A0A087YK43_POEFO Loading...

SLAIN motif family, member 2

AlphaFold DB , UniProt , Accession A0A087YK43, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 641 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
1M51.8Low65Low185 Ų185105.7 Ų105.791%0.91157%0.57SS**  0-2.80-150.9171.5-159.800112.2
2E56.9Low67Low138 Ų138103.6 Ų103.665%0.64556%0.558SS**  trans-78.4-30.4-167.9-64.269.2-155.100112.7I4 N5E2-I4 PolarHBondContact O-N 3.19Å; E2-I4 VanDerWaalsContact O-N 3.11Å; E2-N5 WeakPolarHBondContact O-CB 3.25Å; E2-N5 PolarHBondContact O-N 3.49Å
3D56.9Low68.8Low127 Ų127104.3 Ų104.368%0.67956%0.556SS**Hα-helixtrans-58.7-30.9-170.3-42.7-84.8000113.5N5 S6 N7D3-N5 VanDerWaalsContact C-N 3.33Å; D3-N5 PolarHBondContact O-N 3.34Å; D3-S6 PolarHBondContact O-N 3.34Å; D3-N7 PolarHBondContact O-N 3.26Å
4I59.2Low70.6Confident107 Ų107102 Ų10255%0.54955%0.547SS..Hα-helixtrans-64.6-38.8179.6-58.3173.1000110.6E2 N7 I8E2-I4 PolarHBondContact O-N 3.19Å; E2-I4 VanDerWaalsContact O-N 3.11Å; I4-N7 PolarHBondContact O-N 3.13Å; I4-I8 HydrophobicContact CG2-CD1 3.97Å; I4-I8 VanDerWaalsContact O-CG1 3.31Å; I4-I8 WeakPolarHBondContact O-CG1 3.37Å; I4-I8 PolarHBondContact O-N 3.08Å; I4-I8 VanDerWaalsContact O-N 3.09Å
5N58Low72.1Confident112 Ų112103.4 Ų103.460%0.59954%0.542SS*.Hα-helixtrans-71.1-37.6-178-65.8-24.4000111.7E2 D3 N7 I8 N9E2-N5 WeakPolarHBondContact O-CB 3.25Å; E2-N5 PolarHBondContact O-N 3.49Å; D3-N5 VanDerWaalsContact C-N 3.33Å; D3-N5 PolarHBondContact O-N 3.34Å; N5-N7 VanDerWaalsContact C-N 3.35Å; N5-I8 PolarHBondContact O-N 3.22Å; N5-N9 PolarHBondContact O-N 3.16Å; N5-N9 VanDerWaalsContact O-N 3.14Å
6S61.2Low73.5Confident86 Ų86105.6 Ų105.660%0.60155%0.545SS*.Hα-helixtrans-61.9-42.6174.6-57.10000111.7D3 N9 A10D3-S6 PolarHBondContact O-N 3.34Å; S6-N9 PolarHBondContact O-N 3.4Å; S6-A10 PolarHBondContact O-N 3.2Å; S6-A10 VanDerWaalsContact O-N 3.13Å
7N60.1Low74.8Confident103 Ų103104.9 Ų104.955%0.55154%0.542SS*.Hα-helixtrans-66.7-40.9178.2-163.844.1000112.2D3 I4 N5 N9 A10 D11D3-N7 PolarHBondContact O-N 3.26Å; I4-N7 PolarHBondContact O-N 3.13Å; N5-N7 VanDerWaalsContact C-N 3.35Å; N7-N9 VanDerWaalsContact C-N 3.27Å; N7-N9 PolarHBondContact O-N 2.78Å; N7-A10 PolarHBondContact O-N 3.03Å; N7-A10 VanDerWaalsContact O-N 3.15Å; N7-D11 PolarHBondContact O-N 3.34Å
8I69.4Low75.9Confident88 Ų88105.6 Ų105.645%0.45154%0.543SS..Hα-helixtrans-59-38.6174.7-70.3164.3000111.5I4 N5 L12I4-I8 HydrophobicContact CG2-CD1 3.97Å; I4-I8 VanDerWaalsContact O-CG1 3.31Å; I4-I8 WeakPolarHBondContact O-CG1 3.37Å; I4-I8 PolarHBondContact O-N 3.08Å; I4-I8 VanDerWaalsContact O-N 3.09Å; N5-I8 PolarHBondContact O-N 3.22Å; I8-L12 HydrophobicContact CG2-CD1 4.13Å; I8-L12 VanDerWaalsContact O-CG 3.28Å; I8-L12 WeakPolarHBondContact O-CG 3.28Å; I8-L12 PolarHBondContact O-N 2.83Å; I8-L12 VanDerWaalsContact O-N 3.09Å
9N73.3Confident77Confident95 Ų95105.2 Ų105.251%0.50854%0.542SS..Hα-helixtrans-68.2-39.8176-169.962.4000112.3N5 S6 N7 L12 E13N5-N9 PolarHBondContact O-N 3.16Å; N5-N9 VanDerWaalsContact O-N 3.14Å; S6-N9 PolarHBondContact O-N 3.4Å; N7-N9 VanDerWaalsContact C-N 3.27Å; N7-N9 PolarHBondContact O-N 2.78Å; N9-L12 PolarHBondContact O-N 3.23Å; N9-E13 PolarHBondContact O-N 2.73Å
10A82.4Confident77.9Confident44 Ų44104.7 Ų104.736%0.36454%0.539SS..Hα-helixtrans-63.2-44.1174.600000112.1S6 N7 L12 E13 V14S6-A10 PolarHBondContact O-N 3.2Å; S6-A10 VanDerWaalsContact O-N 3.13Å; N7-A10 PolarHBondContact O-N 3.03Å; N7-A10 VanDerWaalsContact O-N 3.15Å; A10-L12 VanDerWaalsContact C-N 3.27Å; A10-L12 PolarHBondContact O-N 3.27Å; A10-E13 PolarHBondContact O-N 2.76Å; A10-E13 VanDerWaalsContact O-N 3.13Å; A10-V14 WeakPolarHBondContact O-CG2 3.34Å; A10-V14 PolarHBondContact O-N 3.35Å
11D86.2Confident78.8Confident78 Ų78103.4 Ų103.442%0.41754%0.536SS..Hα-helixtrans-61.6-33174.4-86.2-33.5000112.8N7 R15N7-D11 PolarHBondContact O-N 3.34Å; D11-R15 WeakPolarHBondContact O-CB 3.49Å; D11-R15 PolarHBondContact O-N 3.31Å; D11-R15 VanDerWaalsContact O-N 3.15Å; D11-R15 PolarHBondContact O-NH1 2.91Å
12L89.3Confident81Confident80 Ų80101.2 Ų101.242%0.41952%0.521SS..Hα-helixtrans-72.9-35.7173.9-74167.3000112.2I8 N9 A10 K16I8-L12 HydrophobicContact CG2-CD1 4.13Å; I8-L12 VanDerWaalsContact O-CG 3.28Å; I8-L12 WeakPolarHBondContact O-CG 3.28Å; I8-L12 PolarHBondContact O-N 2.83Å; I8-L12 VanDerWaalsContact O-N 3.09Å; N9-L12 PolarHBondContact O-N 3.23Å; A10-L12 VanDerWaalsContact C-N 3.27Å; A10-L12 PolarHBondContact O-N 3.27Å; L12-K16 VanDerWaalsContact O-CG 3.25Å; L12-K16 WeakPolarHBondContact O-CG 3.25Å; L12-K16 PolarHBondContact O-N 3.34Å; L12-K16 VanDerWaalsContact O-N 3.08Å
13E89.4Confident82.9Confident113 Ų113100.8 Ų100.853%0.52852%0.517SS..Hα-helixtrans-69.9-46174.9-171.7169.3-179.200111.8N9 A10 R15 K16 L17N9-E13 PolarHBondContact O-N 2.73Å; A10-E13 PolarHBondContact O-N 2.76Å; A10-E13 VanDerWaalsContact O-N 3.13Å; E13-R15 VanDerWaalsContact C-N 3.27Å; E13-R15 PolarHBondContact O-N 3.15Å; E13-K16 WeakPolarHBondContact O-CB 3.32Å; E13-K16 PolarHBondContact O-N 3.25Å; E13-K16 VanDerWaalsContact O-N 3.17Å; E13-L17 HydrophobicContact CG-CD1 4.26Å; E13-L17 WeakPolarHBondContact O-CG 3.45Å; E13-L17 PolarHBondContact O-N 3.06Å
14V93.8Very high84.7Confident72 Ų7299.3 Ų99.344%0.43651%0.509SS..Hα-helixtrans-56-42173.3169.90000111.1A10 L17 Q18A10-V14 WeakPolarHBondContact O-CG2 3.34Å; A10-V14 PolarHBondContact O-N 3.35Å; V14-L17 PolarHBondContact O-N 3.14Å; V14-Q18 VanDerWaalsContact O-CG 3.3Å; V14-Q18 WeakPolarHBondContact O-CG 3.49Å; V14-Q18 PolarHBondContact O-N 3.06Å
15R93.8Very high86.5Confident123 Ų123100 Ų10046%0.46451%0.51SS..Hα-helixtrans-66.6-42.5177.4-164168.9-63.6100.29.5112.6D11 E13 L17 Q18 D19D11-R15 WeakPolarHBondContact O-CB 3.49Å; D11-R15 PolarHBondContact O-N 3.31Å; D11-R15 VanDerWaalsContact O-N 3.15Å; D11-R15 PolarHBondContact O-NH1 2.91Å; E13-R15 VanDerWaalsContact C-N 3.27Å; E13-R15 PolarHBondContact O-N 3.15Å; R15-L17 VanDerWaalsContact C-N 3.31Å; R15-L17 PolarHBondContact O-N 3.16Å; R15-Q18 PolarHBondContact O-N 3.47Å; R15-D19 PolarHBondContact O-N 2.82Å
16K93.9Very high88.3Confident139 Ų139100.6 Ų100.660%0.60451%0.509SS*.Hα-helixtrans-60.3-39.7172.5-71164.5-172.8172.30112.1L12 E13 L20L12-K16 VanDerWaalsContact O-CG 3.25Å; L12-K16 WeakPolarHBondContact O-CG 3.25Å; L12-K16 PolarHBondContact O-N 3.34Å; L12-K16 VanDerWaalsContact O-N 3.08Å; E13-K16 WeakPolarHBondContact O-CB 3.32Å; E13-K16 PolarHBondContact O-N 3.25Å; E13-K16 VanDerWaalsContact O-N 3.17Å; K16-L20 WeakPolarHBondContact O-CB 3.41Å; K16-L20 PolarHBondContact O-N 3.05Å
17L96.3Very high89.9Confident93 Ų93101 Ų10149%0.48750%0.502SS..Hα-helixtrans-68.2-39.1176.8-70.3170.2000111.8E13 V14 R15 L20 V21E13-L17 HydrophobicContact CG-CD1 4.26Å; E13-L17 WeakPolarHBondContact O-CG 3.45Å; E13-L17 PolarHBondContact O-N 3.06Å; V14-L17 PolarHBondContact O-N 3.14Å; R15-L17 VanDerWaalsContact C-N 3.31Å; R15-L17 PolarHBondContact O-N 3.16Å; L17-L20 PolarHBondContact O-N 3.32Å; L17-V21 WeakPolarHBondContact O-CG2 3.29Å; L17-V21 PolarHBondContact O-N 3.33Å
