; T13-R15 WeakPolarHBondContact O-CG 3.36Å; T13-R15 PolarHBondContact O-N 2.56Å; T13-R15 VanDerWaalsContact O-N 3.15Å; T13-R15 PolarHBondContact OG1-NE 2.79Å
14F62.4Low60.8Low54 Ų5493.2 Ų93.224%0.23751%0.506CS..  trans-57.4123.2174.1-81.4-105.7000108F8 Q12 N71 L72 G75F8-F14 HydrophobicContact CD1-CZ 4.13Å; F8-F14 HydrophobicContact CE1-CE1 4.31Å; F8-F14 HydrophobicContact CE1-CZ 4.1Å; Q12-F14 PolarHBondContact O-N 2.7Å; F14-N71 WeakPolarHBondContact CD1-O 3.11Å; F14-L72 HydrophobicContact CB-CD2 4.01Å; F14-L72 WeakPolarHBondContact O-CD2 3.33Å; F14-G75 VanDerWaalsContact CD2-CA 3.44Å
15R65.9Low63.4Low171 Ų17191 Ų9165%0.64549%0.487SS*.  trans-125.6157.4178.3-71.4177.7-171.2-162.91.7108.8T13 R17T13-R15 WeakPolarHBondContact O-CG 3.36Å; T13-R15 PolarHBondContact O-N 2.56Å; T13-R15 VanDerWaalsContact O-N 3.15Å; T13-R15 PolarHBondContact OG1-NE 2.79Å; R15-R17 PolarHBondContact O-N 2.74Å; R15-R17 VanDerWaalsContact O-N 3.12Å
16P69.2Low66Low47 Ų4786.3 Ų86.331%0.30546%0.464SS..  trans-52.5121.5168-24.333.2000109.6R19 N68P16-R19 HydrophobicContact CB-CG 4.45Å; P16-N68 WeakPolarHBondContact CA-OD1 3.42Å; P16-N68 HydrophobicContact CB-CB 4.34Å
17R75Confident68.7Low75 Ų7585.3 Ų85.328%0.28345%0.446SS..SBendtrans-80.1-25.8-176.9-80.5180173.1-14410.5111.8R15 F67 N68 D122 E125R15-R17 PolarHBondContact O-N 2.74Å; R15-R17 VanDerWaalsContact O-N 3.12Å; R17-F67 HydrophobicContact CB-CE1 3.67Å; R17-F67 HydrophobicContact CB-CZ 4.02Å; R17-F67 HydrophobicContact CG-CZ 4.43Å; R17-N68 PolarHBondContact N-OD1 3.09Å; R17-D122 IonicContact CZ-OD1 2.88Å; R17-D122 IonicContact NH1-OD1 3.65Å; R17-D122 PolarHBondContact NH1-OD1 2.92Å; R17-D122 IonicContact NH2-OD1 2.69Å; R17-E125 WeakPolarHBondContact CD-OE2 3.03Å; R17-E125 IonicContact CZ-OE2 3.83Å; R17-E125 IonicContact NE-OE2 3.76Å; R17-E125 IonicContact NH1-OE2 2.87Å; R17-E125 PolarHBondContact NH1-OE2 3.47Å
18K78.7Confident71.1Confident26 Ų2686.6 Ų86.611%0.11345%0.451CS..  trans-132139.7173.7-174.3171.2-170.7131.20112.3V64 N68 I128 N129K18-V64 HydrophobicContact CB-CG1 4.01Å; K18-V64 HydrophobicContact CD-CG1 4.18Å; K18-V64 HydrophobicContact CD-CG2 4.05Å; K18-V64 HydrophobicContact CG-CG1 4.06Å; K18-N68 PolarHBondContact N-OD1 3.25Å; K18-N68 PolarHBondContact O-ND2 2.98Å; K18-I128 HydrophobicContact CB-CD1 3.88Å; K18-I128 HydrophobicContact CD-CB 4.26Å; K18-I128 HydrophobicContact CD-CD1 3.79Å; K18-I128 HydrophobicContact CD-CG1 3.87Å; K18-I128 HydrophobicContact CG-CD1 4.47Å; K18-I128 PolarHBondContact NZ-O 2.98Å; K18-N129 WeakPolarHBondContact CD-OD1 3.46Å; K18-N129 PolarHBondContact NZ-OD1 2.81Å
19R81.7Confident73.4Confident180 Ų18083.1 Ų83.168%0.67944%0.436SS*.  trans-131.6145.5173.2-60.3-178.9-175.7-165-1.3109.4P16P16-R19 HydrophobicContact CB-CG 4.45Å
20F85.5Confident75.8Confident20 Ų2079.4 Ų79.49%0.08842%0.417CS..PPolyproline II helixtrans-80.5140.1171.6-60.5-65.4000110R26 Y27 Q30 V61 V64F20-R26 HydrophobicContact CB-CB 4.36Å; F20-R26 HydrophobicContact CD1-CB 3.69Å; F20-R26 HydrophobicContact CD2-CB 4.35Å; F20-R26 HydrophobicContact CE1-CB 4.02Å; F20-R26 HydrophobicContact CG-CB 3.87Å; F20-R26 HydrophobicContact CZ-CB 4.48Å; F20-Y27 WeakPolarHBondContact O-CD2 3.01Å; F20-Q30 HydrophobicContact CD2-CB 3.99Å; F20-Q30 HydrophobicContact CD2-CG 4.31Å; F20-Q30 HydrophobicContact CE2-CB 4.48Å; F20-V61 HydrophobicContact CD2-CG2 4.43Å; F20-V61 HydrophobicContact CE2-CB 4.21Å; F20-V61 HydrophobicContact CE2-CG1 4.33Å; F20-V61 HydrophobicContact CE2-CG2 3.88Å; F20-V61 HydrophobicContact CZ-CB 4.47Å; F20-V61 HydrophobicContact CZ-CG2 4.07Å; F20-V64 HydrophobicContact CE1-CG2 4.28Å; F20-V64 HydrophobicContact CE2-CB 3.98Å; F20-V64 HydrophobicContact CE2-CG1 3.98Å; F20-V64 HydrophobicContact CZ-CB 3.62Å; F20-V64 HydrophobicContact CZ-CG1 3.87Å; F20-V64 HydrophobicContact CZ-CG2 3.68Å
21A86.9Confident78.1Confident57 Ų5777.4 Ų77.447%0.47140%0.402SS..PPolyproline II helixtrans-69.5134.8-178.700000110.7T24 Y27A21-T24 HydrophobicContact CB-CG2 4.01Å; A21-T24 WeakPolarHBondContact O-CB 3.44Å; A21-T24 WeakPolarHBondContact O-CG2 3.36Å; A21-T24 PolarHBondContact O-N 3.13Å; A21-T24 PolarHBondContact O-OG1 2.85Å; A21-Y27 WeakPolarHBondContact O-CB 3.18Å
22P87.7Confident80.3Confident105 Ų10574.2 Ų74.268%0.68238%0.384SS*.THydrogen-bonded Turntrans-51.8141.3173.1-26.935.3000112.1T24 Y27P22-T24 VanDerWaalsContact C-N 3.33Å; P22-Y27 HydrophobicContact CB-CE1 4.35Å; P22-Y27 HydrophobicContact CG-CE2 4.21Å
23G86.3Confident82.2Confident81 Ų8167.9 Ų67.984%0.83536%0.356SS*.THydrogen-bonded Turntrans87.4-9.2-17800000115.2
24T88.8Confident83.8Confident46 Ų4666.1 Ų66.128%0.28234%0.341SS..SBendtrans-83.2154.6175.264.20000112.4A21 P22 R26 Y27 K28A21-T24 HydrophobicContact CB-CG2 4.01Å; A21-T24 WeakPolarHBondContact O-CB 3.44Å; A21-T24 WeakPolarHBondContact O-CG2 3.36Å; A21-T24 PolarHBondContact O-N 3.13Å; A21-T24 PolarHBondContact O-OG1 2.85Å; P22-T24 VanDerWaalsContact C-N 3.33Å; T24-R26 VanDerWaalsContact C-N 3.27Å; T24-R26 PolarHBondContact O-N 3.33Å; T24-Y27 WeakPolarHBondContact O-CB 3.29Å; T24-Y27 PolarHBondContact O-N 3.04Å; T24-Y27 VanDerWaalsContact O-N 3.08Å; T24-Y27 WeakPolarHBondContact OG1-CB 3.5Å; T24-Y27 PolarHBondContact OG1-N 3.42Å; T24-K28 PolarHBondContact O-N 3.17Å; T24-K28 VanDerWaalsContact O-N 3.12Å
25V88.5Confident84.8Confident64 Ų6466.5 Ų66.539%0.38836%0.355SS..Hα-helixtrans-53.3-46.2173.4175.20000110.8Y27 K28 L29V25-Y27 VanDerWaalsContact C-N 3.31Å; V25-Y27 PolarHBondContact O-N 3.07Å; V25-K28 WeakPolarHBondContact O-CB 3.43Å; V25-K28 PolarHBondContact O-N 2.89Å; V25-K28 VanDerWaalsContact O-N 3.14Å; V25-L29 HydrophobicContact CG1-CD1 4.07Å; V25-L29 HydrophobicContact CG1-CG 4.43Å; V25-L29 PolarHBondContact O-N 3.42Å
26R89.3Confident85.5Confident19 Ų1960.2 Ų60.27%0.07234%0.336CS..Hα-helixtrans-65-31.3178.7-67.2-172.4-168.7136.217.4113.8F20 T24 Q30 D57 V61 P135F20-R26 HydrophobicContact CB-CB 4.36Å; F20-R26 HydrophobicContact CD1-CB 3.69Å; F20-R26 HydrophobicContact CD2-CB 4.35Å; F20-R26 HydrophobicContact CE1-CB 4.02Å; F20-R26 HydrophobicContact CG-CB 3.87Å; F20-R26 HydrophobicContact CZ-CB 4.48Å; T24-R26 VanDerWaalsContact C-N 3.27Å; T24-R26 PolarHBondContact O-N 3.33Å; R26-Q30 VanDerWaalsContact O-CB 3.26Å; R26-Q30 WeakPolarHBondContact O-CB 3.48Å; R26-Q30 PolarHBondContact O-N 2.92Å; R26-D57 HydrophobicContact CG-CB 4.42Å; R26-D57 IonicContact CZ-OD1 2.75Å; R26-D57 VanDerWaalsContact CZ-OD1 3.25Å; R26-D57 IonicContact NE-OD1 2.8Å; R26-D57 PolarHBondContact NE-OD1 3.12Å; R26-D57 IonicContact NH2-OD1 3.79Å; R26-D57 PolarHBondContact NH2-OD1 2.83Å; R26-V61 HydrophobicContact CB-CG2 3.73Å; R26-V61 HydrophobicContact CG-CG2 3.97Å; R26-V61 WeakPolarHBondContact O-CG2 3.5Å; R26-P135 PolarHBondContact NH1-O 2.96Å; R26-P135 PolarHBondContact NH2-O 2.9Å
27Y90.6Very high86Confident72 Ų7259.4 Ų59.428%0.28233%0.329SS..Hα-helixtrans-67.2-43.2172.7-180-95.1000111.5F20 A21 P22 T24 V25 Q30 K31F20-Y27 WeakPolarHBondContact O-CD2 3.01Å; A21-Y27 WeakPolarHBondContact O-CB 3.18Å; P22-Y27 HydrophobicContact CB-CE1 4.35Å; P22-Y27 HydrophobicContact CG-CE2 4.21Å; T24-Y27 WeakPolarHBondContact O-CB 3.29Å; T24-Y27 PolarHBondContact O-N 3.04Å; T24-Y27 VanDerWaalsContact O-N 3.08Å; T24-Y27 WeakPolarHBondContact OG1-CB 3.5Å; T24-Y27 PolarHBondContact OG1-N 3.42Å; V25-Y27 VanDerWaalsContact C-N 3.31Å; V25-Y27 PolarHBondContact O-N 3.07Å; Y27-Q30 PolarHBondContact O-N 3.38Å; Y27-K31 HydrophobicContact CD1-CG 4.45Å; Y27-K31 HydrophobicContact CE1-CG 4.12Å; Y27-K31 VanDerWaalsContact CZ-CE 3.46Å; Y27-K31 WeakPolarHBondContact O-CG 3.36Å; Y27-K31 PolarHBondContact O-N 3.07Å; Y27-K31 WeakPolarHBondContact OH-CE 3.5Å
28K91.6Very high86Confident132 Ų13263.1 Ų63.157%0.57435%0.35SS*.Hα-helixtrans-59.3-48.5173.5179.4-166169.2-1460111T24 V25 Q30 K31 C32 E53T24-K28 PolarHBondContact O-N 3.17Å; T24-K28 VanDerWaalsContact O-N 3.12Å; V25-K28 WeakPolarHBondContact O-CB 3.43Å; V25-K28 PolarHBondContact O-N 2.89Å; V25-K28 VanDerWaalsContact O-N 3.14Å; K28-Q30 PolarHBondContact O-N 2.88Å; K28-K31 PolarHBondContact O-N 2.9Å; K28-C32 PolarHBondContact O-N 3.11Å; K28-E53 IonicContact NZ-OE1 2.82Å; K28-E53 PolarHBondContact NZ-OE1 3.08Å
29L90.6Very high85.8Confident2 Ų265.4 Ų65.41%0.0137%0.369CS..Hα-helixtrans-61-43.5177.4-74.8176.8000112.4V25 K31 C32 A33 P50 E53 D57 W58 V61V25-L29 HydrophobicContact CG1-CD1 4.07Å; V25-L29 HydrophobicContact CG1-CG 4.43Å; V25-L29 PolarHBondContact O-N 3.42Å; L29-K31 VanDerWaalsContact C-N 3.31Å; L29-K31 PolarHBondContact O-N 3.15Å; L29-C32 WeakPolarHBondContact O-CB 3.39Å; L29-C32 PolarHBondContact O-N 2.87Å; L29-A33 PolarHBondContact O-N 2.86Å; L29-P50 HydrophobicContact CD2-CG 4.37Å; L29-E53 HydrophobicContact CD2-CB 3.99Å; L29-E53 HydrophobicContact CD2-CG 3.63Å; L29-D57 HydrophobicContact CD1-CB 3.79Å; L29-W58 HydrophobicContact CB-CE3 4.4Å; L29-W58 HydrophobicContact CD2-CE3 4.06Å; L29-W58 HydrophobicContact CD2-CZ3 4.28Å; L29-V61 HydrophobicContact CB-CG2 3.96Å
30Q90.3Very high85.2Confident22 Ų2260.2 Ų60.210%0.10337%0.371CS..Hα-helixtrans-58.3-44175.4-178.3-178.444.500111.5F20 R26 Y27 K28 A33 Q34 V61F20-Q30 HydrophobicContact CD2-CB 3.99Å; F20-Q30 HydrophobicContact CD2-CG 4.31Å; F20-Q30 HydrophobicContact CE2-CB 4.48Å; R26-Q30 VanDerWaalsContact O-CB 3.26Å; R26-Q30 WeakPolarHBondContact O-CB 3.48Å; R26-Q30 PolarHBondContact O-N 2.92Å; Y27-Q30 PolarHBondContact O-N 3.38Å; K28-Q30 PolarHBondContact O-N 2.88Å; Q30-A33 PolarHBondContact O-N 2.82Å; Q30-Q34 WeakPolarHBondContact O-CB 3.42Å; Q30-Q34 VanDerWaalsContact O-CG 3.27Å; Q30-Q34 WeakPolarHBondContact O-CG 3.42Å; Q30-Q34 PolarHBondContact O-N 3Å; Q30-V61 HydrophobicContact CB-CG1 3.88Å; Q30-V61 HydrophobicContact CG-CG1 4.48Å
31K90.3Very high84.6Confident99 Ų9962.3 Ų62.343%0.4339%0.386SS..Hα-helixtrans-65.3-38.8177.3-68.8-62.3-177.7-175.40112.3Y27 K28 L29 Q34 A35Y27-K31 HydrophobicContact CD1-CG 4.45Å; Y27-K31 HydrophobicContact CE1-CG 4.12Å; Y27-K31 VanDerWaalsContact CZ-CE 3.46Å; Y27-K31 WeakPolarHBondContact O-CG 3.36Å; Y27-K31 PolarHBondContact O-N 3.07Å; Y27-K31 WeakPolarHBondContact OH-CE 3.5Å; K28-K31 PolarHBondContact O-N 2.9Å; L29-K31 VanDerWaalsContact C-N 3.31Å; L29-K31 PolarHBondContact O-N 3.15Å; K31-Q34 PolarHBondContact O-N 2.85Å; K31-A35 WeakPolarHBondContact O-CB 3.37Å; K31-A35 PolarHBondContact O-N 3.27Å
32C86.8Confident84.5Confident53 Ų5363.9 Ų63.936%0.35839%0.386SS..Hα-helixtrans-62.2-51.1174.9-174.80000111.6K28 L29 Q34 A35 S36K28-C32 PolarHBondContact O-N 3.11Å; L29-C32 WeakPolarHBondContact O-CB 3.39Å; L29-C32 PolarHBondContact O-N 2.87Å; C32-Q34 VanDerWaalsContact C-N 3.31Å; C32-Q34 PolarHBondContact O-N 3.05Å; C32-A35 PolarHBondContact O-N 3.35Å; C32-A35 VanDerWaalsContact O-N 3.1Å; C32-S36 PolarHBondContact O-N 3.38Å; C32-S36 PolarHBondContact O-OG 3.37Å
33A86.6Confident84.5Confident8 Ų860.2 Ų60.27%0.06636%0.359CS..Hα-helixtrans-57.1-44.1177.100000112L29 Q30 S36 L37 W58L29-A33 PolarHBondContact O-N 2.86Å; Q30-A33 PolarHBondContact O-N 2.82Å; A33-S36 PolarHBondContact O-N 3.41Å; A33-L37 PolarHBondContact O-N 3.4Å; A33-W58 HydrophobicContact CB-CH2 3.72Å; A33-W58 HydrophobicContact CB-CZ3 3.88Å
34Q87.5Confident84.6Confident55 Ų5564 Ų6426%0.25735%0.348SS..Hα-helixtrans-62.1-44.9175.5-73.5174.5-7.600111.4Q30 K31 C32 S36 L37 H38Q30-Q34 WeakPolarHBondContact O-CB 3.42Å; Q30-Q34 VanDerWaalsContact O-CG 3.27Å; Q30-Q34 WeakPolarHBondContact O-CG 3.42Å; Q30-Q34 PolarHBondContact O-N 3Å; K31-Q34 PolarHBondContact O-N 2.85Å; C32-Q34 VanDerWaalsContact C-N 3.31Å; C32-Q34 PolarHBondContact O-N 3.05Å; Q34-S36 PolarHBondContact O-N 3.44Å; Q34-L37 PolarHBondContact O-N 3.02Å; Q34-H38 PolarHBondContact O-CE1 3.03Å; Q34-H38 PolarHBondContact O-N 3.31Å; Q34-H38 PolarHBondContact O-ND1 2.95Å
35A83.6Confident84.5Confident63 Ų6366.1 Ų66.152%0.52136%0.361SS..Hα-helixtrans-60.3-44.4179.500000112.6K31 C32 L37 H38 S39K31-A35 WeakPolarHBondContact O-CB 3.37Å; K31-A35 PolarHBondContact O-N 3.27Å; C32-A35 PolarHBondContact O-N 3.35Å; C32-A35 VanDerWaalsContact O-N 3.1Å; A35-L37 VanDerWaalsContact C-N 3.28Å; A35-L37 PolarHBondContact O-N 3.37Å; A35-H38 PolarHBondContact O-N 3.45Å; A35-S39 PolarHBondContact O-N 3.46Å
36S79.3Confident84.6Confident38 Ų3863.3 Ų63.327%0.26635%0.345SS..Hα-helixtrans-62.9-33.3177.8-61.80000113.2C32 A33 Q34 S39C32-S36 PolarHBondContact O-N 3.38Å; C32-S36 PolarHBondContact O-OG 3.37Å; A33-S36 PolarHBondContact O-N 3.41Å; Q34-S36 PolarHBondContact O-N 3.44Å; S36-S39 PolarHBondContact O-OG 3.12Å
37L79.9Confident84.8Confident30 Ų3062.4 Ų62.416%0.15734%0.341CS..Hα-helixtrans-70.7-33.8177.7-176.165.1000112.7A33 Q34 A35 F43 R69 T183 H187A33-L37 PolarHBondContact O-N 3.4Å; Q34-L37 PolarHBondContact O-N 3.02Å; A35-L37 VanDerWaalsContact C-N 3.28Å; A35-L37 PolarHBondContact O-N 3.37Å; L37-F43 HydrophobicContact CD1-CD1 3.93Å; L37-F43 HydrophobicContact CD1-CE1 3.34Å; L37-F43 HydrophobicContact CD1-CZ 4.16Å; L37-R69 VanDerWaalsContact CD2-NH1 3.3Å; L37-T183 HydrophobicContact CD1-CG2 4.3Å; L37-H187 HydrophobicContact CD1-CB 4.27Å
38H76.4Confident85Confident154 Ų15463 Ų6371%0.71335%0.347SS*.Hα-helixtrans-86.7-15.9-177.6-62.5102.7000113.7Q34 A35 G40Q34-H38 PolarHBondContact O-CE1 3.03Å; Q34-H38 PolarHBondContact O-N 3.31Å; Q34-H38 PolarHBondContact O-ND1 2.95Å; A35-H38 PolarHBondContact O-N 3.45Å; H38-G40 PolarHBondContact O-N 3.16Å
39S73.3Confident85.2Confident73 Ų7359.6 Ų59.651%0.5133%0.334SS..THydrogen-bonded Turntrans-76.9-1.6-179.358.40000114.2A35 S36 V41A35-S39 PolarHBondContact O-N 3.46Å; S36-S39 PolarHBondContact O-OG 3.12Å; S39-V41 PolarHBondContact O-N 3.28Å; S39-V41 WeakPolarHBondContact OG-CG2 3.43Å
40G70.2Confident85.4Confident71 Ų7160.7 Ų60.773%0.73234%0.342SS*.THydrogen-bonded Turntrans72.112.5-179.100000114H38H38-G40 PolarHBondContact O-N 3.16Å
41V72.2Confident85.6Confident64 Ų6465.1 Ų65.139%0.38837%0.373SS..  trans-64.4154.1174174.60000110S39 F43 V45S39-V41 PolarHBondContact O-N 3.28Å; S39-V41 WeakPolarHBondContact OG-CG2 3.43Å; V41-F43 PolarHBondContact O-N 3.4Å; V41-V45 HydrophobicContact CG1-CB 3.69Å; V41-V45 HydrophobicContact CG1-CG1 3.74Å
42D85Confident85.7Confident90 Ų9070.3 Ų70.348%0.48140%0.398SS..  trans-54.3131.4172.6-169.7-36.8000110.2R44 V45 A46D42-R44 PolarHBondContact O-N 2.92Å; D42-R44 VanDerWaalsContact O-N 3.12Å; D42-R44 WeakPolarHBondContact OD1-CB 3.37Å; D42-R44 WeakPolarHBondContact OD1-CG 3.39Å; D42-R44 PolarHBondContact OD1-N 3.2Å; D42-V45 HydrophobicContact CB-CG2 4.34Å; D42-V45 WeakPolarHBondContact O-CB 3.39Å; D42-V45 PolarHBondContact O-N 2.86Å; D42-A46 PolarHBondContact O-N 3.32Å
43F87.9Confident86.1Confident28 Ų2869.9 Ų69.912%0.12339%0.391CS..Hα-helixtrans-55.8-30.4178.5-72.5-90.4000112.7L37 V41 V45 A46 V47 T183 K186 H187 C190L37-F43 HydrophobicContact CD1-CD1 3.93Å; L37-F43 HydrophobicContact CD1-CE1 3.34Å; L37-F43 HydrophobicContact CD1-CZ 4.16Å; V41-F43 PolarHBondContact O-N 3.4Å; F43-V45 VanDerWaalsContact C-N 3.26Å; F43-V45 PolarHBondContact O-N 3.45Å; F43-A46 PolarHBondContact O-N 2.91Å; F43-V47 WeakPolarHBondContact O-CG1 3.34Å; F43-V47 WeakPolarHBondContact O-CG2 3.4Å; F43-V47 PolarHBondContact O-N 3.36Å; F43-T183 HydrophobicContact CE1-CG2 4.14Å; F43-T183 WeakPolarHBondContact CE1-O 3.42Å; F43-T183 HydrophobicContact CZ-CG2 3.95Å; F43-K186 HydrophobicContact CD1-CB 4.06Å; F43-K186 HydrophobicContact CD2-CB 3.95Å; F43-K186 HydrophobicContact CD2-CD 4.15Å; F43-K186 HydrophobicContact CE1-CB 3.98Å; F43-K186 HydrophobicContact CE2-CB 3.96Å; F43-K186 HydrophobicContact CE2-CD 3.77Å; F43-K186 VanDerWaalsContact CE2-CE 3.44Å; F43-K186 HydrophobicContact CG-CB 4.02Å; F43-K186 HydrophobicContact CZ-CB 3.96Å; F43-K186 HydrophobicContact CZ-CD 4.28Å; F43-H187 HydrophobicContact CD1-CB 3.74Å; F43-H187 HydrophobicContact CE1-CB 3.84Å; F43-C190 HydrophobicContact CB-CB 4.13Å
44R87.3Confident86.5Confident160 Ų16073.2 Ų73.260%0.60441%0.408SS*.Hα-helixtrans-64.4-31.5175.9-65.2178.6179.2-137.8-0.5112.9D42 V47 Q48D42-R44 PolarHBondContact O-N 2.92Å; D42-R44 VanDerWaalsContact O-N 3.12Å; D42-R44 WeakPolarHBondContact OD1-CB 3.37Å; D42-R44 WeakPolarHBondContact OD1-CG 3.39Å; D42-R44 PolarHBondContact OD1-N 3.2Å; R44-V47 WeakPolarHBondContact O-CG2 3.35Å; R44-Q48 WeakPolarHBondContact O-CG 3.23Å; R44-Q48 PolarHBondContact O-NE2 3.49Å
45V88.4Confident86.9Confident91 Ų9173.5 Ų73.555%0.55241%0.411SS*.Hα-helixtrans-82.6-38.9174.91770000109.9V41 D42 F43 V47 Q48V41-V45 HydrophobicContact CG1-CB 3.69Å; V41-V45 HydrophobicContact CG1-CG1 3.74Å; D42-V45 HydrophobicContact CB-CG2 4.34Å; D42-V45 WeakPolarHBondContact O-CB 3.39Å; D42-V45 PolarHBondContact O-N 2.86Å; F43-V45 VanDerWaalsContact C-N 3.26Å; F43-V45 PolarHBondContact O-N 3.45Å; V45-V47 PolarHBondContact O-N 3.49Å; V45-Q48 WeakPolarHBondContact O-CB 3.39Å; V45-Q48 PolarHBondContact O-N 3.4Å; V45-Q48 VanDerWaalsContact O-N 3.15Å
46A89.4Confident87.5Confident5 Ų572.4 Ų72.44%0.04140%0.396CS..Hα-helixtrans-62.6-24.5-17900000114D42 F43D42-A46 PolarHBondContact O-N 3.32Å; F43-A46 PolarHBondContact O-N 2.91Å
47V94.4Very high88.3Confident0 Ų071.7 Ų71.70%039%0.389CS..THydrogen-bonded Turntrans-89.7-7.3179.5-62.30000114F43 R44 V45 W58 C190 F191 E194 Y195F43-V47 WeakPolarHBondContact O-CG1 3.34Å; F43-V47 WeakPolarHBondContact O-CG2 3.4Å; F43-V47 PolarHBondContact O-N 3.36Å; R44-V47 WeakPolarHBondContact O-CG2 3.35Å; V45-V47 PolarHBondContact O-N 3.49Å; V47-W58 PolarHBondContact O-NE1 3.44Å; V47-C190 HydrophobicContact CG1-CB 4.04Å; V47-C190 HydrophobicContact CG2-CB 4.25Å; V47-F191 HydrophobicContact CB-CB 4.33Å; V47-F191 HydrophobicContact CB-CD2 3.95Å; V47-F191 HydrophobicContact CG1-CB 3.79Å; V47-F191 HydrophobicContact CG1-CD2 4.07Å; V47-F191 HydrophobicContact CG1-CG 4.47Å; V47-E194 HydrophobicContact CG2-CB 4.13Å; V47-E194 HydrophobicContact CG2-CG 4.21Å; V47-Y195 WeakPolarHBondContact O-CE2 3.41Å; V47-Y195 PolarHBondContact O-OH 3.27Å
48Q95.2Very high89.1Confident86 Ų8670.4 Ų70.440%0.40238%0.382SS..SBendtrans-66.2140-177.4-66.5-62.6-44.600111.2R44 V45 P50 W58 E194R44-Q48 WeakPolarHBondContact O-CG 3.23Å; R44-Q48 PolarHBondContact O-NE2 3.49Å; V45-Q48 WeakPolarHBondContact O-CB 3.39Å; V45-Q48 PolarHBondContact O-N 3.4Å; V45-Q48 VanDerWaalsContact O-N 3.15Å; Q48-P50 WeakPolarHBondContact O-CD 3.36Å; Q48-W58 VanDerWaalsContact O-CZ2 3.28Å; Q48-W58 WeakPolarHBondContact O-CZ2 3.22Å; Q48-E194 PolarHBondContact NE2-OE1 2.94Å; Q48-E194 PolarHBondContact NE2-OE2 3.19Å
49L95.8Very high90.1Very high59 Ų5963 Ų6331%0.30935%0.348SS..PPolyproline II helixtrans-62.1123.1175.5177.265.1000108E53 L55 W58 Y195L49-E53 HydrophobicContact CD1-CB 4.08Å; L49-L55 HydrophobicContact CD2-CB 4.15Å; L49-L55 HydrophobicContact CD2-CD1 4.42Å; L49-W58 HydrophobicContact CD1-CB 3.46Å; L49-W58 VanDerWaalsContact CD1-CB 3.46Å; L49-W58 HydrophobicContact CD1-CD2 4.37Å; L49-W58 HydrophobicContact CD1-CG 3.66Å; L49-Y195 PolarHBondContact N-OH 3.19Å
