A0A060Z2G5_ONCMY Loading...

Histone H2A

AlphaFold DB , UniProt , Accession A0A060Z2G5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110495475, Length 139 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
1M47Very low55.1Low249 Ų249153.2 Ų153.2100%1.22785%0.853SS**  093.40-69.5-126.2-99.200109.2
2S47.9Very low55.6Low133 Ų133150.8 Ų150.893%0.9385%0.854SS**  trans-100.292.6176-179.40000109.2
3G52.9Low56.4Low70 Ų70152.8 Ų152.872%0.72285%0.848SS**  trans-92.3116.6174.700000111.3
4R58.4Low57.4Low230 Ų230151.8 Ų151.887%0.86885%0.848SS**  trans51.297.6130.9-149.6171.6-162.4168.33.3117.8
5G50.8Low59Low72 Ų72149 Ų14974%0.74284%0.843SS**  trans-112.1104.2148.600000109.7K7G5-K7 PolarHBondContact O-N 3.45Å
6K59.8Low61Low192 Ų192143.8 Ų143.884%0.83582%0.815SS**  trans-50.5114.1164.3-94.6175.3172.6174.60106.7A8K6-A8 PolarHBondContact O-N 2.8Å; K6-A8 VanDerWaalsContact O-N 3.12Å
7K55.2Low63Low211 Ų211138.5 Ų138.592%0.91779%0.79SS**  trans-50.4123.6178.2-84.2-178.8175.4177.30109G5G5-K7 PolarHBondContact O-N 3.45Å
8A54.8Low64.8Low90 Ų90136.2 Ų136.274%0.74477%0.766SS**  trans-47.6151.3174.600000111.3K6 S10K6-A8 PolarHBondContact O-N 2.8Å; K6-A8 VanDerWaalsContact O-N 3.12Å; A8-S10 VanDerWaalsContact C-N 3.3Å; A8-S10 PolarHBondContact O-N 2.94Å
9V60Low66.5Low152 Ų152129.8 Ų129.892%0.92173%0.731SS**  trans-49.591.9176.8-178.40000109.4K11V9-K11 PolarHBondContact O-N 3.28Å
10S59.8Low68Low89 Ų89128.5 Ų128.562%0.62273%0.726SS**  trans-68.9130.9172.459.70000107.2A8 S12A8-S10 VanDerWaalsContact C-N 3.3Å; A8-S10 PolarHBondContact O-N 2.94Å; S10-S12 PolarHBondContact O-N 3.13Å
11K59.3Low69.4Low197 Ų197130.5 Ų130.586%0.85772%0.722SS**  trans-22.2128.1167.1-89.2177.9172.4175.30111.1V9 K13V9-K11 PolarHBondContact O-N 3.28Å; K11-K13 VanDerWaalsContact C-N 3.25Å; K11-K13 PolarHBondContact O-N 3.19Å
12S62.1Low71.8Confident124 Ų124120.6 Ų120.687%0.86768%0.68SS**  trans-42.687.8173.6160.60000110.8S10 T14S10-S12 PolarHBondContact O-N 3.13Å; S12-T14 PolarHBondContact O-N 2.99Å
13K65.9Low74.2Confident177 Ų177117.3 Ų117.377%0.7767%0.667SS**  trans-65.2130.5167.3-77.3-174.6175.4-176.10105.1K11 S15K11-K13 VanDerWaalsContact C-N 3.25Å; K11-K13 PolarHBondContact O-N 3.19Å; K13-S15 PolarHBondContact O-N 3.29Å
14T69.4Low76.3Confident139 Ų139115.2 Ų115.285%0.85364%0.639SS**  trans-45109.3169.112.90000108S12 T16S12-T14 PolarHBondContact O-N 2.99Å; T14-T16 PolarHBondContact O-N 2.83Å; T14-T16 VanDerWaalsContact O-N 3.07Å
15S82.3Confident78.2Confident110 Ų110112.4 Ų112.477%0.76964%0.635SS**  trans-70.8112.9-172.7104.30000107.4K13 S17K13-S15 PolarHBondContact O-N 3.29Å; S15-S17 PolarHBondContact O-N 3.32Å
16T90.6Very high80.5Confident65 Ų65111.9 Ų111.940%0.39961%0.613SS.*  trans-61.4128.8173.3-41.50000109T14 V20 R21T14-T16 PolarHBondContact O-N 2.83Å; T14-T16 VanDerWaalsContact O-N 3.07Å; T16-V20 HydrophobicContact CG2-CB 3.87Å; T16-V20 HydrophobicContact CG2-CG1 3.54Å; T16-R21 HydrophobicContact CG2-CG 3.81Å
17S94.5Very high82.3Confident55 Ų55105 Ų10539%0.38559%0.588SS.*  trans-65.4154.4179.681.10000110.8S15 S19 V20 R21S15-S17 PolarHBondContact O-N 3.32Å; S17-S19 PolarHBondContact O-N 2.89Å; S17-V20 PolarHBondContact O-N 3.16Å; S17-V20 VanDerWaalsContact OG-CG2 3.31Å; S17-V20 WeakPolarHBondContact OG-CG2 3.42Å; S17-V20 PolarHBondContact OG-N 2.88Å; S17-V20 VanDerWaalsContact OG-N 3.09Å; S17-R21 WeakPolarHBondContact O-CG 3.44Å; S17-R21 PolarHBondContact O-N 2.9Å
18R95.5Very high84.4Confident97 Ų9794.9 Ų94.937%0.36654%0.544SS..Hα-helixtrans-62.1-32174.7-74.6-172.7-76.5165.4-8.3112.5A22 V28 H32R18-A22 VanDerWaalsContact O-CB 3.31Å; R18-A22 WeakPolarHBondContact O-CB 3.36Å; R18-A22 PolarHBondContact O-N 3.35Å; R18-V28 HydrophobicContact CB-CB 4.12Å; R18-V28 HydrophobicContact CB-CG1 3.88Å; R18-H32 PolarHBondContact NH1-ND1 3.07Å; R18-H32 VanDerWaalsContact NH1-ND1 3.19Å
19S97.4Very high86.4Confident15 Ų1592.1 Ų92.111%0.10552%0.524CS..Hα-helixtrans-63.3-50.7174.6-63.70000111.4S17 R21 A22 G23 L24 F26 P27 V28S17-S19 PolarHBondContact O-N 2.89Å; S19-R21 VanDerWaalsContact C-N 3.31Å; S19-R21 PolarHBondContact O-N 3.04Å; S19-A22 CarbonylContact O-C 3.48Å; S19-A22 PolarHBondContact O-N 2.75Å; S19-G23 PolarHBondContact O-N 2.84Å; S19-L24 WeakPolarHBondContact CB-O 3.14Å; S19-L24 PolarHBondContact O-N 2.94Å; S19-F26 WeakPolarHBondContact CB-O 3.13Å; S19-F26 PolarHBondContact OG-O 2.82Å; S19-P27 WeakPolarHBondContact OG-CA 3.34Å; S19-V28 PolarHBondContact OG-N 3.16Å
20V97.3Very high88.2Confident102 Ų10292.1 Ų92.162%0.61851%0.507SS*.Hα-helixtrans-60.8-41.1178.2171.30000111.2T16 S17 A22 G23T16-V20 HydrophobicContact CG2-CB 3.87Å; T16-V20 HydrophobicContact CG2-CG1 3.54Å; S17-V20 PolarHBondContact O-N 3.16Å; S17-V20 VanDerWaalsContact OG-CG2 3.31Å; S17-V20 WeakPolarHBondContact OG-CG2 3.42Å; S17-V20 PolarHBondContact OG-N 2.88Å; S17-V20 VanDerWaalsContact OG-N 3.09Å; V20-A22 VanDerWaalsContact C-N 3.26Å; V20-A22 PolarHBondContact O-N 3.15Å; V20-G23 PolarHBondContact O-N 3.26Å
21R96.4Very high90.1Very high172 Ų17288.6 Ų88.665%0.64948%0.481SS*.Hα-helixtrans-64.9-29175.4-71.5-180178.7145.45.3113.8T16 S17 S19T16-R21 HydrophobicContact CG2-CG 3.81Å; S17-R21 WeakPolarHBondContact O-CG 3.44Å; S17-R21 PolarHBondContact O-N 2.9Å; S19-R21 VanDerWaalsContact C-N 3.31Å; S19-R21 PolarHBondContact O-N 3.04Å
22A97.2Very high91.9Very high41 Ų4180 Ų8034%0.33944%0.444SS..Hα-helixtrans-90.6-4.9178.700000113.1R18 S19 V20 L24 V50R18-A22 VanDerWaalsContact O-CB 3.31Å; R18-A22 WeakPolarHBondContact O-CB 3.36Å; R18-A22 PolarHBondContact O-N 3.35Å; S19-A22 CarbonylContact O-C 3.48Å; S19-A22 PolarHBondContact O-N 2.75Å; V20-A22 VanDerWaalsContact C-N 3.26Å; V20-A22 PolarHBondContact O-N 3.15Å; A22-L24 VanDerWaalsContact C-N 3.29Å; A22-L24 HydrophobicContact CB-CD1 4Å; A22-L24 HydrophobicContact CB-CG 4.03Å; A22-L24 PolarHBondContact O-N 3.17Å; A22-V50 HydrophobicContact CB-CG1 3.83Å
23G97.9Very high93.7Very high63 Ų6380.8 Ų80.865%0.64943%0.428SS*.THydrogen-bonded Turntrans69.923.3-175.200000114.3S19 V20S19-G23 PolarHBondContact O-N 2.84Å; V20-G23 PolarHBondContact O-N 3.26Å
24L98.3Very high95.2Very high27 Ų2776.6 Ų76.614%0.14141%0.414CS..  trans-106140.5-175.7-63.1176.3000111.4S19 A22 V28 V50 A53 A54 E57S19-L24 WeakPolarHBondContact CB-O 3.14Å; S19-L24 PolarHBondContact O-N 2.94Å; A22-L24 VanDerWaalsContact C-N 3.29Å; A22-L24 HydrophobicContact CB-CD1 4Å; A22-L24 HydrophobicContact CB-CG 4.03Å; A22-L24 PolarHBondContact O-N 3.17Å; L24-V28 HydrophobicContact CD1-CG2 3.84Å; L24-V50 HydrophobicContact CD1-CG1 4.26Å; L24-A53 HydrophobicContact CD1-CB 3.81Å; L24-A54 HydrophobicContact CD1-CB 4.13Å; L24-A54 HydrophobicContact CD2-CB 3.89Å; L24-E57 WeakPolarHBondContact CA-OE2 3.44Å; L24-E57 WeakPolarHBondContact CB-OE2 3.29Å