18Q95.2Very high91.5Very high118 Ų11899.7 Ų99.755%0.55150%0.495SS*.Hα-helixtrans-62.6-45.7173.3-73.7168.7-5.500112V14 R15 L20 V21 K22V14-Q18 VanDerWaalsContact O-CG 3.3Å; V14-Q18 WeakPolarHBondContact O-CG 3.49Å; V14-Q18 PolarHBondContact O-N 3.06Å; R15-Q18 PolarHBondContact O-N 3.47Å; Q18-L20 VanDerWaalsContact C-N 3.33Å; Q18-L20 PolarHBondContact O-N 3.18Å; Q18-V21 PolarHBondContact O-N 2.88Å; Q18-K22 VanDerWaalsContact O-CB 3.32Å; Q18-K22 WeakPolarHBondContact O-CB 3.25Å; Q18-K22 PolarHBondContact O-N 3.02Å
19D95.4Very high92.6Very high98 Ų98100.1 Ų100.152%0.52450%0.495SS..Hα-helixtrans-64.5-36.7175.4-75-36.5000112.2R15 K23R15-D19 PolarHBondContact O-N 2.82Å; D19-K23 WeakPolarHBondContact O-CB 3.45Å; D19-K23 PolarHBondContact O-N 3.37Å
20L96.5Very high93.5Very high94 Ų94100.9 Ų100.949%0.49250%0.495SS..Hα-helixtrans-66.3-46175.1-179.162.2000112.1K16 L17 Q18 K23 L24K16-L20 WeakPolarHBondContact O-CB 3.41Å; K16-L20 PolarHBondContact O-N 3.05Å; L17-L20 PolarHBondContact O-N 3.32Å; Q18-L20 VanDerWaalsContact C-N 3.33Å; Q18-L20 PolarHBondContact O-N 3.18Å; L20-K23 PolarHBondContact O-N 2.94Å; L20-L24 HydrophobicContact CD1-CD1 4.39Å; L20-L24 HydrophobicContact CD1-CG 4.45Å; L20-L24 HydrophobicContact CG-CD1 4.17Å; L20-L24 WeakPolarHBondContact O-CG 3.47Å; L20-L24 PolarHBondContact O-N 3.49Å
21V96.7Very high93.7Very high79 Ų79103.7 Ų103.748%0.47950%0.504SS..Hα-helixtrans-59.2-49.7175.3168.20000110.1L17 Q18 K23 L24 E25L17-V21 WeakPolarHBondContact O-CG2 3.29Å; L17-V21 PolarHBondContact O-N 3.33Å; Q18-V21 PolarHBondContact O-N 2.88Å; V21-K23 VanDerWaalsContact C-N 3.28Å; V21-K23 PolarHBondContact O-N 3.49Å; V21-L24 PolarHBondContact O-N 2.87Å; V21-L24 VanDerWaalsContact O-N 3.1Å; V21-E25 HydrophobicContact CG1-CG 4.33Å; V21-E25 WeakPolarHBondContact O-CG 3.48Å; V21-E25 PolarHBondContact O-N 3.48Å
22K96.8Very high93.5Very high138 Ų138105.9 Ų105.960%0.651%0.506SS*.Hα-helixtrans-58.1-38.3177.7-176.7178.8177.8-176.60112.7Q18 Q26Q18-K22 VanDerWaalsContact O-CB 3.32Å; Q18-K22 WeakPolarHBondContact O-CB 3.25Å; Q18-K22 PolarHBondContact O-N 3.02Å; K22-Q26 WeakPolarHBondContact O-CB 3.37Å; K22-Q26 PolarHBondContact O-N 3.06Å
23K96.3Very high93.1Very high129 Ų129105.1 Ų105.156%0.56151%0.507SS*.Hα-helixtrans-69.3-41175.4-170.3174.8-178.8-179.60112.1D19 L20 V21 Q26 Q27D19-K23 WeakPolarHBondContact O-CB 3.45Å; D19-K23 PolarHBondContact O-N 3.37Å; L20-K23 PolarHBondContact O-N 2.94Å; V21-K23 VanDerWaalsContact C-N 3.28Å; V21-K23 PolarHBondContact O-N 3.49Å; K23-Q26 PolarHBondContact O-N 3.07Å; K23-Q27 WeakPolarHBondContact O-CG 3.43Å; K23-Q27 PolarHBondContact O-N 3.38Å
24L96.5Very high92.4Very high97 Ų97108.2 Ų108.251%0.50851%0.514SS..Hα-helixtrans-65.8-40.1175.2-72.6169.6000112L20 V21 Q27 N28L20-L24 HydrophobicContact CD1-CD1 4.39Å; L20-L24 HydrophobicContact CD1-CG 4.45Å; L20-L24 HydrophobicContact CG-CD1 4.17Å; L20-L24 WeakPolarHBondContact O-CG 3.47Å; L20-L24 PolarHBondContact O-N 3.49Å; V21-L24 PolarHBondContact O-N 2.87Å; V21-L24 VanDerWaalsContact O-N 3.1Å; L24-Q27 PolarHBondContact O-N 2.96Å; L24-N28 VanDerWaalsContact O-CB 3.3Å; L24-N28 WeakPolarHBondContact O-CB 3.3Å; L24-N28 PolarHBondContact O-N 2.91Å
25E95.6Very high91Very high121 Ų121108 Ų10857%0.56552%0.516SS*.Hα-helixtrans-60.7-46172.3-72.4176.1150.900111V21 Q27 N28 E29V21-E25 HydrophobicContact CG1-CG 4.33Å; V21-E25 WeakPolarHBondContact O-CG 3.48Å; V21-E25 PolarHBondContact O-N 3.48Å; E25-Q27 PolarHBondContact O-N 3.49Å; E25-N28 PolarHBondContact O-N 3.42Å; E25-E29 WeakPolarHBondContact O-CB 3.27Å; E25-E29 PolarHBondContact O-N 3.06Å
26Q95.4Very high89.6Confident125 Ų125106.6 Ų106.658%0.58452%0.521SS*.Hα-helixtrans-62.2-41176.5-170.2175.626.600112.6K22 K23 E29 Q30K22-Q26 WeakPolarHBondContact O-CB 3.37Å; K22-Q26 PolarHBondContact O-N 3.06Å; K23-Q26 PolarHBondContact O-N 3.07Å; Q26-E29 PolarHBondContact O-N 2.99Å; Q26-Q30 WeakPolarHBondContact O-CG 3.37Å; Q26-Q30 PolarHBondContact O-N 3.15Å
27Q95.3Very high87.7Confident94 Ų94106.4 Ų106.444%0.43952%0.524SS..Hα-helixtrans-66.3-40174.4-72.6-177.6-82.100112K23 L24 E25 E29 Q30 L31K23-Q27 WeakPolarHBondContact O-CG 3.43Å; K23-Q27 PolarHBondContact O-N 3.38Å; L24-Q27 PolarHBondContact O-N 2.96Å; E25-Q27 PolarHBondContact O-N 3.49Å; Q27-E29 VanDerWaalsContact C-N 3.34Å; Q27-Q30 PolarHBondContact O-N 2.81Å; Q27-L31 WeakPolarHBondContact O-CG 3.4Å; Q27-L31 PolarHBondContact O-N 2.67Å
28N93.6Very high85.8Confident76 Ų76108.5 Ų108.541%0.40654%0.535SS..Hα-helixtrans-64.8-39.3176.8-160.1-18.6000111.1L24 E25 L31 R32L24-N28 VanDerWaalsContact O-CB 3.3Å; L24-N28 WeakPolarHBondContact O-CB 3.3Å; L24-N28 PolarHBondContact O-N 2.91Å; E25-N28 PolarHBondContact O-N 3.42Å; N28-L31 WeakPolarHBondContact O-CB 3.13Å; N28-L31 PolarHBondContact O-N 2.81Å; N28-R32 WeakPolarHBondContact O-CG 3.28Å; N28-R32 PolarHBondContact O-N 2.84Å; N28-R32 PolarHBondContact OD1-NH2 2.93Å
29E93Very high83.6Confident96 Ų96107.5 Ų107.545%0.44954%0.541SS..Hα-helixtrans-72.3-32176.7-15553.7-135.400113.1E25 Q26 Q27 R32 S33E25-E29 WeakPolarHBondContact O-CB 3.27Å; E25-E29 PolarHBondContact O-N 3.06Å; Q26-E29 PolarHBondContact O-N 2.99Å; Q27-E29 VanDerWaalsContact C-N 3.34Å; E29-R32 PolarHBondContact O-N 2.98Å; E29-R32 WeakPolarHBondContact OE2-CD 3.39Å; E29-R32 IonicContact OE2-CZ 3.75Å; E29-R32 IonicContact OE2-NE 4Å; E29-R32 IonicContact OE2-NH1 2.75Å; E29-R32 PolarHBondContact OE2-NH1 3.27Å; E29-S33 VanDerWaalsContact O-CB 3.32Å; E29-S33 WeakPolarHBondContact O-CB 3.41Å; E29-S33 PolarHBondContact O-N 3.49Å; E29-S33 PolarHBondContact O-OG 2.99Å
30Q91.3Very high81.5Confident111 Ų111107 Ų10752%0.51955%0.545SS..Hα-helixtrans-63.3-40.9166.5-75.7176.4-800111.8Q26 Q27 S33 R34Q26-Q30 WeakPolarHBondContact O-CG 3.37Å; Q26-Q30 PolarHBondContact O-N 3.15Å; Q27-Q30 PolarHBondContact O-N 2.81Å; Q30-S33 PolarHBondContact O-N 3.44Å; Q30-R34 WeakPolarHBondContact O-CG 3.45Å; Q30-R34 PolarHBondContact O-N 2.93Å
31L87.8Confident79.2Confident104 Ų104107.4 Ų107.455%0.54556%0.556SS.*Hα-helixtrans-64.5-40.7175.7-71.9170000111.6Q27 N28 R34 S35Q27-L31 WeakPolarHBondContact O-CG 3.4Å; Q27-L31 PolarHBondContact O-N 2.67Å; N28-L31 WeakPolarHBondContact O-CB 3.13Å; N28-L31 PolarHBondContact O-N 2.81Å; L31-R34 PolarHBondContact O-N 3.04Å; L31-S35 WeakPolarHBondContact O-CB 3.33Å; L31-S35 PolarHBondContact O-N 2.71Å; L31-S35 PolarHBondContact O-OG 2.76Å
32R80.8Confident76.6Confident124 Ų124107.2 Ų107.247%0.46857%0.57SS.*Hα-helixtrans-60.8-47.2171.6-69.7-176.9-171.5108.510111.6N28 E29 R34 S35 T36N28-R32 WeakPolarHBondContact O-CG 3.28Å; N28-R32 PolarHBondContact O-N 2.84Å; N28-R32 PolarHBondContact OD1-NH2 2.93Å; E29-R32 PolarHBondContact O-N 2.98Å; E29-R32 WeakPolarHBondContact OE2-CD 3.39Å; E29-R32 IonicContact OE2-CZ 3.75Å; E29-R32 IonicContact OE2-NE 4Å; E29-R32 IonicContact OE2-NH1 2.75Å; E29-R32 PolarHBondContact OE2-NH1 3.27Å; R32-R34 VanDerWaalsContact C-N 3.31Å; R32-R34 PolarHBondContact O-N 3.34Å; R32-S35 WeakPolarHBondContact O-CB 3.47Å; R32-S35 PolarHBondContact O-N 2.85Å; R32-T36 PolarHBondContact O-N 3.38Å; R32-T36 PolarHBondContact O-OG1 3.35Å
