A0A077YXE8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YXE8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 289 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
1M43.2Very low62.4Low224 Ų224115.5 Ų115.5100%1.10360%0.603SS**  0880-71.7-77.2-159.900107.1K3M1-K3 PolarHBondContact O-N 3.34Å
2N50.7Low62.4Low171 Ų171109.9 Ų109.991%0.91458%0.575SS**  trans-85.392.1178.9-66.4-5.8000107.5
3K70.8Confident62.9Low189 Ų189108 Ų10882%0.82256%0.561SS**PPolyproline II helixtrans-77.7135.5170.1-68.2-174.5178.2-1790107.9M1M1-K3 PolarHBondContact O-N 3.34Å
4E69.3Low63Low174 Ų174108.1 Ų108.181%0.81356%0.557SS**PPolyproline II helixtrans-59.4138.5170.1-71.8-175.9159.500109.3T6E4-T6 PolarHBondContact O-N 3.17Å
5P65Low62.8Low80 Ų80102.5 Ų102.552%0.51953%0.529SS..PPolyproline II helixtrans-63.2122.2177.725.5-32.2000109.1D9 K10P5-D9 WeakPolarHBondContact CA-OD2 3.42Å; P5-D9 HydrophobicContact CB-CB 3.74Å; P5-K10 HydrophobicContact CB-CG 4.42Å
6T66.3Low62.9Low75 Ų75107 Ų10746%0.4654%0.537SS..PPolyproline II helixtrans-62.7164171.762.90000110.2E4 V8 D9 K10E4-T6 PolarHBondContact O-N 3.17Å; T6-V8 PolarHBondContact O-N 3.01Å; T6-V8 VanDerWaalsContact O-N 3.13Å; T6-D9 WeakPolarHBondContact CB-OD2 3.43Å; T6-D9 PolarHBondContact N-OD2 3.1Å; T6-D9 WeakPolarHBondContact O-CB 3.29Å; T6-D9 PolarHBondContact O-N 2.96Å; T6-D9 PolarHBondContact OG1-N 3.34Å; T6-D9 PolarHBondContact OG1-OD2 3.36Å; T6-K10 PolarHBondContact O-N 2.84Å; T6-K10 VanDerWaalsContact O-N 3.07Å
7S66.7Low62.9Low100 Ų100108.7 Ų108.770%0.69954%0.543SS*.Hα-helixtrans-55.7-29173.253.20000112.3A11S7-A11 PolarHBondContact O-N 2.92Å; S7-A11 VanDerWaalsContact O-N 3.14Å
8V59.5Low62.4Low49 Ų49105.2 Ų105.230%0.29752%0.524SS..Hα-helixtrans-69.5-46174.6179.20000110.7T6 K10 A11 L12 I39T6-V8 PolarHBondContact O-N 3.01Å; T6-V8 VanDerWaalsContact O-N 3.13Å; V8-K10 VanDerWaalsContact C-N 3.25Å; V8-K10 PolarHBondContact O-N 3.31Å; V8-A11 PolarHBondContact O-N 3.11Å; V8-A11 VanDerWaalsContact O-N 3.1Å; V8-L12 HydrophobicContact CG1-CD1 4.08Å; V8-L12 HydrophobicContact CG1-CG 4.39Å; V8-L12 WeakPolarHBondContact O-CG 3.26Å; V8-L12 PolarHBondContact O-N 2.62Å; V8-I39 HydrophobicContact CG1-CD1 3.92Å; V8-I39 HydrophobicContact CG1-CG1 4.11Å; V8-I39 HydrophobicContact CG2-CG1 4.45Å
9D64.5Low61.9Low74 Ų74102.4 Ų102.440%0.39651%0.514SS..Hα-helixtrans-59.5-38.7177.2-61.1-45.1000111.7P5 T6 L12 E13P5-D9 WeakPolarHBondContact CA-OD2 3.42Å; P5-D9 HydrophobicContact CB-CB 3.74Å; T6-D9 WeakPolarHBondContact CB-OD2 3.43Å; T6-D9 PolarHBondContact N-OD2 3.1Å; T6-D9 WeakPolarHBondContact O-CB 3.29Å; T6-D9 PolarHBondContact O-N 2.96Å; T6-D9 PolarHBondContact OG1-N 3.34Å; T6-D9 PolarHBondContact OG1-OD2 3.36Å; D9-L12 PolarHBondContact O-N 3.14Å; D9-E13 WeakPolarHBondContact O-CB 3.3Å; D9-E13 PolarHBondContact O-N 3.26Å
10K69.4Low61.4Low126 Ų126100.5 Ų100.555%0.54850%0.504SS..Hα-helixtrans-65-43.6174.8-66.6-179.3-176.8179.30112.1P5 T6 V8 E13 E14P5-K10 HydrophobicContact CB-CG 4.42Å; T6-K10 PolarHBondContact O-N 2.84Å; T6-K10 VanDerWaalsContact O-N 3.07Å; V8-K10 VanDerWaalsContact C-N 3.25Å; V8-K10 PolarHBondContact O-N 3.31Å; K10-E13 PolarHBondContact O-N 3.19Å; K10-E14 WeakPolarHBondContact O-CG 3.49Å; K10-E14 PolarHBondContact O-N 3.31Å
11A61.1Low60.6Low8 Ų8101.9 Ų101.97%0.06651%0.514CS..Hα-helixtrans-66-37.1178.100000112.5S7 V8 L15 A35S7-A11 PolarHBondContact O-N 2.92Å; S7-A11 VanDerWaalsContact O-N 3.14Å; V8-A11 PolarHBondContact O-N 3.11Å; V8-A11 VanDerWaalsContact O-N 3.1Å; A11-L15 WeakPolarHBondContact O-CB 3.44Å; A11-L15 WeakPolarHBondContact O-CG 3.43Å; A11-L15 PolarHBondContact O-N 3.22Å; A11-A35 HydrophobicContact CB-CB 3.88Å
12L61.8Low60.9Low49 Ų4995.9 Ų95.926%0.25748%0.483SS..Hα-helixtrans-67.9-39.6175.2-71.3174.4000111.9V8 D9 L15 R16V8-L12 HydrophobicContact CG1-CD1 4.08Å; V8-L12 HydrophobicContact CG1-CG 4.39Å; V8-L12 WeakPolarHBondContact O-CG 3.26Å; V8-L12 PolarHBondContact O-N 2.62Å; D9-L12 PolarHBondContact O-N 3.14Å; L12-L15 PolarHBondContact O-N 3.33Å; L12-R16 WeakPolarHBondContact O-CB 3.47Å; L12-R16 PolarHBondContact O-N 3.1Å
13E68.7Low60.8Low85 Ų8588.3 Ų88.340%0.39744%0.443SS..Hα-helixtrans-68.6-38.3176.2-168.358.6-148.200111.6D9 K10 R16 Q17D9-E13 WeakPolarHBondContact O-CB 3.3Å; D9-E13 PolarHBondContact O-N 3.26Å; K10-E13 PolarHBondContact O-N 3.19Å; E13-R16 WeakPolarHBondContact O-CB 3.47Å; E13-R16 PolarHBondContact O-N 3.48Å; E13-Q17 WeakPolarHBondContact O-CG 3.43Å; E13-Q17 PolarHBondContact O-N 2.96Å; E13-Q17 PolarHBondContact OE1-NE2 3.31Å
14E65.2Low59.7Low109 Ų10987.4 Ų87.451%0.50943%0.434SS..Hα-helixtrans-62.6-41.9171.3-76.5179.8-163.900112K10 R16 Q17 F18 L32K10-E14 WeakPolarHBondContact O-CG 3.49Å; K10-E14 PolarHBondContact O-N 3.31Å; E14-R16 VanDerWaalsContact C-N 3.3Å; E14-R16 PolarHBondContact O-N 2.94Å; E14-Q17 PolarHBondContact O-N 2.91Å; E14-F18 PolarHBondContact O-N 3.46Å; E14-L32 HydrophobicContact CB-CD1 4.38Å
15L59.4Low58.9Low25 Ų2587.4 Ų87.413%0.13143%0.431CS..Hα-helixtrans-63-36.6174.2-84.7165.7000112.9A11 L12 Q17 F18 L32 I36A11-L15 WeakPolarHBondContact O-CB 3.44Å; A11-L15 WeakPolarHBondContact O-CG 3.43Å; A11-L15 PolarHBondContact O-N 3.22Å; L12-L15 PolarHBondContact O-N 3.33Å; L15-Q17 VanDerWaalsContact C-N 3.31Å; L15-F18 PolarHBondContact O-N 2.89Å; L15-L32 HydrophobicContact CD2-CD1 4.46Å; L15-L32 HydrophobicContact CD2-CD2 3.99Å; L15-L32 HydrophobicContact CD2-CG 4.31Å; L15-L32 HydrophobicContact CG-CD1 3.98Å; L15-L32 HydrophobicContact CG-CD2 4.33Å; L15-L32 HydrophobicContact CG-CG 4.37Å; L15-I36 HydrophobicContact CD1-CD1 4.14Å; L15-I36 HydrophobicContact CD1-CG1 3.91Å; L15-I36 HydrophobicContact CD2-CD1 4Å
16R64.2Low58.3Low174 Ų17489.6 Ų89.666%0.65744%0.435SS*.Hα-helixtrans-66-37.9177.3-170.3-178.6-173.61713.4111.7L12 E13 E14L12-R16 WeakPolarHBondContact O-CB 3.47Å; L12-R16 PolarHBondContact O-N 3.1Å; E13-R16 WeakPolarHBondContact O-CB 3.47Å; E13-R16 PolarHBondContact O-N 3.48Å; E14-R16 VanDerWaalsContact C-N 3.3Å; E14-R16 PolarHBondContact O-N 2.94Å
17Q63.3Low57.9Low136 Ų13689.9 Ų89.964%0.63644%0.438SS*.Hα-helixtrans-80-18.9178.7-67.6176.821.200112.8E13 E14 L15 P19E13-Q17 WeakPolarHBondContact O-CG 3.43Å; E13-Q17 PolarHBondContact O-N 2.96Å; E13-Q17 PolarHBondContact OE1-NE2 3.31Å; E14-Q17 PolarHBondContact O-N 2.91Å; L15-Q17 VanDerWaalsContact C-N 3.31Å; Q17-P19 VanDerWaalsContact O-CD 3.26Å; Q17-P19 WeakPolarHBondContact O-CD 3.21Å
18F53.5Low57.5Low46 Ų4686.7 Ų86.720%0.20241%0.413CS..SBendtrans-63.4117.1-179.9-155.6-89.9000110.8E14 L15 I20 E22 V23 L28 R73E14-F18 PolarHBondContact O-N 3.46Å; L15-F18 PolarHBondContact O-N 2.89Å; F18-I20 PolarHBondContact O-N 3.07Å; F18-E22 HydrophobicContact CE1-CB 4.37Å; F18-V23 HydrophobicContact CD1-CG2 3.52Å; F18-V23 HydrophobicContact CE1-CB 4.23Å; F18-V23 HydrophobicContact CE1-CG2 3.42Å; F18-V23 VanDerWaalsContact CE1-CG2 3.42Å; F18-L28 HydrophobicContact CD1-CD2 4.28Å; F18-L28 HydrophobicContact CE1-CD2 4.03Å; F18-L28 HydrophobicContact CE2-CD2 4.29Å; F18-L28 HydrophobicContact CZ-CD2 4.03Å; F18-R73 PolarHBondContact O-NH1 3.13Å; F18-R73 VanDerWaalsContact O-NH1 3.07Å
19P54.2Low57.8Low51 Ų5187.1 Ų87.133%0.33142%0.418SS..  trans-67.8120.2178.124.9-30000109.2Q17 D21 E22Q17-P19 VanDerWaalsContact O-CD 3.26Å; Q17-P19 WeakPolarHBondContact O-CD 3.21Å; P19-D21 PolarHBondContact O-N 3.14Å; P19-E22 HydrophobicContact CB-CG 4.22Å; P19-E22 HydrophobicContact CG-CB 3.88Å; P19-E22 HydrophobicContact CG-CG 3.56Å; P19-E22 WeakPolarHBondContact CG-OE2 3.41Å; P19-E22 PolarHBondContact O-N 3.21Å
20I51.5Low57.7Low64 Ų6486.2 Ų86.233%0.32842%0.421SS..Hα-helixtrans-54.8-31.6179.8-63.4160.3000110.5F18 E22 V23 I70 R73F18-I20 PolarHBondContact O-N 3.07Å; I20-E22 VanDerWaalsContact C-N 3.26Å; I20-E22 PolarHBondContact O-N 3.02Å; I20-V23 WeakPolarHBondContact O-CB 3.48Å; I20-V23 WeakPolarHBondContact O-CG2 3.47Å; I20-V23 PolarHBondContact O-N 2.7Å; I20-I70 HydrophobicContact CG2-CG1 4.25Å; I20-R73 VanDerWaalsContact CG1-NH1 3.34Å
21D44.7Very low57.4Low131 Ų13186.4 Ų86.470%0.70143%0.428SS*.Hα-helixtrans-66.9-23.9179.1-62.5-34.2000113.5P19P19-D21 PolarHBondContact O-N 3.14Å