50P94Very high91.2Very high25 Ų2559.6 Ų59.616%0.16232%0.324CS..PPolyproline II helixtrans-62.2150.7175.9-2031.4000111.1L29 Q48 E52 E53 W58L29-P50 HydrophobicContact CD2-CG 4.37Å; Q48-P50 WeakPolarHBondContact O-CD 3.36Å; P50-E52 PolarHBondContact O-N 3.45Å; P50-E53 HydrophobicContact CB-CB 4.47Å; P50-E53 HydrophobicContact CB-CG 3.87Å; P50-E53 HydrophobicContact CG-CG 4.38Å; P50-E53 PolarHBondContact O-N 3.08Å; P50-W58 HydrophobicContact CG-CE3 4.43Å; P50-W58 HydrophobicContact CG-CH2 4.12Å; P50-W58 HydrophobicContact CG-CZ3 4.04Å
51P93.3Very high92.4Very high116 Ų11656.2 Ų56.275%0.75329%0.29SS*.THydrogen-bonded Turntrans-53.9139.4179.5-25.134000112E53P51-E53 PolarHBondContact O-N 2.92Å; P51-E53 VanDerWaalsContact O-N 3.09Å
52E93.4Very high93.6Very high208 Ų20853.2 Ų53.297%0.97227%0.271SS*.THydrogen-bonded Turntrans65.54.3175.7-51.4175.3178.900115.6P50P50-E52 PolarHBondContact O-N 3.45Å
53E94.9Very high94.3Very high43 Ų4349 Ų4920%0.20125%0.248CC..  trans-89.4156.3177-62.3-72.9179.500111.8K28 L29 L49 P50 P51K28-E53 IonicContact NZ-OE1 2.82Å; K28-E53 PolarHBondContact NZ-OE1 3.08Å; L29-E53 HydrophobicContact CD2-CB 3.99Å; L29-E53 HydrophobicContact CD2-CG 3.63Å; L49-E53 HydrophobicContact CD1-CB 4.08Å; P50-E53 HydrophobicContact CB-CB 4.47Å; P50-E53 HydrophobicContact CB-CG 3.87Å; P50-E53 HydrophobicContact CG-CG 4.38Å; P50-E53 PolarHBondContact O-N 3.08Å; P51-E53 PolarHBondContact O-N 2.92Å; P51-E53 VanDerWaalsContact O-N 3.09Å
54N94.6Very high94.7Very high78 Ų7847.6 Ų47.642%0.41724%0.243SC..  trans-80.6130.2179.9-176.9-75.4000111.7N56 D57 W58N54-N56 PolarHBondContact O-N 2.88Å; N54-N56 WeakPolarHBondContact OD1-CA 3.21Å; N54-N56 WeakPolarHBondContact OD1-CB 3.38Å; N54-N56 PolarHBondContact OD1-N 2.92Å; N54-D57 HydrophobicContact CB-CB 4.17Å; N54-D57 WeakPolarHBondContact CB-OD2 3.16Å; N54-D57 PolarHBondContact O-N 2.78Å; N54-D57 PolarHBondContact OD1-N 2.87Å; N54-D57 VanDerWaalsContact OD1-N 3.13Å; N54-W58 PolarHBondContact O-N 3.4Å
55L96.3Very high95Very high62 Ų6240.9 Ų40.933%0.32522%0.219SC..Hα-helixtrans-60.4-40.2179.917860.3000113.3L49 W58 I59 Y195L49-L55 HydrophobicContact CD2-CB 4.15Å; L49-L55 HydrophobicContact CD2-CD1 4.42Å; L55-W58 WeakPolarHBondContact O-CB 3.4Å; L55-W58 PolarHBondContact O-N 3.03Å; L55-I59 HydrophobicContact CD1-CD1 3.94Å; L55-I59 HydrophobicContact CD1-CG1 4.16Å; L55-I59 HydrophobicContact CG-CD1 3.91Å; L55-I59 WeakPolarHBondContact O-CG1 3.22Å; L55-I59 PolarHBondContact O-N 3.12Å; L55-Y195 HydrophobicContact CD1-CD1 3.68Å; L55-Y195 HydrophobicContact CD1-CE1 3.4Å
56N97.3Very high95.5Very high40 Ų4036.6 Ų36.621%0.21419%0.192CC..Hα-helixtrans-71-38.1-178.4-65.7-17.7000111.3N54 W58 I59 A60 F142 F146 H147N54-N56 PolarHBondContact O-N 2.88Å; N54-N56 WeakPolarHBondContact OD1-CA 3.21Å; N54-N56 WeakPolarHBondContact OD1-CB 3.38Å; N54-N56 PolarHBondContact OD1-N 2.92Å; N56-W58 VanDerWaalsContact C-N 3.31Å; N56-W58 PolarHBondContact O-N 2.88Å; N56-I59 PolarHBondContact O-N 3.05Å; N56-A60 VanDerWaalsContact O-CB 3.26Å; N56-A60 WeakPolarHBondContact O-CB 3.12Å; N56-A60 PolarHBondContact O-N 2.84Å; N56-F142 HydrophobicContact CB-CB 4.35Å; N56-F142 HydrophobicContact CB-CD1 4.17Å; N56-F142 HydrophobicContact CB-CD2 3.39Å; N56-F142 HydrophobicContact CB-CE1 4.27Å; N56-F142 HydrophobicContact CB-CE2 3.51Å; N56-F142 HydrophobicContact CB-CG 3.72Å; N56-F142 HydrophobicContact CB-CZ 3.94Å; N56-F146 HydrophobicContact CB-CD1 3.95Å; N56-F146 HydrophobicContact CB-CE1 3.63Å; N56-F146 HydrophobicContact CB-CZ 4.39Å; N56-F146 WeakPolarHBondContact O-CZ 3.35Å; N56-H147 PolarHBondContact OD1-NE2 3.16Å
57D95.5Very high95.8Very high23 Ų2336.3 Ų36.312%0.12319%0.19CC..Hα-helixtrans-63.1-39.9171.5-74-58.3000111.7R26 L29 N54 A60 V61R26-D57 HydrophobicContact CG-CB 4.42Å; R26-D57 IonicContact CZ-OD1 2.75Å; R26-D57 VanDerWaalsContact CZ-OD1 3.25Å; R26-D57 IonicContact NE-OD1 2.8Å; R26-D57 PolarHBondContact NE-OD1 3.12Å; R26-D57 IonicContact NH2-OD1 3.79Å; R26-D57 PolarHBondContact NH2-OD1 2.83Å; L29-D57 HydrophobicContact CD1-CB 3.79Å; N54-D57 HydrophobicContact CB-CB 4.17Å; N54-D57 WeakPolarHBondContact CB-OD2 3.16Å; N54-D57 PolarHBondContact O-N 2.78Å; N54-D57 PolarHBondContact OD1-N 2.87Å; N54-D57 VanDerWaalsContact OD1-N 3.13Å; D57-A60 PolarHBondContact O-N 2.81Å; D57-V61 WeakPolarHBondContact O-CB 3.44Å; D57-V61 VanDerWaalsContact O-CG2 3.28Å; D57-V61 WeakPolarHBondContact O-CG2 3.15Å; D57-V61 PolarHBondContact O-N 3.07Å
58W96.6Very high95.9Very high2 Ų236.8 Ų36.81%0.00819%0.193CC..Hα-helixtrans-61.5-47.1175.3-174.9-122.3000112.5L29 A33 V47 Q48 L49 P50 N54 L55 N56 V61 H62 F191 Y195L29-W58 HydrophobicContact CB-CE3 4.4Å; L29-W58 HydrophobicContact CD2-CE3 4.06Å; L29-W58 HydrophobicContact CD2-CZ3 4.28Å; A33-W58 HydrophobicContact CB-CH2 3.72Å; A33-W58 HydrophobicContact CB-CZ3 3.88Å; V47-W58 PolarHBondContact O-NE1 3.44Å; Q48-W58 VanDerWaalsContact O-CZ2 3.28Å; Q48-W58 WeakPolarHBondContact O-CZ2 3.22Å; L49-W58 HydrophobicContact CD1-CB 3.46Å; L49-W58 VanDerWaalsContact CD1-CB 3.46Å; L49-W58 HydrophobicContact CD1-CD2 4.37Å; L49-W58 HydrophobicContact CD1-CG 3.66Å; P50-W58 HydrophobicContact CG-CE3 4.43Å; P50-W58 HydrophobicContact CG-CH2 4.12Å; P50-W58 HydrophobicContact CG-CZ3 4.04Å; N54-W58 PolarHBondContact O-N 3.4Å; L55-W58 WeakPolarHBondContact O-CB 3.4Å; L55-W58 PolarHBondContact O-N 3.03Å; N56-W58 VanDerWaalsContact C-N 3.31Å; N56-W58 PolarHBondContact O-N 2.88Å; W58-V61 PolarHBondContact O-N 3.15Å; W58-H62 AromaticContact CD2-CE1 3.49Å; W58-H62 VanDerWaalsContact CD2-CE1 3.49Å; W58-H62 AromaticContact CD2-ND1 3.69Å; W58-H62 AromaticContact CE2-CE1 3.21Å; W58-H62 AromaticContact CE2-ND1 3.74Å; W58-H62 AromaticContact CE3-CE1 3.66Å; W58-H62 AromaticContact CH2-CE1 3.39Å; W58-H62 WeakPolarHBondContact CH2-CE1 3.45Å; W58-H62 AromaticContact CZ2-CE1 3.17Å; W58-H62 WeakPolarHBondContact CZ2-CE1 3.22Å; W58-H62 AromaticContact CZ2-NE2 3.79Å; W58-H62 AromaticContact CZ3-CE1 3.61Å; W58-H62 AromaticContact NE1-CE1 3.87Å; W58-H62 PolarHBondContact O-N 2.97Å; W58-H62 VanDerWaalsContact O-N 3.11Å; W58-H62 PolarHBondContact O-ND1 2.82Å; W58-F191 AromaticContact CD1-CE2 3.97Å; W58-F191 AromaticContact NE1-CE2 3.75Å; W58-Y195 AromaticContact CD1-CE2 3.89Å; W58-Y195 AromaticContact CD1-CZ 3.73Å; W58-Y195 VanDerWaalsContact CD1-OH 3.29Å; W58-Y195 AromaticContact NE1-CE2 3.81Å; W58-Y195 AromaticContact NE1-CZ 3.81Å; W58-Y195 PolarHBondContact NE1-OH 3.31Å; W58-Y195 VanDerWaalsContact NE1-OH 3.15Å
59I98Very high95.9Very high0 Ų033.9 Ų33.90%018%0.178CC..Hα-helixtrans-62.8-44.7174.9-68.4168.7000111.1L55 N56 V61 H62 V63 F146 H147 C150 F191 L197L55-I59 HydrophobicContact CD1-CD1 3.94Å; L55-I59 HydrophobicContact CD1-CG1 4.16Å; L55-I59 HydrophobicContact CG-CD1 3.91Å; L55-I59 WeakPolarHBondContact O-CG1 3.22Å; L55-I59 PolarHBondContact O-N 3.12Å; N56-I59 PolarHBondContact O-N 3.05Å; I59-V61 VanDerWaalsContact C-N 3.3Å; I59-V61 PolarHBondContact O-N 3.4Å; I59-H62 PolarHBondContact O-N 3.21Å; I59-H62 VanDerWaalsContact O-N 3.14Å; I59-V63 HydrophobicContact CG2-CG2 4.11Å; I59-V63 WeakPolarHBondContact O-CG2 3.37Å; I59-V63 PolarHBondContact O-N 3.18Å; I59-F146 HydrophobicContact CB-CE1 4.07Å; I59-F146 HydrophobicContact CB-CZ 4.19Å; I59-F146 HydrophobicContact CG2-CE1 3.94Å; I59-F146 HydrophobicContact CG2-CZ 3.91Å; I59-H147 WeakPolarHBondContact CD1-CE1 3.4Å; I59-C150 HydrophobicContact CG2-CB 3.99Å; I59-F191 HydrophobicContact CB-CZ 4.45Å; I59-F191 HydrophobicContact CG1-CZ 4Å; I59-L197 HydrophobicContact CD1-CD1 4.49Å; I59-L197 HydrophobicContact CD1-CD2 4.42Å; I59-L197 HydrophobicContact CG1-CD1 4.36Å; I59-L197 HydrophobicContact CG2-CD1 4.14Å
60A96.6Very high95.9Very high0 Ų031 Ų310%016%0.163CC..Hα-helixtrans-59.4-42.9179.400000111.7N56 D57 V64 F134 F142 F146N56-A60 VanDerWaalsContact O-CB 3.26Å; N56-A60 WeakPolarHBondContact O-CB 3.12Å; N56-A60 PolarHBondContact O-N 2.84Å; D57-A60 PolarHBondContact O-N 2.81Å; A60-V64 WeakPolarHBondContact O-CG2 3.49Å; A60-V64 PolarHBondContact O-N 2.92Å; A60-F134 HydrophobicContact CB-CD1 3.9Å; A60-F134 HydrophobicContact CB-CE1 4.04Å; A60-F142 HydrophobicContact CB-CE1 4.04Å; A60-F142 HydrophobicContact CB-CZ 4.05Å; A60-F146 HydrophobicContact CB-CE2 4.31Å; A60-F146 HydrophobicContact CB-CZ 3.98Å
61V95.3Very high96Very high1 Ų129.9 Ų29.91%0.00616%0.156CC..Hα-helixtrans-59.8-46.3175.1165.70000111.5F20 R26 L29 Q30 D57 W58 I59 V64 D65F20-V61 HydrophobicContact CD2-CG2 4.43Å; F20-V61 HydrophobicContact CE2-CB 4.21Å; F20-V61 HydrophobicContact CE2-CG1 4.33Å; F20-V61 HydrophobicContact CE2-CG2 3.88Å; F20-V61 HydrophobicContact CZ-CB 4.47Å; F20-V61 HydrophobicContact CZ-CG2 4.07Å; R26-V61 HydrophobicContact CB-CG2 3.73Å; R26-V61 HydrophobicContact CG-CG2 3.97Å; R26-V61 WeakPolarHBondContact O-CG2 3.5Å; L29-V61 HydrophobicContact CB-CG2 3.96Å; Q30-V61 HydrophobicContact CB-CG1 3.88Å; Q30-V61 HydrophobicContact CG-CG1 4.48Å; D57-V61 WeakPolarHBondContact O-CB 3.44Å; D57-V61 VanDerWaalsContact O-CG2 3.28Å; D57-V61 WeakPolarHBondContact O-CG2 3.15Å; D57-V61 PolarHBondContact O-N 3.07Å; W58-V61 PolarHBondContact O-N 3.15Å; I59-V61 VanDerWaalsContact C-N 3.3Å; I59-V61 PolarHBondContact O-N 3.4Å; V61-V64 PolarHBondContact O-N 3.46Å; V61-D65 WeakPolarHBondContact O-CB 3.48Å; V61-D65 PolarHBondContact O-N 3Å
62H97.4Very high96Very high1 Ų127.3 Ų27.31%0.00514%0.135CC..Hα-helixtrans-68.9-41.2-179-7977.1000113.1W58 I59 V64 D65 F66 H187 F191W58-H62 AromaticContact CD2-CE1 3.49Å; W58-H62 VanDerWaalsContact CD2-CE1 3.49Å; W58-H62 AromaticContact CD2-ND1 3.69Å; W58-H62 AromaticContact CE2-CE1 3.21Å; W58-H62 AromaticContact CE2-ND1 3.74Å; W58-H62 AromaticContact CE3-CE1 3.66Å; W58-H62 AromaticContact CH2-CE1 3.39Å; W58-H62 WeakPolarHBondContact CH2-CE1 3.45Å; W58-H62 AromaticContact CZ2-CE1 3.17Å; W58-H62 WeakPolarHBondContact CZ2-CE1 3.22Å; W58-H62 AromaticContact CZ2-NE2 3.79Å; W58-H62 AromaticContact CZ3-CE1 3.61Å; W58-H62 AromaticContact NE1-CE1 3.87Å; W58-H62 PolarHBondContact O-N 2.97Å; W58-H62 VanDerWaalsContact O-N 3.11Å; W58-H62 PolarHBondContact O-ND1 2.82Å; I59-H62 PolarHBondContact O-N 3.21Å; I59-H62 VanDerWaalsContact O-N 3.14Å; H62-V64 VanDerWaalsContact C-N 3.29Å; H62-V64 PolarHBondContact O-N 3.12Å; H62-D65 PolarHBondContact O-N 3.48Å; H62-F66 HydrophobicContact CB-CD2 4.2Å; H62-F66 HydrophobicContact CB-CE2 3.89Å; H62-F66 WeakPolarHBondContact O-CB 3.43Å; H62-F66 WeakPolarHBondContact O-CD2 3.49Å; H62-F66 WeakPolarHBondContact O-CG 3.37Å; H62-F66 PolarHBondContact O-N 2.87Å; H62-H187 AromaticContact CD2-CE1 3.66Å; H62-H187 AromaticContact CD2-NE2 3.69Å; H62-H187 AromaticContact NE2-CE1 3.82Å; H62-H187 AromaticContact NE2-NE2 3.63Å; H62-F191 HydrophobicContact CB-CD1 4.06Å; H62-F191 HydrophobicContact CB-CD2 4.03Å; H62-F191 HydrophobicContact CB-CE1 3.58Å; H62-F191 HydrophobicContact CB-CE2 3.58Å; H62-F191 HydrophobicContact CB-CG 4.28Å; H62-F191 HydrophobicContact CB-CZ 3.35Å; H62-F191 AromaticContact CD2-CD2 3.32Å; H62-F191 WeakPolarHBondContact CD2-CD2 3.5Å; H62-F191 AromaticContact CD2-CE2 3.45Å; H62-F191 VanDerWaalsContact CD2-CE2 3.45Å; H62-F191 WeakPolarHBondContact CD2-CE2 3.43Å; H62-F191 AromaticContact CD2-CG 3.98Å; H62-F191 AromaticContact CE1-CE2 3.9Å; H62-F191 AromaticContact CG-CD2 3.52Å; H62-F191 AromaticContact CG-CE2 3.13Å; H62-F191 AromaticContact CG-CZ 3.49Å; H62-F191 VanDerWaalsContact CG-CZ 3.49Å; H62-F191 AromaticContact ND1-CE2 3.43Å; H62-F191 WeakPolarHBondContact ND1-CE2 3.43Å; H62-F191 AromaticContact ND1-CZ 3.9Å; H62-F191 AromaticContact NE2-CD2 3.9Å; H62-F191 AromaticContact NE2-CE2 3.94Å
63V98Very high96Very high0 Ų017.5 Ų17.50%09%0.09CC..Hα-helixtrans-58.2-44.6176.2170.30000110.5I59 F67 I128 F134 C150 I153 L154I59-V63 HydrophobicContact CG2-CG2 4.11Å; I59-V63 WeakPolarHBondContact O-CG2 3.37Å; I59-V63 PolarHBondContact O-N 3.18Å; V63-F67 VanDerWaalsContact O-CB 3.3Å; V63-F67 WeakPolarHBondContact O-CB 3.26Å; V63-F67 PolarHBondContact O-N 3.3Å; V63-I128 HydrophobicContact CG1-CG2 4.08Å; V63-F134 HydrophobicContact CB-CE1 4.38Å; V63-F134 HydrophobicContact CG1-CE1 4.26Å; V63-F134 HydrophobicContact CG1-CZ 4.04Å; V63-C150 HydrophobicContact CG2-CB 3.99Å; V63-I153 HydrophobicContact CG1-CB 4.46Å; V63-I153 HydrophobicContact CG1-CD1 4.18Å; V63-I153 HydrophobicContact CG1-CG2 3.8Å; V63-L154 HydrophobicContact CG2-CD1 4.01Å; V63-L154 HydrophobicContact CG2-CD2 4.26Å; V63-L154 HydrophobicContact CG2-CG 4.16Å
64V96.2Very high96Very high0 Ų016 Ų160%08%0.082CC..Hα-helixtrans-68.2-39.9177174.70000111.9K18 F20 A60 V61 H62 N68 I128K18-V64 HydrophobicContact CB-CG1 4.01Å; K18-V64 HydrophobicContact CD-CG1 4.18Å; K18-V64 HydrophobicContact CD-CG2 4.05Å; K18-V64 HydrophobicContact CG-CG1 4.06Å; F20-V64 HydrophobicContact CE1-CG2 4.28Å; F20-V64 HydrophobicContact CE2-CB 3.98Å; F20-V64 HydrophobicContact CE2-CG1 3.98Å; F20-V64 HydrophobicContact CZ-CB 3.62Å; F20-V64 HydrophobicContact CZ-CG1 3.87Å; F20-V64 HydrophobicContact CZ-CG2 3.68Å; A60-V64 WeakPolarHBondContact O-CG2 3.49Å; A60-V64 PolarHBondContact O-N 2.92Å; V61-V64 PolarHBondContact O-N 3.46Å; H62-V64 VanDerWaalsContact C-N 3.29Å; H62-V64 PolarHBondContact O-N 3.12Å; V64-N68 WeakPolarHBondContact O-CB 3.48Å; V64-N68 PolarHBondContact O-N 3.33Å; V64-N68 PolarHBondContact O-ND2 3.03Å; V64-I128 HydrophobicContact CG2-CB 4.22Å; V64-I128 HydrophobicContact CG2-CD1 4.29Å; V64-I128 HydrophobicContact CG2-CG2 4.34Å
65D95.2Very high96Very high19 Ų1913 Ų1310%0.1027%0.07CC..Hα-helixtrans-61-50.7175.3-173.964.3000111.4V61 H62 F67 N68 R69V61-D65 WeakPolarHBondContact O-CB 3.48Å; V61-D65 PolarHBondContact O-N 3Å; H62-D65 PolarHBondContact O-N 3.48Å; D65-F67 PolarHBondContact O-N 3.48Å; D65-N68 PolarHBondContact O-N 2.93Å; D65-R69 WeakPolarHBondContact O-CB 3.3Å; D65-R69 WeakPolarHBondContact O-CD 3.29Å; D65-R69 VanDerWaalsContact O-CG 3.26Å; D65-R69 WeakPolarHBondContact O-CG 3.32Å; D65-R69 PolarHBondContact O-N 2.69Å; D65-R69 WeakPolarHBondContact OD2-CD 3.45Å; D65-R69 IonicContact OD2-CZ 2.85Å; D65-R69 IonicContact OD2-NE 3.56Å; D65-R69 IonicContact OD2-NH1 3.25Å; D65-R69 PolarHBondContact OD2-NH1 3.25Å
66F97.5Very high95.9Very high0 Ų013.4 Ų13.40%08%0.075CC..Hα-helixtrans-62.5-44.5178.7-69.2-50.8000112.1H62 N68 R69 I70 L154 H187 F188 F191H62-F66 HydrophobicContact CB-CD2 4.2Å; H62-F66 HydrophobicContact CB-CE2 3.89Å; H62-F66 WeakPolarHBondContact O-CB 3.43Å; H62-F66 WeakPolarHBondContact O-CD2 3.49Å; H62-F66 WeakPolarHBondContact O-CG 3.37Å; H62-F66 PolarHBondContact O-N 2.87Å; F66-N68 PolarHBondContact O-N 3.09Å; F66-R69 PolarHBondContact O-N 2.82Å; F66-I70 HydrophobicContact CB-CD1 4.33Å; F66-I70 VanDerWaalsContact O-CB 3.29Å; F66-I70 WeakPolarHBondContact O-CB 3.38Å; F66-I70 WeakPolarHBondContact O-CD1 3.41Å; F66-I70 WeakPolarHBondContact O-CG1 3.3Å; F66-I70 PolarHBondContact O-N 2.87Å; F66-L154 HydrophobicContact CD2-CD2 3.95Å; F66-H187 HydrophobicContact CE1-CB 4.07Å; F66-H187 AromaticContact CE1-CE1 3.83Å; F66-H187 AromaticContact CE1-CG 3.7Å; F66-H187 AromaticContact CE1-ND1 3.22Å; F66-H187 WeakPolarHBondContact CE1-ND1 3.3Å; F66-H187 HydrophobicContact CZ-CB 4.49Å; F66-H187 AromaticContact CZ-CE1 3.66Å; F66-H187 AromaticContact CZ-CG 3.83Å; F66-H187 AromaticContact CZ-ND1 3.48Å; F66-H187 WeakPolarHBondContact CZ-ND1 3.28Å; F66-F188 HydrophobicContact CB-CD2 4.14Å; F66-F188 HydrophobicContact CB-CE2 4.5Å; F66-F188 HydrophobicContact CD1-CB 4.07Å; F66-F188 AromaticContact CD1-CD2 3.84Å; F66-F188 HydrophobicContact CD1-CD2 3.84Å; F66-F188 HydrophobicContact CD1-CG 4.46Å; F66-F188 HydrophobicContact CD2-CD2 4.06Å; F66-F188 VanDerWaalsContact CE1-CA 3.4Å; F66-F188 HydrophobicContact CE1-CB 3.79Å; F66-F188 HydrophobicContact CE1-CD2 4.26Å; F66-F188 HydrophobicContact CE1-CG 4.5Å; F66-F188 HydrophobicContact CE2-CD2 4.47Å; F66-F188 AromaticContact CG-CD2 3.75Å; F66-F188 HydrophobicContact CG-CD2 3.75Å; F66-F188 HydrophobicContact CG-CE2 4.43Å; F66-F188 VanDerWaalsContact CZ-CA 3.47Å; F66-F188 HydrophobicContact CZ-CB 4.27Å; F66-F191 HydrophobicContact CE2-CB 3.78Å; F66-F191 AromaticContact CE2-CD1 3.66Å; F66-F191 HydrophobicContact CE2-CD1 3.66Å; F66-F191 HydrophobicContact CE2-CE1 4.45Å; F66-F191 AromaticContact CE2-CG 3.71Å; F66-F191 HydrophobicContact CE2-CG 3.71Å; F66-F191 HydrophobicContact CZ-CB 3.76Å; F66-F191 HydrophobicContact CZ-CD1 4.49Å; F66-F191 HydrophobicContact CZ-CG 4.13Å
67F97.5Very high95.8Very high0 Ų011.5 Ų11.50%07%0.065CC..Hα-helixtrans-54.7-52.1174.6165.6-114000111.6R17 V63 D65 R69 I70 N71 M121 V124 E125 I128 L157R17-F67 HydrophobicContact CB-CE1 3.67Å; R17-F67 HydrophobicContact CB-CZ 4.02Å; R17-F67 HydrophobicContact CG-CZ 4.43Å; V63-F67 VanDerWaalsContact O-CB 3.3Å; V63-F67 WeakPolarHBondContact O-CB 3.26Å; V63-F67 PolarHBondContact O-N 3.3Å; D65-F67 PolarHBondContact O-N 3.48Å; F67-R69 PolarHBondContact O-N 3.17Å; F67-I70 PolarHBondContact O-N 3.28Å; F67-N71 VanDerWaalsContact O-CB 3.24Å; F67-N71 WeakPolarHBondContact O-CB 3.46Å; F67-N71 PolarHBondContact O-N 2.93Å; F67-M121 HydrophobicContact CD2-SD 4.08Å; F67-M121 HydrophobicContact CE2-CB 4.27Å; F67-M121 WeakPolarHBondContact CE2-O 3.3Å; F67-M121 HydrophobicContact CE2-SD 3.75Å; F67-V124 HydrophobicContact CB-CG1 4.03Å; F67-V124 HydrophobicContact CD2-CB 3.85Å; F67-V124 HydrophobicContact CD2-CG1 3.39Å; F67-V124 HydrophobicContact CE2-CB 3.95Å; F67-V124 HydrophobicContact CE2-CG1 3.91Å; F67-V124 HydrophobicContact CG-CG1 3.72Å; F67-E125 HydrophobicContact CE1-CB 4.47Å; F67-E125 HydrophobicContact CZ-CB 3.93Å; F67-I128 HydrophobicContact CD1-CD1 3.32Å; F67-I128 HydrophobicContact CE1-CD1 3.49Å; F67-I128 VanDerWaalsContact CE1-CD1 3.49Å; F67-I128 HydrophobicContact CG-CD1 4.14Å; F67-I128 HydrophobicContact CZ-CD1 4.46Å; F67-L157 HydrophobicContact CB-CD1 4.25Å; F67-L157 HydrophobicContact CD2-CD2 4.45Å
68N95.7Very high95.8Very high10 Ų1011.5 Ų11.55%0.0537%0.067CC..Hα-helixtrans-61.4-43.6-179.5-76.6-45.9000112.2P16 R17 K18 V64 D65 F66 N71 L72P16-N68 WeakPolarHBondContact CA-OD1 3.42Å; P16-N68 HydrophobicContact CB-CB 4.34Å; R17-N68 PolarHBondContact N-OD1 3.09Å; K18-N68 PolarHBondContact N-OD1 3.25Å; K18-N68 PolarHBondContact O-ND2 2.98Å; V64-N68 WeakPolarHBondContact O-CB 3.48Å; V64-N68 PolarHBondContact O-N 3.33Å; V64-N68 PolarHBondContact O-ND2 3.03Å; D65-N68 PolarHBondContact O-N 2.93Å; F66-N68 PolarHBondContact O-N 3.09Å; N68-N71 PolarHBondContact O-N 3.22Å; N68-L72 WeakPolarHBondContact O-CG 3.24Å; N68-L72 PolarHBondContact O-N 3.45Å
69R95.1Very high95.7Very high24 Ų2418.2 Ų18.29%0.09110%0.098CC..Hα-helixtrans-69.6-39.5-178.7-70.2165.664.1171.55.6112.5L37 D65 F66 F67 L72 L73 C184 H187L37-R69 VanDerWaalsContact CD2-NH1 3.3Å; D65-R69 WeakPolarHBondContact O-CB 3.3Å; D65-R69 WeakPolarHBondContact O-CD 3.29Å; D65-R69 VanDerWaalsContact O-CG 3.26Å; D65-R69 WeakPolarHBondContact O-CG 3.32Å; D65-R69 PolarHBondContact O-N 2.69Å; D65-R69 WeakPolarHBondContact OD2-CD 3.45Å; D65-R69 IonicContact OD2-CZ 2.85Å; D65-R69 IonicContact OD2-NE 3.56Å; D65-R69 IonicContact OD2-NH1 3.25Å; D65-R69 PolarHBondContact OD2-NH1 3.25Å; F66-R69 PolarHBondContact O-N 2.82Å; F67-R69 PolarHBondContact O-N 3.17Å; R69-L72 PolarHBondContact O-N 2.91Å; R69-L73 VanDerWaalsContact O-CB 3.3Å; R69-L73 WeakPolarHBondContact O-CB 3.36Å; R69-L73 PolarHBondContact O-N 3.5Å; R69-C184 PolarHBondContact NE-SG 3.34Å; R69-H187 PolarHBondContact NH1-ND1 3.35Å