33S81.8Confident74.1Confident63 Ų63104.5 Ų104.544%0.44157%0.573SS.*Hα-helixtrans-63.9-30.5178.9-58.60000113.6E29 Q30 T36 M37E29-S33 VanDerWaalsContact O-CB 3.32Å; E29-S33 WeakPolarHBondContact O-CB 3.41Å; E29-S33 PolarHBondContact O-N 3.49Å; E29-S33 PolarHBondContact O-OG 2.99Å; Q30-S33 PolarHBondContact O-N 3.44Å; S33-T36 PolarHBondContact O-OG1 3.07Å; S33-M37 WeakPolarHBondContact O-CG 3.48Å
34R74.8Confident71.5Confident179 Ų179106.9 Ų106.968%0.67559%0.588SS**Hα-helixtrans-76.3-35.6170.4-70.5177.873.9179.92.3112Q30 L31 R32 M37 L38Q30-R34 WeakPolarHBondContact O-CG 3.45Å; Q30-R34 PolarHBondContact O-N 2.93Å; L31-R34 PolarHBondContact O-N 3.04Å; R32-R34 VanDerWaalsContact C-N 3.31Å; R32-R34 PolarHBondContact O-N 3.34Å; R34-M37 PolarHBondContact O-N 3.4Å; R34-L38 WeakPolarHBondContact O-CG 3.29Å; R34-L38 PolarHBondContact O-N 3.06Å; R34-L38 VanDerWaalsContact O-N 3.09Å
35S65.1Low68.9Low68 Ų68107.6 Ų107.648%0.47660%0.601SS.*Hα-helixtrans-67.5-35179.3-58.20000112.8L31 R32 S39L31-S35 WeakPolarHBondContact O-CB 3.33Å; L31-S35 PolarHBondContact O-N 2.71Å; L31-S35 PolarHBondContact O-OG 2.76Å; R32-S35 WeakPolarHBondContact O-CB 3.47Å; R32-S35 PolarHBondContact O-N 2.85Å; S35-S39 PolarHBondContact O-N 3.19Å; S35-S39 PolarHBondContact O-OG 3.4Å
36T62.6Low65.9Low92 Ų92106.6 Ų106.656%0.56461%0.614SS**Hα-helixtrans-68.1-41.8173.851.60000112R32 S33 L38 S39 S40R32-T36 PolarHBondContact O-N 3.38Å; R32-T36 PolarHBondContact O-OG1 3.35Å; S33-T36 PolarHBondContact O-OG1 3.07Å; T36-L38 PolarHBondContact O-N 3.25Å; T36-S39 WeakPolarHBondContact O-CB 3.46Å; T36-S39 PolarHBondContact O-N 3.16Å; T36-S39 VanDerWaalsContact O-N 3.15Å; T36-S40 PolarHBondContact O-N 2.89Å
37M55Low63.4Low136 Ų136107.7 Ų107.767%0.6762%0.624SS**Hα-helixtrans-63.4-37.7175.9-69.5-70.6177.800113.2S33 R34 S39 S40S33-M37 WeakPolarHBondContact O-CG 3.48Å; R34-M37 PolarHBondContact O-N 3.4Å; M37-S39 VanDerWaalsContact C-N 3.29Å; M37-S39 PolarHBondContact O-N 2.91Å; M37-S40 PolarHBondContact O-OG 3.43Å
38L55.5Low60.4Low137 Ų137112.5 Ų112.572%0.71765%0.646SS**Hα-helixtrans-71-26.2175.3-69.9171.7000112.5R34 T36R34-L38 WeakPolarHBondContact O-CG 3.29Å; R34-L38 PolarHBondContact O-N 3.06Å; R34-L38 VanDerWaalsContact O-N 3.09Å; T36-L38 PolarHBondContact O-N 3.25Å
39S50.7Low57.5Low97 Ų97118.5 Ų118.568%0.67866%0.663SS**Hα-helixtrans-75.3-22.4179.2-58.90000113.4S35 T36 M37S35-S39 PolarHBondContact O-N 3.19Å; S35-S39 PolarHBondContact O-OG 3.4Å; T36-S39 WeakPolarHBondContact O-CB 3.46Å; T36-S39 PolarHBondContact O-N 3.16Å; T36-S39 VanDerWaalsContact O-N 3.15Å; M37-S39 VanDerWaalsContact C-N 3.29Å; M37-S39 PolarHBondContact O-N 2.91Å
40S49.3Very low54.9Low88 Ų88119.8 Ų119.862%0.61568%0.679SS**THydrogen-bonded Turntrans-81.2-16.2-179.438.90000115.6T36 M37T36-S40 PolarHBondContact O-N 2.89Å; M37-S40 PolarHBondContact O-OG 3.43Å
41S48.8Very low52Low102 Ų102120.8 Ų120.871%0.71369%0.688SS**SBendtrans-101.7-6.7-174.5-58.20000114.6A43S41-A43 VanDerWaalsContact C-N 3.29Å; S41-A43 PolarHBondContact O-N 2.87Å; S41-A43 VanDerWaalsContact O-N 3.16Å
42G43.2Very low49.3Very low75 Ų75121.6 Ų121.677%0.77370%0.702SS**  trans-83.125.6-171.100000116.7
43A43Very low46.9Very low80 Ų80120.4 Ų120.466%0.66172%0.719SS**  trans-124.429.3-162.800000115.6S41S41-A43 VanDerWaalsContact C-N 3.29Å; S41-A43 PolarHBondContact O-N 2.87Å; S41-A43 VanDerWaalsContact O-N 3.16Å
44M42.8Very low44.2Very low179 Ų179121.1 Ų121.188%0.88274%0.736SS**  trans-120.1130.7179.2-63-61.8152.100112.8
45S41.7Very low42.1Very low112 Ų112123.6 Ų123.678%0.78375%0.747SS**  trans-66.6141.1-169.2178.80000115.5
46A32.9Very low40.3Very low101 Ų101128.8 Ų128.884%0.83576%0.764SS**  trans-155.9104144.900000111.9
47N42.5Very low38.5Very low148 Ų148130.2 Ų130.279%0.79178%0.777SS**  trans-80.7119.8159.7-76.9-76.1000108.7
48H31.2Very low37.3Very low195 Ų195129.6 Ų129.690%0.90379%0.787SS**  trans-158.9128.6150-109.1-72.9000112.1
49R34.4Very low36.1Very low201 Ų201128.3 Ų128.376%0.75879%0.789SS**  trans-122.5112.6174.5-177.8-172-169.7-1413.9108.8
50P37.4Very low35.1Very low123 Ų123132.3 Ų132.380%0.79980%0.802SS**  trans-73.1149.8170.130.6-32.9000110.5
51L31Very low34.1Very low132 Ų132133.6 Ų133.669%0.69181%0.811SS**  trans-128.6122178.4-89.2174.5000111.8
52S31.1Very low33.2Very low121 Ų121135.9 Ų135.985%0.84682%0.82SS**  trans71.9171.5143.8-148.20000119.6
53A29.1Very low32.5Very low100 Ų100135.7 Ų135.783%0.82682%0.818SS**  trans65.1128-176.800000116.3
54G26Very low31.8Very low78 Ų78140.6 Ų140.680%0.80483%0.83SS**  cis155.8130-12.200000113.3
55Y30.4Very low31.1Very low231 Ų231136.6 Ų136.691%0.90683%0.825SS**  trans-145.3162.7155.574.8-97000110
56E26.6Very low30.5Very low177 Ų177136.4 Ų136.483%0.82783%0.83SS**  trans-84.6154.3-152.7-58.4-169.7125.400115.9
57S26.3Very low30.2Very low121 Ų121134.9 Ų134.985%0.84683%0.825SS**  trans-90.2102.5164.9-63.50000109.9S59S57-S59 PolarHBondContact O-N 2.8Å
58S28.3Very low29.5Very low123 Ų123136.4 Ų136.486%0.8683%0.832SS**  trans-67.6111.5165.4-71.70000109.8
59S30.3Very low29.4Very low110 Ų110132.3 Ų132.377%0.76983%0.831SS**  trans-78131.2176.149.30000111.3S57S57-S59 PolarHBondContact O-N 2.8Å
60L30.8Very low29.1Very low181 Ų181126.4 Ų126.495%0.94883%0.834SS**  trans-133.5134.8156.9-84178000110
61S29.2Very low28.8Very low116 Ų116130.4 Ų130.481%0.81184%0.839SS**  trans-100.5168.5-171.648.60000112.4
62V28.1Very low29.4Very low149 Ų149130.2 Ų130.290%0.90385%0.846SS**  trans-72.5133.6173.2174.40000110.3
63G29Very low29.3Very low71 Ų71127.1 Ų127.173%0.73283%0.832SS**  trans-152.4143.4167.800000110.6
64M28.3Very low29.6Very low184 Ų184130 Ų13091%0.90684%0.839SS**  trans-123.4136-176.7-95.7-149.2179.200113.4
65A28Very low29.7Very low95 Ų95129.3 Ų129.379%0.78583%0.832SS**  trans69156.8143.700000120.5
66A29.1Very low29.7Very low108 Ų108129 Ų12989%0.89384%0.836SS**  trans66.2132.6-177.200000116.2
67G27.8Very low29.7Very low69 Ų69123.8 Ų123.871%0.71183%0.83SS**  cis173171.5-10.300000114.5
68L27.7Very low29.9Very low179 Ų179121.9 Ų121.994%0.93783%0.83SS**  trans72.2134.6165.1-58.1173000120.4
69A29.1Very low30.1Very low109 Ų109122.1 Ų122.190%0.90183%0.831SS**  trans64.5142.515100000121.5
70G28.3Very low30.1Very low78 Ų78120.6 Ų120.680%0.80483%0.832SS**  trans121.679.7157.600000118.6
71F30.5Very low30.1Very low207 Ų207114.7 Ų114.791%0.90882%0.816SS**  trans-91161.9138.9-86.2-84.8000107.3
72P43.3Very low30.2Very low128 Ų128120.5 Ų120.583%0.83182%0.822SS**  cis-120.3-168.817.943.3-29.1000112.4
73G29.5Very low30.3Very low55 Ų55117.5 Ų117.557%0.56782%0.82SS**  cis162.8-174.5-3.900000111.1
74V35.2Very low30.2Very low161 Ų161118 Ų11898%0.97683%0.826SS**  trans57.7158.5179.1-54.90000116.5
75G27.9Very low30.2Very low63 Ų63114.5 Ų114.565%0.64982%0.82SS**  cis149.7151.1-8.700000112.2
76F29.5Very low30.3Very low224 Ų224115.6 Ų115.698%0.98282%0.816SS**  trans66.4153.9-177-84-107.6000117.4
77G28.4Very low30.2Very low68 Ų68118.3 Ų118.370%0.70181%0.81SS**  cis152.4110.3-16.400000116.8