22E48.2Very low57.3Low97 Ų9786.3 Ų86.345%0.45343%0.426SS..Hα-helixtrans-88.3-18.9177.5-66.8-178.5179.100113.1F18 P19 I20 R24 K25 E26F18-E22 HydrophobicContact CE1-CB 4.37Å; P19-E22 HydrophobicContact CB-CG 4.22Å; P19-E22 HydrophobicContact CG-CB 3.88Å; P19-E22 HydrophobicContact CG-CG 3.56Å; P19-E22 WeakPolarHBondContact CG-OE2 3.41Å; P19-E22 PolarHBondContact O-N 3.21Å; I20-E22 VanDerWaalsContact C-N 3.26Å; I20-E22 PolarHBondContact O-N 3.02Å; E22-R24 PolarHBondContact O-N 2.75Å; E22-R24 VanDerWaalsContact O-N 3.13Å; E22-K25 WeakPolarHBondContact O-CA 3.34Å; E22-K25 PolarHBondContact O-N 2.72Å; E22-E26 PolarHBondContact O-N 2.92Å
23V49.5Very low57.2Low13 Ų1389.7 Ų89.78%0.07944%0.435CS..Hα-helixtrans-59.8-28.4175.7-1720000111.2F18 I20 K25 R65 A69F18-V23 HydrophobicContact CD1-CG2 3.52Å; F18-V23 HydrophobicContact CE1-CB 4.23Å; F18-V23 HydrophobicContact CE1-CG2 3.42Å; F18-V23 VanDerWaalsContact CE1-CG2 3.42Å; I20-V23 WeakPolarHBondContact O-CB 3.48Å; I20-V23 WeakPolarHBondContact O-CG2 3.47Å; I20-V23 PolarHBondContact O-N 2.7Å; V23-K25 VanDerWaalsContact C-N 3.26Å; V23-K25 PolarHBondContact O-N 2.9Å; V23-R65 WeakPolarHBondContact CG1-O 3.35Å; V23-A69 HydrophobicContact CB-CB 4.33Å; V23-A69 HydrophobicContact CG1-CB 3.61Å; V23-A69 HydrophobicContact CG2-CB 4.01Å
24R47Very low56.9Low170 Ų17090.7 Ų90.764%0.64244%0.443SS*.THydrogen-bonded Turntrans-68.2-24.5173.9-73.8-175.1179.2-162.7-0.8113.5E22 I66E22-R24 PolarHBondContact O-N 2.75Å; E22-R24 VanDerWaalsContact O-N 3.13Å; R24-I66 HydrophobicContact CG-CD1 3.65Å; R24-I66 HydrophobicContact CG-CG1 3.58Å
25K52.7Low56.5Low173 Ų17386.7 Ų86.775%0.75243%0.429SS*.THydrogen-bonded Turntrans-108.9-36.5-167.8-64-178.4-178.3174.70112.4E22 V23E22-K25 WeakPolarHBondContact O-CA 3.34Å; E22-K25 PolarHBondContact O-N 2.72Å; V23-K25 VanDerWaalsContact C-N 3.26Å; V23-K25 PolarHBondContact O-N 2.9Å
26E53Low56.4Low127 Ų12785.9 Ų85.959%0.59343%0.425SS*.SBendtrans-125.6134.5-176.3-63.9-164169.800111.9E22 L28E22-E26 PolarHBondContact O-N 2.92Å; E26-L28 PolarHBondContact O-N 3.28Å
27P57Low56.2Low80 Ų8078.8 Ų78.852%0.51940%0.402SS..PPolyproline II helixtrans-63.3137.5170.728.4-32.4000109.3S29P27-S29 PolarHBondContact O-N 3.2Å
28L58.7Low55.9Low34 Ų3478 Ų7818%0.17840%0.398CS..PPolyproline II helixtrans-46.5141.2173-66171000110.6F18 E26 L32 R33 I36F18-L28 HydrophobicContact CD1-CD2 4.28Å; F18-L28 HydrophobicContact CE1-CD2 4.03Å; F18-L28 HydrophobicContact CE2-CD2 4.29Å; F18-L28 HydrophobicContact CZ-CD2 4.03Å; E26-L28 PolarHBondContact O-N 3.28Å; L28-L32 HydrophobicContact CD2-CD2 3.97Å; L28-R33 HydrophobicContact CB-CG 3.76Å; L28-R33 HydrophobicContact CD1-CG 4.48Å; L28-R33 PolarHBondContact O-NE 3.02Å; L28-R33 PolarHBondContact O-NH2 3.24Å; L28-I36 HydrophobicContact CD1-CD1 4.2Å
29S66Low56Low57 Ų5776.1 Ų76.140%0.39939%0.39SS..PPolyproline II helixtrans-56147.2179.478.70000110.4P27 N31 L32 R33P27-S29 PolarHBondContact O-N 3.2Å; S29-N31 PolarHBondContact O-N 3.35Å; S29-L32 PolarHBondContact O-N 3.27Å; S29-L32 VanDerWaalsContact O-N 3.14Å; S29-L32 VanDerWaalsContact OG-CB 3.27Å; S29-L32 WeakPolarHBondContact OG-CB 3.31Å; S29-L32 PolarHBondContact OG-N 2.91Å; S29-R33 PolarHBondContact O-N 3.1Å
30A63.2Low56.2Low55 Ų5574 Ų7446%0.45538%0.376SS..Hα-helixtrans-59-35.7-178.200000111.9R33 N34A30-R33 PolarHBondContact O-N 3.34Å; A30-N34 WeakPolarHBondContact O-CB 3.39Å; A30-N34 PolarHBondContact O-N 3.47Å; A30-N34 PolarHBondContact O-ND2 2.86Å
31N62.5Low56.5Low130 Ų13080.1 Ų80.170%0.69540%0.395SS*.Hα-helixtrans-63.5-44.8176.2-66.1-14.3000111.6S29 N34 A35S29-N31 PolarHBondContact O-N 3.35Å; N31-N34 PolarHBondContact O-N 2.89Å; N31-A35 WeakPolarHBondContact O-CB 3.43Å; N31-A35 PolarHBondContact O-N 2.83Å
32L58.1Low57.1Low6 Ų679 Ų793%0.03139%0.39CS..Hα-helixtrans-67.6-41.3179.5-165.361.2000111.5E14 L15 L28 S29 N34 A35 I36E14-L32 HydrophobicContact CB-CD1 4.38Å; L15-L32 HydrophobicContact CD2-CD1 4.46Å; L15-L32 HydrophobicContact CD2-CD2 3.99Å; L15-L32 HydrophobicContact CD2-CG 4.31Å; L15-L32 HydrophobicContact CG-CD1 3.98Å; L15-L32 HydrophobicContact CG-CD2 4.33Å; L15-L32 HydrophobicContact CG-CG 4.37Å; L28-L32 HydrophobicContact CD2-CD2 3.97Å; S29-L32 PolarHBondContact O-N 3.27Å; S29-L32 VanDerWaalsContact O-N 3.14Å; S29-L32 VanDerWaalsContact OG-CB 3.27Å; S29-L32 WeakPolarHBondContact OG-CB 3.31Å; S29-L32 PolarHBondContact OG-N 2.91Å; L32-N34 VanDerWaalsContact C-N 3.34Å; L32-N34 PolarHBondContact O-N 3.46Å; L32-A35 PolarHBondContact O-N 3.49Å; L32-I36 HydrophobicContact CG-CD1 4.12Å; L32-I36 WeakPolarHBondContact O-CB 3.28Å; L32-I36 WeakPolarHBondContact O-CD1 3.41Å; L32-I36 WeakPolarHBondContact O-CG1 3.27Å; L32-I36 PolarHBondContact O-N 3.23Å
33R61Low57.1Low120 Ų12078.4 Ų78.445%0.45339%0.386SS..Hα-helixtrans-59.9-42.9173.1-76.7-176.3-80.6176.6-7.5112.4L28 S29 A30 S37L28-R33 HydrophobicContact CB-CG 3.76Å; L28-R33 HydrophobicContact CD1-CG 4.48Å; L28-R33 PolarHBondContact O-NE 3.02Å; L28-R33 PolarHBondContact O-NH2 3.24Å; S29-R33 PolarHBondContact O-N 3.1Å; A30-R33 PolarHBondContact O-N 3.34Å; R33-S37 VanDerWaalsContact O-CB 3.31Å; R33-S37 WeakPolarHBondContact O-CB 3.33Å; R33-S37 PolarHBondContact O-N 2.92Å; R33-S37 PolarHBondContact O-OG 3.39Å
34N61.8Low57Low106 Ų10678.5 Ų78.557%0.56739%0.387SS*.Hα-helixtrans-66.2-41.4177.5-71.8-17.1000111.6A30 N31 L32 S37 Q38A30-N34 WeakPolarHBondContact O-CB 3.39Å; A30-N34 PolarHBondContact O-N 3.47Å; A30-N34 PolarHBondContact O-ND2 2.86Å; N31-N34 PolarHBondContact O-N 2.89Å; L32-N34 VanDerWaalsContact C-N 3.34Å; L32-N34 PolarHBondContact O-N 3.46Å; N34-S37 PolarHBondContact O-N 3.33Å; N34-Q38 WeakPolarHBondContact O-CB 3.42Å; N34-Q38 PolarHBondContact O-N 3.3Å
35A57.1Low57Low26 Ų2679.7 Ų79.722%0.21540%0.4CS..Hα-helixtrans-63.7-46.2176.700000111.8A11 N31 L32 S37 Q38 I39A11-A35 HydrophobicContact CB-CB 3.88Å; N31-A35 WeakPolarHBondContact O-CB 3.43Å; N31-A35 PolarHBondContact O-N 2.83Å; L32-A35 PolarHBondContact O-N 3.49Å; A35-S37 VanDerWaalsContact C-N 3.34Å; A35-S37 PolarHBondContact O-N 3.28Å; A35-Q38 PolarHBondContact O-N 2.76Å; A35-I39 VanDerWaalsContact O-CG1 3.28Å; A35-I39 WeakPolarHBondContact O-CG1 3.18Å; A35-I39 PolarHBondContact O-N 3.34Å
36I57.6Low56.8Low7 Ų776.7 Ų76.74%0.03639%0.393CS..Hα-helixtrans-60.4-45.2174.6-66.5163.1000110.5L15 L28 L32 Q38 I39 L40L15-I36 HydrophobicContact CD1-CD1 4.14Å; L15-I36 HydrophobicContact CD1-CG1 3.91Å; L15-I36 HydrophobicContact CD2-CD1 4Å; L28-I36 HydrophobicContact CD1-CD1 4.2Å; L32-I36 HydrophobicContact CG-CD1 4.12Å; L32-I36 WeakPolarHBondContact O-CB 3.28Å; L32-I36 WeakPolarHBondContact O-CD1 3.41Å; L32-I36 WeakPolarHBondContact O-CG1 3.27Å; L32-I36 PolarHBondContact O-N 3.23Å; I36-Q38 VanDerWaalsContact C-N 3.26Å; I36-Q38 PolarHBondContact O-N 3.38Å; I36-I39 PolarHBondContact O-N 3.24Å; I36-L40 HydrophobicContact CG2-CD1 3.62Å; I36-L40 HydrophobicContact CG2-CG 4.3Å; I36-L40 WeakPolarHBondContact O-CB 3.09Å; I36-L40 VanDerWaalsContact O-CG 3.27Å; I36-L40 WeakPolarHBondContact O-CG 3.41Å; I36-L40 PolarHBondContact O-N 2.95Å
37S58.8Low56.3Low26 Ų2673.5 Ų73.518%0.18238%0.377CS..Hα-helixtrans-61.1-36.4177.9-59.50000112.2R33 N34 A35 R41 L49R33-S37 VanDerWaalsContact O-CB 3.31Å; R33-S37 WeakPolarHBondContact O-CB 3.33Å; R33-S37 PolarHBondContact O-N 2.92Å; R33-S37 PolarHBondContact O-OG 3.39Å; N34-S37 PolarHBondContact O-N 3.33Å; A35-S37 VanDerWaalsContact C-N 3.34Å; A35-S37 PolarHBondContact O-N 3.28Å; S37-R41 VanDerWaalsContact O-CG 3.29Å; S37-R41 WeakPolarHBondContact O-CG 3.44Å; S37-R41 PolarHBondContact O-N 3.02Å; S37-R41 VanDerWaalsContact O-N 3.1Å; S37-L49 WeakPolarHBondContact OG-CD1 3.26Å
38Q57.5Low55.7Low119 Ų11972.7 Ų72.756%0.55637%0.368SS*.Hα-helixtrans-70.4-46.4176.6-173.7172.7-2.600111.4N34 A35 I36 L40 R41 D42N34-Q38 WeakPolarHBondContact O-CB 3.42Å; N34-Q38 PolarHBondContact O-N 3.3Å; A35-Q38 PolarHBondContact O-N 2.76Å; I36-Q38 VanDerWaalsContact C-N 3.26Å; I36-Q38 PolarHBondContact O-N 3.38Å; Q38-L40 VanDerWaalsContact C-N 3.28Å; Q38-L40 PolarHBondContact O-N 3.28Å; Q38-R41 PolarHBondContact O-N 2.79Å; Q38-R41 VanDerWaalsContact O-N 3.17Å; Q38-D42 WeakPolarHBondContact O-CB 2.96Å; Q38-D42 VanDerWaalsContact O-CG 3.25Å; Q38-D42 PolarHBondContact O-N 3Å