25Q98.4Very high96.6Very high170 Ų17071.2 Ų71.279%0.79438%0.38SS*.SBendtrans-75.1-33.2167.2-60.6-56.8-34.600111.5E57Q25-E57 PolarHBondContact N-OE1 3.08Å; Q25-E57 VanDerWaalsContact N-OE1 3.15Å; Q25-E57 PolarHBondContact N-OE2 3.41Å
26F98.3Very high97.3Very high61 Ų6171.8 Ų71.827%0.26837%0.368SS..SBendtrans-68.9147.3-179-93.847.3000112.4S19 V28 I31 A53 L56 E57 C60S19-F26 WeakPolarHBondContact CB-O 3.13Å; S19-F26 PolarHBondContact OG-O 2.82Å; F26-V28 PolarHBondContact O-N 2.86Å; F26-I31 HydrophobicContact CD2-CD1 4.41Å; F26-A53 HydrophobicContact CB-CB 4.38Å; F26-L56 HydrophobicContact CD2-CB 3.81Å; F26-L56 HydrophobicContact CE2-CB 3.73Å; F26-E57 HydrophobicContact CB-CB 4.15Å; F26-E57 WeakPolarHBondContact CB-OE2 3.49Å; F26-E57 HydrophobicContact CD1-CB 3.75Å; F26-E57 HydrophobicContact CD1-CG 3.86Å; F26-E57 HydrophobicContact CD2-CB 4.45Å; F26-E57 HydrophobicContact CE1-CB 4.27Å; F26-E57 HydrophobicContact CE1-CG 4.38Å; F26-E57 HydrophobicContact CG-CB 3.86Å; F26-E57 HydrophobicContact CG-CG 4.42Å; F26-E57 PolarHBondContact N-OE2 2.93Å; F26-C60 HydrophobicContact CE1-CB 4.25Å; F26-C60 HydrophobicContact CZ-CB 3.81Å
27P98.2Very high97.7Very high47 Ų4776.1 Ų76.131%0.30538%0.382SS..  trans-82.285-171.633.4-37000112.5S19 G29 R30 I31S19-P27 WeakPolarHBondContact OG-CA 3.34Å; P27-G29 PolarHBondContact O-N 3.1Å; P27-G29 VanDerWaalsContact O-N 3.11Å; P27-R30 HydrophobicContact CB-CB 3.84Å; P27-R30 HydrophobicContact CG-CB 3.98Å; P27-R30 WeakPolarHBondContact O-CB 3.04Å; P27-R30 PolarHBondContact O-N 2.8Å; P27-I31 PolarHBondContact O-N 3.45Å
28V98.4Very high97.8Very high0 Ų075.1 Ų75.10%038%0.38CS..Hα-helixtrans-48.8-41.9177.1176.20000112.1R18 S19 L24 F26 R30 I31 H32 A49 V50 A53R18-V28 HydrophobicContact CB-CB 4.12Å; R18-V28 HydrophobicContact CB-CG1 3.88Å; S19-V28 PolarHBondContact OG-N 3.16Å; L24-V28 HydrophobicContact CD1-CG2 3.84Å; F26-V28 PolarHBondContact O-N 2.86Å; V28-R30 PolarHBondContact O-N 2.72Å; V28-I31 PolarHBondContact O-N 3.37Å; V28-H32 WeakPolarHBondContact O-CB 3.34Å; V28-H32 PolarHBondContact O-N 3.01Å; V28-A49 HydrophobicContact CG1-CB 4.35Å; V28-V50 HydrophobicContact CG1-CG2 3.75Å; V28-A53 HydrophobicContact CG2-CB 3.83Å
29G97.7Very high97.9Very high32 Ų3278.3 Ų78.333%0.3340%0.399SS..Hα-helixtrans-63.2-40.6179.500000113.5P27 R33P27-G29 PolarHBondContact O-N 3.1Å; P27-G29 VanDerWaalsContact O-N 3.11Å; G29-R33 PolarHBondContact O-N 2.81Å
30R98.3Very high97.8Very high151 Ų15186 Ų8657%0.5743%0.427SS*.Hα-helixtrans-69.9-45177.9-175.4-177.7-66.3166.1-1.3110.5P27 V28 H32 R33 L34P27-R30 HydrophobicContact CB-CB 3.84Å; P27-R30 HydrophobicContact CG-CB 3.98Å; P27-R30 WeakPolarHBondContact O-CB 3.04Å; P27-R30 PolarHBondContact O-N 2.8Å; V28-R30 PolarHBondContact O-N 2.72Å; R30-H32 VanDerWaalsContact C-N 3.34Å; R30-H32 PolarHBondContact O-N 2.89Å; R30-R33 WeakPolarHBondContact O-CB 3.25Å; R30-R33 PolarHBondContact O-N 2.81Å; R30-R33 VanDerWaalsContact O-N 3.1Å; R30-L34 HydrophobicContact CG-CD1 4.3Å; R30-L34 WeakPolarHBondContact O-CG 3.35Å; R30-L34 PolarHBondContact O-N 3.45Å
31I98.3Very high97.8Very high15 Ų1583.9 Ų83.98%0.07742%0.42CS..Hα-helixtrans-60.4-44.4178.3-69.2167.2000110.6F26 P27 V28 R33 L34 L35 L52 A53 L56F26-I31 HydrophobicContact CD2-CD1 4.41Å; P27-I31 PolarHBondContact O-N 3.45Å; V28-I31 PolarHBondContact O-N 3.37Å; I31-R33 VanDerWaalsContact C-N 3.29Å; I31-R33 PolarHBondContact O-N 3.1Å; I31-L34 PolarHBondContact O-N 3.13Å; I31-L34 VanDerWaalsContact O-N 3.15Å; I31-L35 HydrophobicContact CG2-CD1 4.18Å; I31-L35 HydrophobicContact CG2-CG 4.45Å; I31-L35 WeakPolarHBondContact O-CG 3.42Å; I31-L35 PolarHBondContact O-N 3.38Å; I31-L52 HydrophobicContact CG2-CB 4.35Å; I31-L52 HydrophobicContact CG2-CD2 3.91Å; I31-L52 HydrophobicContact CG2-CG 4.21Å; I31-A53 HydrophobicContact CD1-CB 3.47Å; I31-A53 VanDerWaalsContact CD1-CB 3.47Å; I31-L56 HydrophobicContact CD1-CD1 4.11Å
32H98.3Very high97.9Very high16 Ų1681 Ų817%0.07443%0.433CS..Hα-helixtrans-57.5-41.8174.5-167.1111.7000112.4R18 V28 R30 K36 A49R18-H32 PolarHBondContact NH1-ND1 3.07Å; R18-H32 VanDerWaalsContact NH1-ND1 3.19Å; V28-H32 WeakPolarHBondContact O-CB 3.34Å; V28-H32 PolarHBondContact O-N 3.01Å; R30-H32 VanDerWaalsContact C-N 3.34Å; R30-H32 PolarHBondContact O-N 2.89Å; H32-K36 WeakPolarHBondContact NE2-CE 3.37Å; H32-K36 PolarHBondContact O-N 3.34Å; H32-A49 HydrophobicContact CB-CB 3.49Å; H32-A49 VanDerWaalsContact CB-CB 3.49Å
33R98.3Very high97.9Very high141 Ų14190 Ų9053%0.53246%0.458SS..Hα-helixtrans-66.1-41.8177-177.1-179.36280.30.2111.6G29 R30 I31 K36 K37G29-R33 PolarHBondContact O-N 2.81Å; R30-R33 WeakPolarHBondContact O-CB 3.25Å; R30-R33 PolarHBondContact O-N 2.81Å; R30-R33 VanDerWaalsContact O-N 3.1Å; I31-R33 VanDerWaalsContact C-N 3.29Å; I31-R33 PolarHBondContact O-N 3.1Å; R33-K36 PolarHBondContact O-N 2.94Å; R33-K37 PolarHBondContact O-N 2.94Å
34L98.4Very high97.9Very high89 Ų8988.5 Ų88.547%0.46644%0.435SS..Hα-helixtrans-63.6-41.9176.8-68.7174.6000111.7R30 I31 K36 K37 G38R30-L34 HydrophobicContact CG-CD1 4.3Å; R30-L34 WeakPolarHBondContact O-CG 3.35Å; R30-L34 PolarHBondContact O-N 3.45Å; I31-L34 PolarHBondContact O-N 3.13Å; I31-L34 VanDerWaalsContact O-N 3.15Å; L34-K36 VanDerWaalsContact C-N 3.32Å; L34-K36 PolarHBondContact O-N 3.09Å; L34-K37 PolarHBondContact O-N 2.91Å; L34-G38 PolarHBondContact O-N 3.37Å
35L98.1Very high97.8Very high26 Ų2689.3 Ų89.314%0.13645%0.45CS..Hα-helixtrans-59.1-41.1174.6-73.5171.3000112.4I31 Y40 I44 A49 L52I31-L35 HydrophobicContact CG2-CD1 4.18Å; I31-L35 HydrophobicContact CG2-CG 4.45Å; I31-L35 WeakPolarHBondContact O-CG 3.42Å; I31-L35 PolarHBondContact O-N 3.38Å; L35-Y40 HydrophobicContact CD2-CD2 3.93Å; L35-Y40 HydrophobicContact CD2-CE2 4.12Å; L35-Y40 WeakPolarHBondContact O-CD2 3.19Å; L35-I44 HydrophobicContact CB-CD1 4.36Å; L35-I44 HydrophobicContact CB-CG1 4.22Å; L35-I44 HydrophobicContact CB-CG2 3.97Å; L35-I44 HydrophobicContact CD1-CG2 4.03Å; L35-A49 HydrophobicContact CD1-CB 4.19Å; L35-L52 HydrophobicContact CD1-CD2 4.14Å; L35-L52 HydrophobicContact CD2-CD2 3.83Å; L35-L52 HydrophobicContact CG-CD2 4.23Å
36K97.7Very high97.6Very high123 Ų12386.2 Ų86.254%0.53544%0.443SS..Hα-helixtrans-67.6-42.1174.8-75-175.5169.1178.30112.7H32 R33 L34 G38 H39 I44H32-K36 WeakPolarHBondContact NE2-CE 3.37Å; H32-K36 PolarHBondContact O-N 3.34Å; R33-K36 PolarHBondContact O-N 2.94Å; L34-K36 VanDerWaalsContact C-N 3.32Å; L34-K36 PolarHBondContact O-N 3.09Å; K36-G38 VanDerWaalsContact C-N 3.28Å; K36-G38 PolarHBondContact O-N 3.11Å; K36-H39 PolarHBondContact O-N 2.88Å; K36-I44 HydrophobicContact CG-CB 4.21Å; K36-I44 HydrophobicContact CG-CG1 3.98Å