78G29Very low30.2Very low82 Ų82122.1 Ų122.185%0.84581%0.814SS**  trans83.6174.6165.700000116.7
79S33.9Very low30.2Very low128 Ų128120.3 Ų120.390%0.89581%0.806SS**  cis-169.6129.7-21.3-1720000111.4
80G29.3Very low30.3Very low77 Ų77125.7 Ų125.779%0.79480%0.803SS**  trans70.5161.7169.900000116.8
81G30.2Very low30.2Very low58 Ų58127.6 Ų127.660%0.59880%0.802SS**  cis168.3168.3-9.200000113.5
82Y32.1Very low30.1Very low238 Ų238123.9 Ų123.993%0.93380%0.802SS**  trans71.2148.1162.6-37.1-74.6000119.1
83G30.3Very low29.5Very low85 Ų85128.7 Ų128.788%0.87680%0.804SS**  trans120102166.900000115
84G27.3Very low29.7Very low83 Ų83132.3 Ų132.386%0.85682%0.817SS**  trans-147.8135.4172.400000112.7
85S27.6Very low29.5Very low110 Ų110135.7 Ų135.777%0.76981%0.812SS**  trans-165.6112168-171.80000105.8
86V30.3Very low29.5Very low117 Ų117140.8 Ų140.871%0.70982%0.824SS**  70.5105.374.5176.60000112.4
87E27.8Very low29.5Very low166 Ų166134.7 Ų134.778%0.77681%0.809SS**  trans46.2123.7143.8-57.617415600121.1
88N26.1Very low29.3Very low148 Ų148140.8 Ų140.879%0.79181%0.812SS**  -164.6155.6106.7-114-80.7000114.8
89N28.6Very low29.3Very low141 Ų141142.6 Ų142.675%0.75480%0.802SS**  trans-116.7127.5171.9-92.3-51.8000110
90R30.7Very low29Very low222 Ų222139.3 Ų139.384%0.83879%0.789SS**  trans-174.8119.8134.5-109.6160.8-89.1-134.71.9115.3
91C26.6Very low29.1Very low118 Ų118144.3 Ų144.380%0.79780%0.795SS**  trans39.4124.9135.2-53.60000122
92S28.3Very low29Very low129 Ų129146.6 Ų146.690%0.90280%0.802SS**  -156.6125.9127.9-80.90000111.5
93R30.3Very low28.8Very low230 Ų230143.5 Ų143.587%0.86879%0.794SS**  trans-103.7160.1159.5-89.9-177.4168.9174.6-2.3107.8
94P33.8Very low28.8Very low131 Ų131146 Ų14685%0.85178%0.781SS**  -139.3169109.232.7-18.1000114.3
95R32.7Very low28.9Very low232 Ų232152.6 Ų152.688%0.87578%0.78SS**  trans-111.7151.3171.1-105.3-162.6-178.8-168.55.4110
96L27.7Very low29Very low170 Ų170150.5 Ų150.589%0.8977%0.769SS**  trans-170.6154.4149.2-124.875.1000106
97S28.1Very low29.1Very low95 Ų95155 Ų15566%0.66478%0.775SS**  cis-146.8-150.1-6.3-163.60000105.8
98Y23.9Very low29.1Very low197 Ų197154.9 Ų154.977%0.77377%0.774SS**  cis-168.7149.7-3.3-159.3-142.8000105.7
99D29.6Very low29.3Very low120 Ų120153 Ų15364%0.64277%0.772SS**  cis-147.1175.9-9.3-159.92.1000108.7
100G27.5Very low29.3Very low59 Ų59155.6 Ų155.661%0.60878%0.779SS**  trans-115.1145.5172.800000114
101I32.6Very low29.3Very low182 Ų182148.6 Ų148.693%0.93378%0.776SS**  trans-86.4135.7-175.3-56.5174.7000111.9
102S28.2Very low29.5Very low105 Ų105147.5 Ų147.573%0.73478%0.776SS**  trans-76146.1-167.1178.80000116.6
103F27.7Very low29.6Very low174 Ų174146.8 Ų146.876%0.76377%0.771SS**  trans-147.3107.8145.1-147.1-110.1000114.9
104K29.8Very low29.5Very low138 Ų138140.5 Ų140.560%0.677%0.768SS**  trans54.8115.4153-68.6-173.7-174.7167.70121.7
105R29.7Very low29.2Very low221 Ų221138.2 Ų138.283%0.83476%0.76SS**  68.8139.8116.9-175.5-161.1-72.8-175-6.7119
106A28.7Very low29Very low66 Ų66133.2 Ų133.255%0.54576%0.755SS.*  cis-175.1171.5-21.100000108.4
107Y31.9Very low28.9Very low211 Ų211131.3 Ų131.383%0.82776%0.756SS**  trans72153.5176.8-53.2-79.1000116.1
108E28.8Very low28.9Very low163 Ų163134.3 Ų134.376%0.76276%0.764SS**  cis174.5163.2-43.2173.7160.3-135.400107.3
109C29.3Very low29.2Very low110 Ų110129.4 Ų129.474%0.74376%0.758SS**  trans67.7128.2-170.1-62.30000114.7
110E29.1Very low29.1Very low194 Ų194129.2 Ų129.291%0.90777%0.767SS**  cis95.113736.7-174.6176.1-143.800112.9
111G30.3Very low29.3Very low76 Ų76133.9 Ų133.978%0.78477%0.774SS**  trans131.3120.1176.400000112.2
112A31.3Very low29.1Very low95 Ų95131.9 Ų131.979%0.78577%0.766SS**  trans-125.9154.8-173.400000113.6
113S31.1Very low28.9Very low114 Ų114132 Ų13280%0.79777%0.767SS**  trans61.1101.1148.8-61.10000121
114A27.3Very low29.1Very low98 Ų98131 Ų13181%0.8177%0.768SS**  81.6143.6111.700000123.2
115A28.3Very low29.3Very low82 Ų82135 Ų13568%0.67878%0.781SS**  trans85.398.9142.800000121.8
116T28Very low30.2Very low127 Ų127129.6 Ų129.678%0.77978%0.775SS**  60129.8128.560.10000122.1
117S25.8Very low30.2Very low130 Ų130133.8 Ų133.891%0.90979%0.788SS**  -167.7162.5121.9-88.60000115.6
118L28.4Very low30.3Very low159 Ų159130.5 Ų130.583%0.83279%0.785SS**  trans-79.1144.9-156.5-145.972.2000117.8
119S28.8Very low30.4Very low93 Ų93127.3 Ų127.365%0.6579%0.786SS**  trans45.6126.5139.964.80000124.2
120S27.6Very low30.5Very low117 Ų117126 Ų12682%0.81879%0.792SS**  trans168.6150.3131.2-80.50000109.8
121M32.6Very low30.5Very low156 Ų156120.5 Ų120.577%0.76879%0.787SS**  cis172.9122.7-21.4-113.4-89.6179.900106.4
122N28.8Very low31Very low140 Ų140124.7 Ų124.775%0.74979%0.79SS**  trans71.8154.7154.7-65.8-15000124.6
123S24.3Very low31.2Very low108 Ų108126.9 Ų126.976%0.75580%0.795SS**  trans78.7137.6158.1-62.20000118.2
124L31Very low31.5Very low152 Ų152125.3 Ų125.380%0.79679%0.788SS**  cis-157.1154.9-5.2-150.473.2000111.2
125Y34.5Very low31.8Very low222 Ų222128.9 Ų128.987%0.87179%0.794SS**  trans-123.2153.4159.1-89.7-72000107.1
126P47.7Very low32.6Very low109 Ų109128 Ų12871%0.70879%0.792SS**  cis-130.3-158.343.436.7-13.8000111.8
127D29.4Very low33.1Very low153 Ų153130 Ų13082%0.81879%0.793SS**  cis-155.7173.318.1-155.65.7000115.2
128N34.5Very low33.6Very low142 Ų142129.8 Ų129.876%0.75979%0.786SS**  trans-65.8129.5-171.8161.950.1000117.3
129A30.6Very low34.7Very low96 Ų96127.9 Ų127.979%0.79379%0.786SS**  trans-159.2141.314200000110.9
130G31.6Very low35.6Very low83 Ų83129.5 Ų129.586%0.85679%0.786SS**  trans-82.2156.3-171.200000116.3
131G29.5Very low36.5Very low79 Ų79131.5 Ų131.581%0.81479%0.787SS**  trans-162.2157.6172.900000110.9
132L40.1Very low37.4Very low163 Ų163131.5 Ų131.585%0.85379%0.79SS**  trans-106.7167.1178.1-75166000110.9
133T35.1Very low38.3Very low142 Ų142132.8 Ų132.887%0.87179%0.792SS**  trans72.2151.9178.475.50000115.1
134A37.3Very low39.7Very low80 Ų80133.3 Ų133.366%0.66179%0.79SS**  cis-167.4163.4-26.900000108.6
135D34.9Very low40.4Very low173 Ų173133.2 Ų133.293%0.92579%0.79SS**  trans59.3171.8175.5-56.2-32.6000115.3
136G43.2Very low41.4Very low63 Ų63130.2 Ų130.265%0.64979%0.788SS**  trans149-133.8-174.100000113.2
137E39.4Very low41.4Very low171 Ų171132.2 Ų132.280%0.79979%0.792SS**  trans-135.5133.6-161.137.7-99.892.800116.1
138T35.3Very low42.2Very low125 Ų125130.7 Ų130.777%0.76778%0.783SS**  trans175.789.1139.936.10000104.7I140T138-I140 VanDerWaalsContact C-N 3.29Å
139S52.8Low43.3Very low118 Ų118130.4 Ų130.483%0.82578%0.781SS**  48.148.854.4-158.80000112.5
140I48.2Very low44.3Very low127 Ų127133.8 Ų133.865%0.65178%0.781SS**  trans-116.238.7173.7-162.4167.5000110.7T138T138-I140 VanDerWaalsContact C-N 3.29Å
141L44.7Very low45.2Very low159 Ų159136.6 Ų136.683%0.83278%0.776SS**  trans-115.531.2176-63.6178.5000111.3
142D51.7Low46.2Very low157 Ų157137.5 Ų137.584%0.8476%0.76SS**SBendtrans-125.116.9173.3-155.536.5000111.3
143E49.4Very low46.5Very low167 Ų167135.4 Ų135.478%0.7875%0.75SS**  trans-115.761.5164.2-73.4-172.2164.300108.6