70I96.6Very high95.6Very high0 Ų023.1 Ų23.10%012%0.121CC..Hα-helixtrans-70.6-37177.1-64.7168000110.3F66 F67 L73 Y74 M121 L157 V160 F161 F188F66-I70 HydrophobicContact CB-CD1 4.33Å; F66-I70 VanDerWaalsContact O-CB 3.29Å; F66-I70 WeakPolarHBondContact O-CB 3.38Å; F66-I70 WeakPolarHBondContact O-CD1 3.41Å; F66-I70 WeakPolarHBondContact O-CG1 3.3Å; F66-I70 PolarHBondContact O-N 2.87Å; F67-I70 PolarHBondContact O-N 3.28Å; I70-L73 PolarHBondContact O-N 3.04Å; I70-Y74 WeakPolarHBondContact O-CB 3.49Å; I70-Y74 PolarHBondContact O-N 3.47Å; I70-M121 HydrophobicContact CG2-CE 4.1Å; I70-L157 HydrophobicContact CD1-CB 3.8Å; I70-L157 HydrophobicContact CD1-CD1 4.32Å; I70-L157 HydrophobicContact CD1-CD2 4.38Å; I70-L157 HydrophobicContact CD1-CG 4.4Å; I70-L157 HydrophobicContact CG2-CD2 4.31Å; I70-V160 HydrophobicContact CG2-CB 3.69Å; I70-V160 HydrophobicContact CG2-CG1 3.67Å; I70-V160 HydrophobicContact CG2-CG2 4.1Å; I70-F161 HydrophobicContact CD1-CD2 4.25Å; I70-F161 HydrophobicContact CD1-CE2 3.5Å; I70-F161 HydrophobicContact CD1-CZ 3.92Å; I70-F161 HydrophobicContact CG1-CE1 4.47Å; I70-F161 HydrophobicContact CG1-CE2 3.85Å; I70-F161 HydrophobicContact CG1-CZ 3.73Å; I70-F188 HydrophobicContact CD1-CD2 4.24Å; I70-F188 HydrophobicContact CD1-CE2 4.31Å
71N95Very high95.7Very high1 Ų123.3 Ų23.31%0.00512%0.122CC..Hα-helixtrans-61.2-45.1172.3-174.754000111.6F14 F67 N68 Y74 G75 M121F14-N71 WeakPolarHBondContact CD1-O 3.11Å; F67-N71 VanDerWaalsContact O-CB 3.24Å; F67-N71 WeakPolarHBondContact O-CB 3.46Å; F67-N71 PolarHBondContact O-N 2.93Å; N68-N71 PolarHBondContact O-N 3.22Å; N71-Y74 PolarHBondContact O-N 3.41Å; N71-G75 PolarHBondContact O-N 2.91Å; N71-M121 HydrophobicContact CB-CE 4.37Å; N71-M121 HydrophobicContact CB-SD 3.96Å
72L93.4Very high95.8Very high61 Ų6125.8 Ų25.832%0.31914%0.137SC..Hα-helixtrans-63.4-45.4174.5-71.5174.6000112.2F14 N68 R69 Y74 G75 T76F14-L72 HydrophobicContact CB-CD2 4.01Å; F14-L72 WeakPolarHBondContact O-CD2 3.33Å; N68-L72 WeakPolarHBondContact O-CG 3.24Å; N68-L72 PolarHBondContact O-N 3.45Å; R69-L72 PolarHBondContact O-N 2.91Å; L72-Y74 PolarHBondContact O-N 3.05Å; L72-G75 WeakPolarHBondContact O-CA 3.26Å; L72-G75 PolarHBondContact O-N 3.31Å; L72-G75 VanDerWaalsContact O-N 3.12Å; L72-T76 PolarHBondContact O-N 3.35Å
73L93.4Very high95.8Very high3 Ų330.4 Ų30.42%0.01616%0.159CC..Hα-helixtrans-58-46.2177172.370.2000111.8R69 I70 G75 T76 F161 L172 V181R69-L73 VanDerWaalsContact O-CB 3.3Å; R69-L73 WeakPolarHBondContact O-CB 3.36Å; R69-L73 PolarHBondContact O-N 3.5Å; I70-L73 PolarHBondContact O-N 3.04Å; L73-G75 VanDerWaalsContact C-N 3.28Å; L73-G75 PolarHBondContact O-N 3.33Å; L73-T76 PolarHBondContact O-N 3.21Å; L73-T76 PolarHBondContact O-OG1 3.38Å; L73-F161 HydrophobicContact CD2-CD1 4.03Å; L73-F161 HydrophobicContact CD2-CE1 3.81Å; L73-L172 HydrophobicContact CD1-CD1 4.24Å; L73-L172 HydrophobicContact CD1-CD2 4.05Å; L73-V181 HydrophobicContact CD1-CB 3.68Å; L73-V181 HydrophobicContact CD1-CG2 3.88Å; L73-V181 HydrophobicContact CD2-CB 4.27Å; L73-V181 HydrophobicContact CD2-CG2 3.58Å; L73-V181 HydrophobicContact CG-CG2 4.36Å
74Y95.8Very high95.8Very high11 Ų1139 Ų394%0.04320%0.199CC..Hα-helixtrans-65.3-37.3176.5179.8-109.8000111.2I70 N71 L72 T76 V77 S78 C81 P114 I117I70-Y74 WeakPolarHBondContact O-CB 3.49Å; I70-Y74 PolarHBondContact O-N 3.47Å; N71-Y74 PolarHBondContact O-N 3.41Å; L72-Y74 PolarHBondContact O-N 3.05Å; Y74-T76 PolarHBondContact O-N 3.22Å; Y74-V77 HydrophobicContact CD2-CG2 4.08Å; Y74-V77 HydrophobicContact CE2-CG2 4.49Å; Y74-V77 WeakPolarHBondContact O-CG2 3.28Å; Y74-V77 PolarHBondContact O-N 2.89Å; Y74-S78 WeakPolarHBondContact O-CB 3.28Å; Y74-S78 PolarHBondContact O-N 3.2Å; Y74-C81 HydrophobicContact CE2-CB 4.06Å; Y74-C81 PolarHBondContact OH-SG 2.88Å; Y74-C81 VanDerWaalsContact OH-SG 3.35Å; Y74-P114 WeakPolarHBondContact OH-CA 3.47Å; Y74-I117 HydrophobicContact CD1-CG2 3.5Å; Y74-I117 HydrophobicContact CD2-CD1 3.72Å; Y74-I117 HydrophobicContact CD2-CG2 4.09Å; Y74-I117 HydrophobicContact CE1-CB 4.15Å; Y74-I117 HydrophobicContact CE1-CG2 3.58Å; Y74-I117 HydrophobicContact CE2-CB 4.43Å; Y74-I117 HydrophobicContact CE2-CD1 3.34Å; Y74-I117 HydrophobicContact CE2-CG1 4.46Å; Y74-I117 HydrophobicContact CE2-CG2 4.18Å; Y74-I117 HydrophobicContact CG-CD1 4.47Å; Y74-I117 HydrophobicContact CG-CG2 3.76Å
75G94.2Very high95.9Very high15 Ų1543 Ų4316%0.15522%0.224CC..Hα-helixtrans-52.5-36.7175.200000113.8F14 N71 L72 L73 V77 S78F14-G75 VanDerWaalsContact CD2-CA 3.44Å; N71-G75 PolarHBondContact O-N 2.91Å; L72-G75 WeakPolarHBondContact O-CA 3.26Å; L72-G75 PolarHBondContact O-N 3.31Å; L72-G75 VanDerWaalsContact O-N 3.12Å; L73-G75 VanDerWaalsContact C-N 3.28Å; L73-G75 PolarHBondContact O-N 3.33Å; G75-V77 VanDerWaalsContact C-N 3.31Å; G75-V77 PolarHBondContact O-N 3.42Å; G75-S78 PolarHBondContact O-OG 2.98Å
76T93.5Very high96Very high70 Ų7042.3 Ų42.343%0.42922%0.22SC..Hα-helixtrans-70.8-23.1-179.869.90000114.1L72 L73 Y74L72-T76 PolarHBondContact O-N 3.35Å; L73-T76 PolarHBondContact O-N 3.21Å; L73-T76 PolarHBondContact O-OG1 3.38Å; Y74-T76 PolarHBondContact O-N 3.22Å
77V94.9Very high96Very high0 Ų046 Ų460%024%0.244CC..Hα-helixtrans-110.1-8.5179.5-58.40000113.2Y74 G75 Q79 H80 C81 V164 H168 T171 L172Y74-V77 HydrophobicContact CD2-CG2 4.08Å; Y74-V77 HydrophobicContact CE2-CG2 4.49Å; Y74-V77 WeakPolarHBondContact O-CG2 3.28Å; Y74-V77 PolarHBondContact O-N 2.89Å; G75-V77 VanDerWaalsContact C-N 3.31Å; G75-V77 PolarHBondContact O-N 3.42Å; V77-Q79 PolarHBondContact O-N 2.93Å; V77-Q79 VanDerWaalsContact O-N 3.11Å; V77-H80 PolarHBondContact O-N 3.38Å; V77-C81 PolarHBondContact O-N 3.15Å; V77-V164 HydrophobicContact CG2-CG2 4.19Å; V77-H168 HydrophobicContact CB-CB 3.92Å; V77-H168 HydrophobicContact CG1-CB 3.97Å; V77-H168 HydrophobicContact CG2-CB 4.11Å; V77-T171 HydrophobicContact CG1-CG2 4.2Å; V77-L172 HydrophobicContact CG1-CD2 3.71Å; V77-L172 HydrophobicContact CG1-CG 3.84Å
78S96.2Very high96Very high24 Ų2452.2 Ų52.217%0.16827%0.268CS..G310 helixtrans-53.7-35.7-171.961.30000114.1Y74 G75 H80 C81Y74-S78 WeakPolarHBondContact O-CB 3.28Å; Y74-S78 PolarHBondContact O-N 3.2Å; G75-S78 PolarHBondContact O-OG 2.98Å; S78-H80 PolarHBondContact O-N 3.19Å; S78-C81 PolarHBondContact O-N 3.08Å; S78-C81 VanDerWaalsContact O-N 3.13Å
79Q94.2Very high96.2Very high143 Ų14351.7 Ų51.767%0.66827%0.265SS*.G310 helixtrans-64.5-23.8178.1-66.4-177.6-1400113.7V77V77-Q79 PolarHBondContact O-N 2.93Å; V77-Q79 VanDerWaalsContact O-N 3.11Å
80H96.1Very high96.3Very high102 Ų10251.4 Ų51.447%0.47227%0.266SS..G310 helixtrans-99.4-5.1178.3-57.292.5000112.5V77 S78 T85 H168V77-H80 PolarHBondContact O-N 3.38Å; S78-H80 PolarHBondContact O-N 3.19Å; H80-T85 PolarHBondContact O-OG1 3.32Å; H80-H168 PolarHBondContact O-CE1 2.7Å
81C97.7Very high96.1Very high5 Ų551.8 Ų51.83%0.03427%0.27CS..  trans-100.485.3179.4-169.40000109.5Y74 V77 S78 P114 H163 H168Y74-C81 HydrophobicContact CE2-CB 4.06Å; Y74-C81 PolarHBondContact OH-SG 2.88Å; Y74-C81 VanDerWaalsContact OH-SG 3.35Å; V77-C81 PolarHBondContact O-N 3.15Å; S78-C81 PolarHBondContact O-N 3.08Å; S78-C81 VanDerWaalsContact O-N 3.13Å; C81-P114 WeakPolarHBondContact O-CB 3.33Å; C81-H163 PolarHBondContact SG-NE2 2.8Å; C81-H163 VanDerWaalsContact SG-NE2 3.37Å; C81-H168 WeakPolarHBondContact CB-NE2 3.32Å; C81-H168 PolarHBondContact SG-NE2 2.77Å; C81-H168 VanDerWaalsContact SG-NE2 3.38Å
82T97.9Very high95.9Very high53 Ų5353 Ų5333%0.32528%0.284SS..  trans-107.3168.5-179.173.10000110.9E84 T85 C86T82-E84 PolarHBondContact O-N 3.44Å; T82-E84 PolarHBondContact OG1-N 3.11Å; T82-T85 PolarHBondContact N-OG1 3.12Å; T82-T85 PolarHBondContact O-N 3.07Å; T82-T85 PolarHBondContact OG1-N 3.15Å; T82-T85 VanDerWaalsContact OG1-N 3.09Å; T82-T85 PolarHBondContact OG1-OG1 3.36Å; T82-C86 CarbonylContact O-C 3.54Å; T82-C86 WeakPolarHBondContact O-CA 3.47Å; T82-C86 WeakPolarHBondContact O-CB 3.33Å; T82-C86 PolarHBondContact O-N 2.9Å
83E98.3Very high95.6Very high97 Ų9762.8 Ų62.845%0.45332%0.316SS..THydrogen-bonded Turntrans-64.2-23.2173.7-54.5-154.8-128.900112.5F7 P87 S112 P114F7-E83 WeakPolarHBondContact CZ-OE1 3.39Å; E83-P87 WeakPolarHBondContact O-CA 3.31Å; E83-P87 WeakPolarHBondContact O-CB 3.24Å; E83-S112 VanDerWaalsContact CD-OG 3.31Å; E83-S112 WeakPolarHBondContact CG-OG 3.24Å; E83-S112 WeakPolarHBondContact OE2-CB 3.3Å; E83-S112 PolarHBondContact OE2-OG 3Å; E83-P114 HydrophobicContact CG-CG 4.06Å
84E97.7Very high95.4Very high180 Ų18073 Ų7384%0.84136%0.355SS*.THydrogen-bonded Turntrans-79.7-46.6176.1-63.5177.117800111.9T82T82-E84 PolarHBondContact O-N 3.44Å; T82-E84 PolarHBondContact OG1-N 3.11Å
85T97.2Very high95.4Very high85 Ų8575.9 Ų75.952%0.52137%0.366SS..THydrogen-bonded Turntrans-76.4-31-179.6630000111.9H80 T82H80-T85 PolarHBondContact O-OG1 3.32Å; T82-T85 PolarHBondContact N-OG1 3.12Å; T82-T85 PolarHBondContact O-N 3.07Å; T82-T85 PolarHBondContact OG1-N 3.15Å; T82-T85 VanDerWaalsContact OG1-N 3.09Å; T82-T85 PolarHBondContact OG1-OG1 3.36Å
86C98Very high95.6Very high5 Ų578.8 Ų78.83%0.03438%0.375CS..  trans-132.164.5-176-66.80000111.5T82 R88 S112 A113 H168T82-C86 CarbonylContact O-C 3.54Å; T82-C86 WeakPolarHBondContact O-CA 3.47Å; T82-C86 WeakPolarHBondContact O-CB 3.33Å; T82-C86 PolarHBondContact O-N 2.9Å; C86-R88 PolarHBondContact O-N 3.4Å; C86-S112 WeakPolarHBondContact O-CA 3.31Å; C86-S112 WeakPolarHBondContact O-CB 3.15Å; C86-A113 HydrophobicContact CB-CB 3.64Å; C86-A113 PolarHBondContact O-N 3.18Å; C86-H168 PolarHBondContact SG-NE2 3.27Å; C86-H168 VanDerWaalsContact SG-NE2 3.41Å
87P97.7Very high95.8Very high77 Ų7776.4 Ų76.450%0.536%0.359SS..SBendtrans-66.7-7.6-174.328-36.8000114E83 S112E83-P87 WeakPolarHBondContact O-CA 3.31Å; E83-P87 WeakPolarHBondContact O-CB 3.24Å; P87-S112 WeakPolarHBondContact O-CA 3.27Å
88R97.8Very high96Very high130 Ų13079.6 Ų79.649%0.49138%0.376SS..SBendtrans-145.5135.3-178.9-59.6171.7-178.3-170.63.7110.2C86 S90 R110 L111C86-R88 PolarHBondContact O-N 3.4Å; R88-S90 PolarHBondContact O-N 3Å; R88-S90 VanDerWaalsContact O-N 3.07Å; R88-S90 PolarHBondContact O-OG 3.48Å; R88-R110 VanDerWaalsContact CD-NH1 3.26Å; R88-R110 HydrophobicContact CG-CG 4.29Å; R88-L111 WeakPolarHBondContact CA-O 3.46Å
89M98.5Very high96.1Very high0 Ų078.6 Ų78.60%037%0.368CS..  trans-67.7105.4169.6-174.562.7-176.700110.5Y97 L111 A113 Y116 I117 R159 H163M89-Y97 HydrophobicContact CG-CD2 4.11Å; M89-Y97 PolarHBondContact O-N 2.89Å; M89-L111 PolarHBondContact N-O 3.48Å; M89-A113 HydrophobicContact SD-CB 3.93Å; M89-Y116 HydrophobicContact CB-CD1 4.25Å; M89-Y116 HydrophobicContact CB-CD2 3.79Å; M89-Y116 HydrophobicContact CB-CG 3.67Å; M89-Y116 HydrophobicContact CE-CD1 4.19Å; M89-Y116 HydrophobicContact CE-CE1 4.37Å; M89-Y116 HydrophobicContact CG-CD1 3.59Å; M89-Y116 HydrophobicContact CG-CD2 3.86Å; M89-Y116 HydrophobicContact CG-CE1 4.05Å; M89-Y116 HydrophobicContact CG-CE2 4.26Å; M89-Y116 HydrophobicContact CG-CG 3.54Å; M89-Y116 HydrophobicContact SD-CD1 4Å; M89-Y116 HydrophobicContact SD-CG 4.3Å; M89-I117 HydrophobicContact CE-CD1 4.18Å; M89-I117 HydrophobicContact CE-CG1 4.03Å; M89-I117 HydrophobicContact SD-CD1 4.01Å; M89-I117 HydrophobicContact SD-CG1 3.92Å; M89-R159 HydrophobicContact CE-CB 3.87Å; M89-R159 VanDerWaalsContact CE-O 3.22Å; M89-R159 WeakPolarHBondContact CE-O 3.33Å; M89-H163 HydrophobicContact CE-CB 3.61Å; M89-H163 HydrophobicContact SD-CB 4.05Å
90S97.8Very high96.2Very high17 Ų1775.9 Ų75.912%0.11936%0.355CS..EExtended strand (participates in β ladder)trans-150156.9-172.663.90000114.2R88 Y95 H163 H167R88-S90 PolarHBondContact O-N 3Å; R88-S90 VanDerWaalsContact O-N 3.07Å; R88-S90 PolarHBondContact O-OG 3.48Å; S90-Y95 CarbonylContact C-O 3.44Å; S90-Y95 WeakPolarHBondContact CA-O 3.49Å; S90-Y95 VanDerWaalsContact CB-O 3.22Å; S90-Y95 WeakPolarHBondContact CB-O 3.41Å; S90-H163 PolarHBondContact O-ND1 3.44Å; S90-H167 PolarHBondContact O-CD2 2.83Å; S90-H167 VanDerWaalsContact O-CD2 3.27Å; S90-H167 PolarHBondContact O-NE2 3.28Å; S90-H167 PolarHBondContact OG-NE2 3.38Å; S90-H167 VanDerWaalsContact OG-NE2 3.17Å
91G93.9Very high96.1Very high8 Ų872.8 Ų72.88%0.08234%0.342CS..EExtended strand (participates in β ladder)trans-105.872163.200000110.8Y95 V162G91-Y95 PolarHBondContact N-O 3.43Å; G91-V162 VanDerWaalsContact CA-CG1 3.46Å
92G89.2Confident95.8Very high28 Ų2874.9 Ų74.929%0.28936%0.364SS..THydrogen-bonded Turntrans66.9-153.6-174.100000111.9R94 T166G92-R94 PolarHBondContact O-N 2.85Å; G92-T166 VanDerWaalsContact N-CG2 3.27Å
93R86.7Confident95.4Very high265 Ų26578.9 Ų78.9100%138%0.383SS*.THydrogen-bonded Turntrans-76.3-18.4-173.5-61.4-175-176.5-1730.7114.7
94R91.1Very high95.2Very high218 Ų21881.9 Ų81.982%0.82340%0.399SS*.THydrogen-bonded Turntrans-94.5-26.3-170.6-75.4-170.4-73.5-158.4-4114.3G92G92-R94 PolarHBondContact O-N 2.85Å
95Y95.8Very high95Very high71 Ų7175.7 Ų75.728%0.27837%0.369SS..EExtended strand (participates in β ladder)trans-122.7107.5-174.2-57.2-73.8000108.7S90 G91 P205S90-Y95 CarbonylContact C-O 3.44Å; S90-Y95 WeakPolarHBondContact CA-O 3.49Å; S90-Y95 VanDerWaalsContact CB-O 3.22Å; S90-Y95 WeakPolarHBondContact CB-O 3.41Å; G91-Y95 PolarHBondContact N-O 3.43Å; Y95-P205 HydrophobicContact CD1-CG 3.75Å; Y95-P205 HydrophobicContact CD2-CB 3.83Å; Y95-P205 HydrophobicContact CD2-CG 3.96Å; Y95-P205 HydrophobicContact CE1-CB 4.42Å; Y95-P205 HydrophobicContact CE1-CG 3.68Å; Y95-P205 HydrophobicContact CE2-CB 3.72Å; Y95-P205 HydrophobicContact CE2-CG 3.89Å; Y95-P205 HydrophobicContact CG-CB 4.24Å; Y95-P205 HydrophobicContact CG-CG 3.88Å
96E97.7Very high94.9Very high76 Ų7679 Ų7936%0.35538%0.375SS..EExtended strand (participates in β ladder)trans-112.4136.7170.1174.2160.4-140.500109.2L98 R110E96-L98 HydrophobicContact CG-CD2 4.17Å; E96-R110 VanDerWaalsContact CD-CZ 3.42Å; E96-R110 IonicContact OE1-CZ 3.07Å; E96-R110 IonicContact OE1-NE 3.6Å; E96-R110 IonicContact OE1-NH1 2.56Å; E96-R110 PolarHBondContact OE1-NH1 2.89Å; E96-R110 IonicContact OE1-NH2 3.73Å; E96-R110 IonicContact OE2-CZ 3.09Å; E96-R110 IonicContact OE2-NH1 2.7Å; E96-R110 PolarHBondContact OE2-NH1 3.18Å; E96-R110 IonicContact OE2-NH2 3.67Å; E96-R110 PolarHBondContact OE2-NH2 2.86Å
97Y98.2Very high94.9Very high21 Ų2185.2 Ų85.28%0.08240%0.404CS..  trans-114.2113.3-178.1-56.2-65.4000110.1M89 R159 V162M89-Y97 HydrophobicContact CG-CD2 4.11Å; M89-Y97 PolarHBondContact O-N 2.89Å; Y97-R159 HydrophobicContact CD1-CB 4.49Å; Y97-R159 HydrophobicContact CD1-CG 3.75Å; Y97-R159 HydrophobicContact CD2-CB 3.89Å; Y97-R159 HydrophobicContact CD2-CG 4.05Å; Y97-R159 HydrophobicContact CE1-CG 3.74Å; Y97-R159 HydrophobicContact CE2-CB 3.9Å; Y97-R159 HydrophobicContact CE2-CG 4.04Å; Y97-R159 HydrophobicContact CG-CB 4.18Å; Y97-R159 HydrophobicContact CG-CG 3.89Å; Y97-V162 HydrophobicContact CE2-CB 4.31Å; Y97-V162 HydrophobicContact CE2-CG1 4.12Å
98L98.1Very high94.9Very high67 Ų6784.8 Ų84.835%0.35140%0.401SS..  trans-86.3144.7173.4-53.8-176.9000110E96 P108 R110E96-L98 HydrophobicContact CG-CD2 4.17Å; L98-P108 HydrophobicContact CB-CB 3.9Å; L98-P108 HydrophobicContact CD1-CB 3.72Å; L98-P108 HydrophobicContact CG-CB 4.49Å; L98-R110 HydrophobicContact CD2-CB 3.99Å; L98-R110 HydrophobicContact CD2-CG 4.46Å
99W98.4Very high94.9Very high2 Ų280.7 Ų80.71%0.00839%0.391CS..BIsolated β-bridgetrans-88137.1175.8-176.9-94.2000110.6D101 Y105 T109 L111 Y116 L119 L120 W123W99-D101 HydrophobicContact CZ2-CB 4.15Å; W99-D101 PolarHBondContact NE1-OD2 3.39Å; W99-Y105 AromaticContact CD1-CD2 3.38Å; W99-Y105 AromaticContact CD1-CG 3.49Å; W99-Y105 VanDerWaalsContact CD1-CG 3.49Å; W99-Y105 AromaticContact NE1-CD2 3.51Å; W99-T109 PolarHBondContact N-O 2.86Å; W99-T109 PolarHBondContact O-N 3.42Å; W99-L111 HydrophobicContact CB-CD1 3.47Å; W99-L111 VanDerWaalsContact CB-CD1 3.47Å; W99-L111 HydrophobicContact CB-CG 4.2Å; W99-L111 HydrophobicContact CG-CD1 3.8Å; W99-Y116 HydrophobicContact CB-CD2 3.87Å; W99-Y116 HydrophobicContact CB-CE2 3.97Å; W99-Y116 HydrophobicContact CE3-CD1 4.28Å; W99-Y116 AromaticContact CE3-CD2 3.91Å; W99-Y116 HydrophobicContact CE3-CD2 3.91Å; W99-Y116 HydrophobicContact CE3-CE1 4.09Å; W99-Y116 AromaticContact CE3-CE2 3.73Å; W99-Y116 HydrophobicContact CE3-CE2 3.73Å; W99-Y116 HydrophobicContact CE3-CG 4.15Å; W99-Y116 AromaticContact CE3-CZ 3.79Å; W99-Y116 HydrophobicContact CZ3-CE1 4.28Å; W99-L119 HydrophobicContact CD2-CB 4.14Å; W99-L119 HydrophobicContact CD2-CD1 4.15Å; W99-L119 HydrophobicContact CE3-CB 4.14Å; W99-L119 HydrophobicContact CG-CD1 4.24Å; W99-L119 HydrophobicContact CH2-CB 3.64Å; W99-L119 WeakPolarHBondContact CH2-O 3.42Å; W99-L119 HydrophobicContact CZ2-CB 3.63Å; W99-L119 HydrophobicContact CZ3-CB 3.88Å; W99-L120 HydrophobicContact CH2-CB 4.34Å; W99-L120 VanDerWaalsContact CZ3-CA 3.49Å; W99-L120 HydrophobicContact CZ3-CB 3.8Å; W99-L120 HydrophobicContact CZ3-CD1 4.3Å; W99-L120 VanDerWaalsContact CZ3-N 3.34Å; W99-W123 HydrophobicContact CH2-CB 3.89Å; W99-W123 HydrophobicContact CH2-CG 4.32Å; W99-W123 HydrophobicContact CZ2-CB 4.25Å
100Q97.1Very high94.9Very high87 Ų8786.2 Ų86.241%0.40741%0.412SS..  trans-151.8130.6170.3-168-174.91500107.8K106 R156Q100-K106 PolarHBondContact NE2-O 3.02Å; Q100-R156 PolarHBondContact O-NH1 2.62Å; Q100-R156 PolarHBondContact O-NH2 3.38Å
101D93.5Very high94.9Very high37 Ų3786.5 Ų86.520%0.19841%0.412CS..  trans-127.1-11.2177.457.532.1000113.4W99 L103 M104 Y105W99-D101 HydrophobicContact CZ2-CB 4.15Å; W99-D101 PolarHBondContact NE1-OD2 3.39Å; D101-L103 PolarHBondContact O-N 3Å; D101-L103 WeakPolarHBondContact OD1-CA 3.3Å; D101-L103 PolarHBondContact OD1-N 3.48Å; D101-M104 PolarHBondContact OD1-N 2.89Å; D101-M104 VanDerWaalsContact OD1-N 3.08Å; D101-Y105 PolarHBondContact N-O 3.16Å; D101-Y105 VanDerWaalsContact N-O 3.12Å; D101-Y105 PolarHBondContact OD1-N 3.17Å; D101-Y105 WeakPolarHBondContact OD2-CD2 3.29Å
102G90.8Very high95.1Very high48 Ų4886.4 Ų86.450%0.49541%0.41SS..SBendtrans74.51.6-178.300000114.2Y105G102-Y105 PolarHBondContact N-O 3.39Å; G102-Y105 VanDerWaalsContact N-O 3.12Å
103L90.6Very high95.6Very high138 Ų13885 Ų8572%0.72340%0.396SS*.SBendtrans-108.8-89.5178.4-61.8177000109.3D101D101-L103 PolarHBondContact O-N 3Å; D101-L103 WeakPolarHBondContact OD1-CA 3.3Å; D101-L103 PolarHBondContact OD1-N 3.48Å
104M92.8Very high96.1Very high160 Ų16073.3 Ų73.379%0.78835%0.354SS*.SBendtrans-75.9-32.2178.1-68.4-62-64.600111.4D101D101-M104 PolarHBondContact OD1-N 2.89Å; D101-M104 VanDerWaalsContact OD1-N 3.08Å
105Y95.2Very high96.5Very high50 Ų5063.8 Ų63.820%0.19632%0.32CS..  trans-118.685.4179.7-61.4-88.6000109.3W99 D101 G102 T109 L111 L119W99-Y105 AromaticContact CD1-CD2 3.38Å; W99-Y105 AromaticContact CD1-CG 3.49Å; W99-Y105 VanDerWaalsContact CD1-CG 3.49Å; W99-Y105 AromaticContact NE1-CD2 3.51Å; D101-Y105 PolarHBondContact N-O 3.16Å; D101-Y105 VanDerWaalsContact N-O 3.12Å; D101-Y105 PolarHBondContact OD1-N 3.17Å; D101-Y105 WeakPolarHBondContact OD2-CD2 3.29Å; G102-Y105 PolarHBondContact N-O 3.39Å; G102-Y105 VanDerWaalsContact N-O 3.12Å; Y105-T109 HydrophobicContact CD1-CG2 3.78Å; Y105-T109 HydrophobicContact CE1-CG2 3.93Å; Y105-L111 HydrophobicContact CE1-CD1 4.22Å; Y105-L111 HydrophobicContact CE1-CD2 3.93Å; Y105-L119 HydrophobicContact CD2-CD1 4.41Å; Y105-L119 HydrophobicContact CE2-CD1 3.68Å