39I56.5Low55Low6 Ų675.7 Ų75.73%0.03138%0.384CS..Hα-helixtrans-57.6-43.8175.8-67.1164000110.5V8 A35 I36 D42 H43 L76 I80V8-I39 HydrophobicContact CG1-CD1 3.92Å; V8-I39 HydrophobicContact CG1-CG1 4.11Å; V8-I39 HydrophobicContact CG2-CG1 4.45Å; A35-I39 VanDerWaalsContact O-CG1 3.28Å; A35-I39 WeakPolarHBondContact O-CG1 3.18Å; A35-I39 PolarHBondContact O-N 3.34Å; I36-I39 PolarHBondContact O-N 3.24Å; I39-D42 PolarHBondContact O-N 2.96Å; I39-H43 WeakPolarHBondContact O-CB 3.47Å; I39-H43 PolarHBondContact O-CD2 3.48Å; I39-H43 VanDerWaalsContact O-CD2 3.27Å; I39-H43 PolarHBondContact O-N 3.46Å; I39-L76 HydrophobicContact CG2-CD2 4.23Å; I39-I80 HydrophobicContact CG2-CD1 4.23Å
40L57.3Low53.8Low8 Ų877.8 Ų77.84%0.04240%0.398CS..Hα-helixtrans-64.4-41.2178.1-72.1165.5000112I36 Q38 C44 F47 L49 L76I36-L40 HydrophobicContact CG2-CD1 3.62Å; I36-L40 HydrophobicContact CG2-CG 4.3Å; I36-L40 WeakPolarHBondContact O-CB 3.09Å; I36-L40 VanDerWaalsContact O-CG 3.27Å; I36-L40 WeakPolarHBondContact O-CG 3.41Å; I36-L40 PolarHBondContact O-N 2.95Å; Q38-L40 VanDerWaalsContact C-N 3.28Å; Q38-L40 PolarHBondContact O-N 3.28Å; L40-C44 CarbonylContact O-C 3.57Å; L40-C44 WeakPolarHBondContact O-CA 3.27Å; L40-C44 WeakPolarHBondContact O-CB 3.43Å; L40-C44 PolarHBondContact O-N 3.36Å; L40-C44 VanDerWaalsContact O-O 3.08Å; L40-F47 HydrophobicContact CB-CB 4.3Å; L40-F47 HydrophobicContact CB-CD1 4.1Å; L40-F47 HydrophobicContact CB-CG 4.46Å; L40-F47 HydrophobicContact CD1-CD1 3.65Å; L40-F47 HydrophobicContact CD1-CE1 3.72Å; L40-F47 HydrophobicContact CD2-CB 4.5Å; L40-F47 HydrophobicContact CD2-CD1 3.96Å; L40-F47 HydrophobicContact CD2-CE1 4.29Å; L40-F47 HydrophobicContact CD2-CG 4.09Å; L40-F47 HydrophobicContact CG-CD1 4.12Å; L40-L49 HydrophobicContact CD1-CD1 3.7Å; L40-L49 HydrophobicContact CD1-CG 4.22Å; L40-L76 HydrophobicContact CD2-CD1 3.8Å
41R58Low52.7Low192 Ų19278 Ų7873%0.72539%0.394SS*.Hα-helixtrans-65.7-37174.6-72.8175.8-158.2-177.15.3113.2S37 Q38S37-R41 VanDerWaalsContact O-CG 3.29Å; S37-R41 WeakPolarHBondContact O-CG 3.44Å; S37-R41 PolarHBondContact O-N 3.02Å; S37-R41 VanDerWaalsContact O-N 3.1Å; Q38-R41 PolarHBondContact O-N 2.79Å; Q38-R41 VanDerWaalsContact O-N 3.17Å
42D56.8Low51.7Low108 Ų10876.1 Ų76.158%0.57839%0.389SS*.Hα-helixtrans-78.1-25.7-175.3-68.8-15.3000112.2Q38 I39Q38-D42 WeakPolarHBondContact O-CB 2.96Å; Q38-D42 VanDerWaalsContact O-CG 3.25Å; Q38-D42 PolarHBondContact O-N 3Å; I39-D42 PolarHBondContact O-N 2.96Å
43H49.6Very low50.6Low83 Ų8380.9 Ų80.938%0.38441%0.409SS..Hα-helixtrans-120.6-16.7-172.6-65.6-73.3000115.6I39 N83I39-H43 WeakPolarHBondContact O-CB 3.47Å; I39-H43 PolarHBondContact O-CD2 3.48Å; I39-H43 VanDerWaalsContact O-CD2 3.27Å; I39-H43 PolarHBondContact O-N 3.46Å; H43-N83 PolarHBondContact O-ND2 2.99Å
44C47.3Very low49.6Very low15 Ų1576.3 Ų76.310%0.10140%0.4CS..  trans-120.3101.9178.9-53.70000108.5L40 D46 F47L40-C44 CarbonylContact O-C 3.57Å; L40-C44 WeakPolarHBondContact O-CA 3.27Å; L40-C44 WeakPolarHBondContact O-CB 3.43Å; L40-C44 PolarHBondContact O-N 3.36Å; L40-C44 VanDerWaalsContact O-O 3.08Å; C44-D46 PolarHBondContact O-N 2.97Å; C44-F47 HydrophobicContact CB-CB 3.64Å; C44-F47 PolarHBondContact O-N 2.9Å
45E46.6Very low48.6Very low196 Ų19673.9 Ų73.992%0.91639%0.39SS*.THydrogen-bonded Turntrans-59.6-6.3-173.9-77.4-177.5154.700115.1
46D47.7Very low47.8Very low110 Ų11077.1 Ų77.159%0.58840%0.397SS*.THydrogen-bonded Turntrans-130.71.7-178.9-69-50.7000114.6C44 D48 P55C44-D46 PolarHBondContact O-N 2.97Å; D46-D48 PolarHBondContact O-N 3.45Å; D46-P55 HydrophobicContact CB-CB 3.94Å; D46-P55 HydrophobicContact CB-CG 4.31Å; D46-P55 WeakPolarHBondContact O-CB 3.29Å; D46-P55 WeakPolarHBondContact O-CD 3.16Å; D46-P55 WeakPolarHBondContact O-CG 2.99Å
47F44Very low46.6Very low60 Ų6079.3 Ų79.326%0.26342%0.422SS..  trans-83.992.3-168.1-151.2-85.6000113.8L40 C44 L49L40-F47 HydrophobicContact CB-CB 4.3Å; L40-F47 HydrophobicContact CB-CD1 4.1Å; L40-F47 HydrophobicContact CB-CG 4.46Å; L40-F47 HydrophobicContact CD1-CD1 3.65Å; L40-F47 HydrophobicContact CD1-CE1 3.72Å; L40-F47 HydrophobicContact CD2-CB 4.5Å; L40-F47 HydrophobicContact CD2-CD1 3.96Å; L40-F47 HydrophobicContact CD2-CE1 4.29Å; L40-F47 HydrophobicContact CD2-CG 4.09Å; L40-F47 HydrophobicContact CG-CD1 4.12Å; C44-F47 HydrophobicContact CB-CB 3.64Å; C44-F47 PolarHBondContact O-N 2.9Å; F47-L49 HydrophobicContact CD1-CD2 4.42Å; F47-L49 HydrophobicContact CD1-CG 4.05Å; F47-L49 HydrophobicContact CE1-CD2 3.68Å; F47-L49 HydrophobicContact CE1-CG 3.81Å
48D43.8Very low45.5Very low63 Ų6382.5 Ų82.534%0.33744%0.44SS..  trans-93.4111.5170.6-177.621.5000112D46 S50 T51D46-D48 PolarHBondContact O-N 3.45Å; D48-S50 VanDerWaalsContact C-N 3.29Å; D48-S50 VanDerWaalsContact CG-OG 3.25Å; D48-S50 WeakPolarHBondContact OD1-CA 3.02Å; D48-S50 VanDerWaalsContact OD1-CB 3.26Å; D48-S50 WeakPolarHBondContact OD1-CB 3.15Å; D48-S50 PolarHBondContact OD1-N 3.44Å; D48-S50 PolarHBondContact OD1-OG 3.43Å; D48-S50 PolarHBondContact OD2-OG 3.14Å; D48-S50 VanDerWaalsContact OD2-OG 3.11Å; D48-T51 PolarHBondContact O-OG1 3.27Å; D48-T51 VanDerWaalsContact OD2-CG2 3.3Å; D48-T51 WeakPolarHBondContact OD2-CG2 3.39Å; D48-T51 PolarHBondContact OD2-N 3.09Å; D48-T51 PolarHBondContact OD2-OG1 3.28Å
49L43.2Very low44.5Very low97 Ų9787.5 Ų87.551%0.50845%0.454SS..SBendtrans-78.2-10173-80.7167000113.5S37 L40 F47S37-L49 WeakPolarHBondContact OG-CD1 3.26Å; L40-L49 HydrophobicContact CD1-CD1 3.7Å; L40-L49 HydrophobicContact CD1-CG 4.22Å; F47-L49 HydrophobicContact CD1-CD2 4.42Å; F47-L49 HydrophobicContact CD1-CG 4.05Å; F47-L49 HydrophobicContact CE1-CD2 3.68Å; F47-L49 HydrophobicContact CE1-CG 3.81Å
50S42.1Very low43.2Very low101 Ų10188.6 Ų88.671%0.70647%0.466SS*.SBendtrans-90.6-16.8-175.776.20000113.6D48D48-S50 VanDerWaalsContact C-N 3.29Å; D48-S50 VanDerWaalsContact CG-OG 3.25Å; D48-S50 WeakPolarHBondContact OD1-CA 3.02Å; D48-S50 VanDerWaalsContact OD1-CB 3.26Å; D48-S50 WeakPolarHBondContact OD1-CB 3.15Å; D48-S50 PolarHBondContact OD1-N 3.44Å; D48-S50 PolarHBondContact OD1-OG 3.43Å; D48-S50 PolarHBondContact OD2-OG 3.14Å; D48-S50 VanDerWaalsContact OD2-OG 3.11Å
51T39.5Very low41.8Very low59 Ų5996.4 Ų96.436%0.36250%0.502SS..SBendtrans-82128.8168.931.90000108.9D48 F53 G54D48-T51 PolarHBondContact O-OG1 3.27Å; D48-T51 VanDerWaalsContact OD2-CG2 3.3Å; D48-T51 WeakPolarHBondContact OD2-CG2 3.39Å; D48-T51 PolarHBondContact OD2-N 3.09Å; D48-T51 PolarHBondContact OD2-OG1 3.28Å; T51-F53 PolarHBondContact O-N 3.41Å; T51-G54 PolarHBondContact O-N 2.83Å; T51-G54 VanDerWaalsContact O-N 3.1Å; T51-G54 WeakPolarHBondContact OG1-CA 3.37Å; T51-G54 PolarHBondContact OG1-N 2.9Å
52P40.9Very low40.5Very low90 Ų9090 Ų9058%0.58450%0.496SS*.THydrogen-bonded Turntrans-61.1-10.417423.2-28.9000112.1G60P52-G60 WeakPolarHBondContact O-CA 3.31Å; P52-G60 PolarHBondContact O-N 2.92Å
53F35.6Very low39.4Very low106 Ų10691.4 Ų91.447%0.46550%0.502SS..THydrogen-bonded Turntrans-110.4-1.6179-62.5-90.5000116.4T51 G57 V58T51-F53 PolarHBondContact O-N 3.41Å; F53-G57 CarbonylContact O-C 3.59Å; F53-G57 WeakPolarHBondContact O-CA 3.17Å; F53-G57 PolarHBondContact O-N 2.99Å; F53-V58 WeakPolarHBondContact CA-O 3.36Å; F53-V58 WeakPolarHBondContact CD1-O 3.33Å; F53-V58 PolarHBondContact O-N 2.87Å
54G39.1Very low38.7Very low25 Ų2594.2 Ų94.226%0.25852%0.515SS..THydrogen-bonded Turntrans48.5-173.6-169.700000113.4T51 Y56T51-G54 PolarHBondContact O-N 2.83Å; T51-G54 VanDerWaalsContact O-N 3.1Å; T51-G54 WeakPolarHBondContact OG1-CA 3.37Å; T51-G54 PolarHBondContact OG1-N 2.9Å; G54-Y56 PolarHBondContact O-N 2.99Å
55P41.9Very low38.4Very low54 Ų5499.1 Ų99.135%0.35153%0.532SS..THydrogen-bonded Turntrans-68.2-10.5168.829.6-40.6000114.6D46D46-P55 HydrophobicContact CB-CB 3.94Å; D46-P55 HydrophobicContact CB-CG 4.31Å; D46-P55 WeakPolarHBondContact O-CB 3.29Å; D46-P55 WeakPolarHBondContact O-CD 3.16Å; D46-P55 WeakPolarHBondContact O-CG 2.99Å
56Y40.8Very low38Very low95 Ų9592.4 Ų92.437%0.37350%0.502SS..THydrogen-bonded Turntrans-120.714.2-168.9-60.2-63000115.2G54 L92G54-Y56 PolarHBondContact O-N 2.99Å; Y56-L92 HydrophobicContact CD2-CD1 4.08Å; Y56-L92 HydrophobicContact CE2-CB 4.27Å; Y56-L92 HydrophobicContact CE2-CD1 3.42Å; Y56-L92 VanDerWaalsContact CE2-CD1 3.42Å; Y56-L92 HydrophobicContact CE2-CG 4.45Å
57G32.3Very low37.7Very low53 Ų5390.6 Ų90.655%0.54649%0.492SS..THydrogen-bonded Turntrans75.830.2170.900000114.9F53 R59F53-G57 CarbonylContact O-C 3.59Å; F53-G57 WeakPolarHBondContact O-CA 3.17Å; F53-G57 PolarHBondContact O-N 2.99Å; G57-R59 PolarHBondContact O-N 3.48Å