144V52Low46.9Very low118 Ų118133.9 Ų133.972%0.71574%0.744SS**  trans-101.477.5163.9-173.40000107.3I146V144-I146 PolarHBondContact O-N 3.33Å
145D47.2Very low47.2Very low150 Ų150135.9 Ų135.980%0.80274%0.742SS**  trans-54.2125.1164.1-90.7-33.5000108.2L147D145-L147 PolarHBondContact O-N 3.22Å
146I54Low47.8Very low160 Ų160132.8 Ų132.882%0.82173%0.726SS**  trans-70.798.5176.2-59.3174000106.3V144 D148V144-I146 PolarHBondContact O-N 3.33Å; I146-D148 PolarHBondContact O-N 3.48Å
147L48.9Very low47.9Very low151 Ų151138 Ų13879%0.79173%0.734SS**  trans-55.9112.2174.1-75.3170.1000108.8D145 L149D145-L147 PolarHBondContact O-N 3.22Å; L147-L149 PolarHBondContact O-N 3.49Å; L147-L149 VanDerWaalsContact O-N 3.08Å
148D46.4Very low48.3Very low120 Ų120135.2 Ų135.264%0.64272%0.724SS**  trans-71.2105.7-175-149.7-13.8000109I146 E150 D151I146-D148 PolarHBondContact O-N 3.48Å; D148-E150 PolarHBondContact O-N 3.11Å; D148-D151 PolarHBondContact O-N 3.24Å
149L56.2Low48.8Very low137 Ų137136 Ų13672%0.71772%0.719SS**G310 helixtrans-70.1-18.4-168-76166.8000112.8L147 D151 M152L147-L149 PolarHBondContact O-N 3.49Å; L147-L149 VanDerWaalsContact O-N 3.08Å; L149-D151 VanDerWaalsContact C-N 3.29Å; L149-D151 PolarHBondContact O-N 2.87Å; L149-M152 PolarHBondContact O-N 3.01Å
150E51.8Low48.3Very low167 Ų167138.2 Ų138.278%0.7872%0.722SS**G310 helixtrans-71.1-19.4-178.9-60.3-167.8167.600113.2D148D148-E150 PolarHBondContact O-N 3.11Å
151D52.3Low48.3Very low141 Ų141134.8 Ų134.875%0.75471%0.709SS**G310 helixtrans-87.7-10.9176-94.1-10.4000113.7D148 L149D148-D151 PolarHBondContact O-N 3.24Å; L149-D151 VanDerWaalsContact C-N 3.29Å; L149-D151 PolarHBondContact O-N 2.87Å
152M50.2Low48.6Very low98 Ų98137.1 Ų137.148%0.48371%0.707SS.*SBendtrans-95-4.7-177.6-98.6-60.4-56.500115.3L149 C154 L155L149-M152 PolarHBondContact O-N 3.01Å; M152-C154 PolarHBondContact O-N 3.14Å; M152-L155 HydrophobicContact CE-CB 4.37Å; M152-L155 HydrophobicContact SD-CD1 4.15Å
153D45.4Very low48.4Very low120 Ų120136.4 Ų136.464%0.64270%0.702SS**G310 helixtrans-68.9-23.3173.9-78.7-22.5000112.3L155 N156D153-L155 PolarHBondContact O-N 3.04Å; D153-L155 VanDerWaalsContact O-N 3.11Å; D153-N156 PolarHBondContact O-N 2.79Å
154C43.2Very low48.3Very low110 Ų110138 Ų13874%0.74370%0.703SS**G310 helixtrans-73.12.9-178.8-69.40000115.5M152M152-C154 PolarHBondContact O-N 3.14Å
155L44.2Very low47.7Very low121 Ų121138.4 Ų138.463%0.63470%0.697SS**G310 helixtrans-125.56.3179.3-68177.7000114.2M152 D153M152-L155 HydrophobicContact CE-CB 4.37Å; M152-L155 HydrophobicContact SD-CD1 4.15Å; D153-L155 PolarHBondContact O-N 3.04Å; D153-L155 VanDerWaalsContact O-N 3.11Å
156N46.7Very low47.7Very low109 Ų109135.2 Ų135.258%0.58369%0.686SS**SBendtrans-106-2.5-177.7-88.1-67.1000115.4D153D153-N156 PolarHBondContact O-N 2.79Å
157E45.9Very low47.2Very low173 Ų173136.8 Ų136.881%0.80869%0.687SS**SBendtrans-82.1-13177.1-60.5-161.2136.400113.8
158D48.7Very low47.1Very low111 Ų111133.2 Ų133.259%0.59467%0.668SS**SBendtrans-85.4-23.2-172.2-82.8-45.7000115.1S161 W162D158-S161 PolarHBondContact O-N 3.34Å; D158-W162 PolarHBondContact O-NE1 3.47Å; D158-W162 VanDerWaalsContact O-NE1 3.15Å
159E44.4Very low47Very low143 Ų143135 Ų13567%0.66868%0.678SS**SBendtrans-79.2-28.3-166.2-148.9174129.300114S161 W162E159-S161 VanDerWaalsContact C-N 3.35Å; E159-W162 HydrophobicContact CG-CZ2 4.38Å
160D43.7Very low46.3Very low164 Ų164130.5 Ų130.588%0.87766%0.658SS**G310 helixtrans-77.9-17.6172.9-94.9-31.9000113.1W162D160-W162 PolarHBondContact O-N 3.39Å
161S46.8Very low45.9Very low55 Ų55128.3 Ų128.339%0.38566%0.658SS.*G310 helixtrans-74.6-9.3-174.7-67.80000114.1D158 E159 L163 E165D158-S161 PolarHBondContact O-N 3.34Å; E159-S161 VanDerWaalsContact C-N 3.35Å; S161-L163 PolarHBondContact O-N 3.39Å; S161-L163 VanDerWaalsContact O-N 3.09Å; S161-E165 PolarHBondContact O-N 3.43Å
162W52Low45.7Very low208 Ų208128.1 Ų128.179%0.78866%0.656SS**G310 helixtrans-69.4-10.8-170.4-6715.8000114.8D158 E159 D160D158-W162 PolarHBondContact O-NE1 3.47Å; D158-W162 VanDerWaalsContact O-NE1 3.15Å; E159-W162 HydrophobicContact CG-CZ2 4.38Å; D160-W162 PolarHBondContact O-N 3.39Å
163L47.3Very low45.7Very low142 Ų142127 Ų12774%0.74365%0.65SS**G310 helixtrans-89.5-20.8-175.3-162.459.8000114.7S161S161-L163 PolarHBondContact O-N 3.39Å; S161-L163 VanDerWaalsContact O-N 3.09Å
164Y47.2Very low46Very low200 Ų200129.1 Ų129.178%0.78465%0.653SS**THydrogen-bonded Turntrans-135.21.8-177.9-81.3-73.3000116.9S166Y164-S166 VanDerWaalsContact C-N 3.3Å; Y164-S166 PolarHBondContact O-N 3.39Å
165E38.9Very low46.5Very low126 Ų126129.5 Ų129.559%0.58965%0.653SS**  trans-72.680.2177.3-150.863.8-164.300112.4S161 K167S161-E165 PolarHBondContact O-N 3.43Å; E165-K167 PolarHBondContact O-N 3Å; E165-K167 VanDerWaalsContact O-N 3.14Å
166S46.8Very low47.1Very low83 Ų83127.8 Ų127.858%0.5864%0.643SS**  trans-62.3114.9170.263.10000108.8Y164 L168Y164-S166 VanDerWaalsContact C-N 3.3Å; Y164-S166 PolarHBondContact O-N 3.39Å; S166-L168 WeakPolarHBondContact O-CG 3.27Å; S166-L168 PolarHBondContact O-N 2.96Å
167K44.6Very low48.1Very low194 Ų194125.9 Ų125.984%0.84364%0.639SS**  trans-59.492.9-177.6-70.1-173.4176.5-176.40111.9E165 N169E165-K167 PolarHBondContact O-N 3Å; E165-K167 VanDerWaalsContact O-N 3.14Å; K167-N169 PolarHBondContact O-N 3.24Å
168L45.8Very low49.2Very low75 Ų75122.4 Ų122.439%0.39363%0.631SS.*  trans-69.296.8174.3-61.7179.6000108.7S166 S170 Q173S166-L168 WeakPolarHBondContact O-CG 3.27Å; S166-L168 PolarHBondContact O-N 2.96Å; L168-S170 PolarHBondContact O-N 3.28Å; L168-Q173 HydrophobicContact CB-CB 3.96Å; L168-Q173 HydrophobicContact CD1-CB 3.97Å; L168-Q173 HydrophobicContact CD2-CB 4.36Å; L168-Q173 HydrophobicContact CG-CB 4.31Å
169N45.4Very low50.5Low158 Ų158122.6 Ų122.685%0.84563%0.631SS**SBendtrans-73.552.1-178.8-86.5-23000112.9K167K167-N169 PolarHBondContact O-N 3.24Å
170S40.6Very low51.8Low43 Ų43119.1 Ų119.130%0.30162%0.619SS.*SBendtrans-173.3140.4158.8-175.50000110.1L168 L172 Q173L168-S170 PolarHBondContact O-N 3.28Å; S170-L172 PolarHBondContact O-N 3.19Å; S170-L172 PolarHBondContact OG-N 3.35Å; S170-Q173 PolarHBondContact O-N 2.91Å; S170-Q173 VanDerWaalsContact O-N 3.15Å
171P44.5Very low53.5Low120 Ų120117.2 Ų117.278%0.77960%0.6SS**G310 helixtrans-53.4-26.2169.9-26.635.5000114Q173P171-Q173 PolarHBondContact O-N 3.47Å
172L46.9Very low54.9Low137 Ų137117.2 Ų117.272%0.71760%0.599SS**G310 helixtrans-68.6-11.8-179.7-76.3159.6000114.9S170S170-L172 PolarHBondContact O-N 3.19Å; S170-L172 PolarHBondContact OG-N 3.35Å
173Q51.3Low56.2Low76 Ų76115 Ų11536%0.35559%0.591SS.*G310 helixtrans-92.6-14.1-178.1-70.5-175.5-20.800113.8L168 S170 P171 T175L168-Q173 HydrophobicContact CB-CB 3.96Å; L168-Q173 HydrophobicContact CD1-CB 3.97Å; L168-Q173 HydrophobicContact CD2-CB 4.36Å; L168-Q173 HydrophobicContact CG-CB 4.31Å; S170-Q173 PolarHBondContact O-N 2.91Å; S170-Q173 VanDerWaalsContact O-N 3.15Å; P171-Q173 PolarHBondContact O-N 3.47Å; Q173-T175 PolarHBondContact O-N 2.97Å
174K51.9Low57.5Low164 Ų164113.2 Ų113.271%0.71358%0.579SS**THydrogen-bonded Turntrans-74.2-4.9179.8-70.9-160.5171.4-158.80114.8