37K98.1Very high97.5Very high155 Ų15585.5 Ų85.567%0.67445%0.452SS*.Hα-helixtrans-67.6-29.6178.9-172-178.9177.1-173.20112.2R33 L34 H39R33-K37 PolarHBondContact O-N 2.94Å; L34-K37 PolarHBondContact O-N 2.91Å; K37-H39 PolarHBondContact O-CD2 3.35Å; K37-H39 PolarHBondContact O-N 3.25Å
38G97.6Very high97.5Very high34 Ų3485.7 Ų85.735%0.35146%0.458SS..THydrogen-bonded Turntrans-75.3-4.6179.500000114.8L34 K36 Y40L34-G38 PolarHBondContact O-N 3.37Å; K36-G38 VanDerWaalsContact C-N 3.28Å; K36-G38 PolarHBondContact O-N 3.11Å; G38-Y40 PolarHBondContact O-N 3.3Å; G38-Y40 VanDerWaalsContact O-N 3.08Å
39H96.4Very high97.5Very high165 Ų16585.7 Ų85.776%0.76446%0.458SS*.THydrogen-bonded Turntrans53.129.6179.2-61-74.1000114.7K36 K37 A41K36-H39 PolarHBondContact O-N 2.88Å; K37-H39 PolarHBondContact O-CD2 3.35Å; K37-H39 PolarHBondContact O-N 3.25Å; H39-A41 PolarHBondContact O-N 2.84Å
40Y97Very high97.5Very high175 Ų17586.6 Ų86.669%0.68646%0.457SS*.SBendtrans-65.3-26.2-179.8-58.4-68.4000113.7L35 G38L35-Y40 HydrophobicContact CD2-CD2 3.93Å; L35-Y40 HydrophobicContact CD2-CE2 4.12Å; L35-Y40 WeakPolarHBondContact O-CD2 3.19Å; G38-Y40 PolarHBondContact O-N 3.3Å; G38-Y40 VanDerWaalsContact O-N 3.08Å
41A97.5Very high97.6Very high58 Ų5887.6 Ų87.648%0.47946%0.462SS..SBendtrans-158.6159.9175.200000110.5H39 R43 I44H39-A41 PolarHBondContact O-N 2.84Å; A41-R43 VanDerWaalsContact C-N 3.26Å; A41-R43 PolarHBondContact O-N 2.89Å; A41-I44 HydrophobicContact CB-CD1 4.14Å
42A97.1Very high97.6Very high111 Ų11189.7 Ų89.792%0.91747%0.473SS*.SBendtrans-61.4-32.2177.400000113.3
43R97.8Very high97.6Very high230 Ų23089 Ų8987%0.86847%0.47SS*.  trans-135.2138.5176.8-61.8179.574.2-153.14.2109.9A41A41-R43 VanDerWaalsContact C-N 3.26Å; A41-R43 PolarHBondContact O-N 2.89Å
44I98Very high97.6Very high32 Ų3284 Ų8416%0.16446%0.459CS..  trans-112.5119.2175.5-56.6-61.6000108.8L35 K36 A41L35-I44 HydrophobicContact CB-CD1 4.36Å; L35-I44 HydrophobicContact CB-CG1 4.22Å; L35-I44 HydrophobicContact CB-CG2 3.97Å; L35-I44 HydrophobicContact CD1-CG2 4.03Å; K36-I44 HydrophobicContact CG-CB 4.21Å; K36-I44 HydrophobicContact CG-CG1 3.98Å; A41-I44 HydrophobicContact CB-CD1 4.14Å
45G96.9Very high97.6Very high45 Ų4583 Ų8346%0.46445%0.453SS..  trans-64.3151.617500000112.2A48G45-A48 PolarHBondContact O-N 3.44Å
46T92.1Very high97.6Very high105 Ų10585 Ų8564%0.64446%0.464SS*.Hα-helixtrans-65-40176.946.20000112.1A49T46-A49 PolarHBondContact O-N 2.9Å
47G97.3Very high97.7Very high45 Ų4581.2 Ų81.246%0.46445%0.448SS..Hα-helixtrans-64.4-35178.200000113.8A49 V50 Y51G47-A49 VanDerWaalsContact C-N 3.27Å; G47-A49 PolarHBondContact O-N 3.26Å; G47-V50 WeakPolarHBondContact O-CB 3.29Å; G47-V50 PolarHBondContact O-N 2.95Å; G47-Y51 PolarHBondContact O-N 3.13Å
48A98.3Very high97.7Very high51 Ų5180.2 Ų80.242%0.42144%0.441SS..Hα-helixtrans-57.3-40.8179.200000112.5G45 V50 Y51 L52G45-A48 PolarHBondContact O-N 3.44Å; A48-V50 VanDerWaalsContact C-N 3.35Å; A48-Y51 PolarHBondContact O-N 2.99Å; A48-L52 WeakPolarHBondContact O-CB 3.45Å; A48-L52 PolarHBondContact O-N 3.42Å
49A98.2Very high97.8Very high0 Ų081.4 Ų81.40%044%0.439CS..Hα-helixtrans-71.6-28.3178.200000113.5V28 H32 L35 T46 G47 A53V28-A49 HydrophobicContact CG1-CB 4.35Å; H32-A49 HydrophobicContact CB-CB 3.49Å; H32-A49 VanDerWaalsContact CB-CB 3.49Å; L35-A49 HydrophobicContact CD1-CB 4.19Å; T46-A49 PolarHBondContact O-N 2.9Å; G47-A49 VanDerWaalsContact C-N 3.27Å; G47-A49 PolarHBondContact O-N 3.26Å; A49-A53 WeakPolarHBondContact O-CB 3.42Å; A49-A53 PolarHBondContact O-N 3.39Å
50V98.5Very high97.9Very high51 Ų5176 Ų7631%0.30942%0.42SS..Hα-helixtrans-72.2-48.3174.5177.40000109.3A22 L24 V28 G47 A48 A53 A54A22-V50 HydrophobicContact CB-CG1 3.83Å; L24-V50 HydrophobicContact CD1-CG1 4.26Å; V28-V50 HydrophobicContact CG1-CG2 3.75Å; G47-V50 WeakPolarHBondContact O-CB 3.29Å; G47-V50 PolarHBondContact O-N 2.95Å; A48-V50 VanDerWaalsContact C-N 3.35Å; V50-A53 WeakPolarHBondContact O-CB 3.07Å; V50-A53 PolarHBondContact O-N 3.37Å; V50-A54 PolarHBondContact O-N 3.24Å
51Y98.8Very high97.9Very high172 Ų17270.3 Ų70.368%0.67541%0.408SS*.Hα-helixtrans-61-48.3-179.2-165.3-98.6000111.9G47 A48 A53 A54 I55G47-Y51 PolarHBondContact O-N 3.13Å; A48-Y51 PolarHBondContact O-N 2.99Å; Y51-A53 VanDerWaalsContact C-N 3.32Å; Y51-A53 PolarHBondContact O-N 3.19Å; Y51-A54 PolarHBondContact O-N 3.32Å; Y51-I55 HydrophobicContact CD1-CD1 3.59Å; Y51-I55 HydrophobicContact CD1-CG1 4.5Å; Y51-I55 HydrophobicContact CE1-CD1 3.31Å; Y51-I55 HydrophobicContact CE1-CG1 4.32Å; Y51-I55 PolarHBondContact O-N 3.16Å
52L98.6Very high98Very high60 Ų6070.6 Ų70.631%0.31440%0.4SS..Hα-helixtrans-63.6-37.6176.3-178.260.5000112.2I31 L35 A48 A54 I55 L56I31-L52 HydrophobicContact CG2-CB 4.35Å; I31-L52 HydrophobicContact CG2-CD2 3.91Å; I31-L52 HydrophobicContact CG2-CG 4.21Å; L35-L52 HydrophobicContact CD1-CD2 4.14Å; L35-L52 HydrophobicContact CD2-CD2 3.83Å; L35-L52 HydrophobicContact CG-CD2 4.23Å; A48-L52 WeakPolarHBondContact O-CB 3.45Å; A48-L52 PolarHBondContact O-N 3.42Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 3.4Å; L52-I55 PolarHBondContact O-N 3.28Å; L52-L56 HydrophobicContact CD1-CD1 4.25Å; L52-L56 HydrophobicContact CD1-CG 4.12Å; L52-L56 HydrophobicContact CG-CD1 4.02Å; L52-L56 HydrophobicContact CG-CG 4.33Å; L52-L56 WeakPolarHBondContact O-CB 3.32Å; L52-L56 VanDerWaalsContact O-CG 3.26Å; L52-L56 WeakPolarHBondContact O-CG 3.3Å; L52-L56 PolarHBondContact O-N 3.21Å
53A98.6Very high98Very high0 Ų066.8 Ų66.80%037%0.365CS..Hα-helixtrans-62.6-41.717600000112.1L24 F26 V28 I31 A49 V50 Y51 L56 E57L24-A53 HydrophobicContact CD1-CB 3.81Å; F26-A53 HydrophobicContact CB-CB 4.38Å; V28-A53 HydrophobicContact CG2-CB 3.83Å; I31-A53 HydrophobicContact CD1-CB 3.47Å; I31-A53 VanDerWaalsContact CD1-CB 3.47Å; A49-A53 WeakPolarHBondContact O-CB 3.42Å; A49-A53 PolarHBondContact O-N 3.39Å; V50-A53 WeakPolarHBondContact O-CB 3.07Å; V50-A53 PolarHBondContact O-N 3.37Å; Y51-A53 VanDerWaalsContact C-N 3.32Å; Y51-A53 PolarHBondContact O-N 3.19Å; A53-L56 PolarHBondContact O-N 2.86Å; A53-E57 WeakPolarHBondContact O-CB 3.29Å; A53-E57 PolarHBondContact O-N 2.8Å