106K94.7Very high96.6Very high153 Ų15360.4 Ų60.467%0.66531%0.307SS*.  trans-68-37.7179.7-63.6-175.5-179.4-178.60112.3Q100Q100-K106 PolarHBondContact NE2-O 3.02Å
107E96.7Very high96.6Very high137 Ų13756.8 Ų56.864%0.6429%0.29SS*.SBendtrans-105.7152.8178.5-62.8-56.4145.500111.6T109E107-T109 PolarHBondContact O-N 3.26Å; E107-T109 PolarHBondContact O-OG1 3.32Å
108P97.8Very high96.6Very high68 Ų6856 Ų5644%0.44229%0.288SS..  trans-53.6110.7172.9-25.535000111.9L98L98-P108 HydrophobicContact CB-CB 3.9Å; L98-P108 HydrophobicContact CD1-CB 3.72Å; L98-P108 HydrophobicContact CG-CB 4.49Å
109T98.4Very high96.5Very high44 Ų4454.7 Ų54.727%0.2728%0.282SS..BIsolated β-bridgetrans-114.3134-171.8-58.70000110.8W99 Y105 E107 L111W99-T109 PolarHBondContact N-O 2.86Å; W99-T109 PolarHBondContact O-N 3.42Å; Y105-T109 HydrophobicContact CD1-CG2 3.78Å; Y105-T109 HydrophobicContact CE1-CG2 3.93Å; E107-T109 PolarHBondContact O-N 3.26Å; E107-T109 PolarHBondContact O-OG1 3.32Å; T109-L111 HydrophobicContact CG2-CD2 4.1Å; T109-L111 HydrophobicContact CG2-CG 4.42Å
110R98.2Very high96.5Very high116 Ų11654.6 Ų54.644%0.43828%0.281SS..  trans-76.2126.4174.4-173.1-178.1-61.2-102.4-9.2109.2R88 E96 L98R88-R110 VanDerWaalsContact CD-NH1 3.26Å; R88-R110 HydrophobicContact CG-CG 4.29Å; E96-R110 VanDerWaalsContact CD-CZ 3.42Å; E96-R110 IonicContact OE1-CZ 3.07Å; E96-R110 IonicContact OE1-NE 3.6Å; E96-R110 IonicContact OE1-NH1 2.56Å; E96-R110 PolarHBondContact OE1-NH1 2.89Å; E96-R110 IonicContact OE1-NH2 3.73Å; E96-R110 IonicContact OE2-CZ 3.09Å; E96-R110 IonicContact OE2-NH1 2.7Å; E96-R110 PolarHBondContact OE2-NH1 3.18Å; E96-R110 IonicContact OE2-NH2 3.67Å; E96-R110 PolarHBondContact OE2-NH2 2.86Å; L98-R110 HydrophobicContact CD2-CB 3.99Å; L98-R110 HydrophobicContact CD2-CG 4.46Å
111L98.4Very high96.5Very high22 Ų2250.5 Ų50.512%0.11526%0.262CS..  trans-131.7154177.5-61.5177.2000109.8R88 M89 W99 Y105 T109 V115 L119R88-L111 WeakPolarHBondContact CA-O 3.46Å; M89-L111 PolarHBondContact N-O 3.48Å; W99-L111 HydrophobicContact CB-CD1 3.47Å; W99-L111 VanDerWaalsContact CB-CD1 3.47Å; W99-L111 HydrophobicContact CB-CG 4.2Å; W99-L111 HydrophobicContact CG-CD1 3.8Å; Y105-L111 HydrophobicContact CE1-CD1 4.22Å; Y105-L111 HydrophobicContact CE1-CD2 3.93Å; T109-L111 HydrophobicContact CG2-CD2 4.1Å; T109-L111 HydrophobicContact CG2-CG 4.42Å; L111-V115 HydrophobicContact CB-CB 4.49Å; L111-V115 HydrophobicContact CB-CG1 4.35Å; L111-V115 HydrophobicContact CD1-CG1 4.1Å; L111-V115 HydrophobicContact CD2-CG1 4.26Å; L111-V115 HydrophobicContact CG-CG1 4.48Å; L111-L119 HydrophobicContact CD1-CD1 3.5Å
112S98.5Very high96.6Very high6 Ų652 Ų524%0.04227%0.27CS..  trans-61.2153.116758.20000110.5E83 C86 P87 V115 Y116E83-S112 VanDerWaalsContact CD-OG 3.31Å; E83-S112 WeakPolarHBondContact CG-OG 3.24Å; E83-S112 WeakPolarHBondContact OE2-CB 3.3Å; E83-S112 PolarHBondContact OE2-OG 3Å; C86-S112 WeakPolarHBondContact O-CA 3.31Å; C86-S112 WeakPolarHBondContact O-CB 3.15Å; P87-S112 WeakPolarHBondContact O-CA 3.27Å; S112-V115 PolarHBondContact O-N 3.15Å; S112-V115 WeakPolarHBondContact OG-CB 3.3Å; S112-V115 WeakPolarHBondContact OG-CG2 3.34Å; S112-Y116 WeakPolarHBondContact O-CB 3.4Å; S112-Y116 PolarHBondContact O-N 3.09Å
113A98.6Very high96.9Very high0 Ų051.5 Ų51.50%025%0.253CS..Hα-helixtrans-58.2-45.7-178.700000113.5C86 M89 V115 Y116 I117 H163C86-A113 HydrophobicContact CB-CB 3.64Å; C86-A113 PolarHBondContact O-N 3.18Å; M89-A113 HydrophobicContact SD-CB 3.93Å; A113-V115 PolarHBondContact O-N 2.83Å; A113-Y116 PolarHBondContact O-N 3.15Å; A113-I117 WeakPolarHBondContact O-CB 3.33Å; A113-I117 VanDerWaalsContact O-CG1 3.23Å; A113-I117 WeakPolarHBondContact O-CG1 3.41Å; A113-I117 PolarHBondContact O-N 3.26Å; A113-H163 WeakPolarHBondContact CB-CE1 3.35Å; A113-H163 WeakPolarHBondContact CB-NE2 3.3Å
114P98.3Very high97.2Very high19 Ų1945 Ų4512%0.12322%0.219CC..Hα-helixtrans-62.7-39.5177.923.5-34.8000113.2Y74 C81 E83 I117 G118Y74-P114 WeakPolarHBondContact OH-CA 3.47Å; C81-P114 WeakPolarHBondContact O-CB 3.33Å; E83-P114 HydrophobicContact CG-CG 4.06Å; P114-I117 PolarHBondContact O-N 3.21Å; P114-G118 PolarHBondContact O-N 3.19Å
115V98.2Very high97.3Very high17 Ų1739.5 Ų39.510%0.10319%0.191CC..Hα-helixtrans-65.4-47176.3176.30000110.7F7 L111 S112 A113 I117 G118 L119F7-V115 HydrophobicContact CE1-CG2 4.05Å; F7-V115 HydrophobicContact CE2-CG2 4.48Å; F7-V115 HydrophobicContact CZ-CG2 3.5Å; L111-V115 HydrophobicContact CB-CB 4.49Å; L111-V115 HydrophobicContact CB-CG1 4.35Å; L111-V115 HydrophobicContact CD1-CG1 4.1Å; L111-V115 HydrophobicContact CD2-CG1 4.26Å; L111-V115 HydrophobicContact CG-CG1 4.48Å; S112-V115 PolarHBondContact O-N 3.15Å; S112-V115 WeakPolarHBondContact OG-CB 3.3Å; S112-V115 WeakPolarHBondContact OG-CG2 3.34Å; A113-V115 PolarHBondContact O-N 2.83Å; V115-I117 PolarHBondContact O-N 2.91Å; V115-G118 PolarHBondContact O-N 3.16Å; V115-L119 HydrophobicContact CG1-CD1 4.14Å; V115-L119 WeakPolarHBondContact O-CG 3.38Å; V115-L119 PolarHBondContact O-N 3.45Å
116Y98.6Very high97.3Very high0 Ų042.5 Ų42.50%021%0.211CC..Hα-helixtrans-58.4-47.8177.5-177.2-71.9000111.4M89 W99 S112 A113 L119 L120 R159M89-Y116 HydrophobicContact CB-CD1 4.25Å; M89-Y116 HydrophobicContact CB-CD2 3.79Å; M89-Y116 HydrophobicContact CB-CG 3.67Å; M89-Y116 HydrophobicContact CE-CD1 4.19Å; M89-Y116 HydrophobicContact CE-CE1 4.37Å; M89-Y116 HydrophobicContact CG-CD1 3.59Å; M89-Y116 HydrophobicContact CG-CD2 3.86Å; M89-Y116 HydrophobicContact CG-CE1 4.05Å; M89-Y116 HydrophobicContact CG-CE2 4.26Å; M89-Y116 HydrophobicContact CG-CG 3.54Å; M89-Y116 HydrophobicContact SD-CD1 4Å; M89-Y116 HydrophobicContact SD-CG 4.3Å; W99-Y116 HydrophobicContact CB-CD2 3.87Å; W99-Y116 HydrophobicContact CB-CE2 3.97Å; W99-Y116 HydrophobicContact CE3-CD1 4.28Å; W99-Y116 AromaticContact CE3-CD2 3.91Å; W99-Y116 HydrophobicContact CE3-CD2 3.91Å; W99-Y116 HydrophobicContact CE3-CE1 4.09Å; W99-Y116 AromaticContact CE3-CE2 3.73Å; W99-Y116 HydrophobicContact CE3-CE2 3.73Å; W99-Y116 HydrophobicContact CE3-CG 4.15Å; W99-Y116 AromaticContact CE3-CZ 3.79Å; W99-Y116 HydrophobicContact CZ3-CE1 4.28Å; S112-Y116 WeakPolarHBondContact O-CB 3.4Å; S112-Y116 PolarHBondContact O-N 3.09Å; A113-Y116 PolarHBondContact O-N 3.15Å; Y116-L119 PolarHBondContact O-N 3.23Å; Y116-L120 HydrophobicContact CE1-CB 4.39Å; Y116-L120 HydrophobicContact CE1-CD2 4.27Å; Y116-L120 WeakPolarHBondContact O-CB 3.37Å; Y116-L120 PolarHBondContact O-N 2.9Å; Y116-R159 VanDerWaalsContact OH-CD 3.28Å; Y116-R159 WeakPolarHBondContact OH-CD 3.46Å; Y116-R159 PolarHBondContact OH-NH1 3.42Å
117I98.3Very high97.3Very high0 Ų037.6 Ų37.60%019%0.19CC..Hα-helixtrans-69.3-38.1-176.2-66.2168.6000110.3Y74 M89 A113 P114 V115 L120 M121 V160Y74-I117 HydrophobicContact CD1-CG2 3.5Å; Y74-I117 HydrophobicContact CD2-CD1 3.72Å; Y74-I117 HydrophobicContact CD2-CG2 4.09Å; Y74-I117 HydrophobicContact CE1-CB 4.15Å; Y74-I117 HydrophobicContact CE1-CG2 3.58Å; Y74-I117 HydrophobicContact CE2-CB 4.43Å; Y74-I117 HydrophobicContact CE2-CD1 3.34Å; Y74-I117 HydrophobicContact CE2-CG1 4.46Å; Y74-I117 HydrophobicContact CE2-CG2 4.18Å; Y74-I117 HydrophobicContact CG-CD1 4.47Å; Y74-I117 HydrophobicContact CG-CG2 3.76Å; M89-I117 HydrophobicContact CE-CD1 4.18Å; M89-I117 HydrophobicContact CE-CG1 4.03Å; M89-I117 HydrophobicContact SD-CD1 4.01Å; M89-I117 HydrophobicContact SD-CG1 3.92Å; A113-I117 WeakPolarHBondContact O-CB 3.33Å; A113-I117 VanDerWaalsContact O-CG1 3.23Å; A113-I117 WeakPolarHBondContact O-CG1 3.41Å; A113-I117 PolarHBondContact O-N 3.26Å; P114-I117 PolarHBondContact O-N 3.21Å; V115-I117 PolarHBondContact O-N 2.91Å; I117-L120 WeakPolarHBondContact O-CB 3.08Å; I117-L120 PolarHBondContact O-N 2.94Å; I117-M121 HydrophobicContact CG2-CE 3.87Å; I117-M121 HydrophobicContact CG2-CG 4.35Å; I117-M121 WeakPolarHBondContact O-CG 3.38Å; I117-M121 PolarHBondContact O-N 3.43Å; I117-V160 HydrophobicContact CD1-CG1 4.49Å; I117-V160 HydrophobicContact CG1-CG2 4.41Å
118G96.6Very high97.3Very high5 Ų531 Ų315%0.05216%0.159CC..Hα-helixtrans-56-54.717200000112.3P114 V115 L120 M121 D122P114-G118 PolarHBondContact O-N 3.19Å; V115-G118 PolarHBondContact O-N 3.16Å; G118-L120 PolarHBondContact O-N 3.03Å; G118-M121 PolarHBondContact O-N 2.86Å; G118-M121 VanDerWaalsContact O-N 3.16Å; G118-D122 PolarHBondContact O-N 3.29Å; G118-D122 VanDerWaalsContact O-N 3.12Å
119L97.7Very high97.1Very high40 Ų4031.2 Ų31.221%0.20916%0.156CC..Hα-helixtrans-58.5-37.1175.8-67.5171.6000112.1W99 Y105 L111 V115 Y116 W123W99-L119 HydrophobicContact CD2-CB 4.14Å; W99-L119 HydrophobicContact CD2-CD1 4.15Å; W99-L119 HydrophobicContact CE3-CB 4.14Å; W99-L119 HydrophobicContact CG-CD1 4.24Å; W99-L119 HydrophobicContact CH2-CB 3.64Å; W99-L119 WeakPolarHBondContact CH2-O 3.42Å; W99-L119 HydrophobicContact CZ2-CB 3.63Å; W99-L119 HydrophobicContact CZ3-CB 3.88Å; Y105-L119 HydrophobicContact CD2-CD1 4.41Å; Y105-L119 HydrophobicContact CE2-CD1 3.68Å; L111-L119 HydrophobicContact CD1-CD1 3.5Å; V115-L119 HydrophobicContact CG1-CD1 4.14Å; V115-L119 WeakPolarHBondContact O-CG 3.38Å; V115-L119 PolarHBondContact O-N 3.45Å; Y116-L119 PolarHBondContact O-N 3.23Å; L119-W123 WeakPolarHBondContact O-CB 3.34Å; L119-W123 PolarHBondContact O-N 3.43Å
120L98Very high96.9Very high0 Ų031.9 Ų31.90%016%0.158CC..Hα-helixtrans-62.3-48.5176.7-179.458.2000111.6W99 Y116 I117 G118 D122 W123 V124 R156 L157 V160W99-L120 HydrophobicContact CH2-CB 4.34Å; W99-L120 VanDerWaalsContact CZ3-CA 3.49Å; W99-L120 HydrophobicContact CZ3-CB 3.8Å; W99-L120 HydrophobicContact CZ3-CD1 4.3Å; W99-L120 VanDerWaalsContact CZ3-N 3.34Å; Y116-L120 HydrophobicContact CE1-CB 4.39Å; Y116-L120 HydrophobicContact CE1-CD2 4.27Å; Y116-L120 WeakPolarHBondContact O-CB 3.37Å; Y116-L120 PolarHBondContact O-N 2.9Å; I117-L120 WeakPolarHBondContact O-CB 3.08Å; I117-L120 PolarHBondContact O-N 2.94Å; G118-L120 PolarHBondContact O-N 3.03Å; L120-D122 VanDerWaalsContact C-N 3.33Å; L120-W123 HydrophobicContact CD1-CE3 4.21Å; L120-W123 PolarHBondContact O-N 3.04Å; L120-V124 HydrophobicContact CD1-CG2 3.87Å; L120-V124 HydrophobicContact CG-CG2 4.36Å; L120-V124 VanDerWaalsContact O-CG2 3.3Å; L120-V124 WeakPolarHBondContact O-CG2 3.4Å; L120-V124 PolarHBondContact O-N 3.31Å; L120-R156 HydrophobicContact CD1-CB 3.5Å; L120-R156 HydrophobicContact CD1-CG 4.41Å; L120-R156 HydrophobicContact CD2-CB 4.37Å; L120-R156 WeakPolarHBondContact CD2-O 3.48Å; L120-L157 HydrophobicContact CD2-CD2 4.36Å; L120-V160 HydrophobicContact CD2-CG2 3.66Å
121M97.2Very high96.7Very high1 Ų132.2 Ų32.21%0.00517%0.165CC..Hα-helixtrans-64.4-42.5-176.9-65.1-54.9171.100111.1F67 I70 N71 I117 G118 V124 E125 L157 V160F67-M121 HydrophobicContact CD2-SD 4.08Å; F67-M121 HydrophobicContact CE2-CB 4.27Å; F67-M121 WeakPolarHBondContact CE2-O 3.3Å; F67-M121 HydrophobicContact CE2-SD 3.75Å; I70-M121 HydrophobicContact CG2-CE 4.1Å; N71-M121 HydrophobicContact CB-CE 4.37Å; N71-M121 HydrophobicContact CB-SD 3.96Å; I117-M121 HydrophobicContact CG2-CE 3.87Å; I117-M121 HydrophobicContact CG2-CG 4.35Å; I117-M121 WeakPolarHBondContact O-CG 3.38Å; I117-M121 PolarHBondContact O-N 3.43Å; G118-M121 PolarHBondContact O-N 2.86Å; G118-M121 VanDerWaalsContact O-N 3.16Å; M121-V124 PolarHBondContact O-N 2.87Å; M121-E125 VanDerWaalsContact O-CB 3.3Å; M121-E125 WeakPolarHBondContact O-CB 3.48Å; M121-E125 PolarHBondContact O-N 3.1Å; M121-L157 HydrophobicContact SD-CD2 4.47Å; M121-V160 HydrophobicContact CE-CG2 4.27Å
122D95.1Very high96.5Very high69 Ų6937.3 Ų37.337%0.36919%0.188SC..Hα-helixtrans-65.8-44.7177.4-62.6-16.2000110.9R17 G118 L120 V124 E125 D126R17-D122 IonicContact CZ-OD1 2.88Å; R17-D122 IonicContact NH1-OD1 3.65Å; R17-D122 PolarHBondContact NH1-OD1 2.92Å; R17-D122 IonicContact NH2-OD1 2.69Å; G118-D122 PolarHBondContact O-N 3.29Å; G118-D122 VanDerWaalsContact O-N 3.12Å; L120-D122 VanDerWaalsContact C-N 3.33Å; D122-V124 PolarHBondContact O-N 3.05Å; D122-E125 PolarHBondContact O-N 2.82Å; D122-D126 PolarHBondContact O-N 2.99Å
123W96.3Very high96.2Very high37 Ų3739.2 Ų39.214%0.1419%0.194CC..Hα-helixtrans-62.3-40.2177.1178.882.6000113.1W99 L119 L120 K127 K152 I153W99-W123 HydrophobicContact CH2-CB 3.89Å; W99-W123 HydrophobicContact CH2-CG 4.32Å; W99-W123 HydrophobicContact CZ2-CB 4.25Å; L119-W123 WeakPolarHBondContact O-CB 3.34Å; L119-W123 PolarHBondContact O-N 3.43Å; L120-W123 HydrophobicContact CD1-CE3 4.21Å; L120-W123 PolarHBondContact O-N 3.04Å; W123-K127 HydrophobicContact CH2-CG 4.48Å; W123-K127 HydrophobicContact CZ2-CG 4.12Å; W123-K127 WeakPolarHBondContact O-CG 3.34Å; W123-K127 PolarHBondContact O-N 3.45Å; W123-K152 HydrophobicContact CH2-CB 4.31Å; W123-K152 HydrophobicContact CH2-CD 3.9Å; W123-K152 HydrophobicContact CH2-CG 3.76Å; W123-K152 HydrophobicContact CZ2-CD 3.97Å; W123-K152 HydrophobicContact CZ2-CG 4.33Å; W123-I153 HydrophobicContact CH2-CG1 3.95Å; W123-I153 HydrophobicContact CZ3-CB 4.47Å; W123-I153 HydrophobicContact CZ3-CG1 3.72Å
124V97Very high96Very high0 Ų039.4 Ų39.40%020%0.195CC..Hα-helixtrans-68.6-42.4175.7174.80000110.3F67 L120 M121 D122 D126 K127 I128 I153 L157F67-V124 HydrophobicContact CB-CG1 4.03Å; F67-V124 HydrophobicContact CD2-CB 3.85Å; F67-V124 HydrophobicContact CD2-CG1 3.39Å; F67-V124 HydrophobicContact CE2-CB 3.95Å; F67-V124 HydrophobicContact CE2-CG1 3.91Å; F67-V124 HydrophobicContact CG-CG1 3.72Å; L120-V124 HydrophobicContact CD1-CG2 3.87Å; L120-V124 HydrophobicContact CG-CG2 4.36Å; L120-V124 VanDerWaalsContact O-CG2 3.3Å; L120-V124 WeakPolarHBondContact O-CG2 3.4Å; L120-V124 PolarHBondContact O-N 3.31Å; M121-V124 PolarHBondContact O-N 2.87Å; D122-V124 PolarHBondContact O-N 3.05Å; V124-D126 PolarHBondContact O-N 3.26Å; V124-K127 PolarHBondContact O-N 2.93Å; V124-I128 HydrophobicContact CG1-CG2 4.09Å; V124-I128 WeakPolarHBondContact O-CG1 3.41Å; V124-I128 WeakPolarHBondContact O-CG2 3.44Å; V124-I128 PolarHBondContact O-N 3.21Å; V124-I153 HydrophobicContact CG1-CG2 3.71Å; V124-I153 HydrophobicContact CG2-CG1 4.42Å; V124-I153 HydrophobicContact CG2-CG2 3.94Å; V124-L157 HydrophobicContact CG2-CD2 4.36Å; V124-L157 HydrophobicContact CG2-CG 4.43Å
125E95.7Very high95.8Very high45 Ų4538.7 Ų38.721%0.2119%0.19CC..Hα-helixtrans-57.6-47.9177.7-175.8165.8-152.700111.9R17 F67 M121 D122 K127 I128 N129R17-E125 WeakPolarHBondContact CD-OE2 3.03Å; R17-E125 IonicContact CZ-OE2 3.83Å; R17-E125 IonicContact NE-OE2 3.76Å; R17-E125 IonicContact NH1-OE2 2.87Å; R17-E125 PolarHBondContact NH1-OE2 3.47Å; F67-E125 HydrophobicContact CE1-CB 4.47Å; F67-E125 HydrophobicContact CZ-CB 3.93Å; M121-E125 VanDerWaalsContact O-CB 3.3Å; M121-E125 WeakPolarHBondContact O-CB 3.48Å; M121-E125 PolarHBondContact O-N 3.1Å; D122-E125 PolarHBondContact O-N 2.82Å; E125-K127 VanDerWaalsContact C-N 3.3Å; E125-K127 PolarHBondContact O-N 2.94Å; E125-I128 WeakPolarHBondContact O-CG1 3.47Å; E125-I128 PolarHBondContact O-N 3.33Å; E125-N129 VanDerWaalsContact CG-ND2 3.31Å; E125-N129 WeakPolarHBondContact CG-ND2 3.43Å; E125-N129 VanDerWaalsContact O-CB 3.27Å; E125-N129 WeakPolarHBondContact O-CB 3.44Å; E125-N129 PolarHBondContact O-N 3.49Å; E125-N129 PolarHBondContact O-ND2 3.4Å; E125-N129 VanDerWaalsContact O-ND2 3.16Å
126D94.8Very high95.3Very high113 Ų11342.1 Ų42.160%0.60421%0.207SC*.Hα-helixtrans-56.3-46.3175.4-74.2-15.3000110.8D122 V124 N129 D130D122-D126 PolarHBondContact O-N 2.99Å; V124-D126 PolarHBondContact O-N 3.26Å; D126-N129 PolarHBondContact O-N 3.47Å; D126-D130 WeakPolarHBondContact O-CB 3.33Å; D126-D130 PolarHBondContact O-N 2.88Å
127K95.2Very high94.9Very high50 Ų5046.3 Ų46.322%0.21723%0.23CC..Hα-helixtrans-67.2-42.9-179.2-72.1-60.2-178.4-169.20113.9W123 V124 E125 N129 Y133 F134 I153W123-K127 HydrophobicContact CH2-CG 4.48Å; W123-K127 HydrophobicContact CZ2-CG 4.12Å; W123-K127 WeakPolarHBondContact O-CG 3.34Å; W123-K127 PolarHBondContact O-N 3.45Å; V124-K127 PolarHBondContact O-N 2.93Å; E125-K127 VanDerWaalsContact C-N 3.3Å; E125-K127 PolarHBondContact O-N 2.94Å; K127-N129 VanDerWaalsContact C-N 3.28Å; K127-N129 PolarHBondContact O-N 3.26Å; K127-Y133 HydrophobicContact CD-CD2 4.09Å; K127-Y133 HydrophobicContact CD-CE2 4.05Å; K127-Y133 VanDerWaalsContact NZ-CE2 3.29Å; K127-F134 WeakPolarHBondContact O-CD2 3.36Å; K127-I153 HydrophobicContact CB-CD1 4.02Å
128I95.6Very high94.3Very high0 Ų051.4 Ų51.40%026%0.263CS..Hα-helixtrans-73.2-2418066.1177.6000111.7K18 V63 V64 F67 V124 E125 F134 I153K18-I128 HydrophobicContact CB-CD1 3.88Å; K18-I128 HydrophobicContact CD-CB 4.26Å; K18-I128 HydrophobicContact CD-CD1 3.79Å; K18-I128 HydrophobicContact CD-CG1 3.87Å; K18-I128 HydrophobicContact CG-CD1 4.47Å; K18-I128 PolarHBondContact NZ-O 2.98Å; V63-I128 HydrophobicContact CG1-CG2 4.08Å; V64-I128 HydrophobicContact CG2-CB 4.22Å; V64-I128 HydrophobicContact CG2-CD1 4.29Å; V64-I128 HydrophobicContact CG2-CG2 4.34Å; F67-I128 HydrophobicContact CD1-CD1 3.32Å; F67-I128 HydrophobicContact CE1-CD1 3.49Å; F67-I128 VanDerWaalsContact CE1-CD1 3.49Å; F67-I128 HydrophobicContact CG-CD1 4.14Å; F67-I128 HydrophobicContact CZ-CD1 4.46Å; V124-I128 HydrophobicContact CG1-CG2 4.09Å; V124-I128 WeakPolarHBondContact O-CG1 3.41Å; V124-I128 WeakPolarHBondContact O-CG2 3.44Å; V124-I128 PolarHBondContact O-N 3.21Å; E125-I128 WeakPolarHBondContact O-CG1 3.47Å; E125-I128 PolarHBondContact O-N 3.33Å; I128-F134 HydrophobicContact CG2-CE1 4.31Å; I128-F134 HydrophobicContact CG2-CE2 4.23Å; I128-F134 HydrophobicContact CG2-CZ 4.03Å; I128-F134 WeakPolarHBondContact O-CB 3.26Å; I128-I153 HydrophobicContact CG2-CD1 4.27Å
129N93.9Very high94Very high71 Ų7155.1 Ų55.138%0.3829%0.293SS..Hα-helixtrans-87.5-17.3177.8-74.1-34.5000114.2K18 E125 D126 K127 Q131K18-N129 WeakPolarHBondContact CD-OD1 3.46Å; K18-N129 PolarHBondContact NZ-OD1 2.81Å; E125-N129 VanDerWaalsContact CG-ND2 3.31Å; E125-N129 WeakPolarHBondContact CG-ND2 3.43Å; E125-N129 VanDerWaalsContact O-CB 3.27Å; E125-N129 WeakPolarHBondContact O-CB 3.44Å; E125-N129 PolarHBondContact O-N 3.49Å; E125-N129 PolarHBondContact O-ND2 3.4Å; E125-N129 VanDerWaalsContact O-ND2 3.16Å; D126-N129 PolarHBondContact O-N 3.47Å; K127-N129 VanDerWaalsContact C-N 3.28Å; K127-N129 PolarHBondContact O-N 3.26Å; N129-Q131 PolarHBondContact O-N 2.98Å
130D94.2Very high93.8Very high58 Ų5856.6 Ų56.631%0.3130%0.304SS..  trans-71112173.4-172.4-12.3000111.3D126 Q132 Y133 F134D126-D130 WeakPolarHBondContact O-CB 3.33Å; D126-D130 PolarHBondContact O-N 2.88Å; D130-Q132 PolarHBondContact O-N 3.28Å; D130-Q132 WeakPolarHBondContact OD1-CB 3.27Å; D130-Q132 PolarHBondContact OD1-N 3.4Å; D130-Y133 HydrophobicContact CB-CD2 3.96Å; D130-Y133 PolarHBondContact O-N 2.91Å; D130-Y133 VanDerWaalsContact O-N 3.07Å; D130-Y133 VanDerWaalsContact OD2-CD2 3.3Å; D130-Y133 WeakPolarHBondContact OD2-CD2 3.38Å; D130-Y133 VanDerWaalsContact OD2-CE2 3.3Å; D130-Y133 WeakPolarHBondContact OD2-CE2 3.35Å; D130-F134 PolarHBondContact O-N 3.47Å