175T52.6Low58.8Low118 Ų118106.9 Ų106.972%0.72456%0.561SS**THydrogen-bonded Turntrans-107.9-3-176.854.80000114.4Q173Q173-T175 PolarHBondContact O-N 2.97Å
176L56.8Low60.2Low84 Ų84107.6 Ų107.644%0.4457%0.568SS.*SBendtrans-102.1115.7-178.5-66.6174.3000110.7V180L176-V180 HydrophobicContact CD2-CG1 4.15Å
177S67.5Low61.7Low69 Ų69108.6 Ų108.648%0.48357%0.567SS.*  trans-55.3140.1172.11800000110.6I179 V180 W181S177-I179 PolarHBondContact O-N 2.9Å; S177-V180 WeakPolarHBondContact O-CA 3.29Å; S177-V180 WeakPolarHBondContact O-CB 3.42Å; S177-V180 PolarHBondContact O-N 3.49Å; S177-W181 PolarHBondContact O-N 3.49Å
178P70.1Confident63Low100 Ų100104 Ų10465%0.64955%0.551SS**Hα-helixtrans-53.5-33.6-175-30.536.2000114.7V180 W181 C182P178-V180 VanDerWaalsContact C-N 3.33Å; P178-V180 PolarHBondContact O-N 3.42Å; P178-W181 PolarHBondContact O-N 3.37Å; P178-C182 WeakPolarHBondContact O-CB 3.34Å; P178-C182 PolarHBondContact O-N 2.87Å; P178-C182 PolarHBondContact O-SG 2.7Å; P178-C182 VanDerWaalsContact O-SG 3.32Å
179I74.8Confident64.5Low115 Ų115103 Ų10359%0.5955%0.55SS*.Hα-helixtrans-66.9-33.6175.8-167.661.4000112.6S177 R183S177-I179 PolarHBondContact O-N 2.9Å; I179-R183 WeakPolarHBondContact O-CG 3.44Å; I179-R183 PolarHBondContact O-N 3.05Å; I179-R183 VanDerWaalsContact O-N 3.14Å
180V73.2Confident66.1Low71 Ų7198.2 Ų98.243%0.4353%0.528SS..Hα-helixtrans-73.5-39.5175.2-177.70000110.2L176 S177 P178 R183 Q184L176-V180 HydrophobicContact CD2-CG1 4.15Å; S177-V180 WeakPolarHBondContact O-CA 3.29Å; S177-V180 WeakPolarHBondContact O-CB 3.42Å; S177-V180 PolarHBondContact O-N 3.49Å; P178-V180 VanDerWaalsContact C-N 3.33Å; P178-V180 PolarHBondContact O-N 3.42Å; V180-R183 PolarHBondContact O-N 2.79Å; V180-Q184 VanDerWaalsContact O-CB 3.28Å; V180-Q184 WeakPolarHBondContact O-CB 3.34Å; V180-Q184 PolarHBondContact O-N 3.37Å
181W78.8Confident68Low124 Ų124101 Ų10147%0.4755%0.545SS..Hα-helixtrans-60.9-49.7173-178.589.3000111.8S177 P178 R183 Q184 T185S177-W181 PolarHBondContact O-N 3.49Å; P178-W181 PolarHBondContact O-N 3.37Å; W181-R183 VanDerWaalsContact C-N 3.3Å; W181-R183 PolarHBondContact O-N 2.9Å; W181-Q184 PolarHBondContact O-N 3.04Å; W181-Q184 VanDerWaalsContact O-N 3.16Å; W181-T185 PolarHBondContact O-N 3.25Å; W181-T185 PolarHBondContact O-OG1 2.88Å
182C75.8Confident69.9Low55 Ų55102.7 Ų102.737%0.37254%0.543SS..Hα-helixtrans-56.1-43.7176.9-73.80000112.1P178 L186P178-C182 WeakPolarHBondContact O-CB 3.34Å; P178-C182 PolarHBondContact O-N 2.87Å; P178-C182 PolarHBondContact O-SG 2.7Å; P178-C182 VanDerWaalsContact O-SG 3.32Å; C182-L186 WeakPolarHBondContact O-CB 3.22Å; C182-L186 WeakPolarHBondContact O-CD1 3.45Å; C182-L186 VanDerWaalsContact O-CG 3.25Å; C182-L186 WeakPolarHBondContact O-CG 3.33Å; C182-L186 PolarHBondContact O-N 3.49Å; C182-L186 VanDerWaalsContact O-N 3.16Å
183R80.4Confident71.6Confident160 Ų160101.9 Ų101.960%0.60454%0.537SS*.Hα-helixtrans-65.4-49.3174.9-71.6-171.868.2-157.9-3.3111.7I179 V180 W181 T185 L186 D187I179-R183 WeakPolarHBondContact O-CG 3.44Å; I179-R183 PolarHBondContact O-N 3.05Å; I179-R183 VanDerWaalsContact O-N 3.14Å; V180-R183 PolarHBondContact O-N 2.79Å; W181-R183 VanDerWaalsContact C-N 3.3Å; W181-R183 PolarHBondContact O-N 2.9Å; R183-T185 VanDerWaalsContact C-N 3.27Å; R183-T185 PolarHBondContact O-N 3.45Å; R183-L186 PolarHBondContact O-N 2.79Å; R183-L186 VanDerWaalsContact O-N 3.08Å; R183-D187 IonicContact NE-OD2 3.89Å; R183-D187 IonicContact NH2-OD2 3.88Å; R183-D187 VanDerWaalsContact O-CB 3.25Å; R183-D187 WeakPolarHBondContact O-CB 3.29Å; R183-D187 VanDerWaalsContact O-CG 3.28Å; R183-D187 PolarHBondContact O-N 3.12Å
184Q74.6Confident73.3Confident105 Ų105101.6 Ų101.649%0.49154%0.536SS..Hα-helixtrans-54.1-41.6178.6-176.961.127.500112.5V180 W181 N188V180-Q184 VanDerWaalsContact O-CB 3.28Å; V180-Q184 WeakPolarHBondContact O-CB 3.34Å; V180-Q184 PolarHBondContact O-N 3.37Å; W181-Q184 PolarHBondContact O-N 3.04Å; W181-Q184 VanDerWaalsContact O-N 3.16Å; Q184-N188 PolarHBondContact NE2-ND2 2.88Å; Q184-N188 VanDerWaalsContact NE2-ND2 3.2Å; Q184-N188 VanDerWaalsContact O-CB 3.32Å; Q184-N188 WeakPolarHBondContact O-CB 3.37Å; Q184-N188 PolarHBondContact O-N 3.48Å; Q184-N188 PolarHBondContact O-ND2 2.85Å
185T72.8Confident74.9Confident67 Ų6797 Ų9741%0.41152%0.524SS..Hα-helixtrans-74.5-29179-57.70000113.9W181 R183W181-T185 PolarHBondContact O-N 3.25Å; W181-T185 PolarHBondContact O-OG1 2.88Å; R183-T185 VanDerWaalsContact C-N 3.27Å; R183-T185 PolarHBondContact O-N 3.45Å
186L70.2Confident76.8Confident142 Ų14294.1 Ų94.174%0.74351%0.512SS*.Hα-helixtrans-84.9-38.3176.9-69.9171.3000112.6C182 R183 N188C182-L186 WeakPolarHBondContact O-CB 3.22Å; C182-L186 WeakPolarHBondContact O-CD1 3.45Å; C182-L186 VanDerWaalsContact O-CG 3.25Å; C182-L186 WeakPolarHBondContact O-CG 3.33Å; C182-L186 PolarHBondContact O-N 3.49Å; C182-L186 VanDerWaalsContact O-N 3.16Å; R183-L186 PolarHBondContact O-N 2.79Å; R183-L186 VanDerWaalsContact O-N 3.08Å; L186-N188 VanDerWaalsContact C-N 3.34Å
187D78Confident78.3Confident104 Ų10496.8 Ų96.856%0.55652%0.52SS*.Hα-helixtrans-74.8-24.9177.6-65.4-32.3000111.4R183R183-D187 IonicContact NE-OD2 3.89Å; R183-D187 IonicContact NH2-OD2 3.88Å; R183-D187 VanDerWaalsContact O-CB 3.25Å; R183-D187 WeakPolarHBondContact O-CB 3.29Å; R183-D187 VanDerWaalsContact O-CG 3.28Å; R183-D187 PolarHBondContact O-N 3.12Å
188N71.8Confident79.4Confident96 Ų96100.1 Ų100.151%0.51352%0.522SS..SBendtrans-127.774.8175.8-55.5-99.3000110.8Q184 L186Q184-N188 PolarHBondContact NE2-ND2 2.88Å; Q184-N188 VanDerWaalsContact NE2-ND2 3.2Å; Q184-N188 VanDerWaalsContact O-CB 3.32Å; Q184-N188 WeakPolarHBondContact O-CB 3.37Å; Q184-N188 PolarHBondContact O-N 3.48Å; Q184-N188 PolarHBondContact O-ND2 2.85Å; L186-N188 VanDerWaalsContact C-N 3.34Å
189P76.3Confident80.5Confident55 Ų5598.4 Ų98.436%0.35751%0.512SS..  trans-63.5141.2179.827.3-35.2000111.7M193 E194P189-M193 HydrophobicContact CB-CG 4.32Å; P189-E194 HydrophobicContact CB-CG 4.11Å; P189-E194 HydrophobicContact CG-CG 3.94Å
190S78.6Confident81.4Confident57 Ų5796.7 Ų96.740%0.39950%0.504SS..  trans-64.3151.7176.977.40000111.5E192 M193 E194S190-E192 PolarHBondContact O-N 3Å; S190-E192 VanDerWaalsContact O-N 3.15Å; S190-M193 WeakPolarHBondContact O-CB 3.41Å; S190-M193 PolarHBondContact O-N 2.85Å; S190-M193 WeakPolarHBondContact OG-CB 3.34Å; S190-M193 PolarHBondContact OG-N 3.43Å; S190-E194 PolarHBondContact O-N 2.98Å
191P80.4Confident82.4Confident101 Ų10197.3 Ų97.366%0.65650%0.504SS*.Hα-helixtrans-60.4-26.3177.923.6-34.1000112.7S195P191-S195 VanDerWaalsContact O-CB 3.27Å; P191-S195 WeakPolarHBondContact O-CB 3.24Å; P191-S195 PolarHBondContact O-N 3.24Å; P191-S195 PolarHBondContact O-OG 2.99Å
192E84.4Confident83.1Confident156 Ų15696.9 Ų96.973%0.72951%0.507SS*.Hα-helixtrans-68.8-49170.2-176.9178.8-158.300111.8S190 E194 S195 A196S190-E192 PolarHBondContact O-N 3Å; S190-E192 VanDerWaalsContact O-N 3.15Å; E192-E194 VanDerWaalsContact C-N 3.33Å; E192-E194 PolarHBondContact O-N 3.3Å; E192-S195 CarbonylContact O-C 3.6Å; E192-S195 PolarHBondContact O-N 3.32Å; E192-A196 WeakPolarHBondContact O-CB 3.46Å; E192-A196 PolarHBondContact O-N 3.46Å