58V35.7Very low37.8Very low93 Ų9392.2 Ų92.256%0.56450%0.503SS*.  trans-63.4124172-176.20000108.1F53 G60F53-V58 WeakPolarHBondContact CA-O 3.36Å; F53-V58 WeakPolarHBondContact CD1-O 3.33Å; F53-V58 PolarHBondContact O-N 2.87Å; V58-G60 PolarHBondContact O-N 3.11Å
59R35.5Very low37.8Very low224 Ų22490.1 Ų90.185%0.84550%0.495SS*.  trans-55118.1-177-73.6179.9-157.9-150.91111.6G57 E61G57-R59 PolarHBondContact O-N 3.48Å; R59-E61 PolarHBondContact O-N 3.25Å
60G28.6Very low37.9Very low28 Ų2888.4 Ų88.429%0.28949%0.485SS..SBendtrans-68.350.7172.900000115.1P52 V58P52-G60 WeakPolarHBondContact O-CA 3.31Å; P52-G60 PolarHBondContact O-N 2.92Å; V58-G60 PolarHBondContact O-N 3.11Å
61E29.3Very low38.3Very low173 Ų17387.6 Ų87.681%0.80847%0.469SS*.SBendtrans-133.795.4166.7-74.8-169156.900109.4R59R59-E61 PolarHBondContact O-N 3.25Å
62G30.4Very low38.9Very low58 Ų5886.4 Ų86.460%0.59846%0.46SS*.SBendtrans83.999163.100000114.8H64G62-H64 PolarHBondContact O-CD2 3.06Å; G62-H64 PolarHBondContact O-N 3.49Å
63I34Very low39.3Very low136 Ų13687.1 Ų87.170%0.69745%0.452SS*.  trans-11.485.6150.3-43.2173.7000113.6R65I63-R65 VanDerWaalsContact C-N 3.26Å; I63-R65 HydrophobicContact CB-CG 4.37Å; I63-R65 HydrophobicContact CG2-CG 3.37Å; I63-R65 PolarHBondContact O-N 3.26Å
64H34.9Very low40.3Very low143 Ų14388.6 Ų88.666%0.66246%0.46SS*.  trans-8674.2172.6-88.4-82000109G62 I66G62-H64 PolarHBondContact O-CD2 3.06Å; G62-H64 PolarHBondContact O-N 3.49Å; H64-I66 PolarHBondContact O-N 2.96Å
65R40.2Very low40.9Very low117 Ų11789.3 Ų89.344%0.44246%0.456SS..THydrogen-bonded Turntrans-49.4-5.7-172.2-62.8-179.4-172.7-169.10.9117.7V23 I63V23-R65 WeakPolarHBondContact CG1-O 3.35Å; I63-R65 VanDerWaalsContact C-N 3.26Å; I63-R65 HydrophobicContact CB-CG 4.37Å; I63-R65 HydrophobicContact CG2-CG 3.37Å; I63-R65 PolarHBondContact O-N 3.26Å
66I38Very low41.4Very low56 Ų5687.1 Ų87.129%0.28744%0.442SS..THydrogen-bonded Turntrans-108.1-43.1-165.9-61.6162.3000111.5R24 H64 I70R24-I66 HydrophobicContact CG-CD1 3.65Å; R24-I66 HydrophobicContact CG-CG1 3.58Å; H64-I66 PolarHBondContact O-N 2.96Å; I66-I70 HydrophobicContact CG2-CD1 4.41Å; I66-I70 WeakPolarHBondContact O-CG1 3.42Å; I66-I70 PolarHBondContact O-N 3.28Å
67D42.7Very low42.1Very low72 Ų7285.7 Ų85.739%0.38544%0.444SS..Hα-helixtrans-75.5-34.9-177.4-72.4-70.6000111.1A69 I70 F71 R97D67-A69 PolarHBondContact O-N 3.37Å; D67-I70 PolarHBondContact O-N 3.44Å; D67-F71 VanDerWaalsContact O-CB 3.29Å; D67-F71 WeakPolarHBondContact O-CB 3.44Å; D67-F71 PolarHBondContact O-N 2.94Å; D67-R97 IonicContact OD1-CZ 3.87Å; D67-R97 IonicContact OD1-NH1 3.92Å; D67-R97 IonicContact OD1-NH2 2.87Å; D67-R97 PolarHBondContact OD1-NH2 3.37Å
68D44.9Very low43.2Very low93 Ų9385.3 Ų85.350%0.49744%0.436SS..Hα-helixtrans-64.5-37.2176.6-66.3-18.4000112.4F71 I72D68-F71 PolarHBondContact O-N 3.36Å; D68-I72 VanDerWaalsContact O-CB 3.27Å; D68-I72 WeakPolarHBondContact O-CB 3.28Å; D68-I72 VanDerWaalsContact O-CD1 3.28Å; D68-I72 WeakPolarHBondContact O-CD1 3.19Å; D68-I72 WeakPolarHBondContact O-CG1 3.32Å; D68-I72 PolarHBondContact O-N 3.44Å
69A43.7Very low44Very low20 Ų2083.2 Ų83.217%0.16542%0.42CS..Hα-helixtrans-72.8-33-179.700000112.7V23 D67 R73V23-A69 HydrophobicContact CB-CB 4.33Å; V23-A69 HydrophobicContact CG1-CB 3.61Å; V23-A69 HydrophobicContact CG2-CB 4.01Å; D67-A69 PolarHBondContact O-N 3.37Å; A69-R73 WeakPolarHBondContact O-CB 3.28Å; A69-R73 PolarHBondContact O-N 3.05Å
70I46.9Very low44.7Very low60 Ų6074.3 Ų74.331%0.30839%0.389SS..Hα-helixtrans-71.4-43.2173.5-63.7168.3000109.4I20 I66 D67 R73 E74I20-I70 HydrophobicContact CG2-CG1 4.25Å; I66-I70 HydrophobicContact CG2-CD1 4.41Å; I66-I70 WeakPolarHBondContact O-CG1 3.42Å; I66-I70 PolarHBondContact O-N 3.28Å; D67-I70 PolarHBondContact O-N 3.44Å; I70-R73 PolarHBondContact O-N 2.83Å; I70-E74 HydrophobicContact CG2-CG 4.43Å; I70-E74 WeakPolarHBondContact O-CB 3.07Å; I70-E74 PolarHBondContact O-N 2.8Å
71F49.2Very low46Very low84 Ų8475.6 Ų75.637%0.36840%0.396SS..Hα-helixtrans-58.2-49.3175.1-176-96.1000111.7D67 D68 R73 Q75 L92D67-F71 VanDerWaalsContact O-CB 3.29Å; D67-F71 WeakPolarHBondContact O-CB 3.44Å; D67-F71 PolarHBondContact O-N 2.94Å; D68-F71 PolarHBondContact O-N 3.36Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.43Å; F71-Q75 HydrophobicContact CD2-CB 4.33Å; F71-Q75 HydrophobicContact CD2-CG 3.89Å; F71-Q75 HydrophobicContact CE2-CB 4.13Å; F71-Q75 HydrophobicContact CE2-CG 3.83Å; F71-Q75 HydrophobicContact CZ-CB 4.27Å; F71-Q75 HydrophobicContact CZ-CG 4.45Å; F71-Q75 VanDerWaalsContact O-CB 3.28Å; F71-Q75 WeakPolarHBondContact O-CB 3.27Å; F71-Q75 PolarHBondContact O-N 2.89Å; F71-L92 HydrophobicContact CE1-CD2 4.49Å; F71-L92 HydrophobicContact CE2-CD2 4.48Å; F71-L92 HydrophobicContact CZ-CD2 3.66Å
72I52Low47.1Very low34 Ų3469.9 Ų69.917%0.17438%0.379CS..Hα-helixtrans-63.7-35.6177.4-69.1163.5000111.5D68 L76D68-I72 VanDerWaalsContact O-CB 3.27Å; D68-I72 WeakPolarHBondContact O-CB 3.28Å; D68-I72 VanDerWaalsContact O-CD1 3.28Å; D68-I72 WeakPolarHBondContact O-CD1 3.19Å; D68-I72 WeakPolarHBondContact O-CG1 3.32Å; D68-I72 PolarHBondContact O-N 3.44Å; I72-L76 HydrophobicContact CG2-CD2 4.38Å; I72-L76 WeakPolarHBondContact O-CB 3.26Å
73R49.5Very low47.9Very low106 Ų10669.3 Ų69.340%0.436%0.362SS..Hα-helixtrans-78.6-34.3-177.4-176.4173165.8154.3-1.5113.5F18 I20 A69 I70 F71F18-R73 PolarHBondContact O-NH1 3.13Å; F18-R73 VanDerWaalsContact O-NH1 3.07Å; I20-R73 VanDerWaalsContact CG1-NH1 3.34Å; A69-R73 WeakPolarHBondContact O-CB 3.28Å; A69-R73 PolarHBondContact O-N 3.05Å; I70-R73 PolarHBondContact O-N 2.83Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.43Å
74E56.1Low48.7Very low137 Ų13770.8 Ų70.864%0.6437%0.366SS*.Hα-helixtrans-98.4-39.2-175.2-65.3-169.2168.300113.4I70I70-E74 HydrophobicContact CG2-CG 4.43Å; I70-E74 WeakPolarHBondContact O-CB 3.07Å; I70-E74 PolarHBondContact O-N 2.8Å
75Q52.6Low49.3Very low39 Ų3971 Ų7118%0.18237%0.371CS..THydrogen-bonded Turntrans-90.9-39.5-175-63.1-70.94.600112.3F71 A78 E79F71-Q75 HydrophobicContact CD2-CB 4.33Å; F71-Q75 HydrophobicContact CD2-CG 3.89Å; F71-Q75 HydrophobicContact CE2-CB 4.13Å; F71-Q75 HydrophobicContact CE2-CG 3.83Å; F71-Q75 HydrophobicContact CZ-CB 4.27Å; F71-Q75 HydrophobicContact CZ-CG 4.45Å; F71-Q75 VanDerWaalsContact O-CB 3.28Å; F71-Q75 WeakPolarHBondContact O-CB 3.27Å; F71-Q75 PolarHBondContact O-N 2.89Å; Q75-A78 PolarHBondContact O-N 3.11Å; Q75-A78 VanDerWaalsContact O-N 3.1Å; Q75-E79 WeakPolarHBondContact O-CB 3.49Å; Q75-E79 VanDerWaalsContact O-CG 3.32Å; Q75-E79 WeakPolarHBondContact O-CG 3.49Å; Q75-E79 PolarHBondContact O-N 3.38Å
76L52.7Low49.2Very low9 Ų971 Ų715%0.04738%0.38CS..Hα-helixtrans-58.7-45.4-175.3-155.687.2000113I39 L40 I72 A78 E79 I80I39-L76 HydrophobicContact CG2-CD2 4.23Å; L40-L76 HydrophobicContact CD2-CD1 3.8Å; I72-L76 HydrophobicContact CG2-CD2 4.38Å; I72-L76 WeakPolarHBondContact O-CB 3.26Å; L76-A78 VanDerWaalsContact C-N 3.34Å; L76-A78 PolarHBondContact O-N 3.22Å; L76-E79 PolarHBondContact O-N 3.1Å; L76-I80 HydrophobicContact CD2-CD1 4.09Å; L76-I80 HydrophobicContact CG-CD1 3.93Å; L76-I80 WeakPolarHBondContact O-CB 3.45Å; L76-I80 WeakPolarHBondContact O-CD1 3.16Å; L76-I80 WeakPolarHBondContact O-CG1 3.1Å; L76-I80 PolarHBondContact O-N 3.31Å
77P55.8Low49.3Very low65 Ų6577.1 Ų77.142%0.42241%0.405SS..Hα-helixtrans-68.5-32.6177.9-19.734.3000113A81P77-A81 VanDerWaalsContact O-CB 3.31Å; P77-A81 WeakPolarHBondContact O-CB 3.29Å; P77-A81 PolarHBondContact O-N 3.42Å; P77-A81 VanDerWaalsContact O-N 3.09Å
78A55.4Low48.9Very low45 Ų4582 Ų8237%0.37242%0.422SS..Hα-helixtrans-73-37.9177.600000111.8Q75 L76 A82Q75-A78 PolarHBondContact O-N 3.11Å; Q75-A78 VanDerWaalsContact O-N 3.1Å; L76-A78 VanDerWaalsContact C-N 3.34Å; L76-A78 PolarHBondContact O-N 3.22Å; A78-A82 VanDerWaalsContact O-CB 3.29Å; A78-A82 WeakPolarHBondContact O-CB 3.45Å; A78-A82 PolarHBondContact O-N 3.13Å
79E51Low48.3Very low48 Ų4888.5 Ų88.522%0.22444%0.44CS..Hα-helixtrans-71.9-39.7176.4-74179.4177.800111.8Q75 L76 A82 N83Q75-E79 WeakPolarHBondContact O-CB 3.49Å; Q75-E79 VanDerWaalsContact O-CG 3.32Å; Q75-E79 WeakPolarHBondContact O-CG 3.49Å; Q75-E79 PolarHBondContact O-N 3.38Å; L76-E79 PolarHBondContact O-N 3.1Å; E79-A82 PolarHBondContact O-N 2.85Å; E79-N83 VanDerWaalsContact O-CB 3.26Å; E79-N83 WeakPolarHBondContact O-CB 3.48Å; E79-N83 PolarHBondContact O-N 2.78Å