131Q93.5Very high93.7Very high123 Ų12361.8 Ų61.858%0.57534%0.337SS*.THydrogen-bonded Turntrans-67.7-14.5179.9-63.3-172.712.800113.1N129 Y133 P135 I136N129-Q131 PolarHBondContact O-N 2.98Å; Q131-Y133 VanDerWaalsContact C-N 3.27Å; Q131-P135 VanDerWaalsContact O-CA 3.26Å; Q131-P135 WeakPolarHBondContact O-CA 3.38Å; Q131-I136 HydrophobicContact CG-CD1 4.32Å; Q131-I136 HydrophobicContact CG-CG1 4.42Å
132Q94.4Very high93.6Very high130 Ų13063.2 Ų63.261%0.60734%0.343SS*.THydrogen-bonded Turntrans-64.6-36.2170.3-172.9-1805.100111.1D130 P143D130-Q132 PolarHBondContact O-N 3.28Å; D130-Q132 WeakPolarHBondContact OD1-CB 3.27Å; D130-Q132 PolarHBondContact OD1-N 3.4Å; Q132-P143 WeakPolarHBondContact O-CD 3.45Å; Q132-P143 VanDerWaalsContact O-CG 3.22Å; Q132-P143 WeakPolarHBondContact O-CG 3.46Å
133Y93.8Very high93.7Very high45 Ų4561.4 Ų61.418%0.17634%0.336CS..THydrogen-bonded Turntrans-98.6-35.1-179.6-60.9-67.9000113K127 D130 Q131 P135 P143 F146 V149K127-Y133 HydrophobicContact CD-CD2 4.09Å; K127-Y133 HydrophobicContact CD-CE2 4.05Å; K127-Y133 VanDerWaalsContact NZ-CE2 3.29Å; D130-Y133 HydrophobicContact CB-CD2 3.96Å; D130-Y133 PolarHBondContact O-N 2.91Å; D130-Y133 VanDerWaalsContact O-N 3.07Å; D130-Y133 VanDerWaalsContact OD2-CD2 3.3Å; D130-Y133 WeakPolarHBondContact OD2-CD2 3.38Å; D130-Y133 VanDerWaalsContact OD2-CE2 3.3Å; D130-Y133 WeakPolarHBondContact OD2-CE2 3.35Å; Q131-Y133 VanDerWaalsContact C-N 3.27Å; Y133-P135 VanDerWaalsContact C-CD 3.48Å; Y133-P135 WeakPolarHBondContact O-CD 3.45Å; Y133-P143 HydrophobicContact CD1-CG 4.25Å; Y133-F146 WeakPolarHBondContact O-CD2 3.44Å; Y133-V149 HydrophobicContact CD1-CG2 3.73Å; Y133-V149 HydrophobicContact CE1-CG2 3.83Å; Y133-V149 HydrophobicContact CG-CG2 4.46Å
134F94.5Very high93.8Very high5 Ų564.8 Ų64.82%0.02237%0.365CS..SBendtrans-123.667.8-178.6-70.9-104.4000110.3A60 V63 K127 I128 D130 I136 F146 V149 I153A60-F134 HydrophobicContact CB-CD1 3.9Å; A60-F134 HydrophobicContact CB-CE1 4.04Å; V63-F134 HydrophobicContact CB-CE1 4.38Å; V63-F134 HydrophobicContact CG1-CE1 4.26Å; V63-F134 HydrophobicContact CG1-CZ 4.04Å; K127-F134 WeakPolarHBondContact O-CD2 3.36Å; I128-F134 HydrophobicContact CG2-CE1 4.31Å; I128-F134 HydrophobicContact CG2-CE2 4.23Å; I128-F134 HydrophobicContact CG2-CZ 4.03Å; I128-F134 WeakPolarHBondContact O-CB 3.26Å; D130-F134 PolarHBondContact O-N 3.47Å; F134-I136 PolarHBondContact O-N 2.66Å; F134-F146 HydrophobicContact CD1-CE2 4.21Å; F134-F146 AromaticContact CE1-CE2 3.9Å; F134-F146 HydrophobicContact CE1-CE2 3.9Å; F134-F146 HydrophobicContact CE2-CE2 4.49Å; F134-F146 HydrophobicContact CZ-CE2 4.03Å; F134-V149 HydrophobicContact CE2-CG1 4.37Å; F134-I153 HydrophobicContact CE2-CD1 4.27Å; F134-I153 HydrophobicContact CZ-CD1 4.23Å
135P93.5Very high93.7Very high3 Ų369.4 Ų69.42%0.01939%0.386CS..  trans-60.1132.5-175.725-34.7000110.6R26 Q131 Y133 V140 F142R26-P135 PolarHBondContact NH1-O 2.96Å; R26-P135 PolarHBondContact NH2-O 2.9Å; Q131-P135 VanDerWaalsContact O-CA 3.26Å; Q131-P135 WeakPolarHBondContact O-CA 3.38Å; Y133-P135 VanDerWaalsContact C-CD 3.48Å; Y133-P135 WeakPolarHBondContact O-CD 3.45Å; P135-V140 HydrophobicContact CB-CB 3.89Å; P135-V140 HydrophobicContact CB-CG1 3.62Å; P135-V140 HydrophobicContact CG-CG1 4.41Å; P135-F142 HydrophobicContact CG-CD1 4.1Å; P135-F142 HydrophobicContact CG-CD2 4.44Å; P135-F142 HydrophobicContact CG-CE1 4.35Å; P135-F142 HydrophobicContact CG-CG 4.18Å
136I88.4Confident93.8Very high89 Ų8967.2 Ų67.246%0.45638%0.376SS..  trans-86.4-30.7-177.1-59.8172.6000111.7Q131 F134 P138Q131-I136 HydrophobicContact CG-CD1 4.32Å; Q131-I136 HydrophobicContact CG-CG1 4.42Å; F134-I136 PolarHBondContact O-N 2.66Å; I136-P138 WeakPolarHBondContact O-CD 3.27Å
137D88.9Confident94Very high89 Ų8965.3 Ų65.348%0.47636%0.363SS..SBendtrans-74.9120.7178.6-174.1-11.8000110.2A139 V140D137-A139 PolarHBondContact O-N 3.45Å; D137-A139 VanDerWaalsContact O-N 3.14Å; D137-A139 VanDerWaalsContact OD1-CB 3.3Å; D137-A139 WeakPolarHBondContact OD1-CB 3.26Å; D137-A139 PolarHBondContact OD1-N 3.19Å; D137-V140 HydrophobicContact CB-CB 4.33Å; D137-V140 HydrophobicContact CB-CG2 3.89Å; D137-V140 PolarHBondContact O-N 3.38Å
138P86.9Confident94.1Very high107 Ų10767 Ų6770%0.69538%0.381SS*.THydrogen-bonded Turntrans-58.5-20.6174.8-23.234.4000114.4I136 V140I136-P138 WeakPolarHBondContact O-CD 3.27Å; P138-V140 VanDerWaalsContact C-N 3.29Å
139A90.2Very high94.3Very high83 Ų8367.9 Ų67.969%0.68639%0.387SS*.THydrogen-bonded Turntrans-76.6-16.7174.700000113D137D137-A139 PolarHBondContact O-N 3.45Å; D137-A139 VanDerWaalsContact O-N 3.14Å; D137-A139 VanDerWaalsContact OD1-CB 3.3Å; D137-A139 WeakPolarHBondContact OD1-CB 3.26Å; D137-A139 PolarHBondContact OD1-N 3.19Å
140V93.5Very high94.5Very high71 Ų7164.5 Ų64.543%0.4337%0.369SS..SBendtrans-94.7115.9178.61790000109.2P135 D137 P138P135-V140 HydrophobicContact CB-CB 3.89Å; P135-V140 HydrophobicContact CB-CG1 3.62Å; P135-V140 HydrophobicContact CG-CG1 4.41Å; D137-V140 HydrophobicContact CB-CB 4.33Å; D137-V140 HydrophobicContact CB-CG2 3.89Å; D137-V140 PolarHBondContact O-N 3.38Å; P138-V140 VanDerWaalsContact C-N 3.29Å
141P94.6Very high94.7Very high108 Ų10863.2 Ų63.270%0.70136%0.364SS*.PPolyproline II helixtrans-68150.7179.328.8-34.6000111.4
142F96.6Very high94.9Very high31 Ų3162.4 Ų62.414%0.13636%0.359CS..PPolyproline II helixtrans-63.2144.6168.8-73.9-93.5000110.8N56 A60 P135 F146N56-F142 HydrophobicContact CB-CB 4.35Å; N56-F142 HydrophobicContact CB-CD1 4.17Å; N56-F142 HydrophobicContact CB-CD2 3.39Å; N56-F142 HydrophobicContact CB-CE1 4.27Å; N56-F142 HydrophobicContact CB-CE2 3.51Å; N56-F142 HydrophobicContact CB-CG 3.72Å; N56-F142 HydrophobicContact CB-CZ 3.94Å; A60-F142 HydrophobicContact CB-CE1 4.04Å; A60-F142 HydrophobicContact CB-CZ 4.05Å; P135-F142 HydrophobicContact CG-CD1 4.1Å; P135-F142 HydrophobicContact CG-CD2 4.44Å; P135-F142 HydrophobicContact CG-CE1 4.35Å; P135-F142 HydrophobicContact CG-CG 4.18Å; F142-F146 HydrophobicContact CB-CB 4.15Å; F142-F146 HydrophobicContact CB-CD1 4.46Å; F142-F146 HydrophobicContact CB-CG 4.18Å; F142-F146 HydrophobicContact CD1-CB 4.35Å; F142-F146 AromaticContact CD1-CD1 3.97Å; F142-F146 HydrophobicContact CD1-CD1 3.97Å; F142-F146 AromaticContact CD1-CD2 3.4Å; F142-F146 HydrophobicContact CD1-CD2 3.4Å; F142-F146 VanDerWaalsContact CD1-CD2 3.4Å; F142-F146 HydrophobicContact CD1-CE1 4.11Å; F142-F146 AromaticContact CD1-CE2 3.53Å; F142-F146 HydrophobicContact CD1-CE2 3.53Å; F142-F146 AromaticContact CD1-CG 3.62Å; F142-F146 HydrophobicContact CD1-CG 3.62Å; F142-F146 AromaticContact CD1-CZ 3.89Å; F142-F146 HydrophobicContact CD1-CZ 3.89Å; F142-F146 AromaticContact CE1-CD2 3.86Å; F142-F146 HydrophobicContact CE1-CD2 3.86Å; F142-F146 HydrophobicContact CE1-CE1 4.22Å; F142-F146 AromaticContact CE1-CE2 3.45Å; F142-F146 HydrophobicContact CE1-CE2 3.45Å; F142-F146 VanDerWaalsContact CE1-CE2 3.45Å; F142-F146 HydrophobicContact CE1-CG 4.36Å; F142-F146 AromaticContact CE1-CZ 3.66Å; F142-F146 HydrophobicContact CE1-CZ 3.66Å; F142-F146 HydrophobicContact CG-CD1 4.38Å; F142-F146 HydrophobicContact CG-CD2 4.43Å; F142-F146 HydrophobicContact CG-CG 4.24Å; F142-F146 HydrophobicContact CZ-CZ 4.45Å
143P97Very high95.1Very high32 Ų3256.2 Ų56.221%0.20833%0.33CS..PPolyproline II helixtrans-69.6161.2177.933.5-39.9000111.7Q132 Y133 E145 F146Q132-P143 WeakPolarHBondContact O-CD 3.45Å; Q132-P143 VanDerWaalsContact O-CG 3.22Å; Q132-P143 WeakPolarHBondContact O-CG 3.46Å; Y133-P143 HydrophobicContact CD1-CG 4.25Å; P143-E145 PolarHBondContact O-N 2.94Å; P143-E145 VanDerWaalsContact O-N 3.17Å; P143-F146 HydrophobicContact CG-CB 4.16Å; P143-F146 VanDerWaalsContact O-CB 3.23Å; P143-F146 WeakPolarHBondContact O-CB 3.16Å; P143-F146 PolarHBondContact O-N 2.91Å; P143-F146 VanDerWaalsContact O-N 3.08Å
144S97.1Very high95.3Very high108 Ų10854.1 Ų54.176%0.75532%0.322SS*.THydrogen-bonded Turntrans-57-29.9176.232.70000113.3F146S144-F146 VanDerWaalsContact C-N 3.32Å; S144-F146 PolarHBondContact O-N 3.47Å
145E96.3Very high95.5Very high96 Ų9655 Ų5545%0.44933%0.328SS..THydrogen-bonded Turntrans-85.3-3.8-177.4-57.767.9-141.600113P143 H147 S148 V149P143-E145 PolarHBondContact O-N 2.94Å; P143-E145 VanDerWaalsContact O-N 3.17Å; E145-H147 VanDerWaalsContact C-N 3.32Å; E145-H147 PolarHBondContact O-N 3.43Å; E145-S148 WeakPolarHBondContact O-CA 3.4Å; E145-S148 WeakPolarHBondContact O-CB 3.46Å; E145-S148 PolarHBondContact O-N 2.83Å; E145-V149 HydrophobicContact CB-CG2 4.42Å; E145-V149 WeakPolarHBondContact O-CG2 3.4Å; E145-V149 PolarHBondContact O-N 2.96Å
146F97.9Very high95.8Very high0 Ų055.7 Ų55.70%033%0.33CS..Hα-helixtrans-50.5-49-171.7171.4-111.1000112.9N56 I59 A60 Y133 F134 F142 P143 S144 S148 V149 C150N56-F146 HydrophobicContact CB-CD1 3.95Å; N56-F146 HydrophobicContact CB-CE1 3.63Å; N56-F146 HydrophobicContact CB-CZ 4.39Å; N56-F146 WeakPolarHBondContact O-CZ 3.35Å; I59-F146 HydrophobicContact CB-CE1 4.07Å; I59-F146 HydrophobicContact CB-CZ 4.19Å; I59-F146 HydrophobicContact CG2-CE1 3.94Å; I59-F146 HydrophobicContact CG2-CZ 3.91Å; A60-F146 HydrophobicContact CB-CE2 4.31Å; A60-F146 HydrophobicContact CB-CZ 3.98Å; Y133-F146 WeakPolarHBondContact O-CD2 3.44Å; F134-F146 HydrophobicContact CD1-CE2 4.21Å; F134-F146 AromaticContact CE1-CE2 3.9Å; F134-F146 HydrophobicContact CE1-CE2 3.9Å; F134-F146 HydrophobicContact CE2-CE2 4.49Å; F134-F146 HydrophobicContact CZ-CE2 4.03Å; F142-F146 HydrophobicContact CB-CB 4.15Å; F142-F146 HydrophobicContact CB-CD1 4.46Å; F142-F146 HydrophobicContact CB-CG 4.18Å; F142-F146 HydrophobicContact CD1-CB 4.35Å; F142-F146 AromaticContact CD1-CD1 3.97Å; F142-F146 HydrophobicContact CD1-CD1 3.97Å; F142-F146 AromaticContact CD1-CD2 3.4Å; F142-F146 HydrophobicContact CD1-CD2 3.4Å; F142-F146 VanDerWaalsContact CD1-CD2 3.4Å; F142-F146 HydrophobicContact CD1-CE1 4.11Å; F142-F146 AromaticContact CD1-CE2 3.53Å; F142-F146 HydrophobicContact CD1-CE2 3.53Å; F142-F146 AromaticContact CD1-CG 3.62Å; F142-F146 HydrophobicContact CD1-CG 3.62Å; F142-F146 AromaticContact CD1-CZ 3.89Å; F142-F146 HydrophobicContact CD1-CZ 3.89Å; F142-F146 AromaticContact CE1-CD2 3.86Å; F142-F146 HydrophobicContact CE1-CD2 3.86Å; F142-F146 HydrophobicContact CE1-CE1 4.22Å; F142-F146 AromaticContact CE1-CE2 3.45Å; F142-F146 HydrophobicContact CE1-CE2 3.45Å; F142-F146 VanDerWaalsContact CE1-CE2 3.45Å; F142-F146 HydrophobicContact CE1-CG 4.36Å; F142-F146 AromaticContact CE1-CZ 3.66Å; F142-F146 HydrophobicContact CE1-CZ 3.66Å; F142-F146 HydrophobicContact CG-CD1 4.38Å; F142-F146 HydrophobicContact CG-CD2 4.43Å; F142-F146 HydrophobicContact CG-CG 4.24Å; F142-F146 HydrophobicContact CZ-CZ 4.45Å; P143-F146 HydrophobicContact CG-CB 4.16Å; P143-F146 VanDerWaalsContact O-CB 3.23Å; P143-F146 WeakPolarHBondContact O-CB 3.16Å; P143-F146 PolarHBondContact O-N 2.91Å; P143-F146 VanDerWaalsContact O-N 3.08Å; S144-F146 VanDerWaalsContact C-N 3.32Å; S144-F146 PolarHBondContact O-N 3.47Å; F146-S148 PolarHBondContact O-N 2.84Å; F146-V149 PolarHBondContact O-N 3.32Å; F146-C150 WeakPolarHBondContact CE2-SG 3.21Å; F146-C150 WeakPolarHBondContact CZ-SG 3.27Å; F146-C150 PolarHBondContact O-N 3.23Å; F146-C150 PolarHBondContact O-SG 3.07Å
147H98Very high96.3Very high72 Ų7251.5 Ų51.533%0.33331%0.308SS..Hα-helixtrans-62.9-43.3178.7-80.4-104.5000111.8N56 I59 E145 V149 C150 S151N56-H147 PolarHBondContact OD1-NE2 3.16Å; I59-H147 WeakPolarHBondContact CD1-CE1 3.4Å; E145-H147 VanDerWaalsContact C-N 3.32Å; E145-H147 PolarHBondContact O-N 3.43Å; H147-V149 VanDerWaalsContact C-N 3.33Å; H147-V149 PolarHBondContact O-N 2.9Å; H147-C150 PolarHBondContact O-N 2.87Å; H147-S151 WeakPolarHBondContact O-CB 3.44Å; H147-S151 PolarHBondContact O-N 3.35Å; H147-S151 PolarHBondContact O-OG 2.93Å
148S97.9Very high96.8Very high85 Ų8547.3 Ų47.359%0.59429%0.286SS*.Hα-helixtrans-61.6-40.8177.1-179.40000112.1E145 F146 K152E145-S148 WeakPolarHBondContact O-CA 3.4Å; E145-S148 WeakPolarHBondContact O-CB 3.46Å; E145-S148 PolarHBondContact O-N 2.83Å; F146-S148 PolarHBondContact O-N 2.84Å; S148-K152 WeakPolarHBondContact O-CB 3.33Å; S148-K152 PolarHBondContact O-N 2.87Å
149V98Very high97.3Very high19 Ų1944.3 Ų44.312%0.11526%0.261CS..Hα-helixtrans-64.4-47174.9173.50000110.8Y133 F134 E145 F146 H147 K152 I153Y133-V149 HydrophobicContact CD1-CG2 3.73Å; Y133-V149 HydrophobicContact CE1-CG2 3.83Å; Y133-V149 HydrophobicContact CG-CG2 4.46Å; F134-V149 HydrophobicContact CE2-CG1 4.37Å; E145-V149 HydrophobicContact CB-CG2 4.42Å; E145-V149 WeakPolarHBondContact O-CG2 3.4Å; E145-V149 PolarHBondContact O-N 2.96Å; F146-V149 PolarHBondContact O-N 3.32Å; H147-V149 VanDerWaalsContact C-N 3.33Å; H147-V149 PolarHBondContact O-N 2.9Å; V149-K152 PolarHBondContact O-N 2.94Å; V149-I153 HydrophobicContact CG1-CD1 3.89Å; V149-I153 WeakPolarHBondContact O-CG1 3.5Å; V149-I153 PolarHBondContact O-N 3.32Å
150C98.7Very high97.7Very high0 Ų040.4 Ų40.40%023%0.228CC..Hα-helixtrans-60.5-46.8177.2-68.60000111.8I59 V63 F146 H147 K152 I153 L154I59-C150 HydrophobicContact CG2-CB 3.99Å; V63-C150 HydrophobicContact CG2-CB 3.99Å; F146-C150 WeakPolarHBondContact CE2-SG 3.21Å; F146-C150 WeakPolarHBondContact CZ-SG 3.27Å; F146-C150 PolarHBondContact O-N 3.23Å; F146-C150 PolarHBondContact O-SG 3.07Å; H147-C150 PolarHBondContact O-N 2.87Å; C150-K152 VanDerWaalsContact C-N 3.33Å; C150-K152 PolarHBondContact O-N 3.49Å; C150-I153 PolarHBondContact O-N 3.41Å; C150-L154 WeakPolarHBondContact O-CB 3.4Å; C150-L154 VanDerWaalsContact O-CG 3.27Å; C150-L154 WeakPolarHBondContact O-CG 3.24Å; C150-L154 PolarHBondContact O-N 3.23Å
151S98.6Very high97.9Very high31 Ų3137 Ų3722%0.21721%0.208CC..Hα-helixtrans-55.6-47.1174.1-71.60000111.6H147 I153 L154 T155 L197H147-S151 WeakPolarHBondContact O-CB 3.44Å; H147-S151 PolarHBondContact O-N 3.35Å; H147-S151 PolarHBondContact O-OG 2.93Å; S151-I153 PolarHBondContact O-N 3.24Å; S151-L154 PolarHBondContact O-N 2.92Å; S151-T155 WeakPolarHBondContact O-CB 3.01Å; S151-T155 PolarHBondContact O-N 2.91Å; S151-T155 PolarHBondContact O-OG1 3.17Å; S151-L197 VanDerWaalsContact CA-O 3.24Å; S151-L197 WeakPolarHBondContact CA-O 3.47Å; S151-L197 WeakPolarHBondContact CB-O 3.43Å; S151-L197 PolarHBondContact OG-O 3.3Å
152K98.3Very high98.1Very high107 Ų10731.9 Ų31.947%0.46518%0.175SC..Hα-helixtrans-62.7-41178.3-170.7175.2179.4173.70112.2W123 S148 V149 C150 R156W123-K152 HydrophobicContact CH2-CB 4.31Å; W123-K152 HydrophobicContact CH2-CD 3.9Å; W123-K152 HydrophobicContact CH2-CG 3.76Å; W123-K152 HydrophobicContact CZ2-CD 3.97Å; W123-K152 HydrophobicContact CZ2-CG 4.33Å; S148-K152 WeakPolarHBondContact O-CB 3.33Å; S148-K152 PolarHBondContact O-N 2.87Å; V149-K152 PolarHBondContact O-N 2.94Å; C150-K152 VanDerWaalsContact C-N 3.33Å; C150-K152 PolarHBondContact O-N 3.49Å; K152-R156 WeakPolarHBondContact O-CB 3.38Å; K152-R156 VanDerWaalsContact O-CG 3.26Å; K152-R156 WeakPolarHBondContact O-CG 3.48Å; K152-R156 PolarHBondContact O-N 2.78Å
153I98.6Very high98.2Very high0 Ų030.4 Ų30.40%017%0.168CC..Hα-helixtrans-61.3-54.4174.9-70.3166.2000110.1V63 W123 V124 K127 I128 F134 V149 C150 S151 T155 R156 L157V63-I153 HydrophobicContact CG1-CB 4.46Å; V63-I153 HydrophobicContact CG1-CD1 4.18Å; V63-I153 HydrophobicContact CG1-CG2 3.8Å; W123-I153 HydrophobicContact CH2-CG1 3.95Å; W123-I153 HydrophobicContact CZ3-CB 4.47Å; W123-I153 HydrophobicContact CZ3-CG1 3.72Å; V124-I153 HydrophobicContact CG1-CG2 3.71Å; V124-I153 HydrophobicContact CG2-CG1 4.42Å; V124-I153 HydrophobicContact CG2-CG2 3.94Å; K127-I153 HydrophobicContact CB-CD1 4.02Å; I128-I153 HydrophobicContact CG2-CD1 4.27Å; F134-I153 HydrophobicContact CE2-CD1 4.27Å; F134-I153 HydrophobicContact CZ-CD1 4.23Å; V149-I153 HydrophobicContact CG1-CD1 3.89Å; V149-I153 WeakPolarHBondContact O-CG1 3.5Å; V149-I153 PolarHBondContact O-N 3.32Å; C150-I153 PolarHBondContact O-N 3.41Å; S151-I153 PolarHBondContact O-N 3.24Å; I153-T155 PolarHBondContact O-N 2.96Å; I153-R156 PolarHBondContact O-N 2.81Å; I153-L157 HydrophobicContact CG2-CD1 3.63Å; I153-L157 HydrophobicContact CG2-CG 4.2Å; I153-L157 WeakPolarHBondContact O-CB 3.48Å; I153-L157 WeakPolarHBondContact O-CG 3.22Å; I153-L157 PolarHBondContact O-N 3.03Å
154L98.8Very high98.3Very high0 Ų028.9 Ų28.90%016%0.158CC..Hα-helixtrans-63.8-44.6-175.4-67.4164000111.5V63 F66 C150 S151 R156 L157 F158 F188 V192 L197 V198V63-L154 HydrophobicContact CG2-CD1 4.01Å; V63-L154 HydrophobicContact CG2-CD2 4.26Å; V63-L154 HydrophobicContact CG2-CG 4.16Å; F66-L154 HydrophobicContact CD2-CD2 3.95Å; C150-L154 WeakPolarHBondContact O-CB 3.4Å; C150-L154 VanDerWaalsContact O-CG 3.27Å; C150-L154 WeakPolarHBondContact O-CG 3.24Å; C150-L154 PolarHBondContact O-N 3.23Å; S151-L154 PolarHBondContact O-N 2.92Å; L154-R156 VanDerWaalsContact C-N 3.29Å; L154-R156 PolarHBondContact O-N 3.41Å; L154-L157 PolarHBondContact O-N 3.49Å; L154-F158 PolarHBondContact O-N 3.3Å; L154-F188 HydrophobicContact CB-CE2 4.33Å; L154-F188 HydrophobicContact CB-CZ 4.05Å; L154-F188 HydrophobicContact CD2-CD2 4.38Å; L154-F188 HydrophobicContact CD2-CE2 3.58Å; L154-F188 HydrophobicContact CD2-CZ 4.14Å; L154-F188 WeakPolarHBondContact O-CZ 3.06Å; L154-V192 HydrophobicContact CB-CG1 4.19Å; L154-V192 HydrophobicContact CD1-CG1 4.09Å; L154-V192 HydrophobicContact CD2-CG1 4.26Å; L154-V192 HydrophobicContact CG-CG1 4.41Å; L154-L197 HydrophobicContact CD1-CB 3.8Å; L154-L197 HydrophobicContact CD1-CD1 3.56Å; L154-L197 HydrophobicContact CD1-CG 4.25Å; L154-V198 HydrophobicContact CB-CG2 3.74Å
155T98.7Very high98.3Very high24 Ų2425 Ų2515%0.14713%0.127CC..Hα-helixtrans-58-40.7174.9-64.40000112.1S151 I153 E202S151-T155 WeakPolarHBondContact O-CB 3.01Å; S151-T155 PolarHBondContact O-N 2.91Å; S151-T155 PolarHBondContact O-OG1 3.17Å; I153-T155 PolarHBondContact O-N 2.96Å; T155-E202 HydrophobicContact CG2-CB 4.2Å; T155-E202 HydrophobicContact CG2-CG 3.89Å
156R98.7Very high98.3Very high18 Ų1823.4 Ų23.47%0.06812%0.124CC..Hα-helixtrans-73.8-39.4178.5-68.2171.981114.7-10.1111.9Q100 L120 K152 I153 L154 F158 R159Q100-R156 PolarHBondContact O-NH1 2.62Å; Q100-R156 PolarHBondContact O-NH2 3.38Å; L120-R156 HydrophobicContact CD1-CB 3.5Å; L120-R156 HydrophobicContact CD1-CG 4.41Å; L120-R156 HydrophobicContact CD2-CB 4.37Å; L120-R156 WeakPolarHBondContact CD2-O 3.48Å; K152-R156 WeakPolarHBondContact O-CB 3.38Å; K152-R156 VanDerWaalsContact O-CG 3.26Å; K152-R156 WeakPolarHBondContact O-CG 3.48Å; K152-R156 PolarHBondContact O-N 2.78Å; I153-R156 PolarHBondContact O-N 2.81Å; L154-R156 VanDerWaalsContact C-N 3.29Å; L154-R156 PolarHBondContact O-N 3.41Å; R156-F158 VanDerWaalsContact C-N 3.29Å; R156-F158 PolarHBondContact O-N 3.47Å; R156-R159 VanDerWaalsContact O-CB 3.24Å; R156-R159 WeakPolarHBondContact O-CB 3.36Å; R156-R159 WeakPolarHBondContact O-CG 3.27Å; R156-R159 PolarHBondContact O-N 2.99Å; R156-R159 VanDerWaalsContact O-N 3.15Å