54A98.8Very high98.1Very high38 Ų3860 Ų6031%0.31435%0.346SS..Hα-helixtrans-62.9-44.2176.700000112L24 V50 Y51 L52 E57 Y58L24-A54 HydrophobicContact CD1-CB 4.13Å; L24-A54 HydrophobicContact CD2-CB 3.89Å; V50-A54 PolarHBondContact O-N 3.24Å; Y51-A54 PolarHBondContact O-N 3.32Å; L52-A54 VanDerWaalsContact C-N 3.33Å; L52-A54 PolarHBondContact O-N 3.4Å; A54-E57 PolarHBondContact O-N 2.64Å; A54-Y58 WeakPolarHBondContact O-CB 3.34Å; A54-Y58 PolarHBondContact O-N 3.24Å
55I98.6Very high98.1Very high66 Ų6663.9 Ų63.934%0.33836%0.363SS..Hα-helixtrans-62.7-45.9177.2-69.5169.2000111.3Y51 L52 E57 Y58 L59Y51-I55 HydrophobicContact CD1-CD1 3.59Å; Y51-I55 HydrophobicContact CD1-CG1 4.5Å; Y51-I55 HydrophobicContact CE1-CD1 3.31Å; Y51-I55 HydrophobicContact CE1-CG1 4.32Å; Y51-I55 PolarHBondContact O-N 3.16Å; L52-I55 PolarHBondContact O-N 3.28Å; I55-E57 VanDerWaalsContact C-N 3.31Å; I55-E57 PolarHBondContact O-N 3.44Å; I55-Y58 PolarHBondContact O-N 3.13Å; I55-L59 HydrophobicContact CG2-CD1 3.89Å; I55-L59 HydrophobicContact CG2-CG 4.35Å; I55-L59 WeakPolarHBondContact O-CG 3.35Å; I55-L59 PolarHBondContact O-N 3.34Å
56L98.7Very high98.2Very high70 Ų7063.9 Ų63.937%0.36635%0.352SS..Hα-helixtrans-65.2-36.6179.5-68.6174.6000112.1F26 I31 L52 A53 C60F26-L56 HydrophobicContact CD2-CB 3.81Å; F26-L56 HydrophobicContact CE2-CB 3.73Å; I31-L56 HydrophobicContact CD1-CD1 4.11Å; L52-L56 HydrophobicContact CD1-CD1 4.25Å; L52-L56 HydrophobicContact CD1-CG 4.12Å; L52-L56 HydrophobicContact CG-CD1 4.02Å; L52-L56 HydrophobicContact CG-CG 4.33Å; L52-L56 WeakPolarHBondContact O-CB 3.32Å; L52-L56 VanDerWaalsContact O-CG 3.26Å; L52-L56 WeakPolarHBondContact O-CG 3.3Å; L52-L56 PolarHBondContact O-N 3.21Å; A53-L56 PolarHBondContact O-N 2.86Å; L56-C60 VanDerWaalsContact O-CB 3.23Å; L56-C60 WeakPolarHBondContact O-CB 3.37Å; L56-C60 PolarHBondContact O-N 2.86Å; L56-C60 VanDerWaalsContact O-N 3.09Å
57E98.8Very high98.5Very high42 Ų4258.9 Ų58.920%0.19632%0.321CS..Hα-helixtrans-65.3-45.6174.3-174.5166.5149.200111.4L24 Q25 F26 A53 A54 I55 C60 A61L24-E57 WeakPolarHBondContact CA-OE2 3.44Å; L24-E57 WeakPolarHBondContact CB-OE2 3.29Å; Q25-E57 PolarHBondContact N-OE1 3.08Å; Q25-E57 VanDerWaalsContact N-OE1 3.15Å; Q25-E57 PolarHBondContact N-OE2 3.41Å; F26-E57 HydrophobicContact CB-CB 4.15Å; F26-E57 WeakPolarHBondContact CB-OE2 3.49Å; F26-E57 HydrophobicContact CD1-CB 3.75Å; F26-E57 HydrophobicContact CD1-CG 3.86Å; F26-E57 HydrophobicContact CD2-CB 4.45Å; F26-E57 HydrophobicContact CE1-CB 4.27Å; F26-E57 HydrophobicContact CE1-CG 4.38Å; F26-E57 HydrophobicContact CG-CB 3.86Å; F26-E57 HydrophobicContact CG-CG 4.42Å; F26-E57 PolarHBondContact N-OE2 2.93Å; A53-E57 WeakPolarHBondContact O-CB 3.29Å; A53-E57 PolarHBondContact O-N 2.8Å; A54-E57 PolarHBondContact O-N 2.64Å; I55-E57 VanDerWaalsContact C-N 3.31Å; I55-E57 PolarHBondContact O-N 3.44Å; E57-C60 PolarHBondContact O-N 3.31Å; E57-A61 WeakPolarHBondContact O-CB 3.38Å; E57-A61 PolarHBondContact O-N 2.95Å
58Y98.6Very high98.6Very high135 Ų13557.8 Ų57.853%0.52931%0.31SS..Hα-helixtrans-59.1-53.3176.5168.2-115000112.2A54 I55 C60 A61 E62A54-Y58 WeakPolarHBondContact O-CB 3.34Å; A54-Y58 PolarHBondContact O-N 3.24Å; I55-Y58 PolarHBondContact O-N 3.13Å; Y58-C60 VanDerWaalsContact C-N 3.27Å; Y58-C60 PolarHBondContact O-N 3.3Å; Y58-A61 WeakPolarHBondContact O-CB 3.26Å; Y58-A61 PolarHBondContact O-N 2.86Å; Y58-A61 VanDerWaalsContact O-N 3.1Å; Y58-E62 PolarHBondContact O-N 3.37Å
59L98.4Very high98.6Very high59 Ų5957.6 Ų57.631%0.30930%0.302SS..Hα-helixtrans-61.4-36.4179.5-68.5173000112.3I55 V63 L97I55-L59 HydrophobicContact CG2-CD1 3.89Å; I55-L59 HydrophobicContact CG2-CG 4.35Å; I55-L59 WeakPolarHBondContact O-CG 3.35Å; I55-L59 PolarHBondContact O-N 3.34Å; L59-V63 WeakPolarHBondContact O-CG2 3.32Å; L59-V63 PolarHBondContact O-N 3.26Å; L59-V63 VanDerWaalsContact O-N 3.14Å; L59-L97 HydrophobicContact CD2-CD2 4.27Å
60C98.5Very high98.6Very high52 Ų5258.1 Ų58.135%0.35131%0.306SS..Hα-helixtrans-65.5-44.2175.3-169.80000111.2F26 L56 E57 Y58 L64F26-C60 HydrophobicContact CE1-CB 4.25Å; F26-C60 HydrophobicContact CZ-CB 3.81Å; L56-C60 VanDerWaalsContact O-CB 3.23Å; L56-C60 WeakPolarHBondContact O-CB 3.37Å; L56-C60 PolarHBondContact O-N 2.86Å; L56-C60 VanDerWaalsContact O-N 3.09Å; E57-C60 PolarHBondContact O-N 3.31Å; Y58-C60 VanDerWaalsContact C-N 3.27Å; Y58-C60 PolarHBondContact O-N 3.3Å; C60-L64 VanDerWaalsContact O-CB 3.32Å; C60-L64 WeakPolarHBondContact O-CB 3.37Å; C60-L64 WeakPolarHBondContact O-CG 3.42Å; C60-L64 PolarHBondContact O-N 3.02Å
61A98.5Very high98.6Very high54 Ų5455.9 Ų55.945%0.44629%0.293SS..Hα-helixtrans-61.6-44.8177.100000111.6E57 Y58 L64 E65E57-A61 WeakPolarHBondContact O-CB 3.38Å; E57-A61 PolarHBondContact O-N 2.95Å; Y58-A61 WeakPolarHBondContact O-CB 3.26Å; Y58-A61 PolarHBondContact O-N 2.86Å; Y58-A61 VanDerWaalsContact O-N 3.1Å; A61-L64 PolarHBondContact O-N 3.43Å; A61-E65 WeakPolarHBondContact O-CB 3.34Å; A61-E65 PolarHBondContact O-N 3.21Å
62E98.4Very high98.6Very high64 Ų6455.4 Ų55.430%0.29929%0.29SS..Hα-helixtrans-59.6-50.7179-163.563.6-134.700111.7Y58 L64 E65 L66Y58-E62 PolarHBondContact O-N 3.37Å; E62-L64 VanDerWaalsContact C-N 3.3Å; E62-L64 PolarHBondContact O-N 2.92Å; E62-E65 PolarHBondContact O-N 2.96Å; E62-L66 WeakPolarHBondContact O-CG 3.13Å; E62-L66 PolarHBondContact O-N 3.14Å; E62-L66 VanDerWaalsContact O-N 3.14Å
63V98.5Very high98.5Very high31 Ų3158.5 Ų58.519%0.18831%0.306CS..Hα-helixtrans-61.7-40.3177.71740000110.9L59 S67 I84 L94L59-V63 WeakPolarHBondContact O-CG2 3.32Å; L59-V63 PolarHBondContact O-N 3.26Å; L59-V63 VanDerWaalsContact O-N 3.14Å; V63-S67 WeakPolarHBondContact O-CB 3.37Å; V63-S67 PolarHBondContact O-N 3.45Å; V63-S67 PolarHBondContact O-OG 2.94Å; V63-I84 HydrophobicContact CG1-CG2 4.12Å; V63-L94 HydrophobicContact CG2-CD1 3.97Å; V63-L94 HydrophobicContact CG2-CD2 3.89Å
64L98.7Very high98.5Very high89 Ų8962 Ų6247%0.46633%0.326SS..Hα-helixtrans-69.4-37.8179.5-74.9172.9000113C60 A61 E62 G68 I79C60-L64 VanDerWaalsContact O-CB 3.32Å; C60-L64 WeakPolarHBondContact O-CB 3.37Å; C60-L64 WeakPolarHBondContact O-CG 3.42Å; C60-L64 PolarHBondContact O-N 3.02Å; A61-L64 PolarHBondContact O-N 3.43Å; E62-L64 VanDerWaalsContact C-N 3.3Å; E62-L64 PolarHBondContact O-N 2.92Å; L64-G68 PolarHBondContact O-N 3.29Å; L64-I79 HydrophobicContact CD2-CD1 4.1Å
65E98.6Very high98.4Very high113 Ų11369.6 Ų69.653%0.52835%0.351SS..Hα-helixtrans-61.9-54.6177.3-178.960.9-15400110.2A61 E62 S67 G68 N69A61-E65 WeakPolarHBondContact O-CB 3.34Å; A61-E65 PolarHBondContact O-N 3.21Å; E62-E65 PolarHBondContact O-N 2.96Å; E65-S67 VanDerWaalsContact C-N 3.35Å; E65-S67 PolarHBondContact O-N 3.31Å; E65-G68 PolarHBondContact O-N 3.36Å; E65-G68 VanDerWaalsContact O-N 3.12Å; E65-N69 PolarHBondContact O-N 3.3Å; E65-N69 PolarHBondContact O-ND2 2.99Å