80I51.2Low47.9Very low38 Ų3891 Ų9120%0.19545%0.45CS..Hα-helixtrans-62.2-45.2172.5-69.3164.8000110.3I39 L76 A82 N83 E84I39-I80 HydrophobicContact CG2-CD1 4.23Å; L76-I80 HydrophobicContact CD2-CD1 4.09Å; L76-I80 HydrophobicContact CG-CD1 3.93Å; L76-I80 WeakPolarHBondContact O-CB 3.45Å; L76-I80 WeakPolarHBondContact O-CD1 3.16Å; L76-I80 WeakPolarHBondContact O-CG1 3.1Å; L76-I80 PolarHBondContact O-N 3.31Å; I80-A82 VanDerWaalsContact C-N 3.31Å; I80-A82 PolarHBondContact O-N 3.02Å; I80-N83 PolarHBondContact O-N 2.91Å; I80-E84 PolarHBondContact O-N 2.84Å; I80-E84 VanDerWaalsContact O-N 3.14Å
81A55.6Low47.4Very low54 Ų5494.5 Ų94.545%0.44647%0.468SS..Hα-helixtrans-64.9-33.717600000112.9P77P77-A81 VanDerWaalsContact O-CB 3.31Å; P77-A81 WeakPolarHBondContact O-CB 3.29Å; P77-A81 PolarHBondContact O-N 3.42Å; P77-A81 VanDerWaalsContact O-N 3.09Å
82A52.7Low46.9Very low53 Ų5392.6 Ų92.644%0.43846%0.462SS..Hα-helixtrans-73.7-33.5175.100000112.7A78 E79 I80 L85 N86A78-A82 VanDerWaalsContact O-CB 3.29Å; A78-A82 WeakPolarHBondContact O-CB 3.45Å; A78-A82 PolarHBondContact O-N 3.13Å; E79-A82 PolarHBondContact O-N 2.85Å; I80-A82 VanDerWaalsContact C-N 3.31Å; I80-A82 PolarHBondContact O-N 3.02Å; A82-L85 PolarHBondContact O-N 2.91Å; A82-N86 PolarHBondContact O-N 3.29Å
83N47Very low46.1Very low47 Ų4794.9 Ų94.925%0.25148%0.477SS..Hα-helixtrans-71-34.3178.8-164.7-4000112H43 E79 I80 L85 N86H43-N83 PolarHBondContact O-ND2 2.99Å; E79-N83 VanDerWaalsContact O-CB 3.26Å; E79-N83 WeakPolarHBondContact O-CB 3.48Å; E79-N83 PolarHBondContact O-N 2.78Å; I80-N83 PolarHBondContact O-N 2.91Å; N83-L85 PolarHBondContact O-N 3.07Å; N83-N86 CarbonylContact O-C 3.46Å; N83-N86 PolarHBondContact O-N 3.35Å
84E50.2Low45.2Very low167 Ų16794.9 Ų94.978%0.7849%0.485SS*.Hα-helixtrans-62.7-30.8171.8-72.7-161.6158.800112.8I80I80-E84 PolarHBondContact O-N 2.84Å; I80-E84 VanDerWaalsContact O-N 3.14Å
85L48.6Very low44.3Very low146 Ų14695.3 Ų95.376%0.76449%0.491SS*.Hα-helixtrans-87.7-29.9177.4-101.4127.2000113.6A82 N83A82-L85 PolarHBondContact O-N 2.91Å; N83-L85 PolarHBondContact O-N 3.07Å
86N38.6Very low43.5Very low118 Ų11897.4 Ų97.463%0.63150%0.504SS*.  trans-137.288.2-174.8-73.8-47.1000110.9A82 N83 K88A82-N86 PolarHBondContact O-N 3.29Å; N83-N86 CarbonylContact O-C 3.46Å; N83-N86 PolarHBondContact O-N 3.35Å; N86-K88 PolarHBondContact O-N 3.22Å
87K39.3Very low42.9Very low185 Ų185106.2 Ų106.280%0.80454%0.536SS*.  trans-59.612.9178.6-67.2-173.6174-174.60116.4
88K34.1Very low42.1Very low174 Ų174107.4 Ų107.476%0.75754%0.544SS*.SBendtrans-150.7118.5-171.1-62.3-173.2-179.7-176.90109.8N86N86-K88 PolarHBondContact O-N 3.22Å
89R32.8Very low41.2Very low230 Ų230107.5 Ų107.587%0.86855%0.545SS*.  trans9185.4167.2-54.2174.1169.8-162.1-5.8115.3I91R89-I91 PolarHBondContact O-N 3.07Å
90L35.2Very low40.7Very low71 Ų71106.9 Ų106.937%0.37255%0.545SS..  trans-69.2117.4147.8-114.289.7000107.5L92L90-L92 HydrophobicContact CD2-CD1 3.83Å; L90-L92 HydrophobicContact CD2-CG 4.31Å
91I36.9Very low40.1Very low135 Ų135110.2 Ų110.269%0.69256%0.562SS**  trans-114.897.1159.6-60.8175.6000104.4R89 V93R89-I91 PolarHBondContact O-N 3.07Å; I91-V93 HydrophobicContact CG2-CG2 4.26Å; I91-V93 PolarHBondContact O-N 3.03Å; I91-V93 VanDerWaalsContact O-N 3.11Å
92L37.6Very low39.2Very low44 Ų44113.9 Ų113.923%0.2357%0.57CS.*  trans-67.9103.8168.4-91.5147.2000107.2Y56 F71 L90 D94Y56-L92 HydrophobicContact CD2-CD1 4.08Å; Y56-L92 HydrophobicContact CE2-CB 4.27Å; Y56-L92 HydrophobicContact CE2-CD1 3.42Å; Y56-L92 VanDerWaalsContact CE2-CD1 3.42Å; Y56-L92 HydrophobicContact CE2-CG 4.45Å; F71-L92 HydrophobicContact CE1-CD2 4.49Å; F71-L92 HydrophobicContact CE2-CD2 4.48Å; F71-L92 HydrophobicContact CZ-CD2 3.66Å; L90-L92 HydrophobicContact CD2-CD1 3.83Å; L90-L92 HydrophobicContact CD2-CG 4.31Å; L92-D94 VanDerWaalsContact C-N 3.31Å; L92-D94 PolarHBondContact O-N 2.77Å
93V34.8Very low38.3Very low82 Ų82116.1 Ų116.150%0.49757%0.574SS.*  trans-76.288.7175.4179.40000107.7I91I91-V93 HydrophobicContact CG2-CG2 4.26Å; I91-V93 PolarHBondContact O-N 3.03Å; I91-V93 VanDerWaalsContact O-N 3.11Å
94D31.9Very low37.9Very low105 Ų105117 Ų11756%0.56158%0.579SS**THydrogen-bonded Turntrans-61.4143.8159.2-134.7-14.7000108.8L92L92-D94 VanDerWaalsContact C-N 3.31Å; L92-D94 PolarHBondContact O-N 2.77Å
95D35.7Very low37.3Very low146 Ų146114.8 Ų114.878%0.78156%0.563SS**THydrogen-bonded Turntrans83.47172.3-66.6-27000122.7
96N37.2Very low36.5Very low84 Ų84110.9 Ų110.945%0.44955%0.548SS..  trans-139.573.9176-85.9-53.6000116.2P98 A99 V100N96-P98 VanDerWaalsContact O-N 3.13Å; N96-A99 HydrophobicContact CB-CB 3.53Å; N96-A99 PolarHBondContact O-N 2.91Å; N96-V100 WeakPolarHBondContact O-CG2 3.33Å; N96-V100 PolarHBondContact O-N 3.49Å
97R39.5Very low36.4Very low193 Ų193110.3 Ų110.373%0.72854%0.544SS*.Hα-helixtrans-46.5-35.6164.2-77.5-174.3-177.2-152.6-0.2113.6D67 L101D67-R97 IonicContact OD1-CZ 3.87Å; D67-R97 IonicContact OD1-NH1 3.92Å; D67-R97 IonicContact OD1-NH2 2.87Å; D67-R97 PolarHBondContact OD1-NH2 3.37Å; R97-L101 WeakPolarHBondContact O-CD1 3.24Å; R97-L101 WeakPolarHBondContact O-CG 3.24Å; R97-L101 PolarHBondContact O-N 3.19Å
98P38.7Very low36.3Very low90 Ų90107.3 Ų107.358%0.58453%0.531SS*.Hα-helixtrans-74.8-39.4174.1-16.531.1000114N96 L101 Q102N96-P98 VanDerWaalsContact O-N 3.13Å; P98-L101 PolarHBondContact O-N 3.08Å; P98-Q102 WeakPolarHBondContact O-CB 3.32Å; P98-Q102 PolarHBondContact O-N 3.02Å
99A37.3Very low36.3Very low47 Ų47106.8 Ų106.839%0.38853%0.531SS..Hα-helixtrans-76.3-30.4-176.700000112.3N96 Q102 L103N96-A99 HydrophobicContact CB-CB 3.53Å; N96-A99 PolarHBondContact O-N 2.91Å; A99-Q102 CarbonylContact O-C 3.58Å; A99-Q102 PolarHBondContact O-N 2.82Å; A99-L103 VanDerWaalsContact O-CB 3.29Å; A99-L103 WeakPolarHBondContact O-CB 3.45Å; A99-L103 PolarHBondContact O-N 2.83Å
100V39.7Very low36.7Very low36 Ų36101.3 Ų101.322%0.21852%0.522CS..Hα-helixtrans-67.8-39.4172.31750000110.8N96 Q102 L103 L104N96-V100 WeakPolarHBondContact O-CG2 3.33Å; N96-V100 PolarHBondContact O-N 3.49Å; V100-Q102 VanDerWaalsContact C-N 3.32Å; V100-Q102 PolarHBondContact O-N 2.92Å; V100-L103 PolarHBondContact O-N 2.97Å; V100-L104 HydrophobicContact CG1-CD1 4.05Å; V100-L104 WeakPolarHBondContact O-CB 3.28Å; V100-L104 VanDerWaalsContact O-CG 3.32Å; V100-L104 WeakPolarHBondContact O-CG 3.46Å; V100-L104 PolarHBondContact O-N 3.18Å
101L39.3Very low36.8Very low108 Ų108107.1 Ų107.157%0.56555%0.548SS*.Hα-helixtrans-65.3-34.8170.9-79.3167000112.3R97 P98 R105R97-L101 WeakPolarHBondContact O-CD1 3.24Å; R97-L101 WeakPolarHBondContact O-CG 3.24Å; R97-L101 PolarHBondContact O-N 3.19Å; P98-L101 PolarHBondContact O-N 3.08Å; L101-R105 WeakPolarHBondContact O-CB 3.39Å; L101-R105 VanDerWaalsContact O-CG 3.31Å; L101-R105 WeakPolarHBondContact O-CG 3.29Å; L101-R105 PolarHBondContact O-N 2.93Å
102Q36.3Very low36.8Very low130 Ų130102.8 Ų102.861%0.60754%0.536SS*.Hα-helixtrans-72.9-33.3175.4-163.6135.1-10.900112.6P98 A99 V100 S106P98-Q102 WeakPolarHBondContact O-CB 3.32Å; P98-Q102 PolarHBondContact O-N 3.02Å; A99-Q102 CarbonylContact O-C 3.58Å; A99-Q102 PolarHBondContact O-N 2.82Å; V100-Q102 VanDerWaalsContact C-N 3.32Å; V100-Q102 PolarHBondContact O-N 2.92Å; Q102-S106 PolarHBondContact O-N 3.34Å; Q102-S106 PolarHBondContact O-OG 3.48Å
103L34.7Very low36.6Very low100 Ų100106.2 Ų106.252%0.52456%0.561SS.*Hα-helixtrans-71.2-41.9173.1-165.668.9000110.9A99 V100 R105 S106 I107A99-L103 VanDerWaalsContact O-CB 3.29Å; A99-L103 WeakPolarHBondContact O-CB 3.45Å; A99-L103 PolarHBondContact O-N 2.83Å; V100-L103 PolarHBondContact O-N 2.97Å; L103-R105 VanDerWaalsContact C-N 3.34Å; L103-R105 PolarHBondContact O-N 3.16Å; L103-S106 VanDerWaalsContact CA-OG 3.24Å; L103-S106 WeakPolarHBondContact CA-OG 3.44Å; L103-S106 PolarHBondContact O-N 3.48Å; L103-S106 VanDerWaalsContact O-N 3.16Å; L103-S106 PolarHBondContact O-OG 3.04Å; L103-S106 VanDerWaalsContact O-OG 3.04Å; L103-I107 HydrophobicContact CD2-CD1 4.46Å; L103-I107 HydrophobicContact CG-CD1 3.91Å; L103-I107 WeakPolarHBondContact O-CB 3.47Å; L103-I107 VanDerWaalsContact O-CG1 3.24Å; L103-I107 WeakPolarHBondContact O-CG1 3.31Å; L103-I107 PolarHBondContact O-N 3.29Å
104L36.8Very low36.8Very low66 Ų66107.8 Ų107.835%0.34657%0.573SS.*Hα-helixtrans-63.7-37.2171.8-78.3163.4000112.2V100 K108V100-L104 HydrophobicContact CG1-CD1 4.05Å; V100-L104 WeakPolarHBondContact O-CB 3.28Å; V100-L104 VanDerWaalsContact O-CG 3.32Å; V100-L104 WeakPolarHBondContact O-CG 3.46Å; V100-L104 PolarHBondContact O-N 3.18Å; L104-K108 VanDerWaalsContact O-CB 3.28Å; L104-K108 WeakPolarHBondContact O-CB 3.4Å; L104-K108 WeakPolarHBondContact O-CG 3.46Å; L104-K108 PolarHBondContact O-N 2.78Å