193M83.3Confident83.9Confident120 Ų120100 Ų10059%0.59151%0.511SS*.Hα-helixtrans-59-43.3176.7-179.562.570.900111.6P189 S190 S195 A196 K197P189-M193 HydrophobicContact CB-CG 4.32Å; S190-M193 WeakPolarHBondContact O-CB 3.41Å; S190-M193 PolarHBondContact O-N 2.85Å; S190-M193 WeakPolarHBondContact OG-CB 3.34Å; S190-M193 PolarHBondContact OG-N 3.43Å; M193-S195 VanDerWaalsContact C-N 3.33Å; M193-S195 PolarHBondContact O-N 3.37Å; M193-A196 PolarHBondContact O-N 2.91Å; M193-K197 WeakPolarHBondContact O-CB 3.47Å; M193-K197 PolarHBondContact O-N 3.24Å
194E86.6Confident84.5Confident71 Ų7197 Ų9733%0.33251%0.507SS..Hα-helixtrans-64-38173.8-62.3-157.4-40.100112.7P189 S190 E192 K197 R198P189-E194 HydrophobicContact CB-CG 4.11Å; P189-E194 HydrophobicContact CG-CG 3.94Å; S190-E194 PolarHBondContact O-N 2.98Å; E192-E194 VanDerWaalsContact C-N 3.33Å; E192-E194 PolarHBondContact O-N 3.3Å; E194-K197 WeakPolarHBondContact O-CB 3.47Å; E194-K197 PolarHBondContact O-N 2.93Å; E194-R198 WeakPolarHBondContact O-CB 3.26Å; E194-R198 VanDerWaalsContact O-CG 3.25Å; E194-R198 WeakPolarHBondContact O-CG 3.34Å; E194-R198 PolarHBondContact O-N 2.93Å; E194-R198 IonicContact OE1-CZ 3.19Å; E194-R198 IonicContact OE1-NH1 2.76Å; E194-R198 PolarHBondContact OE1-NH1 3.08Å; E194-R198 IonicContact OE1-NH2 2.73Å; E194-R198 PolarHBondContact OE1-NH2 3.49Å; E194-R198 IonicContact OE2-NH2 3.34Å; E194-R198 PolarHBondContact OE2-NH2 2.93Å
195S86.9Confident85.3Confident67 Ų6796.3 Ų96.347%0.46951%0.506SS..Hα-helixtrans-70.5-39179.5-62.40000111.8P191 E192 M193 R198 S199P191-S195 VanDerWaalsContact O-CB 3.27Å; P191-S195 WeakPolarHBondContact O-CB 3.24Å; P191-S195 PolarHBondContact O-N 3.24Å; P191-S195 PolarHBondContact O-OG 2.99Å; E192-S195 CarbonylContact O-C 3.6Å; E192-S195 PolarHBondContact O-N 3.32Å; M193-S195 VanDerWaalsContact C-N 3.33Å; M193-S195 PolarHBondContact O-N 3.37Å; S195-R198 PolarHBondContact O-N 2.88Å; S195-S199 VanDerWaalsContact O-CB 3.3Å; S195-S199 WeakPolarHBondContact O-CB 3.44Å; S195-S199 PolarHBondContact O-N 2.94Å
196A90.9Very high86.2Confident57 Ų5797.9 Ų97.947%0.47151%0.511SS..Hα-helixtrans-60.8-44.5170.100000111.3E192 M193 S199 L200E192-A196 WeakPolarHBondContact O-CB 3.46Å; E192-A196 PolarHBondContact O-N 3.46Å; M193-A196 PolarHBondContact O-N 2.91Å; A196-S199 PolarHBondContact O-N 3.04Å; A196-L200 WeakPolarHBondContact O-CB 3.39Å; A196-L200 PolarHBondContact O-N 2.86Å
197K88.6Confident87.1Confident140 Ų14095.5 Ų95.561%0.60950%0.503SS*.Hα-helixtrans-59.8-47.4173.9179.8177.8178.1178.80112.2M193 E194 S199 L200 I201M193-K197 WeakPolarHBondContact O-CB 3.47Å; M193-K197 PolarHBondContact O-N 3.24Å; E194-K197 WeakPolarHBondContact O-CB 3.47Å; E194-K197 PolarHBondContact O-N 2.93Å; K197-S199 PolarHBondContact O-N 2.99Å; K197-L200 PolarHBondContact O-N 3.31Å; K197-I201 HydrophobicContact CG-CD1 4.07Å; K197-I201 VanDerWaalsContact O-CG1 3.29Å; K197-I201 WeakPolarHBondContact O-CG1 3.39Å; K197-I201 PolarHBondContact O-N 3.39Å
198R90.4Very high87.1Confident140 Ų14095.6 Ų95.653%0.52850%0.503SS..Hα-helixtrans-61.3-42.2176.2-71.9166.8-175.1125.110.6111.8E194 S195 I201 H202E194-R198 WeakPolarHBondContact O-CB 3.26Å; E194-R198 VanDerWaalsContact O-CG 3.25Å; E194-R198 WeakPolarHBondContact O-CG 3.34Å; E194-R198 PolarHBondContact O-N 2.93Å; E194-R198 IonicContact OE1-CZ 3.19Å; E194-R198 IonicContact OE1-NH1 2.76Å; E194-R198 PolarHBondContact OE1-NH1 3.08Å; E194-R198 IonicContact OE1-NH2 2.73Å; E194-R198 PolarHBondContact OE1-NH2 3.49Å; E194-R198 IonicContact OE2-NH2 3.34Å; E194-R198 PolarHBondContact OE2-NH2 2.93Å; S195-R198 PolarHBondContact O-N 2.88Å; R198-I201 PolarHBondContact O-N 3.23Å; R198-H202 WeakPolarHBondContact O-CB 3.34Å; R198-H202 PolarHBondContact O-N 3.05Å
199S94.6Very high87.3Confident63 Ų6394.1 Ų94.144%0.44150%0.5SS..Hα-helixtrans-65.2-40.6176-176.70000112.8S195 A196 K197 H202 R203S195-S199 VanDerWaalsContact O-CB 3.3Å; S195-S199 WeakPolarHBondContact O-CB 3.44Å; S195-S199 PolarHBondContact O-N 2.94Å; A196-S199 PolarHBondContact O-N 3.04Å; K197-S199 PolarHBondContact O-N 2.99Å; S199-H202 PolarHBondContact O-N 3.43Å; S199-R203 WeakPolarHBondContact O-CG 3.35Å; S199-R203 PolarHBondContact O-N 3.42Å
200L92.9Very high86.9Confident79 Ų7994.4 Ų94.441%0.41451%0.507SS..Hα-helixtrans-64.4-45.7175.5-179.263000111.7A196 K197 H202 R203 L204A196-L200 WeakPolarHBondContact O-CB 3.39Å; A196-L200 PolarHBondContact O-N 2.86Å; K197-L200 PolarHBondContact O-N 3.31Å; L200-H202 PolarHBondContact O-N 3.42Å; L200-R203 PolarHBondContact O-N 3.24Å; L200-L204 HydrophobicContact CD1-CD1 4.37Å; L200-L204 HydrophobicContact CD1-CG 4.45Å; L200-L204 HydrophobicContact CG-CD1 4.15Å; L200-L204 WeakPolarHBondContact O-CG 3.28Å; L200-L204 PolarHBondContact O-N 3.39Å
201I93.4Very high86.2Confident84 Ų8496.7 Ų96.743%0.43152%0.515SS..Hα-helixtrans-58.1-49.5175.1-67.6163.6000110K197 R198 R203 L204 D205K197-I201 HydrophobicContact CG-CD1 4.07Å; K197-I201 VanDerWaalsContact O-CG1 3.29Å; K197-I201 WeakPolarHBondContact O-CG1 3.39Å; K197-I201 PolarHBondContact O-N 3.39Å; R198-I201 PolarHBondContact O-N 3.23Å; I201-R203 VanDerWaalsContact C-N 3.34Å; I201-R203 PolarHBondContact O-N 3.39Å; I201-L204 PolarHBondContact O-N 3.4Å; I201-L204 VanDerWaalsContact O-N 3.07Å; I201-D205 PolarHBondContact O-N 3.45Å
202H93.4Very high85.2Confident116 Ų11699.2 Ų99.254%0.53752%0.516SS..Hα-helixtrans-59.6-39.8177.9179.9-113.4000113.1R198 S199 L200 L206R198-H202 WeakPolarHBondContact O-CB 3.34Å; R198-H202 PolarHBondContact O-N 3.05Å; S199-H202 PolarHBondContact O-N 3.43Å; L200-H202 PolarHBondContact O-N 3.42Å; H202-L206 WeakPolarHBondContact O-CB 3.33Å; H202-L206 VanDerWaalsContact O-CG 3.28Å; H202-L206 WeakPolarHBondContact O-CG 3.37Å; H202-L206 PolarHBondContact O-N 2.94Å
203R93Very high83.8Confident120 Ų120101.3 Ų101.345%0.45352%0.517SS..Hα-helixtrans-62.6-42.5172.5-79.2166.953.8-149.5-3.6112.3S199 L200 I201 T207S199-R203 WeakPolarHBondContact O-CG 3.35Å; S199-R203 PolarHBondContact O-N 3.42Å; L200-R203 PolarHBondContact O-N 3.24Å; I201-R203 VanDerWaalsContact C-N 3.34Å; I201-R203 PolarHBondContact O-N 3.39Å; R203-T207 PolarHBondContact O-N 3.08Å; R203-T207 PolarHBondContact O-OG1 2.91Å; R203-T207 VanDerWaalsContact O-OG1 3.04Å
204L93.1Very high82.4Confident98 Ų98104.5 Ų104.551%0.51352%0.522SS..Hα-helixtrans-67.9-42.7178.5-70.1170.7000111.4L200 I201 L206 T207 L208L200-L204 HydrophobicContact CD1-CD1 4.37Å; L200-L204 HydrophobicContact CD1-CG 4.45Å; L200-L204 HydrophobicContact CG-CD1 4.15Å; L200-L204 WeakPolarHBondContact O-CG 3.28Å; L200-L204 PolarHBondContact O-N 3.39Å; I201-L204 PolarHBondContact O-N 3.4Å; I201-L204 VanDerWaalsContact O-N 3.07Å; L204-L206 PolarHBondContact O-N 3.31Å; L204-T207 PolarHBondContact O-N 3.13Å; L204-L208 VanDerWaalsContact O-CB 3.29Å; L204-L208 WeakPolarHBondContact O-CB 3.36Å; L204-L208 PolarHBondContact O-N 2.98Å