66L98.6Very high98.4Very high45 Ų4572.8 Ų72.824%0.23636%0.363CS..Hα-helixtrans-63.7-39.7178.8-62179.2000112E62 G68 N69 A70 A87 D91 L94E62-L66 WeakPolarHBondContact O-CG 3.13Å; E62-L66 PolarHBondContact O-N 3.14Å; E62-L66 VanDerWaalsContact O-N 3.14Å; L66-G68 VanDerWaalsContact C-N 3.31Å; L66-G68 PolarHBondContact O-N 3.09Å; L66-N69 PolarHBondContact O-N 2.9Å; L66-A70 PolarHBondContact O-N 2.96Å; L66-A87 HydrophobicContact CB-CB 3.65Å; L66-D91 HydrophobicContact CD1-CB 4.01Å; L66-L94 HydrophobicContact CD1-CD1 3.73Å
67S98.8Very high98.4Very high0 Ų075.8 Ų75.80%039%0.39CS..Hα-helixtrans-66-34.3175.2-61.40000112.3V63 E65 A71 I84V63-S67 WeakPolarHBondContact O-CB 3.37Å; V63-S67 PolarHBondContact O-N 3.45Å; V63-S67 PolarHBondContact O-OG 2.94Å; E65-S67 VanDerWaalsContact C-N 3.35Å; E65-S67 PolarHBondContact O-N 3.31Å; S67-A71 WeakPolarHBondContact O-CB 3.47Å; S67-A71 PolarHBondContact O-N 3.35Å; S67-I84 WeakPolarHBondContact OG-CA 3.37Å
68G98.8Very high98.4Very high21 Ų2183.7 Ų83.722%0.21642%0.418CS..Hα-helixtrans-65.9-41.6174.300000111.7L64 E65 L66 A71 R72L64-G68 PolarHBondContact O-N 3.29Å; E65-G68 PolarHBondContact O-N 3.36Å; E65-G68 VanDerWaalsContact O-N 3.12Å; L66-G68 VanDerWaalsContact C-N 3.31Å; L66-G68 PolarHBondContact O-N 3.09Å; G68-A71 PolarHBondContact O-N 3.23Å; G68-R72 WeakPolarHBondContact O-CB 3.37Å; G68-R72 PolarHBondContact O-N 3.12Å
69N98.6Very high98.4Very high48 Ų4880.3 Ų80.326%0.25741%0.408SS..Hα-helixtrans-62.9-49.6173.5-66.2-25.1000111E65 L66 A71 R72 D73E65-N69 PolarHBondContact O-N 3.3Å; E65-N69 PolarHBondContact O-ND2 2.99Å; L66-N69 PolarHBondContact O-N 2.9Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 2.82Å; N69-R72 WeakPolarHBondContact O-CA 3.49Å; N69-R72 WeakPolarHBondContact O-CB 3.34Å; N69-R72 PolarHBondContact O-N 3.46Å; N69-R72 PolarHBondContact OD1-NH1 2.92Å; N69-D73 VanDerWaalsContact O-CG 3.27Å; N69-D73 PolarHBondContact O-N 3.14Å
70A98.3Very high98.4Very high11 Ų1179.4 Ų79.49%0.09141%0.409CS..Hα-helixtrans-59.6-35.9175.700000113.2L66 N74 H83 L86L66-A70 PolarHBondContact O-N 2.96Å; A70-N74 WeakPolarHBondContact O-CB 3.48Å; A70-N74 PolarHBondContact O-N 3.31Å; A70-N74 PolarHBondContact O-ND2 3.14Å; A70-H83 HydrophobicContact CB-CB 4.25Å; A70-L86 HydrophobicContact CB-CB 4.25Å
71A98.7Very high98.4Very high3 Ų379.1 Ų79.13%0.02541%0.407CS..Hα-helixtrans-65.7-43.6173.600000111.7S67 G68 N69 N74 K75 K76 I79 H83S67-A71 WeakPolarHBondContact O-CB 3.47Å; S67-A71 PolarHBondContact O-N 3.35Å; G68-A71 PolarHBondContact O-N 3.23Å; N69-A71 VanDerWaalsContact C-N 3.28Å; N69-A71 PolarHBondContact O-N 2.82Å; A71-N74 CarbonylContact O-C 3.49Å; A71-N74 PolarHBondContact O-N 2.83Å; A71-K75 PolarHBondContact O-N 3.35Å; A71-K76 CarbonylContact C-O 3.29Å; A71-K76 VanDerWaalsContact C-O 3.29Å; A71-K76 WeakPolarHBondContact O-CA 3.39Å; A71-K76 PolarHBondContact O-N 3.4Å; A71-I79 HydrophobicContact CB-CG1 4.3Å; A71-H83 HydrophobicContact CB-CB 4.34Å; A71-H83 WeakPolarHBondContact CB-ND1 3.46Å
72R98.4Very high98.4Very high163 Ų16380.1 Ų80.162%0.61540%0.399SS*.Hα-helixtrans-62.4-43.6177.9-171.2-175.3-63.61221.4111.5G68 N69 N74 K75G68-R72 WeakPolarHBondContact O-CB 3.37Å; G68-R72 PolarHBondContact O-N 3.12Å; N69-R72 WeakPolarHBondContact O-CA 3.49Å; N69-R72 WeakPolarHBondContact O-CB 3.34Å; N69-R72 PolarHBondContact O-N 3.46Å; N69-R72 PolarHBondContact OD1-NH1 2.92Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 2.79Å; R72-K75 WeakPolarHBondContact O-CA 3.46Å; R72-K75 PolarHBondContact O-N 3.29Å
73D97.4Very high98.4Very high124 Ų12477.6 Ų77.666%0.66339%0.387SS*.Hα-helixtrans-62.5-36.2177.8-63.7-19.7000111.4N69 K75N69-D73 VanDerWaalsContact O-CG 3.27Å; N69-D73 PolarHBondContact O-N 3.14Å; D73-K75 PolarHBondContact O-N 3.08Å
74N97.3Very high98.4Very high75 Ų7578.8 Ų78.840%0.40139%0.392SS..THydrogen-bonded Turntrans-78.39.5172.1-69.7-18.9000114A70 A71 R72 K76 H83A70-N74 WeakPolarHBondContact O-CB 3.48Å; A70-N74 PolarHBondContact O-N 3.31Å; A70-N74 PolarHBondContact O-ND2 3.14Å; A71-N74 CarbonylContact O-C 3.49Å; A71-N74 PolarHBondContact O-N 2.83Å; R72-N74 VanDerWaalsContact C-N 3.26Å; R72-N74 PolarHBondContact O-N 2.79Å; N74-K76 HydrophobicContact CB-CG 4.39Å; N74-K76 PolarHBondContact O-N 3.46Å; N74-H83 PolarHBondContact ND2-CD2 2.95Å; N74-H83 PolarHBondContact ND2-NE2 3.36Å
75K98.3Very high98.4Very high196 Ų19675.4 Ų75.485%0.85237%0.374SS*.THydrogen-bonded Turntrans56.736.9-179.3-52.6176.9-176.7177.80112.5A71 R72 D73A71-K75 PolarHBondContact O-N 3.35Å; R72-K75 WeakPolarHBondContact O-CA 3.46Å; R72-K75 PolarHBondContact O-N 3.29Å; D73-K75 PolarHBondContact O-N 3.08Å
76K98.3Very high98.4Very high133 Ų13371 Ų7158%0.57835%0.354SS*.  trans-117.3145.4176.3-58.4-62.2-179.8178.70110.3A71 N74A71-K76 CarbonylContact C-O 3.29Å; A71-K76 VanDerWaalsContact C-O 3.29Å; A71-K76 WeakPolarHBondContact O-CA 3.39Å; A71-K76 PolarHBondContact O-N 3.4Å; N74-K76 HydrophobicContact CB-CG 4.39Å; N74-K76 PolarHBondContact O-N 3.46Å
77S97.6Very high98.4Very high134 Ų13469.3 Ų69.394%0.93735%0.346SS*.SBendtrans-94.1-9.6174.1570000113.7
78R98.7Very high98.4Very high207 Ų20769.3 Ų69.378%0.78135%0.346SS*.SBendtrans-114.6128.8-178.5-176.6177.4-65.5149.61.6110.4H83R78-H83 PolarHBondContact O-CE1 2.92Å; R78-H83 PolarHBondContact O-ND1 3.49Å
79I98.8Very high98.4Very high65 Ų6570.4 Ų70.433%0.33334%0.343SS..  trans-67.2133.2170.7-62.3173.4000109L64 A71 H83 I84L64-I79 HydrophobicContact CD2-CD1 4.1Å; A71-I79 HydrophobicContact CB-CG1 4.3Å; I79-H83 HydrophobicContact CG2-CB 4.29Å; I79-I84 HydrophobicContact CG2-CD1 4.28Å; I79-I84 HydrophobicContact CG2-CG1 3.85Å
80A98.5Very high98.3Very high40 Ų4073.8 Ų73.833%0.33136%0.361SS..  trans-126.8164.7177.200000108.5R82 H83 I84A80-R82 PolarHBondContact O-N 3.39Å; A80-R82 VanDerWaalsContact O-N 3.11Å; A80-H83 PolarHBondContact N-ND1 3.4Å; A80-H83 VanDerWaalsContact N-ND1 3.13Å; A80-H83 WeakPolarHBondContact O-CB 3.32Å; A80-H83 PolarHBondContact O-N 2.99Å; A80-I84 PolarHBondContact O-N 3.1Å
81P98.8Very high98.3Very high46 Ų4675.5 Ų75.530%0.29937%0.369SS..Hα-helixtrans-54.7-34.5-179.1-27.135.5000113.7H83 I84 Q85 S104 E105P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 2.87Å; P81-I84 PolarHBondContact O-N 3.2Å; P81-Q85 PolarHBondContact O-N 3.07Å; P81-S104 WeakPolarHBondContact CB-O 3.45Å; P81-E105 HydrophobicContact CB-CB 3.95Å; P81-E105 HydrophobicContact CG-CB 4.12Å