105R37.9Very low37Very low120 Ų120108.4 Ų108.445%0.45358%0.575SS.*Hα-helixtrans-63.6-39.7170.7-82.2174.9-177.7169.2-5.3112L101 L103 H109 D120L101-R105 WeakPolarHBondContact O-CB 3.39Å; L101-R105 VanDerWaalsContact O-CG 3.31Å; L101-R105 WeakPolarHBondContact O-CG 3.29Å; L101-R105 PolarHBondContact O-N 2.93Å; L103-R105 VanDerWaalsContact C-N 3.34Å; L103-R105 PolarHBondContact O-N 3.16Å; R105-H109 PolarHBondContact O-CD2 2.87Å; R105-D120 IonicContact CZ-OD1 3.76Å; R105-D120 IonicContact CZ-OD2 3.68Å; R105-D120 IonicContact NH2-OD1 2.74Å; R105-D120 PolarHBondContact NH2-OD1 3.43Å; R105-D120 IonicContact NH2-OD2 2.84Å; R105-D120 PolarHBondContact NH2-OD2 2.74Å
106S32.7Very low36.9Very low64 Ų64107.4 Ų107.445%0.44857%0.569SS.*Hα-helixtrans-78.8-28.1-179.637.70000113.7Q102 L103Q102-S106 PolarHBondContact O-N 3.34Å; Q102-S106 PolarHBondContact O-OG 3.48Å; L103-S106 VanDerWaalsContact CA-OG 3.24Å; L103-S106 WeakPolarHBondContact CA-OG 3.44Å; L103-S106 PolarHBondContact O-N 3.48Å; L103-S106 VanDerWaalsContact O-N 3.16Å; L103-S106 PolarHBondContact O-OG 3.04Å; L103-S106 VanDerWaalsContact O-OG 3.04Å
107I36.6Very low36.8Very low106 Ų106107 Ų10754%0.54457%0.566SS.*Hα-helixtrans-77.7-36173.2-65.5166.9000111.2L103 H109 V110L103-I107 HydrophobicContact CD2-CD1 4.46Å; L103-I107 HydrophobicContact CG-CD1 3.91Å; L103-I107 WeakPolarHBondContact O-CB 3.47Å; L103-I107 VanDerWaalsContact O-CG1 3.24Å; L103-I107 WeakPolarHBondContact O-CG1 3.31Å; L103-I107 PolarHBondContact O-N 3.29Å; I107-H109 PolarHBondContact O-N 3.46Å; I107-V110 PolarHBondContact O-N 3.44Å; I107-V110 VanDerWaalsContact O-N 3.08Å
108K37.3Very low36.8Very low123 Ų123103.6 Ų103.654%0.53556%0.562SS.*Hα-helixtrans-62.4-21.3174.9-90-178.9172.8171.10114L104 V110 G112 I115L104-K108 VanDerWaalsContact O-CB 3.28Å; L104-K108 WeakPolarHBondContact O-CB 3.4Å; L104-K108 WeakPolarHBondContact O-CG 3.46Å; L104-K108 PolarHBondContact O-N 2.78Å; K108-V110 PolarHBondContact O-N 2.73Å; K108-G112 PolarHBondContact O-N 3Å; K108-I115 HydrophobicContact CD-CD1 4.1Å; K108-I115 VanDerWaalsContact NZ-CD1 3.25Å
109H34Very low36.8Very low163 Ų163105 Ų10576%0.75557%0.565SS**THydrogen-bonded Turntrans-71.9-7.3174.3-83.4-61.6000114.6R105 I107R105-H109 PolarHBondContact O-CD2 2.87Å; I107-H109 PolarHBondContact O-N 3.46Å
110V40.6Very low36.9Very low114 Ų114105.4 Ų105.469%0.69156%0.56SS**THydrogen-bonded Turntrans-93.8-23.3-176.5-1720000112.5I107 K108I107-V110 PolarHBondContact O-N 3.44Å; I107-V110 VanDerWaalsContact O-N 3.08Å; K108-V110 PolarHBondContact O-N 2.73Å
111Q36.9Very low37.1Very low194 Ų194109 Ų10991%0.90757%0.574SS**THydrogen-bonded Turntrans-15111.5-175-71.6-167.70.700118.4
112G36.3Very low37.1Very low44 Ų44110.1 Ų110.145%0.45458%0.58SS.*SBendtrans-139.1154.5-177.200000115.7K108K108-G112 PolarHBondContact O-N 3Å
113P35.4Very low37.4Very low116 Ų116111.2 Ų111.275%0.75359%0.586SS**  trans-63.8146.8174.327.8-32.1000110.3I115P113-I115 PolarHBondContact O-N 3.27Å
114P38.5Very low37.7Very low115 Ų115111.4 Ų111.475%0.74759%0.591SS**  trans-62.8119.6-174.125.2-33000110.5I116P114-I116 PolarHBondContact O-N 3Å
115I34.6Very low38.1Very low117 Ų117116.6 Ų116.660%0.661%0.613SS**  trans-82.5108.1171-62.1165.9000106.6K108 P113 N117K108-I115 HydrophobicContact CD-CD1 4.1Å; K108-I115 VanDerWaalsContact NZ-CD1 3.25Å; P113-I115 PolarHBondContact O-N 3.27Å; I115-N117 PolarHBondContact O-N 2.9Å
116I34Very low38.3Very low126 Ų126117 Ų11765%0.64663%0.629SS**  trans-73.3114.3169.1-61.3169.3000106.4P114P114-I116 PolarHBondContact O-N 3Å
117N35.1Very low38.7Very low74 Ų74117.9 Ų117.940%0.39664%0.641SS.*  trans-87.3121.9172-143.79.1000107.4I115 L119 D120I115-N117 PolarHBondContact O-N 2.9Å; N117-L119 PolarHBondContact O-N 3.09Å; N117-D120 HydrophobicContact CB-CB 4.31Å; N117-D120 WeakPolarHBondContact CB-OD2 3.48Å; N117-D120 WeakPolarHBondContact O-CB 3.4Å; N117-D120 PolarHBondContact O-N 3.37Å
118D40.6Very low39Very low122 Ų122122.2 Ų122.265%0.65266%0.655SS**Hα-helixtrans-61.9-15.8176.9-73.3-26.8000112.6
119L37.9Very low39.3Very low121 Ų121120.7 Ų120.763%0.63467%0.665SS**Hα-helixtrans-75.6-23.5170.5-76.5156.8000113.8N117N117-L119 PolarHBondContact O-N 3.09Å
120D40.2Very low39.9Very low55 Ų55118.6 Ų118.629%0.29467%0.667SS.*Hα-helixtrans-84-16.6176.6-71.8-37.6000112R105 N117 T124R105-D120 IonicContact CZ-OD1 3.76Å; R105-D120 IonicContact CZ-OD2 3.68Å; R105-D120 IonicContact NH2-OD1 2.74Å; R105-D120 PolarHBondContact NH2-OD1 3.43Å; R105-D120 IonicContact NH2-OD2 2.84Å; R105-D120 PolarHBondContact NH2-OD2 2.74Å; N117-D120 HydrophobicContact CB-CB 4.31Å; N117-D120 WeakPolarHBondContact CB-OD2 3.48Å; N117-D120 WeakPolarHBondContact O-CB 3.4Å; N117-D120 PolarHBondContact O-N 3.37Å; D120-T124 PolarHBondContact O-OG1 3.34Å
121Q42.6Very low39.9Very low110 Ų110123.1 Ų123.151%0.51468%0.68SS.*Hα-helixtrans-73.5-29.3170.2-69.5-172.739.400112.3Q123Q121-Q123 PolarHBondContact O-N 2.84Å
122L40.5Very low40.5Very low132 Ų132116.8 Ų116.869%0.69167%0.667SS**Hα-helixtrans-77.8-18.1-177.7-80.3162.9000114.6
123Q41.8Very low41.2Very low153 Ų153123.1 Ų123.172%0.71569%0.685SS**Hα-helixtrans-103.6-17.7178.8-70-170-1.300113.9Q121Q121-Q123 PolarHBondContact O-N 2.84Å
124T41.8Very low41.3Very low104 Ų104124.4 Ų124.464%0.63869%0.69SS**Hα-helixtrans-89-16.3-173.2-46.10000113.2D120D120-T124 PolarHBondContact O-OG1 3.34Å
125E44Very low41.7Very low175 Ų175127.2 Ų127.282%0.81869%0.693SS**THydrogen-bonded Turntrans-88.4-2177.3-65.9-163.5159.400114.7
126V43.1Very low41.8Very low128 Ų128132.8 Ų132.878%0.77671%0.707SS**SBendtrans-104.7-6.2-176.3-173.60000113.3
127A41.6Very low42.4Very low84 Ų84137.9 Ų137.969%0.69472%0.718SS**SBendtrans-117.625.3-168.300000115.8
128K42.5Very low43.1Very low197 Ų197143.6 Ų143.686%0.85774%0.739SS**  trans-120.274.7166.3-78.8-175.5178177.70110.5
129A44.3Very low43.1Very low90 Ų90143.1 Ų143.174%0.74475%0.745SS**  trans-68.7125.4157.100000107.6E131A129-E131 PolarHBondContact O-N 2.86Å; A129-E131 VanDerWaalsContact O-N 3.17Å
130P46.4Very low43.6Very low120 Ų120143 Ų14378%0.77976%0.755SS**  trans-70.9112.1173.228.6-29.6000107.8G132P130-G132 PolarHBondContact O-N 3.06Å
131E40.3Very low44Very low209 Ų209150.3 Ų150.398%0.97778%0.784SS**  trans-65.480155.7-72.5-17116300107.2A129A129-E131 PolarHBondContact O-N 2.86Å; A129-E131 VanDerWaalsContact O-N 3.17Å
132G50.1Low43.8Very low61 Ų61149.8 Ų149.863%0.62980%0.798SS**  trans-118.2125.4178.900000108.8P130P130-G132 PolarHBondContact O-N 3.06Å
133E49.2Very low44.2Very low177 Ų177148.2 Ų148.283%0.82781%0.805SS**  trans-42.9146.7-174.1-70.2172.4126.700116.2Q135E133-Q135 PolarHBondContact O-N 3.25Å
134V39.2Very low44.1Very low142 Ų142150.5 Ų150.586%0.86181%0.812SS**  trans-49.194162.5-176.80000111.1
135Q45.4Very low44.5Very low175 Ų175155.4 Ų155.482%0.81883%0.825SS**  trans-136.495.9156.7-73.4-164.52000111.5E133 R137E133-Q135 PolarHBondContact O-N 3.25Å; Q135-R137 PolarHBondContact O-N 3.48Å
136R37.1Very low44.3Very low234 Ų234153.8 Ų153.888%0.88383%0.826SS**  trans-51.7121.9158.7-74.8166.474.2173.74108.8
137R46.2Very low44.6Very low233 Ų233153 Ų15388%0.87983%0.826SS**  trans-175.2113.7135.7-99.5152-174.4-153.61.6113.8Q135Q135-R137 PolarHBondContact O-N 3.48Å
138K50.5Low44.8Very low194 Ų194158 Ų15884%0.84383%0.832SS**  trans43.2101.9135.5-57.8-173.4179.2-175.80119.2
139S40.5Very low45Very low111 Ų111155.9 Ų155.978%0.77684%0.836SS**  trans20.7122.6131.761.10000119.4
140S49.2Very low44.7Very low120 Ų120155 Ų15584%0.83984%0.836SS**  -178128.6121.740.70000113.8
141K47.3Very low44.2Very low207 Ų207153.6 Ų153.690%0.983%0.834SS**  trans12.1118.9147.6-113.3166.4176.6173.90120.9
142A39Very low44.2Very low99 Ų99152.9 Ų152.982%0.81883%0.831SS**  trans50.8120.1130.900000121.5
143A48.4Very low43.8Very low100 Ų100155 Ų15583%0.82684%0.837SS**  trans-158.4124.7136.300000111.8
144K40.8Very low43.9Very low201 Ų201154.1 Ų154.187%0.87484%0.836SS**  trans-47.8132.5161.8-82.1171168173.40110.8
145K50.3Low43.9Very low207 Ų207151.4 Ų151.490%0.984%0.837SS**  trans-148.3124.1138.2-76.1-158.5178.1177.60111