157L98.7Very high98.3Very high0 Ų027 Ų270%014%0.141CC..Hα-helixtrans-61.7-35.7174.4-75.3175.9000112.2F67 I70 L120 M121 V124 I153 L154 R159 V160F67-L157 HydrophobicContact CB-CD1 4.25Å; F67-L157 HydrophobicContact CD2-CD2 4.45Å; I70-L157 HydrophobicContact CD1-CB 3.8Å; I70-L157 HydrophobicContact CD1-CD1 4.32Å; I70-L157 HydrophobicContact CD1-CD2 4.38Å; I70-L157 HydrophobicContact CD1-CG 4.4Å; I70-L157 HydrophobicContact CG2-CD2 4.31Å; L120-L157 HydrophobicContact CD2-CD2 4.36Å; M121-L157 HydrophobicContact SD-CD2 4.47Å; V124-L157 HydrophobicContact CG2-CD2 4.36Å; V124-L157 HydrophobicContact CG2-CG 4.43Å; I153-L157 HydrophobicContact CG2-CD1 3.63Å; I153-L157 HydrophobicContact CG2-CG 4.2Å; I153-L157 WeakPolarHBondContact O-CB 3.48Å; I153-L157 WeakPolarHBondContact O-CG 3.22Å; I153-L157 PolarHBondContact O-N 3.03Å; L154-L157 PolarHBondContact O-N 3.49Å; L157-R159 PolarHBondContact O-N 2.86Å; L157-V160 VanDerWaalsContact O-CB 3.32Å; L157-V160 WeakPolarHBondContact O-CB 3.01Å; L157-V160 PolarHBondContact O-N 2.66Å
158F98.7Very high98.2Very high2 Ų223.9 Ų23.91%0.00913%0.127CC..Hα-helixtrans-57.3-32.6175.2-178.3-105000112.7L154 R156 V160 F161 V162 L185 F188 E202 L203 P205 L206L154-F158 PolarHBondContact O-N 3.3Å; R156-F158 VanDerWaalsContact C-N 3.29Å; R156-F158 PolarHBondContact O-N 3.47Å; F158-V160 PolarHBondContact O-N 2.86Å; F158-F161 HydrophobicContact CD2-CD2 4.33Å; F158-F161 WeakPolarHBondContact O-CB 3.32Å; F158-F161 PolarHBondContact O-N 2.95Å; F158-V162 HydrophobicContact CD1-CG2 3.79Å; F158-V162 HydrophobicContact CE1-CG2 3.4Å; F158-V162 HydrophobicContact CZ-CG2 3.92Å; F158-V162 WeakPolarHBondContact O-CG2 3.42Å; F158-V162 PolarHBondContact O-N 2.99Å; F158-V162 VanDerWaalsContact O-N 3.08Å; F158-L185 HydrophobicContact CE2-CD1 4.12Å; F158-F188 HydrophobicContact CB-CE1 3.95Å; F158-F188 HydrophobicContact CB-CZ 4.04Å; F158-F188 HydrophobicContact CD2-CD1 4.21Å; F158-F188 AromaticContact CD2-CE1 3.79Å; F158-F188 HydrophobicContact CD2-CE1 3.79Å; F158-F188 HydrophobicContact CG-CE1 4.29Å; F158-E202 WeakPolarHBondContact CD1-O 3.48Å; F158-E202 WeakPolarHBondContact CE1-O 3.39Å; F158-L203 HydrophobicContact CD1-CD2 4.29Å; F158-L203 HydrophobicContact CD2-CD2 3.86Å; F158-L203 HydrophobicContact CE1-CD2 4.27Å; F158-L203 HydrophobicContact CE2-CD2 3.8Å; F158-L203 HydrophobicContact CG-CD2 4.09Å; F158-L203 HydrophobicContact CZ-CB 4.48Å; F158-L203 HydrophobicContact CZ-CD2 4.01Å; F158-P205 HydrophobicContact CE1-CG 4.35Å; F158-L206 HydrophobicContact CE2-CB 4.35Å; F158-L206 HydrophobicContact CE2-CD1 3.97Å; F158-L206 HydrophobicContact CE2-CG 4.46Å; F158-L206 HydrophobicContact CZ-CB 3.89Å; F158-L206 HydrophobicContact CZ-CD1 3.95Å; F158-L206 HydrophobicContact CZ-CG 3.98Å
159R98.5Very high98.2Very high44 Ų4422.6 Ų22.617%0.16611%0.11CC..Hα-helixtrans-59.8-30.2176.6-55.7172.8179-168.7-5.4112.1M89 Y97 Y116 R156 L157 V162 H163M89-R159 HydrophobicContact CE-CB 3.87Å; M89-R159 VanDerWaalsContact CE-O 3.22Å; M89-R159 WeakPolarHBondContact CE-O 3.33Å; Y97-R159 HydrophobicContact CD1-CB 4.49Å; Y97-R159 HydrophobicContact CD1-CG 3.75Å; Y97-R159 HydrophobicContact CD2-CB 3.89Å; Y97-R159 HydrophobicContact CD2-CG 4.05Å; Y97-R159 HydrophobicContact CE1-CG 3.74Å; Y97-R159 HydrophobicContact CE2-CB 3.9Å; Y97-R159 HydrophobicContact CE2-CG 4.04Å; Y97-R159 HydrophobicContact CG-CB 4.18Å; Y97-R159 HydrophobicContact CG-CG 3.89Å; Y116-R159 VanDerWaalsContact OH-CD 3.28Å; Y116-R159 WeakPolarHBondContact OH-CD 3.46Å; Y116-R159 PolarHBondContact OH-NH1 3.42Å; R156-R159 VanDerWaalsContact O-CB 3.24Å; R156-R159 WeakPolarHBondContact O-CB 3.36Å; R156-R159 WeakPolarHBondContact O-CG 3.27Å; R156-R159 PolarHBondContact O-N 2.99Å; R156-R159 VanDerWaalsContact O-N 3.15Å; L157-R159 PolarHBondContact O-N 2.86Å; R159-V162 PolarHBondContact O-N 3Å; R159-H163 WeakPolarHBondContact O-CB 3.41Å; R159-H163 PolarHBondContact O-N 3.12Å
160V98.5Very high98.1Very high0 Ų027.4 Ų27.40%014%0.135CC..Hα-helixtrans-67.3-43175.4-172.60000110.5I70 I117 L120 M121 L157 F158 V162 H163 V164I70-V160 HydrophobicContact CG2-CB 3.69Å; I70-V160 HydrophobicContact CG2-CG1 3.67Å; I70-V160 HydrophobicContact CG2-CG2 4.1Å; I117-V160 HydrophobicContact CD1-CG1 4.49Å; I117-V160 HydrophobicContact CG1-CG2 4.41Å; L120-V160 HydrophobicContact CD2-CG2 3.66Å; M121-V160 HydrophobicContact CE-CG2 4.27Å; L157-V160 VanDerWaalsContact O-CB 3.32Å; L157-V160 WeakPolarHBondContact O-CB 3.01Å; L157-V160 PolarHBondContact O-N 2.66Å; F158-V160 PolarHBondContact O-N 2.86Å; V160-V162 VanDerWaalsContact C-N 3.35Å; V160-V162 PolarHBondContact O-N 3.11Å; V160-H163 PolarHBondContact O-N 3.14Å; V160-V164 HydrophobicContact CG1-CG2 4.17Å; V160-V164 WeakPolarHBondContact O-CB 3.45Å; V160-V164 VanDerWaalsContact O-CG2 3.26Å; V160-V164 WeakPolarHBondContact O-CG2 3.46Å; V160-V164 PolarHBondContact O-N 3.41Å
161F98.5Very high97.9Very high0 Ų028.6 Ų28.60%014%0.143CC..Hα-helixtrans-58.4-49.1172.1-74.3-64.4000111.1I70 L73 F158 H163 V164 Y165 V181 C184 L185 F188 L206I70-F161 HydrophobicContact CD1-CD2 4.25Å; I70-F161 HydrophobicContact CD1-CE2 3.5Å; I70-F161 HydrophobicContact CD1-CZ 3.92Å; I70-F161 HydrophobicContact CG1-CE1 4.47Å; I70-F161 HydrophobicContact CG1-CE2 3.85Å; I70-F161 HydrophobicContact CG1-CZ 3.73Å; L73-F161 HydrophobicContact CD2-CD1 4.03Å; L73-F161 HydrophobicContact CD2-CE1 3.81Å; F158-F161 HydrophobicContact CD2-CD2 4.33Å; F158-F161 WeakPolarHBondContact O-CB 3.32Å; F158-F161 PolarHBondContact O-N 2.95Å; F161-H163 VanDerWaalsContact C-N 3.28Å; F161-H163 PolarHBondContact O-N 3.36Å; F161-V164 PolarHBondContact O-N 2.88Å; F161-Y165 HydrophobicContact CB-CD2 4.4Å; F161-Y165 HydrophobicContact CD1-CE2 4.26Å; F161-Y165 WeakPolarHBondContact O-CB 3.36Å; F161-Y165 VanDerWaalsContact O-CD2 3.29Å; F161-Y165 WeakPolarHBondContact O-CD2 3.45Å; F161-Y165 PolarHBondContact O-N 3.3Å; F161-V181 HydrophobicContact CD1-CG2 4.04Å; F161-V181 HydrophobicContact CE1-CG2 4.15Å; F161-C184 HydrophobicContact CE1-CB 4.09Å; F161-C184 HydrophobicContact CZ-CB 4.1Å; F161-L185 HydrophobicContact CB-CD1 4.34Å; F161-L185 HydrophobicContact CD1-CB 4.24Å; F161-L185 HydrophobicContact CD1-CD1 4.35Å; F161-L185 HydrophobicContact CD2-CD1 4.14Å; F161-L185 HydrophobicContact CE1-CB 4.13Å; F161-L185 HydrophobicContact CG-CD1 4.05Å; F161-F188 HydrophobicContact CD2-CG 4.46Å; F161-F188 HydrophobicContact CE2-CB 3.91Å; F161-F188 HydrophobicContact CE2-CD1 4.21Å; F161-F188 AromaticContact CE2-CD2 3.88Å; F161-F188 HydrophobicContact CE2-CD2 3.88Å; F161-F188 HydrophobicContact CE2-CE2 4.49Å; F161-F188 AromaticContact CE2-CG 3.72Å; F161-F188 HydrophobicContact CE2-CG 3.72Å; F161-F188 HydrophobicContact CZ-CB 4.29Å; F161-L206 HydrophobicContact CB-CD1 3.77Å
162V98.6Very high97.6Very high1 Ų127.1 Ų27.11%0.00613%0.132CC..Hα-helixtrans-55.5-47.2-180178.20000110.9G91 Y97 F158 R159 V160 T166 P205 L206G91-V162 VanDerWaalsContact CA-CG1 3.46Å; Y97-V162 HydrophobicContact CE2-CB 4.31Å; Y97-V162 HydrophobicContact CE2-CG1 4.12Å; F158-V162 HydrophobicContact CD1-CG2 3.79Å; F158-V162 HydrophobicContact CE1-CG2 3.4Å; F158-V162 HydrophobicContact CZ-CG2 3.92Å; F158-V162 WeakPolarHBondContact O-CG2 3.42Å; F158-V162 PolarHBondContact O-N 2.99Å; F158-V162 VanDerWaalsContact O-N 3.08Å; R159-V162 PolarHBondContact O-N 3Å; V160-V162 VanDerWaalsContact C-N 3.35Å; V160-V162 PolarHBondContact O-N 3.11Å; V162-T166 WeakPolarHBondContact O-CB 3.26Å; V162-T166 PolarHBondContact O-N 3.22Å; V162-T166 PolarHBondContact O-OG1 3.45Å; V162-P205 HydrophobicContact CG1-CB 3.87Å; V162-P205 HydrophobicContact CG2-CB 3.77Å; V162-P205 HydrophobicContact CG2-CG 4.18Å; V162-L206 HydrophobicContact CG2-CD1 4.08Å; V162-L206 HydrophobicContact CG2-CG 4.04Å
163H98.4Very high97.4Very high0 Ų026 Ų260%013%0.13CC..Hα-helixtrans-63.3-51.9179.1176.368.1000112C81 M89 S90 A113 R159 V160 F161 Y165 T166 H167 H168C81-H163 PolarHBondContact SG-NE2 2.8Å; C81-H163 VanDerWaalsContact SG-NE2 3.37Å; M89-H163 HydrophobicContact CE-CB 3.61Å; M89-H163 HydrophobicContact SD-CB 4.05Å; S90-H163 PolarHBondContact O-ND1 3.44Å; A113-H163 WeakPolarHBondContact CB-CE1 3.35Å; A113-H163 WeakPolarHBondContact CB-NE2 3.3Å; R159-H163 WeakPolarHBondContact O-CB 3.41Å; R159-H163 PolarHBondContact O-N 3.12Å; V160-H163 PolarHBondContact O-N 3.14Å; F161-H163 VanDerWaalsContact C-N 3.28Å; F161-H163 PolarHBondContact O-N 3.36Å; H163-Y165 PolarHBondContact O-N 3.46Å; H163-T166 PolarHBondContact O-N 3.46Å; H163-T166 VanDerWaalsContact O-N 3.08Å; H163-H167 AromaticContact CE1-CD2 3.74Å; H163-H167 AromaticContact ND1-CD2 3.36Å; H163-H167 PolarHBondContact ND1-CD2 3.45Å; H163-H167 PolarHBondContact O-CD2 2.93Å; H163-H167 PolarHBondContact O-N 3Å; H163-H168 AromaticContact CD2-CD2 3.94Å; H163-H168 AromaticContact CE1-NE2 3.93Å; H163-H168 AromaticContact NE2-CD2 3.45Å; H163-H168 PolarHBondContact NE2-CD2 3.36Å; H163-H168 AromaticContact NE2-NE2 3.31Å; H163-H168 PolarHBondContact NE2-NE2 3.37Å
164V97.9Very high97.2Very high0 Ų032.6 Ų32.60%017%0.166CC..Hα-helixtrans-60.7-45.7-178.41690000111.7V77 V160 F161 T166 H168 F169 L172V77-V164 HydrophobicContact CG2-CG2 4.19Å; V160-V164 HydrophobicContact CG1-CG2 4.17Å; V160-V164 WeakPolarHBondContact O-CB 3.45Å; V160-V164 VanDerWaalsContact O-CG2 3.26Å; V160-V164 WeakPolarHBondContact O-CG2 3.46Å; V160-V164 PolarHBondContact O-N 3.41Å; F161-V164 PolarHBondContact O-N 2.88Å; V164-T166 PolarHBondContact O-N 3.45Å; V164-H168 CarbonylContact O-C 3.27Å; V164-H168 VanDerWaalsContact O-C 3.27Å; V164-H168 WeakPolarHBondContact O-CA 3.36Å; V164-H168 PolarHBondContact O-N 3.29Å; V164-F169 PolarHBondContact O-N 3.32Å; V164-L172 HydrophobicContact CG1-CD1 3.39Å; V164-L172 HydrophobicContact CG1-CG 4.28Å
165Y97.8Very high97Very high25 Ų2537 Ų3710%0.09819%0.188CC..Hα-helixtrans-65.6-24.8176.9-87.4-73.2000113.8F161 H163 F169 V181 N182 L185 L206 L209F161-Y165 HydrophobicContact CB-CD2 4.4Å; F161-Y165 HydrophobicContact CD1-CE2 4.26Å; F161-Y165 WeakPolarHBondContact O-CB 3.36Å; F161-Y165 VanDerWaalsContact O-CD2 3.29Å; F161-Y165 WeakPolarHBondContact O-CD2 3.45Å; F161-Y165 PolarHBondContact O-N 3.3Å; H163-Y165 PolarHBondContact O-N 3.46Å; Y165-F169 AromaticContact CD1-CD2 3.51Å; Y165-F169 HydrophobicContact CD1-CD2 3.51Å; Y165-F169 AromaticContact CD1-CE2 3.73Å; Y165-F169 HydrophobicContact CD1-CE2 3.73Å; Y165-F169 HydrophobicContact CD1-CG 4.26Å; Y165-F169 AromaticContact CE1-CD2 3.74Å; Y165-F169 HydrophobicContact CE1-CD2 3.74Å; Y165-F169 AromaticContact CE1-CE2 3.47Å; Y165-F169 HydrophobicContact CE1-CE2 3.47Å; Y165-F169 VanDerWaalsContact CE1-CE2 3.47Å; Y165-F169 HydrophobicContact CE1-CZ 4.33Å; Y165-V181 HydrophobicContact CD2-CG2 4.36Å; Y165-V181 HydrophobicContact CE1-CG1 4.14Å; Y165-V181 HydrophobicContact CE2-CG2 3.57Å; Y165-N182 WeakPolarHBondContact OH-CA 3.42Å; Y165-N182 PolarHBondContact OH-N 3.18Å; Y165-N182 PolarHBondContact OH-OD1 3.28Å; Y165-L185 HydrophobicContact CD2-CD2 4.29Å; Y165-L185 HydrophobicContact CE2-CB 4.22Å; Y165-L185 HydrophobicContact CE2-CD2 3.49Å; Y165-L185 VanDerWaalsContact CE2-CD2 3.49Å; Y165-L185 HydrophobicContact CE2-CG 4.36Å; Y165-L206 HydrophobicContact CD2-CD1 3.89Å; Y165-L206 HydrophobicContact CD2-CD2 4.43Å; Y165-L206 HydrophobicContact CE2-CD1 4.45Å; Y165-L206 HydrophobicContact CG-CD2 4.42Å; Y165-L209 HydrophobicContact CD1-CD2 3.55Å; Y165-L209 HydrophobicContact CD2-CD2 4.1Å; Y165-L209 HydrophobicContact CE1-CD2 3.49Å; Y165-L209 VanDerWaalsContact CE1-CD2 3.49Å; Y165-L209 HydrophobicContact CE2-CD2 4.06Å; Y165-L209 HydrophobicContact CG-CD2 3.85Å
166T97.1Very high96.7Very high64 Ų6438.3 Ų38.339%0.39321%0.207SC..Hα-helixtrans-89.9-39.5-177-52.80000112.4G92 V162 H163 V164G92-T166 VanDerWaalsContact N-CG2 3.27Å; V162-T166 WeakPolarHBondContact O-CB 3.26Å; V162-T166 PolarHBondContact O-N 3.22Å; V162-T166 PolarHBondContact O-OG1 3.45Å; H163-T166 PolarHBondContact O-N 3.46Å; H163-T166 VanDerWaalsContact O-N 3.08Å; V164-T166 PolarHBondContact O-N 3.45Å
167H97.2Very high96.4Very high76 Ų7638.1 Ų38.135%0.35221%0.21SC..Hα-helixtrans-115.7-18.2-168.6-59.8-78.6000114.3S90 H163S90-H167 PolarHBondContact O-CD2 2.83Å; S90-H167 VanDerWaalsContact O-CD2 3.27Å; S90-H167 PolarHBondContact O-NE2 3.28Å; S90-H167 PolarHBondContact OG-NE2 3.38Å; S90-H167 VanDerWaalsContact OG-NE2 3.17Å; H163-H167 AromaticContact CE1-CD2 3.74Å; H163-H167 AromaticContact ND1-CD2 3.36Å; H163-H167 PolarHBondContact ND1-CD2 3.45Å; H163-H167 PolarHBondContact O-CD2 2.93Å; H163-H167 PolarHBondContact O-N 3Å
168H97Very high96.1Very high6 Ų641.2 Ų41.23%0.02823%0.225CC..SBendtrans-130.915.6-173.4-60.5-59.5000113.4V77 H80 C81 C86 H163 V164 T171 L172V77-H168 HydrophobicContact CB-CB 3.92Å; V77-H168 HydrophobicContact CG1-CB 3.97Å; V77-H168 HydrophobicContact CG2-CB 4.11Å; H80-H168 PolarHBondContact O-CE1 2.7Å; C81-H168 WeakPolarHBondContact CB-NE2 3.32Å; C81-H168 PolarHBondContact SG-NE2 2.77Å; C81-H168 VanDerWaalsContact SG-NE2 3.38Å; C86-H168 PolarHBondContact SG-NE2 3.27Å; C86-H168 VanDerWaalsContact SG-NE2 3.41Å; H163-H168 AromaticContact CD2-CD2 3.94Å; H163-H168 AromaticContact CE1-NE2 3.93Å; H163-H168 AromaticContact NE2-CD2 3.45Å; H163-H168 PolarHBondContact NE2-CD2 3.36Å; H163-H168 AromaticContact NE2-NE2 3.31Å; H163-H168 PolarHBondContact NE2-NE2 3.37Å; V164-H168 CarbonylContact O-C 3.27Å; V164-H168 VanDerWaalsContact O-C 3.27Å; V164-H168 WeakPolarHBondContact O-CA 3.36Å; V164-H168 PolarHBondContact O-N 3.29Å; H168-T171 PolarHBondContact O-N 3.08Å; H168-L172 PolarHBondContact O-N 3.5Å
169F96.4Very high95.8Very high57 Ų5743.9 Ų43.925%0.2525%0.247CC..Hα-helixtrans-69.6-36.4-179.5-166.6-111.5000112.1V164 Y165 L172 I173 E178 V181V164-F169 PolarHBondContact O-N 3.32Å; Y165-F169 AromaticContact CD1-CD2 3.51Å; Y165-F169 HydrophobicContact CD1-CD2 3.51Å; Y165-F169 AromaticContact CD1-CE2 3.73Å; Y165-F169 HydrophobicContact CD1-CE2 3.73Å; Y165-F169 HydrophobicContact CD1-CG 4.26Å; Y165-F169 AromaticContact CE1-CD2 3.74Å; Y165-F169 HydrophobicContact CE1-CD2 3.74Å; Y165-F169 AromaticContact CE1-CE2 3.47Å; Y165-F169 HydrophobicContact CE1-CE2 3.47Å; Y165-F169 VanDerWaalsContact CE1-CE2 3.47Å; Y165-F169 HydrophobicContact CE1-CZ 4.33Å; F169-L172 HydrophobicContact CD2-CD1 4.36Å; F169-L172 WeakPolarHBondContact O-CA 3.33Å; F169-L172 WeakPolarHBondContact O-CB 3.26Å; F169-L172 PolarHBondContact O-N 3.08Å; F169-L172 VanDerWaalsContact O-N 3.09Å; F169-I173 HydrophobicContact CD1-CD1 3.82Å; F169-I173 HydrophobicContact CD1-CG1 4.3Å; F169-I173 HydrophobicContact CE1-CD1 3.7Å; F169-I173 HydrophobicContact CE1-CG1 4.08Å; F169-I173 HydrophobicContact CZ-CG1 4.48Å; F169-I173 WeakPolarHBondContact O-CG1 3.44Å; F169-I173 PolarHBondContact O-N 3.21Å; F169-E178 HydrophobicContact CE2-CB 4.04Å; F169-E178 HydrophobicContact CZ-CB 4.01Å; F169-V181 HydrophobicContact CE2-CG1 4.19Å
170D96.1Very high95.4Very high121 Ų12146.2 Ų46.265%0.64726%0.26SS*.Hα-helixtrans-63.2-44.3175.1-62.5-25.2000110.7L172 I173 D174D170-L172 PolarHBondContact O-N 2.9Å; D170-I173 WeakPolarHBondContact O-CB 3.32Å; D170-I173 PolarHBondContact O-N 3.12Å; D170-D174 PolarHBondContact O-N 3.49Å
171T94.6Very high95.2Very high24 Ų2446.2 Ų46.215%0.14726%0.26CS..Hα-helixtrans-57.2-38.5171.6-49.40000112.1V77 H168 D174 I175V77-T171 HydrophobicContact CG1-CG2 4.2Å; H168-T171 PolarHBondContact O-N 3.08Å; T171-D174 PolarHBondContact O-N 2.93Å; T171-I175 WeakPolarHBondContact O-CG1 3.38Å; T171-I175 PolarHBondContact O-N 3Å
172L92.6Very high95Very high0 Ų047.7 Ų47.70%027%0.268CS..Hα-helixtrans-66.8-37.5175.2-76.5177.4000112.6L73 V77 V164 H168 F169 D170 I175 G176 G177 V181L73-L172 HydrophobicContact CD1-CD1 4.24Å; L73-L172 HydrophobicContact CD1-CD2 4.05Å; V77-L172 HydrophobicContact CG1-CD2 3.71Å; V77-L172 HydrophobicContact CG1-CG 3.84Å; V164-L172 HydrophobicContact CG1-CD1 3.39Å; V164-L172 HydrophobicContact CG1-CG 4.28Å; H168-L172 PolarHBondContact O-N 3.5Å; F169-L172 HydrophobicContact CD2-CD1 4.36Å; F169-L172 WeakPolarHBondContact O-CA 3.33Å; F169-L172 WeakPolarHBondContact O-CB 3.26Å; F169-L172 PolarHBondContact O-N 3.08Å; F169-L172 VanDerWaalsContact O-N 3.09Å; D170-L172 PolarHBondContact O-N 2.9Å; L172-I175 HydrophobicContact CD2-CD1 4.17Å; L172-I175 WeakPolarHBondContact O-CG1 3.33Å; L172-G176 PolarHBondContact O-N 2.73Å; L172-G177 WeakPolarHBondContact O-CA 3.43Å; L172-G177 PolarHBondContact O-N 3.03Å; L172-V181 HydrophobicContact CD1-CB 3.99Å; L172-V181 HydrophobicContact CD1-CG1 3.73Å; L172-V181 HydrophobicContact CD1-CG2 4.28Å
173I94.7Very high94.8Very high83 Ų8349.9 Ų49.943%0.42628%0.281SS..Hα-helixtrans-64.3-45.9175-67.7168.3000110F169 D170 I175 G176 E178F169-I173 HydrophobicContact CD1-CD1 3.82Å; F169-I173 HydrophobicContact CD1-CG1 4.3Å; F169-I173 HydrophobicContact CE1-CD1 3.7Å; F169-I173 HydrophobicContact CE1-CG1 4.08Å; F169-I173 HydrophobicContact CZ-CG1 4.48Å; F169-I173 WeakPolarHBondContact O-CG1 3.44Å; F169-I173 PolarHBondContact O-N 3.21Å; D170-I173 WeakPolarHBondContact O-CB 3.32Å; D170-I173 PolarHBondContact O-N 3.12Å; I173-I175 PolarHBondContact O-N 3.36Å; I173-G176 PolarHBondContact O-N 3.25Å; I173-E178 HydrophobicContact CG1-CB 4.29Å
174D94.6Very high94.7Very high140 Ų14049.9 Ų49.975%0.74928%0.281SS*.Hα-helixtrans-59.9-31.5-177.3-68.4-22.6000112.6D170 T171D170-D174 PolarHBondContact O-N 3.49Å; T171-D174 PolarHBondContact O-N 2.93Å
175I93.7Very high94.6Very high91 Ų9149.9 Ų49.947%0.46728%0.281SS..THydrogen-bonded Turntrans-962.5177.372.3177.4000113.9T171 L172 I173 G177T171-I175 WeakPolarHBondContact O-CG1 3.38Å; T171-I175 PolarHBondContact O-N 3Å; L172-I175 HydrophobicContact CD2-CD1 4.17Å; L172-I175 WeakPolarHBondContact O-CG1 3.33Å; I173-I175 PolarHBondContact O-N 3.36Å; I175-G177 VanDerWaalsContact C-N 3.28Å; I175-G177 PolarHBondContact O-N 3.17Å
176G92.3Very high94.5Very high52 Ų5250.7 Ų50.754%0.53629%0.285SS..THydrogen-bonded Turntrans6724.5-176.300000114.6L172 I173 E178L172-G176 PolarHBondContact O-N 2.73Å; I173-G176 PolarHBondContact O-N 3.25Å; G176-E178 VanDerWaalsContact CA-OE2 3.28Å; G176-E178 WeakPolarHBondContact CA-OE2 3.22Å
177G91.9Very high94.4Very high14 Ų1447.8 Ų47.814%0.14427%0.267CS..  trans-89.2-5.9-177.500000114.7L172 I175 A179 H180 V181L172-G177 WeakPolarHBondContact O-CA 3.43Å; L172-G177 PolarHBondContact O-N 3.03Å; I175-G177 VanDerWaalsContact C-N 3.28Å; I175-G177 PolarHBondContact O-N 3.17Å; G177-A179 VanDerWaalsContact C-N 3.33Å; G177-A179 PolarHBondContact O-N 3.23Å; G177-H180 WeakPolarHBondContact O-CB 3.23Å; G177-H180 PolarHBondContact O-N 3.39Å; G177-H180 VanDerWaalsContact O-N 3.11Å; G177-V181 PolarHBondContact O-N 3.38Å; G177-V181 VanDerWaalsContact O-N 3.15Å
178E93.2Very high94.5Very high66 Ų6644.1 Ų44.131%0.30825%0.25SS..Hα-helixtrans-63.6-36-174.176.6-69.3169.500112.7F169 I173 G176 H180 V181 N182F169-E178 HydrophobicContact CE2-CB 4.04Å; F169-E178 HydrophobicContact CZ-CB 4.01Å; I173-E178 HydrophobicContact CG1-CB 4.29Å; G176-E178 VanDerWaalsContact CA-OE2 3.28Å; G176-E178 WeakPolarHBondContact CA-OE2 3.22Å; E178-H180 VanDerWaalsContact C-N 3.31Å; E178-H180 PolarHBondContact O-N 2.94Å; E178-V181 VanDerWaalsContact O-CG1 3.24Å; E178-V181 WeakPolarHBondContact O-CG1 3.2Å; E178-N182 VanDerWaalsContact O-CB 3.31Å; E178-N182 WeakPolarHBondContact O-CB 3.36Å; E178-N182 PolarHBondContact O-N 3.1Å; E178-N182 VanDerWaalsContact O-N 3.07Å; E178-N182 PolarHBondContact O-ND2 3.49Å