82R98.6Very high98.3Very high74 Ų7483.1 Ų83.128%0.27940%0.404SS..Hα-helixtrans-54.8-44.1171.318056.5175.7178.20.8113A80 I84 Q85 L86 G106 V108A80-R82 PolarHBondContact O-N 3.39Å; A80-R82 VanDerWaalsContact O-N 3.11Å; R82-I84 VanDerWaalsContact C-N 3.35Å; R82-Q85 PolarHBondContact O-N 2.91Å; R82-L86 HydrophobicContact CG-CD1 4.26Å; R82-L86 HydrophobicContact CG-CG 4.48Å; R82-L86 VanDerWaalsContact O-CG 3.29Å; R82-L86 WeakPolarHBondContact O-CG 3.2Å; R82-L86 PolarHBondContact O-N 2.97Å; R82-G106 WeakPolarHBondContact CD-O 3.24Å; R82-G106 PolarHBondContact NH1-O 3.44Å; R82-V108 VanDerWaalsContact CZ-O 3.24Å; R82-V108 VanDerWaalsContact NH1-N 3.18Å; R82-V108 PolarHBondContact NH1-O 2.99Å; R82-V108 PolarHBondContact NH2-O 2.69Å
83H98.8Very high98.3Very high12 Ų1282.4 Ų82.46%0.05641%0.408CS..Hα-helixtrans-67.9-37.8-178.7-55.2143.7000111.5A70 A71 N74 R78 I79 A80 P81 L86 A87A70-H83 HydrophobicContact CB-CB 4.25Å; A71-H83 HydrophobicContact CB-CB 4.34Å; A71-H83 WeakPolarHBondContact CB-ND1 3.46Å; N74-H83 PolarHBondContact ND2-CD2 2.95Å; N74-H83 PolarHBondContact ND2-NE2 3.36Å; R78-H83 PolarHBondContact O-CE1 2.92Å; R78-H83 PolarHBondContact O-ND1 3.49Å; I79-H83 HydrophobicContact CG2-CB 4.29Å; A80-H83 PolarHBondContact N-ND1 3.4Å; A80-H83 VanDerWaalsContact N-ND1 3.13Å; A80-H83 WeakPolarHBondContact O-CB 3.32Å; A80-H83 PolarHBondContact O-N 2.99Å; P81-H83 VanDerWaalsContact C-N 3.32Å; P81-H83 PolarHBondContact O-N 2.87Å; H83-L86 PolarHBondContact O-N 2.97Å; H83-A87 WeakPolarHBondContact O-CB 3.41Å; H83-A87 PolarHBondContact O-N 3.33Å
84I98.8Very high98.3Very high55 Ų5576.9 Ų76.928%0.28238%0.378SS..Hα-helixtrans-64.4-44.5174.5-56.4172.3000110.3V63 S67 I79 A80 P81 R82 A87 V88 I103V63-I84 HydrophobicContact CG1-CG2 4.12Å; S67-I84 WeakPolarHBondContact OG-CA 3.37Å; I79-I84 HydrophobicContact CG2-CD1 4.28Å; I79-I84 HydrophobicContact CG2-CG1 3.85Å; A80-I84 PolarHBondContact O-N 3.1Å; P81-I84 PolarHBondContact O-N 3.2Å; R82-I84 VanDerWaalsContact C-N 3.35Å; I84-A87 PolarHBondContact O-N 2.88Å; I84-V88 HydrophobicContact CG2-CG2 4.24Å; I84-V88 WeakPolarHBondContact O-CB 3.26Å; I84-V88 VanDerWaalsContact O-CG2 3.3Å; I84-V88 WeakPolarHBondContact O-CG2 3.48Å; I84-V88 PolarHBondContact O-N 3.15Å; I84-I103 HydrophobicContact CG2-CD1 3.91Å
85Q98.6Very high98.3Very high18 Ų1876.2 Ų76.28%0.08438%0.375CS..Hα-helixtrans-62-44.7176.6-179.774.1300112.2P81 R82 R89 G106 G107P81-Q85 PolarHBondContact O-N 3.07Å; R82-Q85 PolarHBondContact O-N 2.91Å; Q85-R89 HydrophobicContact CG-CG 4.26Å; Q85-R89 WeakPolarHBondContact O-CB 3.33Å; Q85-R89 VanDerWaalsContact O-CG 3.25Å; Q85-R89 WeakPolarHBondContact O-CG 3.23Å; Q85-R89 PolarHBondContact O-N 3.1Å; Q85-G106 WeakPolarHBondContact CB-O 3.44Å; Q85-G106 WeakPolarHBondContact CG-O 3.49Å; Q85-G107 WeakPolarHBondContact CG-O 3.44Å; Q85-G107 PolarHBondContact NE2-O 3.31Å; Q85-G107 VanDerWaalsContact NE2-O 3.16Å
86L98.3Very high98.3Very high22 Ų2272 Ų7212%0.11537%0.366CS..Hα-helixtrans-61.6-46.3177.4-69.4177.9000111.2A70 R82 H83 N90 L109A70-L86 HydrophobicContact CB-CB 4.25Å; R82-L86 HydrophobicContact CG-CD1 4.26Å; R82-L86 HydrophobicContact CG-CG 4.48Å; R82-L86 VanDerWaalsContact O-CG 3.29Å; R82-L86 WeakPolarHBondContact O-CG 3.2Å; R82-L86 PolarHBondContact O-N 2.97Å; H83-L86 PolarHBondContact O-N 2.97Å; L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.42Å; L86-N90 PolarHBondContact O-N 3.01Å; L86-N90 VanDerWaalsContact O-N 3.07Å; L86-N90 PolarHBondContact O-ND2 3.19Å; L86-N90 VanDerWaalsContact O-ND2 3.16Å; L86-L109 HydrophobicContact CD2-CD2 3.66Å
87A98.3Very high98.3Very high8 Ų870.9 Ų70.97%0.06637%0.365CS..Hα-helixtrans-59.6-51.9177.600000112.1L66 H83 I84 R89 D91L66-A87 HydrophobicContact CB-CB 3.65Å; H83-A87 WeakPolarHBondContact O-CB 3.41Å; H83-A87 PolarHBondContact O-N 3.33Å; I84-A87 PolarHBondContact O-N 2.88Å; A87-R89 PolarHBondContact O-N 3.26Å; A87-D91 WeakPolarHBondContact O-CB 3.37Å; A87-D91 PolarHBondContact O-N 2.92Å
88V98.3Very high98.3Very high0 Ų066.6 Ų66.60%033%0.332CS..Hα-helixtrans-64.8-39-177.9167.90000112.2I84 L94 N95 L98 I103I84-V88 HydrophobicContact CG2-CG2 4.24Å; I84-V88 WeakPolarHBondContact O-CB 3.26Å; I84-V88 VanDerWaalsContact O-CG2 3.3Å; I84-V88 WeakPolarHBondContact O-CG2 3.48Å; I84-V88 PolarHBondContact O-N 3.15Å; V88-L94 HydrophobicContact CG1-CB 4.42Å; V88-N95 WeakPolarHBondContact O-CA 3.43Å; V88-N95 WeakPolarHBondContact O-CB 3.21Å; V88-N95 PolarHBondContact O-N 3.11Å; V88-N95 VanDerWaalsContact O-N 3.13Å; V88-L98 HydrophobicContact CB-CD1 4.42Å; V88-L98 HydrophobicContact CG1-CB 3.87Å; V88-L98 HydrophobicContact CG1-CD1 3.7Å; V88-L98 HydrophobicContact CG1-CG 4.35Å; V88-L98 HydrophobicContact CG2-CD1 3.76Å; V88-I103 HydrophobicContact CB-CD1 4.36Å; V88-I103 HydrophobicContact CG2-CD1 4.25Å
89R98.3Very high98.2Very high44 Ų4459.1 Ų59.117%0.16632%0.319CS..Hα-helixtrans-84-23.4-174.8-61.5-58.5173.9-160.5-4.8114Q85 A87 N95 L98 V101 L109Q85-R89 HydrophobicContact CG-CG 4.26Å; Q85-R89 WeakPolarHBondContact O-CB 3.33Å; Q85-R89 VanDerWaalsContact O-CG 3.25Å; Q85-R89 WeakPolarHBondContact O-CG 3.23Å; Q85-R89 PolarHBondContact O-N 3.1Å; A87-R89 PolarHBondContact O-N 3.26Å; R89-N95 WeakPolarHBondContact CD-OD1 3.43Å; R89-N95 PolarHBondContact NH1-OD1 3.3Å; R89-L98 PolarHBondContact NH1-O 3.45Å; R89-L98 VanDerWaalsContact NH1-O 3.1Å; R89-L98 PolarHBondContact NH2-O 2.96Å; R89-L98 VanDerWaalsContact NH2-O 3.08Å; R89-V101 PolarHBondContact NH2-O 2.92Å; R89-L109 HydrophobicContact CB-CD1 3.6Å; R89-L109 HydrophobicContact CB-CD2 4.05Å; R89-L109 HydrophobicContact CB-CG 3.66Å
90N97.4Very high98.2Very high119 Ų11961.1 Ų61.164%0.63635%0.345SS*.Hα-helixtrans-85.3-16174.5-74.7-34.4000113.2L86 L109L86-N90 VanDerWaalsContact O-CB 3.29Å; L86-N90 WeakPolarHBondContact O-CB 3.42Å; L86-N90 PolarHBondContact O-N 3.01Å; L86-N90 VanDerWaalsContact O-N 3.07Å; L86-N90 PolarHBondContact O-ND2 3.19Å; L86-N90 VanDerWaalsContact O-ND2 3.16Å; N90-L109 WeakPolarHBondContact OD1-CD1 3.44Å; N90-L109 WeakPolarHBondContact OD1-CD2 3.31Å
91D98.3Very high98.2Very high47 Ų4762.5 Ų62.525%0.25135%0.35SS..SBendtrans-95.9127.3175.4-178.9-97000111.2L66 A87 E93 L94 N95L66-D91 HydrophobicContact CD1-CB 4.01Å; A87-D91 WeakPolarHBondContact O-CB 3.37Å; A87-D91 PolarHBondContact O-N 2.92Å; D91-E93 PolarHBondContact OD1-N 3.46Å; D91-L94 HydrophobicContact CB-CB 4.13Å; D91-L94 HydrophobicContact CB-CD1 4.19Å; D91-L94 HydrophobicContact CB-CG 4.36Å; D91-L94 WeakPolarHBondContact OD1-CB 3.42Å; D91-L94 VanDerWaalsContact OD1-CG 3.26Å; D91-L94 WeakPolarHBondContact OD1-CG 3.39Å; D91-L94 PolarHBondContact OD1-N 2.96Å; D91-N95 WeakPolarHBondContact O-CB 3.49Å; D91-N95 PolarHBondContact O-N 3.48Å