146V40Very low44Very low141 Ų141149 Ų14986%0.85584%0.835SS**  trans-84.5131.2168.5176.40000107.6
147S48.8Very low44.4Very low110 Ų110143.1 Ų143.177%0.76983%0.826SS**  trans-147.2100.8157.556.80000106.3
148K44.8Very low44.8Very low189 Ų189141.3 Ų141.382%0.82283%0.825SS**  38.199.489.5-78.2-169.5178-177.70112.7
149T46.5Very low44.7Very low153 Ų153139.1 Ų139.194%0.93982%0.822SS**  trans177144.3132.530.20000112.1
150G39.5Very low44.9Very low72 Ų72140.4 Ų140.474%0.74283%0.825SS**  trans97.975.3163.800000114.5
151A36.4Very low44.4Very low90 Ų90141.9 Ų141.974%0.74482%0.822SS**  57.1114.662.900000113.5
152E39.3Very low44Very low194 Ų194138.3 Ų138.391%0.90782%0.818SS**  trans76.898.7151.5-61.2178.5175.800118.6
153S42.7Very low44.6Very low107 Ų107137.5 Ų137.575%0.74881%0.811SS**  178.2148.9124-1750000109.4
154L50.5Low44.3Very low157 Ų157138.6 Ų138.682%0.82281%0.81SS**  trans88.182.3173-44.4-177.4000115.3V156L154-V156 PolarHBondContact O-N 2.72Å
155G38.5Very low44.7Very low85 Ų85137.4 Ų137.488%0.87681%0.812SS**  trans-63.5109.717900000114.7
156V47.7Very low44.5Very low126 Ų126132.2 Ų132.276%0.76480%0.802SS**  trans-116.2126.6163.7-176.90000108.5L154L154-V156 PolarHBondContact O-N 2.72Å
157P46.8Very low44.7Very low109 Ų109134.7 Ų134.771%0.70880%0.804SS**  trans-62.1144.2-179.3-20.431.5000113.1D159P157-D159 VanDerWaalsContact C-N 3.25Å; P157-D159 PolarHBondContact O-N 3.15Å; P157-D159 VanDerWaalsContact O-N 3.15Å
158K53.8Low44.4Very low196 Ų196140.6 Ų140.685%0.85281%0.81SS**SBendtrans-76.611.5-170.5-77.3178.1174.9174.80116.2
159D48.2Very low44.5Very low148 Ų148137.1 Ų137.179%0.79181%0.809SS**  trans-116.122.3-163.6-66.3-26.7000115.8P157P157-D159 VanDerWaalsContact C-N 3.25Å; P157-D159 PolarHBondContact O-N 3.15Å; P157-D159 VanDerWaalsContact O-N 3.15Å
160V44.3Very low44.9Very low137 Ų137135.7 Ų135.783%0.8380%0.802SS**  trans-119.677.6172.9-168.70000110.5
161I38.1Very low45.2Very low151 Ų151137.1 Ų137.177%0.77480%0.801SS**  trans-97.5114.5166-61.9171.2000107.7
162T40.5Very low45.7Very low133 Ų133143 Ų14382%0.81681%0.81SS**  trans176.9130.1152.522.80000106.9
163A51.3Low46.4Very low81 Ų81140.9 Ų140.967%0.66980%0.804SS**  cis-166.5167.9-6.800000105.3
164P41.5Very low46.5Very low124 Ų124142.5 Ų142.581%0.80580%0.804SS**  trans-84.9131.1-167.933.6-29.6000111.5
165L50.2Low46.6Very low175 Ų175145.9 Ų145.992%0.91681%0.806SS**  trans-115.296.8170.3-76.5172.7000111.2
166S45.1Very low47.2Very low99 Ų99152.5 Ų152.569%0.69280%0.804SS**  trans61104.5133.3-1630000119R168S166-R168 PolarHBondContact O-N 3.2Å
167E44.1Very low47.3Very low193 Ų193152.9 Ų152.990%0.90281%0.807SS**  trans-48.3118.8156.8-58176.7168.700111.8
168R42.9Very low47.7Very low234 Ų234152.5 Ų152.588%0.88381%0.807SS**  trans-140.598.1161.1-101.4-177165.3173.7-3.9108.9S166S166-R168 PolarHBondContact O-N 3.2Å
169S46.6Very low47.8Very low116 Ų116153.3 Ų153.381%0.81181%0.81SS**  trans-63.7130.617143.60000111
170P54.6Low48Very low122 Ų122157 Ų15779%0.79281%0.814SS**  trans-88.4111.6158.218.1-3.3000108.5F172P170-F172 PolarHBondContact O-N 3.35Å
171S45.3Very low48.3Very low103 Ų103156 Ų15672%0.7281%0.813SS**  trans-53.1132.416854.20000111.2I173S171-I173 PolarHBondContact O-N 3.26Å; S171-I173 VanDerWaalsContact O-N 3.15Å
172F47Very low49.2Very low212 Ų212154.6 Ų154.693%0.9382%0.816SS**  trans-54.5113.9171.3-74.2-94.1000110.9P170 D174P170-F172 PolarHBondContact O-N 3.35Å; F172-D174 PolarHBondContact O-N 3.15Å
173I55.8Low50Low151 Ų151157.5 Ų157.577%0.77482%0.817SS**  trans-82109.4167-63.4173.8000107.5S171 R175S171-I173 PolarHBondContact O-N 3.26Å; S171-I173 VanDerWaalsContact O-N 3.15Å; I173-R175 PolarHBondContact O-N 3.5Å
174D43Very low50.2Low140 Ų140165 Ų16575%0.74983%0.828SS**  trans-65.493.2178.7-1527.8000110.6F172 R176F172-D174 PolarHBondContact O-N 3.15Å; D174-R176 PolarHBondContact O-N 3.07Å
175R52.4Low50.7Low228 Ų228166.9 Ų166.986%0.8683%0.831SS**  trans-78.285.7174.7-85.5-174.2175.5179.2-0.2110.1I173 T177I173-R175 PolarHBondContact O-N 3.5Å; R175-T177 PolarHBondContact O-N 3.41Å; R175-T177 VanDerWaalsContact O-N 3.14Å
176R51.3Low51Low224 Ų224163.8 Ų163.885%0.84582%0.824SS**  trans-58.4110.3164.4-79.5179.7170.6173.8-3.3110.6D174 S178D174-R176 PolarHBondContact O-N 3.07Å; R176-S178 PolarHBondContact O-N 3.14Å; R176-S178 VanDerWaalsContact O-N 3.11Å
177T51.6Low51.3Low134 Ų134165 Ų16582%0.82283%0.827SS**  trans-77.284.6166.747.30000109.7R175 K179R175-T177 PolarHBondContact O-N 3.41Å; R175-T177 VanDerWaalsContact O-N 3.14Å; T177-K179 PolarHBondContact O-N 3.06Å
178S53.5Low51.5Low102 Ų102162 Ų16271%0.71382%0.824SS**  trans-79.3100.5169.2-1740000109.8R176 R180R176-S178 PolarHBondContact O-N 3.14Å; R176-S178 VanDerWaalsContact O-N 3.11Å; S178-R180 PolarHBondContact O-N 3.11Å
179K56.6Low52Low212 Ų212157.9 Ų157.992%0.92282%0.815SS**  trans-72.199.7164.6-68.2-170.6178.9-177.80108.6T177T177-K179 PolarHBondContact O-N 3.06Å
180R51.6Low52.1Low227 Ų227160.3 Ų160.386%0.85781%0.81SS**  trans-138.386.4173.2-159178.9-170.31792.5111.2S178S178-R180 PolarHBondContact O-N 3.11Å
181S51.7Low51.9Low116 Ų116164.5 Ų164.581%0.81182%0.816SS**  trans-166.292.4155.4470000110.1
182S56.3Low51.9Low120 Ų120164.4 Ų164.484%0.83982%0.822SS**  trans-11894.3158-154.90000106.3R184S182-R184 PolarHBondContact O-N 3.26Å
183K56.5Low51.7Low194 Ų194159.5 Ų159.584%0.84382%0.82SS**  trans-74.599.9173-76.8178.6176.9176.90107.5
184R55.5Low51.3Low240 Ų240156.8 Ų156.891%0.90682%0.821SS**  trans-99.896.3156.1-84.3-177.3145.7-163.2-6.3107S182S182-R184 PolarHBondContact O-N 3.26Å
185L53Low51.7Low163 Ų163159.9 Ų159.985%0.85383%0.83SS**  trans-101103.7165.9-87.7160.1000107.1
186S55.6Low51.9Low110 Ų110157.7 Ų157.777%0.76983%0.827SS**  trans-81.4123.5167.948.20000109.7
187V51.4Low51.8Low125 Ų125154 Ų15476%0.75882%0.824SS**  trans15.1119.6150.2-168.90000117.5E189V187-E189 HydrophobicContact CG1-CG 4.38Å
188P48.9Very low51.9Low129 Ų129152.6 Ų152.684%0.83883%0.826SS**  trans-102.8114158.133.1-20.4000110.3
189E54.3Low52Low148 Ų148156.7 Ų156.769%0.69283%0.831SS**  trans-105.7131.4162-87.3-158140.500110.8V187V187-E189 HydrophobicContact CG1-CG 4.38Å
190K48.7Very low51.8Low166 Ų166153.8 Ų153.872%0.72283%0.826SS**  trans62.6112.4149.2-65.1172.2179.8159.50118.7
191K50.9Low51.8Low210 Ų210151.7 Ų151.791%0.91383%0.831SS**  177.6132.2100.6-93.7172-176.6-178.80111.6
192A44.3Very low51.4Low102 Ų102151 Ų15184%0.84383%0.826SS**  trans-80.6149171.400000111.6
193A42Very low51.4Low108 Ų108152.3 Ų152.389%0.89383%0.829SS**  trans-178.6144.5134.200000110.6
194A48.9Very low51Low95 Ų95152 Ų15279%0.78583%0.828SS**  trans-73.1158.8-165.900000116.6
195E49.9Very low50.7Low204 Ų204147.4 Ų147.495%0.95383%0.826SS**  trans-149.5142.6145.2-115.9176.1-172.200111.5
196K56.9Low50.5Low183 Ų183143.5 Ų143.580%0.79682%0.818SS**  trans-99.1166.1-162.8-67.3178.1172.7176.10113.2
197N49.5Very low50.2Low145 Ų145147.1 Ų147.178%0.77582%0.82SS**  trans82.1118.9143.4-70.8-31.9000120.4
198A53.4Low50.3Low106 Ų106151.1 Ų151.188%0.87682%0.821SS**  -159.2145.7124.900000111.1
199K55.2Low50.3Low187 Ų187152.4 Ų152.481%0.81382%0.819SS**  trans-94.2148.6-158.5-68.7167.2171.3172.80114.4
200N52.7Low50.1Low152 Ų152149.6 Ų149.681%0.81382%0.816SS**  trans37.1123.4135.3-57.8-12.1000121.1
201L51.6Low50.3Low182 Ų182150.6 Ų150.695%0.95382%0.82SS**  trans-143.3113.8141.8-94.7160.8000108.9
202S43.8Very low50.3Low101 Ų101149.3 Ų149.371%0.70682%0.817SS**  trans-109.6139.5173.794.80000109.5
203T55.5Low50.3Low148 Ų148153.7 Ų153.791%0.90882%0.82SS**  trans-134.3123.2152.642.30000109.8
204K49.6Very low50.6Low188 Ų188156.1 Ų156.182%0.81782%0.819SS**  trans-83151175.9-73.3174.1171.5176.30110.2
205T48.2Very low50.7Low143 Ų143160.9 Ų160.988%0.87782%0.824SS**  152.9141129.844.20000109.4
206A50.1Low50.9Low81 Ų81159 Ų15967%0.66982%0.821SS**  cis-172.6153.2-800000108.8
207K48Very low51.2Low187 Ų187157.3 Ų157.381%0.81382%0.821SS**  trans62.7137.4151-75.3174.6-177.8173.90117.6
208R53.3Low51.7Low209 Ų209156.9 Ų156.979%0.78982%0.818SS**  cis179.2158.94.7-133.9177.9-175.8-178.8-0.9106.3
209I50.1Low51.9Low156 Ų156159 Ų15980%0.882%0.815SS**  trans85.5130.3161.9-52.7148.4000114.4
210S49.9Very low52.2Low89 Ų89155.7 Ų155.762%0.62281%0.811SS**  cis-175.6153-13.559.20000109.1
211K51.5Low52.3Low187 Ų187157.9 Ų157.981%0.81382%0.816SS**  trans73.6102.2162.8-61-177.2177.6-173.40115.4
212Q51.5Low52.7Low182 Ų182153.5 Ų153.585%0.8580%0.801SS**  78.592.267.2-167.4-179.9300110.9