179A91.5Very high94.5Very high58 Ų5846.1 Ų46.148%0.47926%0.258SS..Hα-helixtrans-64.7-36.6175.500000112.1G177 T183G177-A179 VanDerWaalsContact C-N 3.33Å; G177-A179 PolarHBondContact O-N 3.23Å; A179-T183 WeakPolarHBondContact O-CB 3.45Å; A179-T183 PolarHBondContact O-N 2.65Å; A179-T183 PolarHBondContact O-OG1 3.26Å; A179-T183 VanDerWaalsContact O-OG1 3.1Å
180H90.1Very high94.5Very high93 Ų9343.7 Ų43.743%0.43125%0.248SC..Hα-helixtrans-70.1-48.4179.8-172.680.1000111.5G177 E178 N182 T183 C184G177-H180 WeakPolarHBondContact O-CB 3.23Å; G177-H180 PolarHBondContact O-N 3.39Å; G177-H180 VanDerWaalsContact O-N 3.11Å; E178-H180 VanDerWaalsContact C-N 3.31Å; E178-H180 PolarHBondContact O-N 2.94Å; H180-N182 VanDerWaalsContact C-N 3.3Å; H180-N182 PolarHBondContact O-N 3.44Å; H180-T183 PolarHBondContact O-N 3.19Å; H180-C184 WeakPolarHBondContact O-CB 3.46Å; H180-C184 PolarHBondContact O-N 3.19Å
181V95.3Very high94.6Very high0 Ų037.9 Ų37.90%022%0.217CC..Hα-helixtrans-61.9-40.1177.468.70000111.5L73 F161 Y165 F169 L172 G177 E178 T183 C184 L185L73-V181 HydrophobicContact CD1-CB 3.68Å; L73-V181 HydrophobicContact CD1-CG2 3.88Å; L73-V181 HydrophobicContact CD2-CB 4.27Å; L73-V181 HydrophobicContact CD2-CG2 3.58Å; L73-V181 HydrophobicContact CG-CG2 4.36Å; F161-V181 HydrophobicContact CD1-CG2 4.04Å; F161-V181 HydrophobicContact CE1-CG2 4.15Å; Y165-V181 HydrophobicContact CD2-CG2 4.36Å; Y165-V181 HydrophobicContact CE1-CG1 4.14Å; Y165-V181 HydrophobicContact CE2-CG2 3.57Å; F169-V181 HydrophobicContact CE2-CG1 4.19Å; L172-V181 HydrophobicContact CD1-CB 3.99Å; L172-V181 HydrophobicContact CD1-CG1 3.73Å; L172-V181 HydrophobicContact CD1-CG2 4.28Å; G177-V181 PolarHBondContact O-N 3.38Å; G177-V181 VanDerWaalsContact O-N 3.15Å; E178-V181 VanDerWaalsContact O-CG1 3.24Å; E178-V181 WeakPolarHBondContact O-CG1 3.2Å; V181-T183 PolarHBondContact O-N 2.71Å; V181-C184 PolarHBondContact O-N 3.12Å; V181-L185 WeakPolarHBondContact O-CB 3.18Å; V181-L185 PolarHBondContact O-N 3.23Å
182N94.8Very high94.8Very high31 Ų3136.8 Ų36.817%0.16621%0.21CC..Hα-helixtrans-63.3-43177.8-73.5-28.1000111.6Y165 E178 H180 K186 L213Y165-N182 WeakPolarHBondContact OH-CA 3.42Å; Y165-N182 PolarHBondContact OH-N 3.18Å; Y165-N182 PolarHBondContact OH-OD1 3.28Å; E178-N182 VanDerWaalsContact O-CB 3.31Å; E178-N182 WeakPolarHBondContact O-CB 3.36Å; E178-N182 PolarHBondContact O-N 3.1Å; E178-N182 VanDerWaalsContact O-N 3.07Å; E178-N182 PolarHBondContact O-ND2 3.49Å; H180-N182 VanDerWaalsContact C-N 3.3Å; H180-N182 PolarHBondContact O-N 3.44Å; N182-K186 WeakPolarHBondContact O-CB 3.44Å; N182-K186 WeakPolarHBondContact O-CE 3.37Å; N182-K186 VanDerWaalsContact O-CG 3.27Å; N182-K186 WeakPolarHBondContact O-CG 3.35Å; N182-K186 PolarHBondContact O-N 3.25Å; N182-L213 HydrophobicContact CB-CD1 4.27Å; N182-L213 HydrophobicContact CB-CD2 4.13Å
183T93.6Very high95Very high46 Ų4639.4 Ų39.428%0.28223%0.226SC..Hα-helixtrans-65.9-40.9175.7-690000111.6L37 F43 A179 H180 V181 H187L37-T183 HydrophobicContact CD1-CG2 4.3Å; F43-T183 HydrophobicContact CE1-CG2 4.14Å; F43-T183 WeakPolarHBondContact CE1-O 3.42Å; F43-T183 HydrophobicContact CZ-CG2 3.95Å; A179-T183 WeakPolarHBondContact O-CB 3.45Å; A179-T183 PolarHBondContact O-N 2.65Å; A179-T183 PolarHBondContact O-OG1 3.26Å; A179-T183 VanDerWaalsContact O-OG1 3.1Å; H180-T183 PolarHBondContact O-N 3.19Å; V181-T183 PolarHBondContact O-N 2.71Å; T183-H187 PolarHBondContact O-N 2.96Å; T183-H187 VanDerWaalsContact O-N 3.12Å
184C95.2Very high95.1Very high0 Ų039.3 Ų39.30%022%0.224CC..Hα-helixtrans-64.8-43.9176.1-158.30000112.4R69 F161 H180 V181 H187 F188R69-C184 PolarHBondContact NE-SG 3.34Å; F161-C184 HydrophobicContact CE1-CB 4.09Å; F161-C184 HydrophobicContact CZ-CB 4.1Å; H180-C184 WeakPolarHBondContact O-CB 3.46Å; H180-C184 PolarHBondContact O-N 3.19Å; V181-C184 PolarHBondContact O-N 3.12Å; C184-H187 PolarHBondContact O-N 3.14Å; C184-F188 VanDerWaalsContact O-CB 3.26Å; C184-F188 WeakPolarHBondContact O-CB 3.47Å; C184-F188 PolarHBondContact O-N 3.08Å
185L97.2Very high95.3Very high0 Ų034.6 Ų34.60%020%0.196CC..Hα-helixtrans-66-41.9177.6177.763.2000112.1F158 F161 Y165 V181 F188 Y189 L206 L209 L213F158-L185 HydrophobicContact CE2-CD1 4.12Å; F161-L185 HydrophobicContact CB-CD1 4.34Å; F161-L185 HydrophobicContact CD1-CB 4.24Å; F161-L185 HydrophobicContact CD1-CD1 4.35Å; F161-L185 HydrophobicContact CD2-CD1 4.14Å; F161-L185 HydrophobicContact CE1-CB 4.13Å; F161-L185 HydrophobicContact CG-CD1 4.05Å; Y165-L185 HydrophobicContact CD2-CD2 4.29Å; Y165-L185 HydrophobicContact CE2-CB 4.22Å; Y165-L185 HydrophobicContact CE2-CD2 3.49Å; Y165-L185 VanDerWaalsContact CE2-CD2 3.49Å; Y165-L185 HydrophobicContact CE2-CG 4.36Å; V181-L185 WeakPolarHBondContact O-CB 3.18Å; V181-L185 PolarHBondContact O-N 3.23Å; L185-F188 PolarHBondContact O-N 2.85Å; L185-Y189 VanDerWaalsContact O-CB 3.27Å; L185-Y189 WeakPolarHBondContact O-CB 3.45Å; L185-Y189 PolarHBondContact O-N 3.34Å; L185-L206 HydrophobicContact CD1-CD1 4.15Å; L185-L206 HydrophobicContact CD2-CD1 4.09Å; L185-L209 HydrophobicContact CD2-CD2 3.93Å; L185-L209 HydrophobicContact CD2-CG 4.38Å; L185-L213 HydrophobicContact CD2-CD1 3.95Å
186K95.3Very high95.5Very high42 Ų4237 Ų3718%0.18321%0.209CC..Hα-helixtrans-58.8-49.3175.6-76.4179.5-62.2-178.30111.2F43 N182 Y189 C190 L213 L214F43-K186 HydrophobicContact CD1-CB 4.06Å; F43-K186 HydrophobicContact CD2-CB 3.95Å; F43-K186 HydrophobicContact CD2-CD 4.15Å; F43-K186 HydrophobicContact CE1-CB 3.98Å; F43-K186 HydrophobicContact CE2-CB 3.96Å; F43-K186 HydrophobicContact CE2-CD 3.77Å; F43-K186 VanDerWaalsContact CE2-CE 3.44Å; F43-K186 HydrophobicContact CG-CB 4.02Å; F43-K186 HydrophobicContact CZ-CB 3.96Å; F43-K186 HydrophobicContact CZ-CD 4.28Å; N182-K186 WeakPolarHBondContact O-CB 3.44Å; N182-K186 WeakPolarHBondContact O-CE 3.37Å; N182-K186 VanDerWaalsContact O-CG 3.27Å; N182-K186 WeakPolarHBondContact O-CG 3.35Å; N182-K186 PolarHBondContact O-N 3.25Å; K186-Y189 PolarHBondContact O-N 2.99Å; K186-C190 WeakPolarHBondContact O-CB 3.26Å; K186-C190 PolarHBondContact O-N 3.49Å; K186-C190 PolarHBondContact O-SG 3.49Å; K186-L213 HydrophobicContact CD-CB 4.06Å; K186-L213 WeakPolarHBondContact CD-O 3.46Å; K186-L213 HydrophobicContact CG-CB 3.82Å; K186-L214 HydrophobicContact CB-CD2 3.9Å; K186-L214 HydrophobicContact CD-CD2 4.2Å; K186-L214 HydrophobicContact CG-CD2 3.76Å; K186-L214 HydrophobicContact CG-CG 4.3Å
187H95.6Very high95.8Very high3 Ų334.7 Ų34.71%0.01419%0.185CC..Hα-helixtrans-60.6-49.4178.1-173.8-144.3000111.5L37 F43 H62 F66 R69 T183 C184 Y189 C190 F191L37-H187 HydrophobicContact CD1-CB 4.27Å; F43-H187 HydrophobicContact CD1-CB 3.74Å; F43-H187 HydrophobicContact CE1-CB 3.84Å; H62-H187 AromaticContact CD2-CE1 3.66Å; H62-H187 AromaticContact CD2-NE2 3.69Å; H62-H187 AromaticContact NE2-CE1 3.82Å; H62-H187 AromaticContact NE2-NE2 3.63Å; F66-H187 HydrophobicContact CE1-CB 4.07Å; F66-H187 AromaticContact CE1-CE1 3.83Å; F66-H187 AromaticContact CE1-CG 3.7Å; F66-H187 AromaticContact CE1-ND1 3.22Å; F66-H187 WeakPolarHBondContact CE1-ND1 3.3Å; F66-H187 HydrophobicContact CZ-CB 4.49Å; F66-H187 AromaticContact CZ-CE1 3.66Å; F66-H187 AromaticContact CZ-CG 3.83Å; F66-H187 AromaticContact CZ-ND1 3.48Å; F66-H187 WeakPolarHBondContact CZ-ND1 3.28Å; R69-H187 PolarHBondContact NH1-ND1 3.35Å; T183-H187 PolarHBondContact O-N 2.96Å; T183-H187 VanDerWaalsContact O-N 3.12Å; C184-H187 PolarHBondContact O-N 3.14Å; H187-Y189 PolarHBondContact O-N 2.91Å; H187-C190 PolarHBondContact O-N 3.35Å; H187-F191 WeakPolarHBondContact O-CB 3.43Å; H187-F191 PolarHBondContact O-N 3.18Å
188F97.8Very high96.1Very high0 Ų034.3 Ų34.30%018%0.18CC..Hα-helixtrans-56.2-52.1177.9-177-83.1000111.3F66 I70 L154 F158 F161 C184 L185 F191 V192F66-F188 HydrophobicContact CB-CD2 4.14Å; F66-F188 HydrophobicContact CB-CE2 4.5Å; F66-F188 HydrophobicContact CD1-CB 4.07Å; F66-F188 AromaticContact CD1-CD2 3.84Å; F66-F188 HydrophobicContact CD1-CD2 3.84Å; F66-F188 HydrophobicContact CD1-CG 4.46Å; F66-F188 HydrophobicContact CD2-CD2 4.06Å; F66-F188 VanDerWaalsContact CE1-CA 3.4Å; F66-F188 HydrophobicContact CE1-CB 3.79Å; F66-F188 HydrophobicContact CE1-CD2 4.26Å; F66-F188 HydrophobicContact CE1-CG 4.5Å; F66-F188 HydrophobicContact CE2-CD2 4.47Å; F66-F188 AromaticContact CG-CD2 3.75Å; F66-F188 HydrophobicContact CG-CD2 3.75Å; F66-F188 HydrophobicContact CG-CE2 4.43Å; F66-F188 VanDerWaalsContact CZ-CA 3.47Å; F66-F188 HydrophobicContact CZ-CB 4.27Å; I70-F188 HydrophobicContact CD1-CD2 4.24Å; I70-F188 HydrophobicContact CD1-CE2 4.31Å; L154-F188 HydrophobicContact CB-CE2 4.33Å; L154-F188 HydrophobicContact CB-CZ 4.05Å; L154-F188 HydrophobicContact CD2-CD2 4.38Å; L154-F188 HydrophobicContact CD2-CE2 3.58Å; L154-F188 HydrophobicContact CD2-CZ 4.14Å; L154-F188 WeakPolarHBondContact O-CZ 3.06Å; F158-F188 HydrophobicContact CB-CE1 3.95Å; F158-F188 HydrophobicContact CB-CZ 4.04Å; F158-F188 HydrophobicContact CD2-CD1 4.21Å; F158-F188 AromaticContact CD2-CE1 3.79Å; F158-F188 HydrophobicContact CD2-CE1 3.79Å; F158-F188 HydrophobicContact CG-CE1 4.29Å; F161-F188 HydrophobicContact CD2-CG 4.46Å; F161-F188 HydrophobicContact CE2-CB 3.91Å; F161-F188 HydrophobicContact CE2-CD1 4.21Å; F161-F188 AromaticContact CE2-CD2 3.88Å; F161-F188 HydrophobicContact CE2-CD2 3.88Å; F161-F188 HydrophobicContact CE2-CE2 4.49Å; F161-F188 AromaticContact CE2-CG 3.72Å; F161-F188 HydrophobicContact CE2-CG 3.72Å; F161-F188 HydrophobicContact CZ-CB 4.29Å; C184-F188 VanDerWaalsContact O-CB 3.26Å; C184-F188 WeakPolarHBondContact O-CB 3.47Å; C184-F188 PolarHBondContact O-N 3.08Å; L185-F188 PolarHBondContact O-N 2.85Å; F188-F191 PolarHBondContact O-N 2.83Å; F188-V192 HydrophobicContact CD1-CG1 4.06Å; F188-V192 HydrophobicContact CD1-CG2 4.2Å; F188-V192 HydrophobicContact CE1-CB 4.45Å; F188-V192 HydrophobicContact CE1-CG1 3.65Å; F188-V192 HydrophobicContact CE1-CG2 3.98Å; F188-V192 HydrophobicContact CE2-CG1 4.17Å; F188-V192 HydrophobicContact CG-CG1 4.45Å; F188-V192 HydrophobicContact CZ-CG1 3.7Å; F188-V192 WeakPolarHBondContact O-CG1 3.43Å; F188-V192 WeakPolarHBondContact O-CG2 3.28Å; F188-V192 PolarHBondContact O-N 2.75Å
189Y97.7Very high96.3Very high48 Ų4833 Ų3319%0.18818%0.18CC..Hα-helixtrans-61.6-49-177.4-173-82.8000111.7L185 K186 H187 F191 V192 T193 L203 T210 L214L185-Y189 VanDerWaalsContact O-CB 3.27Å; L185-Y189 WeakPolarHBondContact O-CB 3.45Å; L185-Y189 PolarHBondContact O-N 3.34Å; K186-Y189 PolarHBondContact O-N 2.99Å; H187-Y189 PolarHBondContact O-N 2.91Å; Y189-F191 VanDerWaalsContact C-N 3.29Å; Y189-F191 PolarHBondContact O-N 3.06Å; Y189-V192 PolarHBondContact O-N 2.84Å; Y189-T193 HydrophobicContact CD1-CG2 4.04Å; Y189-T193 HydrophobicContact CE1-CG2 3.73Å; Y189-T193 HydrophobicContact CE2-CG2 4.49Å; Y189-T193 WeakPolarHBondContact O-CG2 3.17Å; Y189-T193 PolarHBondContact O-N 3.19Å; Y189-T193 VanDerWaalsContact O-N 3.08Å; Y189-T193 PolarHBondContact O-OG1 3.36Å; Y189-L203 HydrophobicContact CD2-CD1 4.13Å; Y189-L203 HydrophobicContact CE2-CB 4.12Å; Y189-L203 HydrophobicContact CE2-CD1 3.84Å; Y189-L203 HydrophobicContact CE2-CG 4.46Å; Y189-T210 VanDerWaalsContact CB-CG2 3.5Å; Y189-T210 HydrophobicContact CD1-CG2 3.55Å; Y189-T210 HydrophobicContact CD2-CG2 3.42Å; Y189-T210 VanDerWaalsContact CD2-CG2 3.42Å; Y189-T210 HydrophobicContact CE1-CG2 4.09Å; Y189-T210 HydrophobicContact CE2-CG2 3.95Å; Y189-T210 HydrophobicContact CG-CG2 3.18Å; Y189-L214 HydrophobicContact CD1-CD1 3.76Å; Y189-L214 HydrophobicContact CE1-CD1 4.21Å
190C96.3Very high96.6Very high5 Ų534.9 Ų34.93%0.03419%0.187CC..Hα-helixtrans-56.2-46.1177-760000111.2F43 V47 K186 H187 T193 E194F43-C190 HydrophobicContact CB-CB 4.13Å; V47-C190 HydrophobicContact CG1-CB 4.04Å; V47-C190 HydrophobicContact CG2-CB 4.25Å; K186-C190 WeakPolarHBondContact O-CB 3.26Å; K186-C190 PolarHBondContact O-N 3.49Å; K186-C190 PolarHBondContact O-SG 3.49Å; H187-C190 PolarHBondContact O-N 3.35Å; C190-T193 PolarHBondContact O-OG1 3.15Å; C190-T193 VanDerWaalsContact O-OG1 3.12Å; C190-E194 VanDerWaalsContact O-CB 3.23Å; C190-E194 WeakPolarHBondContact O-CB 3.35Å; C190-E194 PolarHBondContact O-N 2.73Å
191F98Very high96.9Very high0 Ų039.7 Ų39.70%020%0.202CC..Hα-helixtrans-64.8-49.4-178.1-172.1-92.3000112.5V47 W58 I59 H62 F66 H187 F188 Y189 T193 E194 Y195 L197V47-F191 HydrophobicContact CB-CB 4.33Å; V47-F191 HydrophobicContact CB-CD2 3.95Å; V47-F191 HydrophobicContact CG1-CB 3.79Å; V47-F191 HydrophobicContact CG1-CD2 4.07Å; V47-F191 HydrophobicContact CG1-CG 4.47Å; W58-F191 AromaticContact CD1-CE2 3.97Å; W58-F191 AromaticContact NE1-CE2 3.75Å; I59-F191 HydrophobicContact CB-CZ 4.45Å; I59-F191 HydrophobicContact CG1-CZ 4Å; H62-F191 HydrophobicContact CB-CD1 4.06Å; H62-F191 HydrophobicContact CB-CD2 4.03Å; H62-F191 HydrophobicContact CB-CE1 3.58Å; H62-F191 HydrophobicContact CB-CE2 3.58Å; H62-F191 HydrophobicContact CB-CG 4.28Å; H62-F191 HydrophobicContact CB-CZ 3.35Å; H62-F191 AromaticContact CD2-CD2 3.32Å; H62-F191 WeakPolarHBondContact CD2-CD2 3.5Å; H62-F191 AromaticContact CD2-CE2 3.45Å; H62-F191 VanDerWaalsContact CD2-CE2 3.45Å; H62-F191 WeakPolarHBondContact CD2-CE2 3.43Å; H62-F191 AromaticContact CD2-CG 3.98Å; H62-F191 AromaticContact CE1-CE2 3.9Å; H62-F191 AromaticContact CG-CD2 3.52Å; H62-F191 AromaticContact CG-CE2 3.13Å; H62-F191 AromaticContact CG-CZ 3.49Å; H62-F191 VanDerWaalsContact CG-CZ 3.49Å; H62-F191 AromaticContact ND1-CE2 3.43Å; H62-F191 WeakPolarHBondContact ND1-CE2 3.43Å; H62-F191 AromaticContact ND1-CZ 3.9Å; H62-F191 AromaticContact NE2-CD2 3.9Å; H62-F191 AromaticContact NE2-CE2 3.94Å; F66-F191 HydrophobicContact CE2-CB 3.78Å; F66-F191 AromaticContact CE2-CD1 3.66Å; F66-F191 HydrophobicContact CE2-CD1 3.66Å; F66-F191 HydrophobicContact CE2-CE1 4.45Å; F66-F191 AromaticContact CE2-CG 3.71Å; F66-F191 HydrophobicContact CE2-CG 3.71Å; F66-F191 HydrophobicContact CZ-CB 3.76Å; F66-F191 HydrophobicContact CZ-CD1 4.49Å; F66-F191 HydrophobicContact CZ-CG 4.13Å; H187-F191 WeakPolarHBondContact O-CB 3.43Å; H187-F191 PolarHBondContact O-N 3.18Å; F188-F191 PolarHBondContact O-N 2.83Å; Y189-F191 VanDerWaalsContact C-N 3.29Å; Y189-F191 PolarHBondContact O-N 3.06Å; F191-T193 VanDerWaalsContact C-N 3.28Å; F191-T193 PolarHBondContact O-N 2.85Å; F191-E194 PolarHBondContact O-N 2.65Å; F191-Y195 HydrophobicContact CD1-CD2 4.38Å; F191-Y195 AromaticContact CD2-CD2 3.96Å; F191-Y195 HydrophobicContact CD2-CD2 3.96Å; F191-Y195 AromaticContact CD2-CE2 3.81Å; F191-Y195 HydrophobicContact CD2-CE2 3.81Å; F191-Y195 HydrophobicContact CE1-CD2 4.08Å; F191-Y195 AromaticContact CE2-CD2 3.59Å; F191-Y195 HydrophobicContact CE2-CD2 3.59Å; F191-Y195 AromaticContact CE2-CE2 3.37Å; F191-Y195 HydrophobicContact CE2-CE2 3.37Å; F191-Y195 HydrophobicContact CG-CD2 4.31Å; F191-Y195 AromaticContact CZ-CD2 3.63Å; F191-Y195 HydrophobicContact CZ-CD2 3.63Å; F191-Y195 AromaticContact CZ-CE2 3.84Å; F191-Y195 HydrophobicContact CZ-CE2 3.84Å; F191-Y195 WeakPolarHBondContact O-CD2 3.39Å; F191-Y195 PolarHBondContact O-N 2.85Å; F191-L197 HydrophobicContact CD1-CD1 4.09Å; F191-L197 HydrophobicContact CE1-CD1 3.5Å; F191-L197 HydrophobicContact CZ-CD1 4.38Å
192V98.5Very high97Very high0 Ų042.5 Ų42.50%022%0.215CC..Hα-helixtrans-70.3-25.5-176.5-57.10000113.2L154 F188 Y189 D196 L197 V198 L203L154-V192 HydrophobicContact CB-CG1 4.19Å; L154-V192 HydrophobicContact CD1-CG1 4.09Å; L154-V192 HydrophobicContact CD2-CG1 4.26Å; L154-V192 HydrophobicContact CG-CG1 4.41Å; F188-V192 HydrophobicContact CD1-CG1 4.06Å; F188-V192 HydrophobicContact CD1-CG2 4.2Å; F188-V192 HydrophobicContact CE1-CB 4.45Å; F188-V192 HydrophobicContact CE1-CG1 3.65Å; F188-V192 HydrophobicContact CE1-CG2 3.98Å; F188-V192 HydrophobicContact CE2-CG1 4.17Å; F188-V192 HydrophobicContact CG-CG1 4.45Å; F188-V192 HydrophobicContact CZ-CG1 3.7Å; F188-V192 WeakPolarHBondContact O-CG1 3.43Å; F188-V192 WeakPolarHBondContact O-CG2 3.28Å; F188-V192 PolarHBondContact O-N 2.75Å; Y189-V192 PolarHBondContact O-N 2.84Å; V192-D196 PolarHBondContact O-N 3.12Å; V192-L197 HydrophobicContact CB-CB 4.44Å; V192-L197 PolarHBondContact O-N 2.86Å; V192-V198 HydrophobicContact CB-CB 3.98Å; V192-V198 HydrophobicContact CB-CG2 3.78Å; V192-V198 HydrophobicContact CG1-CG2 3.87Å; V192-V198 HydrophobicContact CG2-CB 4.04Å; V192-V198 HydrophobicContact CG2-CG2 4.19Å; V192-L203 HydrophobicContact CG2-CD1 4.08Å; V192-L203 HydrophobicContact CG2-CD2 4.17Å
193T97.4Very high97.1Very high56 Ų5641.1 Ų41.134%0.34421%0.208SC..Hα-helixtrans-83.2-31173.457.70000113Y189 C190 F191 Y195 L203Y189-T193 HydrophobicContact CD1-CG2 4.04Å; Y189-T193 HydrophobicContact CE1-CG2 3.73Å; Y189-T193 HydrophobicContact CE2-CG2 4.49Å; Y189-T193 WeakPolarHBondContact O-CG2 3.17Å; Y189-T193 PolarHBondContact O-N 3.19Å; Y189-T193 VanDerWaalsContact O-N 3.08Å; Y189-T193 PolarHBondContact O-OG1 3.36Å; C190-T193 PolarHBondContact O-OG1 3.15Å; C190-T193 VanDerWaalsContact O-OG1 3.12Å; F191-T193 VanDerWaalsContact C-N 3.28Å; F191-T193 PolarHBondContact O-N 2.85Å; T193-Y195 VanDerWaalsContact C-N 3.31Å; T193-L203 HydrophobicContact CG2-CD1 3.76Å
194E97.3Very high97.3Very high81 Ų8143 Ų4338%0.37921%0.213SC..Hα-helixtrans-63.7-39.8177.6-177.562.7-163.400111.5V47 Q48 C190 F191V47-E194 HydrophobicContact CG2-CB 4.13Å; V47-E194 HydrophobicContact CG2-CG 4.21Å; Q48-E194 PolarHBondContact NE2-OE1 2.94Å; Q48-E194 PolarHBondContact NE2-OE2 3.19Å; C190-E194 VanDerWaalsContact O-CB 3.23Å; C190-E194 WeakPolarHBondContact O-CB 3.35Å; C190-E194 PolarHBondContact O-N 2.73Å; F191-E194 PolarHBondContact O-N 2.65Å
195Y98.2Very high97.4Very high40 Ų4044.5 Ų44.516%0.15722%0.223CC..THydrogen-bonded Turntrans-106.914.7-175.7-61.9-66.6000113.7V47 L49 L55 W58 F191 T193 L197V47-Y195 WeakPolarHBondContact O-CE2 3.41Å; V47-Y195 PolarHBondContact O-OH 3.27Å; L49-Y195 PolarHBondContact N-OH 3.19Å; L55-Y195 HydrophobicContact CD1-CD1 3.68Å; L55-Y195 HydrophobicContact CD1-CE1 3.4Å; W58-Y195 AromaticContact CD1-CE2 3.89Å; W58-Y195 AromaticContact CD1-CZ 3.73Å; W58-Y195 VanDerWaalsContact CD1-OH 3.29Å; W58-Y195 AromaticContact NE1-CE2 3.81Å; W58-Y195 AromaticContact NE1-CZ 3.81Å; W58-Y195 PolarHBondContact NE1-OH 3.31Å; W58-Y195 VanDerWaalsContact NE1-OH 3.15Å; F191-Y195 HydrophobicContact CD1-CD2 4.38Å; F191-Y195 AromaticContact CD2-CD2 3.96Å; F191-Y195 HydrophobicContact CD2-CD2 3.96Å; F191-Y195 AromaticContact CD2-CE2 3.81Å; F191-Y195 HydrophobicContact CD2-CE2 3.81Å; F191-Y195 HydrophobicContact CE1-CD2 4.08Å; F191-Y195 AromaticContact CE2-CD2 3.59Å; F191-Y195 HydrophobicContact CE2-CD2 3.59Å; F191-Y195 AromaticContact CE2-CE2 3.37Å; F191-Y195 HydrophobicContact CE2-CE2 3.37Å; F191-Y195 HydrophobicContact CG-CD2 4.31Å; F191-Y195 AromaticContact CZ-CD2 3.63Å; F191-Y195 HydrophobicContact CZ-CD2 3.63Å; F191-Y195 AromaticContact CZ-CE2 3.84Å; F191-Y195 HydrophobicContact CZ-CE2 3.84Å; F191-Y195 WeakPolarHBondContact O-CD2 3.39Å; F191-Y195 PolarHBondContact O-N 2.85Å; T193-Y195 VanDerWaalsContact C-N 3.31Å; Y195-L197 PolarHBondContact O-N 3.41Å
196D98Very high97.4Very high141 Ų14145 Ų4575%0.75423%0.226SC*.THydrogen-bonded Turntrans49.731.3-179.6-68.9-46.6000114.5V192 V198V192-D196 PolarHBondContact O-N 3.12Å; D196-V198 VanDerWaalsContact C-N 3.34Å; D196-V198 PolarHBondContact O-N 2.95Å