92E97.9Very high98.2Very high163 Ų16366.3 Ų66.376%0.76237%0.372SS*.Hα-helixtrans-65.6-43.1-173.5-174.3179.3176.200112.5T96E92-T96 WeakPolarHBondContact O-CB 3.47Å; E92-T96 PolarHBondContact O-N 3.02Å; E92-T96 PolarHBondContact O-OG1 3.5Å
93E98.2Very high98.1Very high149 Ų14964.4 Ų64.470%0.69637%0.367SS*.Hα-helixtrans-71.1-45.6-176-60.8-169.2146.900110.9D91 T96 L97D91-E93 PolarHBondContact OD1-N 3.46Å; E93-T96 PolarHBondContact O-N 3.2Å; E93-L97 WeakPolarHBondContact O-CB 3.49Å; E93-L97 PolarHBondContact O-N 2.98Å
94L98.2Very high98.1Very high7 Ų768.4 Ų68.44%0.03740%0.396CS..Hα-helixtrans-68.1-38.5176.1-67.7178.3000112V63 L66 V88 D91 T96 L97 L98V63-L94 HydrophobicContact CG2-CD1 3.97Å; V63-L94 HydrophobicContact CG2-CD2 3.89Å; L66-L94 HydrophobicContact CD1-CD1 3.73Å; V88-L94 HydrophobicContact CG1-CB 4.42Å; D91-L94 HydrophobicContact CB-CB 4.13Å; D91-L94 HydrophobicContact CB-CD1 4.19Å; D91-L94 HydrophobicContact CB-CG 4.36Å; D91-L94 WeakPolarHBondContact OD1-CB 3.42Å; D91-L94 VanDerWaalsContact OD1-CG 3.26Å; D91-L94 WeakPolarHBondContact OD1-CG 3.39Å; D91-L94 PolarHBondContact OD1-N 2.96Å; L94-T96 VanDerWaalsContact C-N 3.28Å; L94-T96 PolarHBondContact O-N 3.48Å; L94-L97 PolarHBondContact O-N 3.23Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.43Å; L94-L98 PolarHBondContact O-N 3.21Å
95N97.9Very high98.1Very high61 Ų6173.7 Ų73.733%0.32642%0.42SS..Hα-helixtrans-63.8-38.3176.2-17547.3000110.9V88 R89 D91 L98 G99V88-N95 WeakPolarHBondContact O-CA 3.43Å; V88-N95 WeakPolarHBondContact O-CB 3.21Å; V88-N95 PolarHBondContact O-N 3.11Å; V88-N95 VanDerWaalsContact O-N 3.13Å; R89-N95 WeakPolarHBondContact CD-OD1 3.43Å; R89-N95 PolarHBondContact NH1-OD1 3.3Å; D91-N95 WeakPolarHBondContact O-CB 3.49Å; D91-N95 PolarHBondContact O-N 3.48Å; N95-L98 CarbonylContact O-C 3.49Å; N95-G99 WeakPolarHBondContact O-CA 3.48Å; N95-G99 PolarHBondContact O-N 3.4Å
96T98.3Very high98.1Very high108 Ų10872.9 Ų72.966%0.66342%0.416SS*.Hα-helixtrans-66.5-50174.2-60.40000110.9E92 E93 L94 L98 G99E92-T96 WeakPolarHBondContact O-CB 3.47Å; E92-T96 PolarHBondContact O-N 3.02Å; E92-T96 PolarHBondContact O-OG1 3.5Å; E93-T96 PolarHBondContact O-N 3.2Å; L94-T96 VanDerWaalsContact C-N 3.28Å; L94-T96 PolarHBondContact O-N 3.48Å; T96-L98 VanDerWaalsContact C-N 3.26Å; T96-L98 PolarHBondContact O-N 3.26Å; T96-G99 PolarHBondContact O-N 2.76Å
97L98Very high98.1Very high109 Ų10974.2 Ų74.257%0.57144%0.435SS*.Hα-helixtrans-59.9-36.2179.5-178.961.6000112.4L59 E93 L94L59-L97 HydrophobicContact CD2-CD2 4.27Å; E93-L97 WeakPolarHBondContact O-CB 3.49Å; E93-L97 PolarHBondContact O-N 2.98Å; L94-L97 PolarHBondContact O-N 3.23Å
98L97.9Very high98Very high45 Ų4579.2 Ų79.224%0.23647%0.465CS..THydrogen-bonded Turntrans-111.525.1-175.4-57.3177.4000112.7V88 R89 L94 N95 T96 A100 V101V88-L98 HydrophobicContact CB-CD1 4.42Å; V88-L98 HydrophobicContact CG1-CB 3.87Å; V88-L98 HydrophobicContact CG1-CD1 3.7Å; V88-L98 HydrophobicContact CG1-CG 4.35Å; V88-L98 HydrophobicContact CG2-CD1 3.76Å; R89-L98 PolarHBondContact NH1-O 3.45Å; R89-L98 VanDerWaalsContact NH1-O 3.1Å; R89-L98 PolarHBondContact NH2-O 2.96Å; R89-L98 VanDerWaalsContact NH2-O 3.08Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.43Å; L94-L98 PolarHBondContact O-N 3.21Å; N95-L98 CarbonylContact O-C 3.49Å; T96-L98 VanDerWaalsContact C-N 3.26Å; T96-L98 PolarHBondContact O-N 3.26Å; L98-A100 VanDerWaalsContact C-N 3.28Å; L98-A100 PolarHBondContact O-N 2.81Å; L98-V101 HydrophobicContact CB-CB 4.21Å; L98-V101 HydrophobicContact CB-CG2 4.35Å; L98-V101 HydrophobicContact CD2-CB 4.45Å; L98-V101 HydrophobicContact CD2-CG2 3.96Å; L98-V101 PolarHBondContact O-N 3.15Å; L98-V101 VanDerWaalsContact O-N 3.09Å
99G96.9Very high97.9Very high50 Ų5081.9 Ų81.952%0.51548%0.479SS..THydrogen-bonded Turntrans-57.7-39.1-175.500000113.4N95 T96N95-G99 WeakPolarHBondContact O-CA 3.48Å; N95-G99 PolarHBondContact O-N 3.4Å; T96-G99 PolarHBondContact O-N 2.76Å
100A97.9Very high97.8Very high106 Ų10684.2 Ų84.288%0.87650%0.5SS*.THydrogen-bonded Turntrans-95.26.1179.900000114.3L98L98-A100 VanDerWaalsContact C-N 3.28Å; L98-A100 PolarHBondContact O-N 2.81Å
101V98.3Very high97.6Very high70 Ų7083.8 Ų83.842%0.42450%0.497SS..  trans-95.2128.6-177177.60000110.4R89 L98R89-V101 PolarHBondContact NH2-O 2.92Å; L98-V101 HydrophobicContact CB-CB 4.21Å; L98-V101 HydrophobicContact CB-CG2 4.35Å; L98-V101 HydrophobicContact CD2-CB 4.45Å; L98-V101 HydrophobicContact CD2-CG2 3.96Å; L98-V101 PolarHBondContact O-N 3.15Å; L98-V101 VanDerWaalsContact O-N 3.09Å
102T98.4Very high97.5Very high126 Ų12685.9 Ų85.977%0.77351%0.507SS*.  trans-91.1124.4170-550000110.3
103I98.1Very high97.3Very high34 Ų3483.8 Ų83.817%0.17450%0.498CS..  trans-95.1108.2173.1-52.5-173.6000108.1I84 V88 E105 G106I84-I103 HydrophobicContact CG2-CD1 3.91Å; V88-I103 HydrophobicContact CB-CD1 4.36Å; V88-I103 HydrophobicContact CG2-CD1 4.25Å; I103-E105 PolarHBondContact O-N 3.19Å; I103-G106 PolarHBondContact O-N 3.48Å; I103-G106 VanDerWaalsContact O-N 3.1Å
104S98.4Very high97.1Very high95 Ų9580.4 Ų80.466%0.66450%0.496SS*.THydrogen-bonded Turntrans-54.4136.3176.2-59.30000110.8P81 G106P81-S104 WeakPolarHBondContact CB-O 3.45Å; S104-G106 PolarHBondContact O-N 2.99Å; S104-G106 VanDerWaalsContact O-N 3.13Å
105E98.4Very high97Very high167 Ų16788.6 Ų88.678%0.7854%0.536SS*.THydrogen-bonded Turntrans6114.2-178.2-50.9-176.4147.500115.1P81 I103P81-E105 HydrophobicContact CB-CB 3.95Å; P81-E105 HydrophobicContact CG-CB 4.12Å; I103-E105 PolarHBondContact O-N 3.19Å
106G97.8Very high96.8Very high1 Ų192.1 Ų92.11%0.0155%0.554CS.*  trans-77.9-28.6179.900000115R82 Q85 I103 S104R82-G106 WeakPolarHBondContact CD-O 3.24Å; R82-G106 PolarHBondContact NH1-O 3.44Å; Q85-G106 WeakPolarHBondContact CB-O 3.44Å; Q85-G106 WeakPolarHBondContact CG-O 3.49Å; I103-G106 PolarHBondContact O-N 3.48Å; I103-G106 VanDerWaalsContact O-N 3.1Å; S104-G106 PolarHBondContact O-N 2.99Å; S104-G106 VanDerWaalsContact O-N 3.13Å
107G97.8Very high96.5Very high50 Ų5090.8 Ų90.852%0.51554%0.542SS..  trans63.6-155.4-168.300000112.5Q85Q85-G107 WeakPolarHBondContact CG-O 3.44Å; Q85-G107 PolarHBondContact NE2-O 3.31Å; Q85-G107 VanDerWaalsContact NE2-O 3.16Å
108V97.6Very high96.3Very high113 Ų11391.1 Ų91.169%0.68555%0.551SS**  trans-127159.4-180-62.40000111.8R82R82-V108 VanDerWaalsContact CZ-O 3.24Å; R82-V108 VanDerWaalsContact NH1-N 3.18Å; R82-V108 PolarHBondContact NH1-O 2.99Å; R82-V108 PolarHBondContact NH2-O 2.69Å