213E44.5Very low53.2Low194 Ų194157.7 Ų157.791%0.90781%0.809SS**  trans-161.1113.9133.9-100.7162.1-157.100105.7
214D49.4Very low53.4Low160 Ų160158.3 Ų158.386%0.85681%0.807SS**  trans-76.2134.6167.7-87.1-38000107.1
215E49.5Very low53.4Low194 Ų194155.5 Ų155.591%0.90780%0.801SS**  trans-160.387.7151.7-107.4167.4-158.200106.3
216D55.4Low54.1Low164 Ų164154.6 Ų154.688%0.87780%0.8SS**  trans-71.7116.3144.4-81.1-39.2000105.1
217D62.4Low54.2Low148 Ų148159.3 Ų159.379%0.79181%0.808SS**  trans-152.4149.3154.3-142.4-11.4000111.8
218D59.1Low54.5Low136 Ų136158.1 Ų158.173%0.72781%0.811SS**  trans-64.5160.5-154.1-86.7-50.4000116.7T220D218-T220 PolarHBondContact O-N 3.17Å
219D57.6Low54.5Low150 Ų150153.1 Ų153.180%0.80281%0.808SS**  trans-12.9121.5141.9-89.9-40.2000113.6
220T61.4Low54.2Low119 Ų119149.8 Ų149.873%0.7380%0.804SS**  trans-164.3100.7134.729.60000109.9D218 S222D218-T220 PolarHBondContact O-N 3.17Å; T220-S222 PolarHBondContact O-N 2.82Å; T220-S222 PolarHBondContact O-OG 3.29Å
221E54.8Low53.9Low197 Ų197152.6 Ų152.692%0.92182%0.818SS**  trans-47.2106.3144.1-78.7-89.4140.800107.6
222S61.9Low53.7Low91 Ų91149.6 Ų149.664%0.63682%0.82SS**  trans-120.394.6176.1350000108.4T220 N224T220-S222 PolarHBondContact O-N 2.82Å; T220-S222 PolarHBondContact O-OG 3.29Å; S222-N224 PolarHBondContact O-N 2.92Å
223E53.9Low53.6Low189 Ų189145.7 Ų145.788%0.88382%0.819SS**  trans-60.3119.3152.8-63.6-165.2148.800107
224N58.2Low53.4Low160 Ų160140.6 Ų140.686%0.85681%0.81SS**  trans-116.2111.2173.6-132.11.3000110.6S222S222-N224 PolarHBondContact O-N 2.92Å
225D51.2Low53.3Low130 Ų130138.8 Ų138.870%0.69581%0.807SS**  trans-64.3152167.5-162.21.3000111
226S62Low52.8Low123 Ų123134.6 Ų134.686%0.8680%0.799SS**  trans-174.8103152.7-83.50000111.4
227E52Low52.6Low180 Ų180133.6 Ų133.684%0.84180%0.798SS**  trans-52.3150.5161.4-51.8-174.8117.600112.8
228N54.9Low51.7Low163 Ų163132 Ų13287%0.87280%0.797SS**  trans-151.6146.9134.3-156.219.2000113.4
229S53.6Low50.9Low104 Ų104131.5 Ų131.573%0.72780%0.801SS**  trans-78.8151.3-160.1-82.80000118
230A44.4Very low50Low86 Ų86129.1 Ų129.171%0.71180%0.796SS**  trans52.4127.6136.400000121.4
231T43.1Very low49.2Very low148 Ų148130.3 Ų130.391%0.90880%0.798SS**  -172.2141.8108.824.70000112.7
232S46.1Very low48.5Very low124 Ų124125.5 Ų125.587%0.86779%0.791SS**  trans-69.2145.9-174.5-46.90000115.3
233A49.1Very low47.6Very low100 Ų100127 Ų12783%0.82680%0.799SS**  -180117.1126.600000110.3
234A41.5Very low46.9Very low87 Ų87127.2 Ų127.272%0.71980%0.797SS**  trans-78.8163.816200000109.8
235P47.9Very low46.3Very low122 Ų122128.8 Ų128.879%0.79280%0.801SS**  -141.1131.687.832.2-14.5000115.3
236S38.3Very low45.7Very low106 Ų106125.9 Ų125.974%0.74180%0.803SS**  trans19.4117.6131.5-34.30000119.8
237V51.4Low44.5Very low142 Ų142129.8 Ų129.886%0.86181%0.807SS**  -157.5138.5129.7-179.70000109.6
238P43.7Very low43.8Very low116 Ų116124 Ų12475%0.75380%0.796SS**  trans-95.5176-162.94.518.7000115.2
239P41.6Very low43.1Very low125 Ų125123 Ų12381%0.81280%0.796SS**  trans-90.7146.9-165.236.3-32.7000113.2
240S39.2Very low42.7Very low100 Ų100124.7 Ų124.770%0.69980%0.797SS**  trans-170.5135.8164-148.30000115.2
241N44.5Very low42.9Very low144 Ų144125.5 Ų125.577%0.7780%0.797SS**  trans82.4101.7146.2-64.4-17.4000121.4
242A39.5Very low42.8Very low95 Ų95121.9 Ų121.979%0.78579%0.789SS**  trans-54.4154.8137.900000111.6
243P42.9Very low43Very low123 Ų123125.9 Ų125.980%0.79979%0.791SS**  trans-132.5135.2139.232-17.1000113.1
244K40.5Very low42.9Very low194 Ų194127.3 Ų127.384%0.84379%0.789SS**  trans-59.6170.9150.5-84174.8171.4174.40109.9
245M45.7Very low43.6Very low192 Ų192131.1 Ų131.195%0.94680%0.796SS**  trans99127.8172.4-51-84-81.900110.9
246G37.5Very low43.5Very low70 Ų70134.2 Ų134.272%0.72280%0.797SS**  cis129.9104.326.600000106.9
247Q37.7Very low43.9Very low204 Ų204138.3 Ų138.395%0.95380%0.801SS**  trans21.5127.1149.2-137.9171.616.600120.1
248G37.4Very low43.7Very low60 Ų60136.6 Ų136.662%0.61980%0.802SS**  109.5118127.900000118.1
249V39.8Very low43.6Very low141 Ų141137 Ų13786%0.85580%0.802SS**  trans59.9137.4151.4-63.70000116.8
250D44.1Very low44.1Very low140 Ų140143 Ų14375%0.74981%0.809SS**  cis-166.9152.747.7-149.1-28.1000111.1
251S49.2Very low44.3Very low102 Ų102142.7 Ų142.771%0.71381%0.807SS**  trans16.3123157.349.40000123.2
252G41.7Very low44.2Very low73 Ų73144.6 Ų144.675%0.75381%0.811SS**  87.1107.1109.400000118.9
253K49.8Very low44.3Very low208 Ų208146 Ų14690%0.90482%0.816SS**  trans-156.3124.1133.6-112.7168.4-171.3179.90112.6
254V47.5Very low44.2Very low129 Ų129143.7 Ų143.778%0.78281%0.813SS**  trans-72.1131.4179.1178.80000109.9
255I54.9Low44.5Very low167 Ų167143 Ų14386%0.85681%0.814SS**  trans-126.8122159.9-54.3179.1000108.5
256K47.1Very low44.3Very low187 Ų187143.4 Ų143.481%0.81381%0.81SS**  trans-77.9139.8-175.7-73.8174.4174.3174.30112.1
257K45.7Very low44.5Very low192 Ų192143.8 Ų143.884%0.83581%0.814SS**  trans15133.1142.4-91177.7170.2179.20119.6
258A47.6Very low44.9Very low107 Ų107139.2 Ų139.288%0.88481%0.811SS**  trans-14711013000000110.5
259T42.1Very low45Very low124 Ų124145.8 Ų145.876%0.76183%0.825SS**  trans-89.8137.5162.538.50000108.8
260R51.9Low45.5Very low250 Ų250143 Ų14394%0.94382%0.817SS**  trans-132.7123.3162.4-166.7174.4-174.9178.11.2109.1
261S42.5Very low45.9Very low95 Ų95143.9 Ų143.966%0.66482%0.817SS**  trans-95.2159179.4-47.40000111.4
262E42.4Very low46.3Very low184 Ų184146.1 Ų146.186%0.8681%0.814SS**  trans77.4127.2146.2-81.6-179.9143.500122.9
263S42.5Very low47Very low125 Ų125152.3 Ų152.387%0.87482%0.82SS**  116.7137.6126.671.70000118.8
264G40.6Very low46.6Very low73 Ų73145.6 Ų145.675%0.75381%0.81SS**  trans96.2100.4162.400000115.1
265E46.1Very low46.5Very low181 Ų181148.8 Ų148.885%0.84682%0.816SS**  84.311667.8-158.6172.6-167.400114.8
266K43.4Very low46.1Very low200 Ų200147.7 Ų147.787%0.8782%0.817SS**  trans12.3134.5161.7-63.6175.1179.2171.10121.2
267G40.1Very low47Very low78 Ų78143.6 Ų143.680%0.80482%0.818SS**  trans161.4132.2142.700000117.5
268A45.9Very low47.7Very low107 Ų107144.5 Ų144.588%0.88482%0.822SS**  trans88.6100.4147.400000120.8
269E39.4Very low48.6Very low198 Ų198149.2 Ų149.293%0.92582%0.822SS**  trans-56.3134.6150.5-176.4-178.5-167.900112.5
270A51.1Low49.7Very low82 Ų82153 Ų15368%0.67883%0.828SS**  trans-159115.5161.900000113.6
271Q52.7Low50Low160 Ų160150.7 Ų150.775%0.74883%0.825SS**  trans66.8147.2130.7-61.1-168.2-0.300119.2
272K57Low51.1Low149 Ų149156 Ų15665%0.64884%0.836SS**  cis-179.9158-3.1-113.2176-177.8167.30107.4
273K56Low51.5Low203 Ų203154.7 Ų154.788%0.88383%0.83SS**  trans72.5132.6157-63.5162.5-179.9-172.60116.1
274G42.9Very low52.4Low67 Ų67158.7 Ų158.769%0.69183%0.831SS**  cis136.9121.28.500000109.5
275H43.9Very low53.1Low196 Ų196159.2 Ų159.291%0.90783%0.829SS**  trans-166.9111.9151.6-117-72.7000110.9
276T47.8Very low54Low143 Ų143160.6 Ų160.688%0.87783%0.832SS**  trans-110.9132.2162.843.60000108.2
277A66.4Low54.7Low101 Ų101161 Ų16184%0.83583%0.834SS**  trans-114.7114.2175.400000110.1
278K60.7Low55.4Low211 Ų211162.9 Ų162.992%0.91784%0.835SS**  trans-73.8133.2167.3-77.1176.4173173.10110
279K66.4Low55.8Low207 Ų207171 Ų17190%0.985%0.85SS**  trans-139.5104.4155.6-109.5179.8-177.6175.70112.9
280K64.8Low56.7Low204 Ų204169.7 Ų169.789%0.88785%0.846SS**  trans36.2112.8143.3-65-170.9175.6-178.50121.1
281K57.3Low57Low200 Ų200174.3 Ų174.387%0.8786%0.855SS**  trans-61.9132.6150.8-171.9178.1-176.6-179.10110.8
282K65.2Low57.2Low207 Ų207175.1 Ų175.190%0.986%0.861SS**  trans-135.3112.2159.8-146.5178.5-172.8-178.90109.1
283E51.6Low57.2Low157 Ų157176.6 Ų176.673%0.73487%0.874SS**  trans-71.8140.1175.1174.9-174171.600111.1
284K62.3Low57.3Low208 Ų208175 Ų17590%0.90487%0.873SS**  trans-153.8118.5137.3-76.6-151.3177.6179.90110.3
285A54.6Low58.2Low85 Ų85182.2 Ų182.270%0.70289%0.885SS**  trans-70.7148.716900000112
286K64.7Low59.3Low210 Ų210181.2 Ų181.291%0.91388%0.884SS**  trans-142.3115.5137.6-77.2-164177.9178.30109.6
287K58.7Low60.1Low208 Ų208184.2 Ų184.290%0.90488%0.884SS**  trans-60.2144.4164-70.5171.4171.6176.50109.9
288S54.2Low59.6Low117 Ų117191.1 Ų191.182%0.81889%0.889SS**  -176.8131.6129.8177.50000109
289K55Low59.5Low279 Ų279189.3 Ų189.3100%1.21389%0.886SS**  trans-8.50172.5-84.1175.1171.31780118.7

Retrieved 289 of 289 residues in 300.9 ms (Link to these results)