197L98.4Very high97.4Very high5 Ų547.5 Ų47.53%0.02624%0.237CC..  trans-77-22.2-175-66.7171.3000112.6I59 S151 L154 F191 V192 Y195I59-L197 HydrophobicContact CD1-CD1 4.49Å; I59-L197 HydrophobicContact CD1-CD2 4.42Å; I59-L197 HydrophobicContact CG1-CD1 4.36Å; I59-L197 HydrophobicContact CG2-CD1 4.14Å; S151-L197 VanDerWaalsContact CA-O 3.24Å; S151-L197 WeakPolarHBondContact CA-O 3.47Å; S151-L197 WeakPolarHBondContact CB-O 3.43Å; S151-L197 PolarHBondContact OG-O 3.3Å; L154-L197 HydrophobicContact CD1-CB 3.8Å; L154-L197 HydrophobicContact CD1-CD1 3.56Å; L154-L197 HydrophobicContact CD1-CG 4.25Å; F191-L197 HydrophobicContact CD1-CD1 4.09Å; F191-L197 HydrophobicContact CE1-CD1 3.5Å; F191-L197 HydrophobicContact CZ-CD1 4.38Å; V192-L197 HydrophobicContact CB-CB 4.44Å; V192-L197 PolarHBondContact O-N 2.86Å; Y195-L197 PolarHBondContact O-N 3.41Å
198V98.6Very high97.4Very high5 Ų554.5 Ų54.53%0.0327%0.267CS..SBendtrans-132.3122.4178.8-179.60000109.7L154 V192 D196 E202 L203L154-V198 HydrophobicContact CB-CG2 3.74Å; V192-V198 HydrophobicContact CB-CB 3.98Å; V192-V198 HydrophobicContact CB-CG2 3.78Å; V192-V198 HydrophobicContact CG1-CG2 3.87Å; V192-V198 HydrophobicContact CG2-CB 4.04Å; V192-V198 HydrophobicContact CG2-CG2 4.19Å; D196-V198 VanDerWaalsContact C-N 3.34Å; D196-V198 PolarHBondContact O-N 2.95Å; V198-E202 HydrophobicContact CG1-CB 3.71Å; V198-E202 HydrophobicContact CG1-CG 4.38Å; V198-L203 HydrophobicContact CB-CD2 4.27Å; V198-L203 HydrophobicContact CB-CG 4.46Å; V198-L203 HydrophobicContact CG1-CD1 4.48Å; V198-L203 HydrophobicContact CG1-CD2 3.67Å; V198-L203 HydrophobicContact CG1-CG 3.84Å
199A97.5Very high97.3Very high38 Ų3856.1 Ų56.131%0.31428%0.275SS..  trans-60.2141.6-178.700000111.8R201 E202A199-R201 HydrophobicContact CB-CG 4.19Å; A199-R201 PolarHBondContact O-N 3.14Å; A199-E202 HydrophobicContact CB-CG 4.3Å; A199-E202 WeakPolarHBondContact O-CB 3.35Å; A199-E202 PolarHBondContact O-N 3.13Å
200P97.2Very high97.1Very high98 Ų9853.9 Ų53.964%0.63627%0.267SS*.Hα-helixtrans-54.4-31.8-177.1-30.235.5000115E202 L203 E204P200-E202 VanDerWaalsContact C-N 3.3Å; P200-E202 PolarHBondContact O-N 3.35Å; P200-L203 PolarHBondContact O-N 3.4Å; P200-E204 PolarHBondContact O-N 3.49Å
201R96.6Very high97Very high194 Ų19462.1 Ų62.173%0.73230%0.297SS*.Hα-helixtrans-63.3-33.8176.467.4177.5177.9-114.8-2.4113.3A199 L203 E204A199-R201 HydrophobicContact CB-CG 4.19Å; A199-R201 PolarHBondContact O-N 3.14Å; R201-L203 VanDerWaalsContact C-N 3.28Å; R201-E204 WeakPolarHBondContact O-CB 3.4Å; R201-E204 PolarHBondContact O-N 2.9Å
202E97.4Very high96.8Very high59 Ų5969.9 Ų69.928%0.27633%0.326SS..Hα-helixtrans-72.9-28.4179.3-58-63.8146.900110.5T155 F158 V198 A199 P200 P205T155-E202 HydrophobicContact CG2-CB 4.2Å; T155-E202 HydrophobicContact CG2-CG 3.89Å; F158-E202 WeakPolarHBondContact CD1-O 3.48Å; F158-E202 WeakPolarHBondContact CE1-O 3.39Å; V198-E202 HydrophobicContact CG1-CB 3.71Å; V198-E202 HydrophobicContact CG1-CG 4.38Å; A199-E202 HydrophobicContact CB-CG 4.3Å; A199-E202 WeakPolarHBondContact O-CB 3.35Å; A199-E202 PolarHBondContact O-N 3.13Å; P200-E202 VanDerWaalsContact C-N 3.3Å; P200-E202 PolarHBondContact O-N 3.35Å; E202-P205 VanDerWaalsContact O-CD 3.3Å; E202-P205 WeakPolarHBondContact O-CD 3.43Å
203L98Very high96.5Very high3 Ų372 Ų722%0.01634%0.338CS..Hα-helixtrans-84-9.9179.2-59.1177.2000113.7F158 Y189 V192 T193 V198 P200 R201 P205 L206 K207F158-L203 HydrophobicContact CD1-CD2 4.29Å; F158-L203 HydrophobicContact CD2-CD2 3.86Å; F158-L203 HydrophobicContact CE1-CD2 4.27Å; F158-L203 HydrophobicContact CE2-CD2 3.8Å; F158-L203 HydrophobicContact CG-CD2 4.09Å; F158-L203 HydrophobicContact CZ-CB 4.48Å; F158-L203 HydrophobicContact CZ-CD2 4.01Å; Y189-L203 HydrophobicContact CD2-CD1 4.13Å; Y189-L203 HydrophobicContact CE2-CB 4.12Å; Y189-L203 HydrophobicContact CE2-CD1 3.84Å; Y189-L203 HydrophobicContact CE2-CG 4.46Å; V192-L203 HydrophobicContact CG2-CD1 4.08Å; V192-L203 HydrophobicContact CG2-CD2 4.17Å; T193-L203 HydrophobicContact CG2-CD1 3.76Å; V198-L203 HydrophobicContact CB-CD2 4.27Å; V198-L203 HydrophobicContact CB-CG 4.46Å; V198-L203 HydrophobicContact CG1-CD1 4.48Å; V198-L203 HydrophobicContact CG1-CD2 3.67Å; V198-L203 HydrophobicContact CG1-CG 3.84Å; P200-L203 PolarHBondContact O-N 3.4Å; R201-L203 VanDerWaalsContact C-N 3.28Å; L203-P205 VanDerWaalsContact C-N 3.35Å; L203-L206 PolarHBondContact O-N 2.98Å; L203-K207 PolarHBondContact O-N 2.81Å; L203-K207 VanDerWaalsContact O-N 3.15Å
204E97.2Very high96.2Very high85 Ų8571.3 Ų71.340%0.39733%0.332SS..G310 helixtrans-51.8-41.1-177.1-166.560.8-150.400114.4P200 R201 L206 K207P200-E204 PolarHBondContact O-N 3.49Å; R201-E204 WeakPolarHBondContact O-CB 3.4Å; R201-E204 PolarHBondContact O-N 2.9Å; E204-L206 PolarHBondContact O-N 3.39Å; E204-L206 VanDerWaalsContact O-N 3.09Å; E204-K207 WeakPolarHBondContact O-CB 3.43Å; E204-K207 PolarHBondContact O-N 2.98Å; E204-K207 WeakPolarHBondContact OE2-CD 3.49Å; E204-K207 IonicContact OE2-NZ 2.86Å; E204-K207 PolarHBondContact OE2-NZ 3.3Å
205P97.6Very high95.7Very high31 Ų3169.9 Ų69.920%0.20133%0.333CS..G310 helixtrans-53.6-34.9-178.7-25.732000114.8Y95 F158 V162 E202 L203Y95-P205 HydrophobicContact CD1-CG 3.75Å; Y95-P205 HydrophobicContact CD2-CB 3.83Å; Y95-P205 HydrophobicContact CD2-CG 3.96Å; Y95-P205 HydrophobicContact CE1-CB 4.42Å; Y95-P205 HydrophobicContact CE1-CG 3.68Å; Y95-P205 HydrophobicContact CE2-CB 3.72Å; Y95-P205 HydrophobicContact CE2-CG 3.89Å; Y95-P205 HydrophobicContact CG-CB 4.24Å; Y95-P205 HydrophobicContact CG-CG 3.88Å; F158-P205 HydrophobicContact CE1-CG 4.35Å; V162-P205 HydrophobicContact CG1-CB 3.87Å; V162-P205 HydrophobicContact CG2-CB 3.77Å; V162-P205 HydrophobicContact CG2-CG 4.18Å; E202-P205 VanDerWaalsContact O-CD 3.3Å; E202-P205 WeakPolarHBondContact O-CD 3.43Å; L203-P205 VanDerWaalsContact C-N 3.35Å
206L97.1Very high94.8Very high12 Ų1273.5 Ų73.56%0.06336%0.362CS..G310 helixtrans-113.23.5-179.3-59178.7000113.7F158 F161 V162 Y165 L185 L203 E204 K208 L209 T210F158-L206 HydrophobicContact CE2-CB 4.35Å; F158-L206 HydrophobicContact CE2-CD1 3.97Å; F158-L206 HydrophobicContact CE2-CG 4.46Å; F158-L206 HydrophobicContact CZ-CB 3.89Å; F158-L206 HydrophobicContact CZ-CD1 3.95Å; F158-L206 HydrophobicContact CZ-CG 3.98Å; F161-L206 HydrophobicContact CB-CD1 3.77Å; V162-L206 HydrophobicContact CG2-CD1 4.08Å; V162-L206 HydrophobicContact CG2-CG 4.04Å; Y165-L206 HydrophobicContact CD2-CD1 3.89Å; Y165-L206 HydrophobicContact CD2-CD2 4.43Å; Y165-L206 HydrophobicContact CE2-CD1 4.45Å; Y165-L206 HydrophobicContact CG-CD2 4.42Å; L185-L206 HydrophobicContact CD1-CD1 4.15Å; L185-L206 HydrophobicContact CD2-CD1 4.09Å; L203-L206 PolarHBondContact O-N 2.98Å; E204-L206 PolarHBondContact O-N 3.39Å; E204-L206 VanDerWaalsContact O-N 3.09Å; L206-K208 VanDerWaalsContact C-N 3.31Å; L206-K208 PolarHBondContact O-N 2.8Å; L206-K208 VanDerWaalsContact O-N 3.16Å; L206-L209 HydrophobicContact CD2-CD2 4.17Å; L206-L209 CarbonylContact O-C 3.57Å; L206-L209 WeakPolarHBondContact O-CA 3.23Å; L206-L209 WeakPolarHBondContact O-CB 3.17Å; L206-L209 PolarHBondContact O-N 3.42Å; L206-T210 PolarHBondContact O-N 2.93Å; L206-T210 PolarHBondContact O-OG1 3Å
207K95.5Very high93.2Very high94 Ų9473.4 Ų73.441%0.40936%0.361SS..Hα-helixtrans-51.7-44.5-175.2-176.3178.9-174.9-179.90114L203 E204 T210 R211L203-K207 PolarHBondContact O-N 2.81Å; L203-K207 VanDerWaalsContact O-N 3.15Å; E204-K207 WeakPolarHBondContact O-CB 3.43Å; E204-K207 PolarHBondContact O-N 2.98Å; E204-K207 WeakPolarHBondContact OE2-CD 3.49Å; E204-K207 IonicContact OE2-NZ 2.86Å; E204-K207 PolarHBondContact OE2-NZ 3.3Å; K207-T210 PolarHBondContact O-N 3.47Å; K207-R211 WeakPolarHBondContact O-CB 3.34Å; K207-R211 PolarHBondContact O-N 3.33Å
208K95Very high90.9Very high150 Ų15084.6 Ų84.665%0.65240%0.403SS*.Hα-helixtrans-64.9-39.3176.9-176.7179.3177.6-177.80112L206 R212L206-K208 VanDerWaalsContact C-N 3.31Å; L206-K208 PolarHBondContact O-N 2.8Å; L206-K208 VanDerWaalsContact O-N 3.16Å; K208-R212 WeakPolarHBondContact O-CG 3.41Å; K208-R212 PolarHBondContact O-N 2.94Å
209L95.5Very high88.4Confident33 Ų3394.5 Ų94.517%0.17344%0.44CS..Hα-helixtrans-65.5-52.6176.1172.964.7000110Y165 L185 L206 R211 R212 L213Y165-L209 HydrophobicContact CD1-CD2 3.55Å; Y165-L209 HydrophobicContact CD2-CD2 4.1Å; Y165-L209 HydrophobicContact CE1-CD2 3.49Å; Y165-L209 VanDerWaalsContact CE1-CD2 3.49Å; Y165-L209 HydrophobicContact CE2-CD2 4.06Å; Y165-L209 HydrophobicContact CG-CD2 3.85Å; L185-L209 HydrophobicContact CD2-CD2 3.93Å; L185-L209 HydrophobicContact CD2-CG 4.38Å; L206-L209 HydrophobicContact CD2-CD2 4.17Å; L206-L209 CarbonylContact O-C 3.57Å; L206-L209 WeakPolarHBondContact O-CA 3.23Å; L206-L209 WeakPolarHBondContact O-CB 3.17Å; L206-L209 PolarHBondContact O-N 3.42Å; L209-R211 VanDerWaalsContact C-N 3.3Å; L209-R211 PolarHBondContact O-N 3.19Å; L209-R212 WeakPolarHBondContact O-CA 3.42Å; L209-R212 WeakPolarHBondContact O-CB 3.38Å; L209-R212 PolarHBondContact O-N 3.07Å; L209-L213 HydrophobicContact CD1-CD1 4.06Å; L209-L213 HydrophobicContact CD1-CD2 4.44Å; L209-L213 HydrophobicContact CD1-CG 4.03Å; L209-L213 HydrophobicContact CD2-CD1 4.45Å; L209-L213 HydrophobicContact CG-CD1 3.89Å; L209-L213 HydrophobicContact CG-CG 4.26Å; L209-L213 WeakPolarHBondContact O-CG 3.48Å; L209-L213 PolarHBondContact O-N 3.21Å
210T94.7Very high85.7Confident1 Ų1100.7 Ų100.71%0.00646%0.462CS..Hα-helixtrans-60.9-39.8-177.9-47.60000112.2Y189 L206 K207 R212 L213 L214Y189-T210 VanDerWaalsContact CB-CG2 3.5Å; Y189-T210 HydrophobicContact CD1-CG2 3.55Å; Y189-T210 HydrophobicContact CD2-CG2 3.42Å; Y189-T210 VanDerWaalsContact CD2-CG2 3.42Å; Y189-T210 HydrophobicContact CE1-CG2 4.09Å; Y189-T210 HydrophobicContact CE2-CG2 3.95Å; Y189-T210 HydrophobicContact CG-CG2 3.18Å; L206-T210 PolarHBondContact O-N 2.93Å; L206-T210 PolarHBondContact O-OG1 3Å; K207-T210 PolarHBondContact O-N 3.47Å; T210-R212 VanDerWaalsContact C-N 3.27Å; T210-R212 PolarHBondContact O-N 3.37Å; T210-L213 PolarHBondContact O-N 2.74Å; T210-L213 VanDerWaalsContact O-N 3.16Å; T210-L214 HydrophobicContact CG2-CD1 3.63Å; T210-L214 HydrophobicContact CG2-CG 4.1Å; T210-L214 WeakPolarHBondContact O-CB 3.4Å; T210-L214 WeakPolarHBondContact O-CG 3.4Å; T210-L214 PolarHBondContact O-N 3.23Å
211R93.8Very high82.7Confident179 Ų179105.8 Ų105.868%0.67547%0.47SS*.Hα-helixtrans-59-37.3173.5-173.1179.267.1176.70.9112.7K207 L209 A215K207-R211 WeakPolarHBondContact O-CB 3.34Å; K207-R211 PolarHBondContact O-N 3.33Å; L209-R211 VanDerWaalsContact C-N 3.3Å; L209-R211 PolarHBondContact O-N 3.19Å; R211-A215 PolarHBondContact O-N 3.41Å
212R94.1Very high80.1Confident163 Ų163100.4 Ų100.462%0.61546%0.462SS*.Hα-helixtrans-71-42.4174.9-71.6-174.6-63.1157.92.5111.5K208 L209 T210 L214 A215K208-R212 WeakPolarHBondContact O-CG 3.41Å; K208-R212 PolarHBondContact O-N 2.94Å; L209-R212 WeakPolarHBondContact O-CA 3.42Å; L209-R212 WeakPolarHBondContact O-CB 3.38Å; L209-R212 PolarHBondContact O-N 3.07Å; T210-R212 VanDerWaalsContact C-N 3.27Å; T210-R212 PolarHBondContact O-N 3.37Å; R212-L214 VanDerWaalsContact C-N 3.31Å; R212-L214 PolarHBondContact O-N 3.29Å; R212-A215 WeakPolarHBondContact O-CB 3.42Å; R212-A215 PolarHBondContact O-N 2.92Å
213L91.7Very high77.7Confident45 Ų45105.3 Ų105.324%0.23648%0.483CS..Hα-helixtrans-66.1-32.5-179.9-67.8178.1000113N182 L185 K186 L209 T210N182-L213 HydrophobicContact CB-CD1 4.27Å; N182-L213 HydrophobicContact CB-CD2 4.13Å; L185-L213 HydrophobicContact CD2-CD1 3.95Å; K186-L213 HydrophobicContact CD-CB 4.06Å; K186-L213 WeakPolarHBondContact CD-O 3.46Å; K186-L213 HydrophobicContact CG-CB 3.82Å; L209-L213 HydrophobicContact CD1-CD1 4.06Å; L209-L213 HydrophobicContact CD1-CD2 4.44Å; L209-L213 HydrophobicContact CD1-CG 4.03Å; L209-L213 HydrophobicContact CD2-CD1 4.45Å; L209-L213 HydrophobicContact CG-CD1 3.89Å; L209-L213 HydrophobicContact CG-CG 4.26Å; L209-L213 WeakPolarHBondContact O-CG 3.48Å; L209-L213 PolarHBondContact O-N 3.21Å; T210-L213 PolarHBondContact O-N 2.74Å; T210-L213 VanDerWaalsContact O-N 3.16Å
214L91.2Very high75.3Confident41 Ų41110.3 Ų110.322%0.21551%0.513CS..THydrogen-bonded Turntrans-91.8-4.6178-66.3174.3000113.5K186 Y189 T210 R212K186-L214 HydrophobicContact CB-CD2 3.9Å; K186-L214 HydrophobicContact CD-CD2 4.2Å; K186-L214 HydrophobicContact CG-CD2 3.76Å; K186-L214 HydrophobicContact CG-CG 4.3Å; Y189-L214 HydrophobicContact CD1-CD1 3.76Å; Y189-L214 HydrophobicContact CE1-CD1 4.21Å; T210-L214 HydrophobicContact CG2-CD1 3.63Å; T210-L214 HydrophobicContact CG2-CG 4.1Å; T210-L214 WeakPolarHBondContact O-CB 3.4Å; T210-L214 WeakPolarHBondContact O-CG 3.4Å; T210-L214 PolarHBondContact O-N 3.23Å; R212-L214 VanDerWaalsContact C-N 3.31Å; R212-L214 PolarHBondContact O-N 3.29Å
215A87.6Confident72.7Confident50 Ų50112.4 Ų112.441%0.41352%0.523SS..SBendtrans-63.8135.5175.300000108.7R211 R212 N217R211-A215 PolarHBondContact O-N 3.41Å; R212-A215 WeakPolarHBondContact O-CB 3.42Å; R212-A215 PolarHBondContact O-N 2.92Å; A215-N217 PolarHBondContact O-N 3.36Å
216P77.7Confident70.3Confident116 Ų116116.8 Ų116.875%0.75354%0.541SS*.  trans-54.4130.8172.918.1-26.4000108R218P216-R218 PolarHBondContact O-N 3.15Å
217N64.7Low67.8Low139 Ų139121 Ų12174%0.74356%0.563SS**  trans-50.1109.4177-94.1-31.9000107.2A215 R219A215-N217 PolarHBondContact O-N 3.36Å; N217-R219 HydrophobicContact CB-CG 4.27Å; N217-R219 PolarHBondContact O-N 2.98Å
218R49.9Very low65.4Low241 Ų241121.6 Ų121.691%0.90957%0.571SS**  trans-70.566.2164.1-63.3-171.6-158.7-153.63.7106.2P216 H220P216-R218 PolarHBondContact O-N 3.15Å; R218-H220 VanDerWaalsContact C-N 3.35Å; R218-H220 PolarHBondContact O-N 2.92Å
219R47.1Very low63.1Low212 Ų212124.4 Ų124.480%0.858%0.578SS**  trans-55.6114.5159.5-75.5-174.7-179.4171.30.4103.4N217 Y221N217-R219 HydrophobicContact CB-CG 4.27Å; N217-R219 PolarHBondContact O-N 2.98Å; R219-Y221 PolarHBondContact O-N 2.97Å
220H41.1Very low60.9Low169 Ų169128 Ų12878%0.78260%0.597SS**  trans-31.6119.5170-90.8-84.4000108.2R218 S222R218-H220 VanDerWaalsContact C-N 3.35Å; R218-H220 PolarHBondContact O-N 2.92Å; H220-S222 PolarHBondContact O-N 3.19Å
221Y34.4Very low58.7Low204 Ų204130.8 Ų130.880%0.861%0.613SS**  trans-5885.4152.1-108.3-102.7000105.3R219 K223R219-Y221 PolarHBondContact O-N 2.97Å; Y221-K223 PolarHBondContact O-N 2.82Å
222S40.7Very low56.5Low82 Ų82131.1 Ų131.157%0.57362%0.62SS**  trans-86.492.4-174.253.20000107.5H220 T224H220-S222 PolarHBondContact O-N 3.19Å; S222-T224 PolarHBondContact O-N 2.84Å; S222-T224 PolarHBondContact O-OG1 3.34Å
223K47.8Very low54.3Low162 Ų162128 Ų12870%0.70462%0.623SS**SBendtrans51.85.9152.6-77.2-177.2173.1178.90120.2Y221 Q226 N227Y221-K223 PolarHBondContact O-N 2.82Å; K223-Q226 PolarHBondContact O-N 3.06Å; K223-N227 PolarHBondContact O-N 3.42Å
224T46.3Very low52.1Low107 Ų107136.3 Ų136.366%0.65665%0.652SS**Hα-helixtrans-72.3-35.3173.4-7.20000111.6S222 Q226 N227 D228S222-T224 PolarHBondContact O-N 2.84Å; S222-T224 PolarHBondContact O-OG1 3.34Å; T224-Q226 VanDerWaalsContact C-N 3.26Å; T224-Q226 PolarHBondContact O-N 3.13Å; T224-N227 PolarHBondContact O-N 3.12Å; T224-N227 VanDerWaalsContact O-N 3.17Å; T224-D228 PolarHBondContact O-N 3.17Å; T224-D228 VanDerWaalsContact O-N 3.12Å
225E43.2Very low49.6Very low129 Ų129143.2 Ų143.260%0.60368%0.68SS**Hα-helixtrans-72.1-18.9175.3-71.9-175.316400113.7
226Q46.4Very low47.2Very low123 Ų123143.5 Ų143.558%0.57569%0.688SS**Hα-helixtrans-81.8-27.7172.4-148.4164.621.400111.5K223 T224 L230K223-Q226 PolarHBondContact O-N 3.06Å; T224-Q226 VanDerWaalsContact C-N 3.26Å; T224-Q226 PolarHBondContact O-N 3.13Å; Q226-L230 WeakPolarHBondContact O-CD1 3.44Å; Q226-L230 PolarHBondContact O-N 3.24Å
227N44.8Very low45.5Very low100 Ų100144.1 Ų144.154%0.53569%0.69SS.*Hα-helixtrans-74.6-31.7172.2-107.79.5000112.9K223 T224 R229 L230 T231K223-N227 PolarHBondContact O-N 3.42Å; T224-N227 PolarHBondContact O-N 3.12Å; T224-N227 VanDerWaalsContact O-N 3.17Å; N227-R229 VanDerWaalsContact C-N 3.29Å; N227-R229 PolarHBondContact O-N 2.8Å; N227-L230 PolarHBondContact O-N 3.09Å; N227-L230 VanDerWaalsContact O-N 3.13Å; N227-T231 WeakPolarHBondContact O-CG2 3.33Å; N227-T231 PolarHBondContact O-N 3.28Å; N227-T231 PolarHBondContact O-OG1 3.45Å; N227-T231 VanDerWaalsContact O-OG1 3.06Å
228D45.7Very low44.3Very low107 Ų107143.9 Ų143.957%0.57269%0.693SS**Hα-helixtrans-71-23.2174.6-94.3-8.9000113.8T224T224-D228 PolarHBondContact O-N 3.17Å; T224-D228 VanDerWaalsContact O-N 3.12Å
229R47.8Very low43.8Very low209 Ų209143.6 Ų143.679%0.78969%0.692SS**Hα-helixtrans-78.7-29.2168-68.6-170.2-168.7-158.33.3112.6N227N227-R229 VanDerWaalsContact C-N 3.29Å; N227-R229 PolarHBondContact O-N 2.8Å
230L48.7Very low43.7Very low110 Ų110139.6 Ų139.658%0.57669%0.691SS**Hα-helixtrans-80.9-32177.9-78.6160.1000112.9Q226 N227 S233Q226-L230 WeakPolarHBondContact O-CD1 3.44Å; Q226-L230 PolarHBondContact O-N 3.24Å; N227-L230 PolarHBondContact O-N 3.09Å; N227-L230 VanDerWaalsContact O-N 3.13Å; L230-S233 PolarHBondContact O-N 3.4Å
231T47.3Very low43.9Very low58 Ų58147 Ų14736%0.35671%0.712SS.*Hα-helixtrans-74.8-37.3177.251.60000112.2N227 S233 R234 F235N227-T231 WeakPolarHBondContact O-CG2 3.33Å; N227-T231 PolarHBondContact O-N 3.28Å; N227-T231 PolarHBondContact O-OG1 3.45Å; N227-T231 VanDerWaalsContact O-OG1 3.06Å; T231-S233 PolarHBondContact O-N 3.24Å; T231-R234 PolarHBondContact O-N 3.06Å; T231-F235 WeakPolarHBondContact O-CD2 3.38Å
232K47.5Very low44.4Very low186 Ų186144.2 Ų144.281%0.80971%0.708SS**Hα-helixtrans-67.2-18.2174-74.1-171.2179179.80114.1
233S48.8Very low44.6Very low99 Ų99147.4 Ų147.469%0.69272%0.715SS**THydrogen-bonded Turntrans-84.3-15172.1-173.20000113.6L230 T231L230-S233 PolarHBondContact O-N 3.4Å; T231-S233 PolarHBondContact O-N 3.24Å
234R45.4Very low44.4Very low219 Ų219146.6 Ų146.683%0.82672%0.715SS**THydrogen-bonded Turntrans-103.1-11.1-171.7-140.2176.1-173.6-173.61115T231 G236T231-R234 PolarHBondContact O-N 3.06Å; R234-G236 VanDerWaalsContact C-N 3.31Å; R234-G236 PolarHBondContact O-N 3.47Å
235F39.6Very low44.3Very low186 Ų186148.9 Ų148.982%0.81672%0.719SS**  trans-99.652.5172.7-65.2-75.8000111.2T231T231-F235 WeakPolarHBondContact O-CD2 3.38Å
236G35.7Very low44.4Very low56 Ų56150.2 Ų150.258%0.57773%0.726SS**  trans-98.9118.516200000109.3R234R234-G236 VanDerWaalsContact C-N 3.31Å; R234-G236 PolarHBondContact O-N 3.47Å
237T41.7Very low44.2Very low128 Ų128152 Ų15279%0.78574%0.736SS**  trans8279.8153.8-340000117
238V40Very low44.2Very low134 Ų134155.7 Ų155.781%0.81275%0.751SS**  trans-80.2110.7152.8176.40000107.7
239R39.7Very low44.1Very low236 Ų236159.5 Ų159.589%0.89176%0.764SS**  trans-70.9118.7168.5-82.4177.3164.7173.1-5.2109.2
240T45.8Very low43.8Very low128 Ų128155.3 Ų155.379%0.78576%0.762SS**  trans-100.7117.2164.147.70000109.1
241R45Very low43.3Very low324 Ų324159.5 Ų159.5100%1.22378%0.779SS**  trans10.80164.2-66.9-178.1179.6-170.9-0.6119.1

Retrieved 241 of 241 residues in 83.6 ms (Link to these results)

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