109L96.1Very high95.6Very high56 Ų5698.4 Ų98.429%0.29358%0.581SS.*  trans-59.1133.6169.8-70.5-179.7000109.2L86 R89 N90 N111L86-L109 HydrophobicContact CD2-CD2 3.66Å; R89-L109 HydrophobicContact CB-CD1 3.6Å; R89-L109 HydrophobicContact CB-CD2 4.05Å; R89-L109 HydrophobicContact CB-CG 3.66Å; N90-L109 WeakPolarHBondContact OD1-CD1 3.44Å; N90-L109 WeakPolarHBondContact OD1-CD2 3.31Å; L109-N111 PolarHBondContact O-N 3.36Å
110P94.9Very high94.7Very high93 Ų93105.9 Ų105.960%0.60460%0.599SS**  trans-59.2120.2170.6-18.932.7000108.8
111N94.3Very high93Very high110 Ų110106.9 Ų106.959%0.58860%0.595SS**  trans-154.6126.4175.2-179.218.7000108.6L109L109-N111 PolarHBondContact O-N 3.36Å
112I95.6Very high91.2Very high90 Ų90113.6 Ų113.646%0.46262%0.618SS.*  trans-119.1118.9175.3-58.8176.7000107.4A114 L116 L117I112-A114 PolarHBondContact O-N 3.05Å; I112-L116 HydrophobicContact CG2-CB 3.93Å; I112-L117 HydrophobicContact CB-CD2 4.39Å; I112-L117 HydrophobicContact CG2-CD2 3.9Å; I112-L117 HydrophobicContact CG2-CG 4.43Å
113Q95.2Very high89.3Confident119 Ų119115 Ų11556%0.55662%0.62SS**  trans-57132.7176-64.9-63.9-32.400110.1M115 L116Q113-M115 PolarHBondContact O-N 2.99Å; Q113-L116 HydrophobicContact CB-CD1 4.22Å; Q113-L116 HydrophobicContact CB-CG 4.29Å; Q113-L116 WeakPolarHBondContact O-CB 3.31Å; Q113-L116 PolarHBondContact O-N 3.25Å
114A93.8Very high86.9Confident79 Ų79119.1 Ų119.165%0.65365%0.649SS**G310 helixtrans-54.3-30.6-172.400000114I112 L116 L117I112-A114 PolarHBondContact O-N 3.05Å; A114-L116 PolarHBondContact O-N 3.49Å; A114-L117 WeakPolarHBondContact O-CB 3.48Å; A114-L117 PolarHBondContact O-N 3.01Å
115M94.9Very high84.4Confident179 Ų179123.7 Ų123.788%0.88266%0.657SS**G310 helixtrans-65.1-21.9176.6-63-167.3-64.400114.1Q113Q113-M115 PolarHBondContact O-N 2.99Å
116L94.5Very high81.9Confident134 Ų134123.2 Ų123.270%0.70266%0.66SS**G310 helixtrans-88-9.2179-56.9178000112.4I112 Q113 A114I112-L116 HydrophobicContact CG2-CB 3.93Å; Q113-L116 HydrophobicContact CB-CD1 4.22Å; Q113-L116 HydrophobicContact CB-CG 4.29Å; Q113-L116 WeakPolarHBondContact O-CB 3.31Å; Q113-L116 PolarHBondContact O-N 3.25Å; A114-L116 PolarHBondContact O-N 3.49Å
117L92.4Very high79.5Confident81 Ų81130.7 Ų130.742%0.42470%0.699SS.*SBendtrans-72.4142.7178.4-64.1175.4000110.3I112 A114 K119I112-L117 HydrophobicContact CB-CD2 4.39Å; I112-L117 HydrophobicContact CG2-CD2 3.9Å; I112-L117 HydrophobicContact CG2-CG 4.43Å; A114-L117 WeakPolarHBondContact O-CB 3.48Å; A114-L117 PolarHBondContact O-N 3.01Å; L117-K119 PolarHBondContact O-N 3.35Å
118P92.2Very high77.3Confident116 Ų116131 Ų13175%0.75370%0.703SS**PPolyproline II helixtrans-54.3133.2172.6-23.132.5000110.4K120P118-K120 PolarHBondContact O-N 3.37Å; P118-K120 VanDerWaalsContact O-N 3.16Å
119K84.8Confident74.7Confident198 Ų198131.3 Ų131.386%0.86171%0.71SS**PPolyproline II helixtrans-59.5123.7170.3-69.7-175.7179.21800107.5L117 T121L117-K119 PolarHBondContact O-N 3.35Å; K119-T121 VanDerWaalsContact C-N 3.32Å; K119-T121 PolarHBondContact O-N 3.03Å
120K76.9Confident72.4Confident206 Ų206136.9 Ų136.990%0.89674%0.74SS**  trans-6094.8172.9-71.8-173.7179.2-177.70108.8P118 K122P118-K120 PolarHBondContact O-N 3.37Å; P118-K120 VanDerWaalsContact O-N 3.16Å; K120-K122 PolarHBondContact O-N 3.33Å
121T63.4Low69.8Low128 Ų128136.7 Ų136.779%0.78575%0.746SS**  trans-70.6120.516114.20000106.5K119 L123K119-T121 VanDerWaalsContact C-N 3.32Å; K119-T121 PolarHBondContact O-N 3.03Å; T121-L123 PolarHBondContact O-N 3.05Å
122K60.1Low67.3Low210 Ų210138.6 Ų138.691%0.91376%0.757SS**  trans-57.7108.3172.8-75.3179.9176.7178.40107.6K120K120-K122 PolarHBondContact O-N 3.33Å
123L58.3Low64.7Low156 Ų156142 Ų14282%0.81778%0.775SS**  trans-59.9141.2164.1-78.8155.8000107.6T121 K125T121-L123 PolarHBondContact O-N 3.05Å; L123-K125 PolarHBondContact O-N 3.33Å
124P48.6Very low62.3Low120 Ų120142.5 Ų142.578%0.77979%0.787SS**  trans-54.6130.5173.8-18.630000108.8D126P124-D126 PolarHBondContact O-N 3.09Å; P124-D126 VanDerWaalsContact O-N 3.13Å
125K45.4Very low59.6Low192 Ų192147 Ų14784%0.83579%0.794SS**  trans-61.4114.7171.2-85.2-179.3164-175.60107.7L123L123-K125 PolarHBondContact O-N 3.33Å
126D45.2Very low57.2Low157 Ų157143 Ų14384%0.8478%0.784SS**  trans-91.5115.4161.8-15714000107P124 G128P124-D126 PolarHBondContact O-N 3.09Å; P124-D126 VanDerWaalsContact O-N 3.13Å; D126-G128 PolarHBondContact O-N 3.07Å
127D48.8Very low54.5Low158 Ų158144.7 Ų144.785%0.84579%0.788SS**SBendtrans-7665-173.9-85.7-23.5000111.3
128G50.3Low52Low57 Ų57150 Ų15059%0.58881%0.811SS**  trans168.888.8171.600000115.5D126D126-G128 PolarHBondContact O-N 3.07Å
129S42.4Very low49.9Very low119 Ų119154.1 Ų154.183%0.83282%0.817SS**  trans166141.5132.246.10000111.1A131S129-A131 PolarHBondContact O-N 2.88Å
130N48.4Very low48.2Very low172 Ų172152 Ų15292%0.9282%0.815SS**  trans-51.295.1175.5-78.5-28.7000112
131A41.7Very low46.6Very low90 Ų90149.1 Ų149.174%0.74481%0.811SS**  trans-93.9109.5161.100000107.3S129 D133S129-A131 PolarHBondContact O-N 2.88Å; A131-D133 PolarHBondContact O-N 3.41Å; A131-D133 VanDerWaalsContact O-N 3.15Å
132N41.7Very low45.7Very low150 Ų150150.3 Ų150.380%0.80281%0.812SS**  trans-48123165.3-74.6-45.1000108V134N132-V134 PolarHBondContact O-N 3.36Å
133D40.2Very low44.9Very low160 Ų160146.8 Ų146.886%0.85681%0.806SS**  trans-55.192.8167.4-104.2-30.7000107.3A131 Q135A131-D133 PolarHBondContact O-N 3.41Å; A131-D133 VanDerWaalsContact O-N 3.15Å; D133-Q135 PolarHBondContact O-N 3.02Å
134V44Very low44Very low131 Ų131146.2 Ų146.279%0.79481%0.806SS**  trans-70.290.7160.3-173.40000103N132 S136N132-V134 PolarHBondContact O-N 3.36Å; V134-S136 VanDerWaalsContact C-N 3.34Å; V134-S136 PolarHBondContact O-N 2.65Å
135Q38.8Very low43.7Very low172 Ų172147.9 Ų147.980%0.80481%0.808SS**  trans-40.2108.2165.4-93.7174.2-31.900106.2D133 Q137D133-Q135 PolarHBondContact O-N 3.02Å; Q135-Q137 VanDerWaalsContact C-N 3.3Å; Q135-Q137 PolarHBondContact O-N 3.12Å
136S44.1Very low43.6Very low97 Ų97144.8 Ų144.868%0.67881%0.806SS**  trans-50.4107.3165.442.90000104.8V134 E138V134-S136 VanDerWaalsContact C-N 3.34Å; V134-S136 PolarHBondContact O-N 2.65Å; S136-E138 PolarHBondContact O-N 3.46Å
137Q38.3Very low43.5Very low169 Ų169143.8 Ų143.879%0.7980%0.803SS**  trans-51.4115.8166.4-73.6-173.4-22.100104.8Q135 F139Q135-Q137 VanDerWaalsContact C-N 3.3Å; Q135-Q137 PolarHBondContact O-N 3.12Å; Q137-F139 PolarHBondContact O-N 2.74Å
138E37.9Very low43Very low191 Ų191142.7 Ų142.789%0.89380%0.8SS**  trans-52.5116.5168.2-66.5-176.5151.900105.3S136S136-E138 PolarHBondContact O-N 3.46Å
139F48.9Very low42.4Very low204 Ų204150.5 Ų150.590%0.89582%0.819SS**  trans-71.80177.1-72.4-82.2000109.5Q137Q137-F139 PolarHBondContact O-N 2.74Å

Retrieved 139 of 139 residues in 47.1 ms (Link to these results)