205D92.2Very high80.7Confident90 Ų90105.9 Ų105.948%0.48154%0.54SS..Hα-helixtrans-62.8-40.2175.4-76.4-28.3000112.2I201 S209I201-D205 PolarHBondContact O-N 3.45Å; D205-S209 WeakPolarHBondContact O-CB 2.98Å; D205-S209 PolarHBondContact O-N 3.09Å; D205-S209 PolarHBondContact O-OG 3.15Å
206L90.6Very high79.1Confident99 Ų99109.5 Ų109.552%0.51855%0.553SS.*Hα-helixtrans-60.9-47.5171.8-78.1170.9000111.6H202 L204 S209 A210H202-L206 WeakPolarHBondContact O-CB 3.33Å; H202-L206 VanDerWaalsContact O-CG 3.28Å; H202-L206 WeakPolarHBondContact O-CG 3.37Å; H202-L206 PolarHBondContact O-N 2.94Å; L204-L206 PolarHBondContact O-N 3.31Å; L206-S209 PolarHBondContact O-N 3.4Å; L206-A210 WeakPolarHBondContact O-CB 3.49Å; L206-A210 PolarHBondContact O-N 3.08Å
207T88.8Confident77.2Confident92 Ų92116 Ų11656%0.56457%0.567SS**Hα-helixtrans-64.5-43.9178.7-63.30000111.9R203 L204 A210 N211R203-T207 PolarHBondContact O-N 3.08Å; R203-T207 PolarHBondContact O-OG1 2.91Å; R203-T207 VanDerWaalsContact O-OG1 3.04Å; L204-T207 PolarHBondContact O-N 3.13Å; T207-A210 PolarHBondContact O-N 3.48Å; T207-N211 WeakPolarHBondContact O-CB 3.27Å; T207-N211 PolarHBondContact O-N 3.02Å
208L79.9Confident74.7Confident107 Ų107112.4 Ų112.456%0.5657%0.57SS**Hα-helixtrans-67.5-37.4178.8-163.671.3000111.4L204 N211 K212L204-L208 VanDerWaalsContact O-CB 3.29Å; L204-L208 WeakPolarHBondContact O-CB 3.36Å; L204-L208 PolarHBondContact O-N 2.98Å; L208-N211 PolarHBondContact O-N 2.93Å; L208-K212 PolarHBondContact O-N 3.22Å
209S75.8Confident71.9Confident65 Ų65110.9 Ų110.946%0.45558%0.58SS.*Hα-helixtrans-68.1-39.1173.6-63.10000112.5D205 L206 R213D205-S209 WeakPolarHBondContact O-CB 2.98Å; D205-S209 PolarHBondContact O-N 3.09Å; D205-S209 PolarHBondContact O-OG 3.15Å; L206-S209 PolarHBondContact O-N 3.4Å; S209-R213 PolarHBondContact O-N 3.16Å; S209-R213 VanDerWaalsContact O-N 3.16Å
210A66.3Low69.6Low60 Ų60113.4 Ų113.450%0.49660%0.596SS.*Hα-helixtrans-64.8-40.7172.900000111.4L206 T207 R213 R214L206-A210 WeakPolarHBondContact O-CB 3.49Å; L206-A210 PolarHBondContact O-N 3.08Å; T207-A210 PolarHBondContact O-N 3.48Å; A210-R213 PolarHBondContact O-N 3.33Å; A210-R214 PolarHBondContact O-N 3.02Å
211N64.4Low67.3Low105 Ų105119 Ų11956%0.56161%0.613SS**Hα-helixtrans-67.3-41.6177.4-155-1.9000111.8T207 L208 R213 R214 S215T207-N211 WeakPolarHBondContact O-CB 3.27Å; T207-N211 PolarHBondContact O-N 3.02Å; L208-N211 PolarHBondContact O-N 2.93Å; N211-R213 PolarHBondContact O-N 3.14Å; N211-R214 WeakPolarHBondContact O-CB 3.29Å; N211-R214 PolarHBondContact O-N 3.37Å; N211-S215 PolarHBondContact O-N 2.72Å
212K59.3Low65.1Low155 Ų155123.7 Ų123.767%0.67464%0.637SS**Hα-helixtrans-55.2-36.7169.4-89.5-177.3171.4177.20113.1L208L208-K212 PolarHBondContact O-N 3.22Å
213R54.7Low62.2Low199 Ų199126.7 Ų126.775%0.75165%0.651SS**Hα-helixtrans-76-31.5174.7-68.6-176.9-172.7-175.64.1113.2S209 A210 N211 L216S209-R213 PolarHBondContact O-N 3.16Å; S209-R213 VanDerWaalsContact O-N 3.16Å; A210-R213 PolarHBondContact O-N 3.33Å; N211-R213 PolarHBondContact O-N 3.14Å; R213-L216 PolarHBondContact O-N 2.84Å
214R54.3Low59.6Low187 Ų187130.6 Ų130.671%0.70668%0.675SS**Hα-helixtrans-66.2-38.5172.8-174.265.770.2-1795.3111.4A210 N211 L216 Y217A210-R214 PolarHBondContact O-N 3.02Å; N211-R214 WeakPolarHBondContact O-CB 3.29Å; N211-R214 PolarHBondContact O-N 3.37Å; R214-L216 PolarHBondContact O-N 3.23Å; R214-L216 VanDerWaalsContact O-N 3.08Å; R214-Y217 PolarHBondContact O-N 3.42Å
215S50.8Low56.7Low101 Ų101130.5 Ų130.571%0.70668%0.682SS**THydrogen-bonded Turntrans-61.2-15.8178.8-170.20000114.9N211N211-S215 PolarHBondContact O-N 2.72Å
216L52.6Low54.1Low142 Ų142137.2 Ų137.274%0.74370%0.703SS**THydrogen-bonded Turntrans-95.3-5.5177.4-66.1173.9000113.5R213 R214R213-L216 PolarHBondContact O-N 2.84Å; R214-L216 PolarHBondContact O-N 3.23Å; R214-L216 VanDerWaalsContact O-N 3.08Å
217Y51.7Low51.5Low193 Ų193136.3 Ų136.376%0.75772%0.718SS**SBendtrans-128.271.2-178.4-77.8-82.5000111.7R214R214-Y217 PolarHBondContact O-N 3.42Å
218G36.6Very low48.8Very low65 Ų65137.1 Ų137.167%0.6773%0.727SS**  trans64.9109.7153.500000118P220G218-P220 WeakPolarHBondContact O-CD 3.48Å
219S31.9Very low47.1Very low108 Ų108137.5 Ų137.576%0.75574%0.736SS**  trans-74.2123.4148.5-178.80000108.4Y221S219-Y221 VanDerWaalsContact C-N 3.33Å; S219-Y221 PolarHBondContact O-N 2.74Å
220P45.3Very low45.3Very low117 Ų117145 Ų14576%0.7676%0.756SS**  trans-84.70.9-174.332.1-33.7000114.5G218G218-P220 WeakPolarHBondContact O-CD 3.48Å
221Y44.4Very low43.7Very low197 Ų197147.8 Ų147.877%0.77377%0.772SS**SBendtrans-13597.8-179.2-84.2-88.1000112.2S219S219-Y221 VanDerWaalsContact C-N 3.33Å; S219-Y221 PolarHBondContact O-N 2.74Å
222L47.2Very low42.6Very low181 Ų181149.1 Ų149.195%0.94878%0.784SS**  trans157.788.2141-87.9165000110.2
223Q33.7Very low41.7Very low179 Ų179149.6 Ų149.684%0.83679%0.794SS**  trans-14680.3164.6-167.6174.2-17.700111.9
224Q37.9Very low41.3Very low203 Ų203144 Ų14495%0.94979%0.79SS**  trans-105.1101.8144.7-80.8-169.4-25.400107.2
225S32.2Very low40.9Very low95 Ų95139.8 Ų139.866%0.66480%0.795SS**  trans-136.9114.8174.1-177.10000108.1G227S225-G227 PolarHBondContact O-N 2.89Å
226Y37.2Very low40.2Very low231 Ų231143 Ų14391%0.90680%0.804SS**  trans-74.1120167.5-79-91.6000107.8S228Y226-S228 PolarHBondContact O-N 3.31Å
227G37.2Very low39.2Very low81 Ų81141 Ų14184%0.83580%0.803SS**  trans-66130.2-178.400000112.3S225S225-G227 PolarHBondContact O-N 2.89Å
228S32Very low39Very low109 Ų109136.9 Ų136.976%0.76280%0.8SS**  trans-116.2127.8166.1-175.40000108.9Y226 Y230Y226-S228 PolarHBondContact O-N 3.31Å; S228-Y230 VanDerWaalsContact C-N 3.33Å; S228-Y230 PolarHBondContact O-N 2.85Å; S228-Y230 VanDerWaalsContact O-N 3.14Å
229P44Very low38.9Very low115 Ų115144.6 Ų144.675%0.74781%0.81SS**SBendtrans-8826.1-158.335.7-38.8000115.8
230Y38.6Very low38.8Very low221 Ų221145.1 Ų145.187%0.86781%0.814SS**  trans-140.192.7176.8-80.3-77.2000113.2S228S228-Y230 VanDerWaalsContact C-N 3.33Å; S228-Y230 PolarHBondContact O-N 2.85Å; S228-Y230 VanDerWaalsContact O-N 3.14Å
231S31.3Very low38.4Very low120 Ų120145.4 Ų145.484%0.83982%0.819SS**  trans-160125.5151.5-164.60000110.8N233S231-N233 PolarHBondContact O-N 2.68Å
232T42Very low37.7Very low133 Ų133139.7 Ų139.782%0.81682%0.819SS**  trans-79.1112.5175.947.30000110A234T232-A234 PolarHBondContact O-N 2.98Å
233N39.9Very low37.1Very low165 Ų165139.4 Ų139.488%0.88281%0.811SS**  trans-71.6100.9-174.8-157.8-6.4000111.1S231S231-N233 PolarHBondContact O-N 2.68Å
234A46.3Very low37.1Very low80 Ų80138.2 Ų138.266%0.66181%0.81SS**  trans-139.5154.3-179.400000110.7T232T232-A234 PolarHBondContact O-N 2.98Å
235A46.8Very low36.7Very low100 Ų100132.7 Ų132.783%0.82679%0.794SS**  trans61.873-178.600000115.8
236N35.3Very low36.9Very low167 Ų167134.5 Ų134.589%0.89380%0.803SS**  trans-146.662158.8-120.6-25.4000113.2
237S31.4Very low36.4Very low101 Ų101128.7 Ų128.771%0.70680%0.797SS**  trans-173.1128.4152.5-173.40000110.6
238P48.3Very low36.1Very low107 Ų107130.8 Ų130.870%0.69580%0.799SS**SBendtrans-80.9135.6174.432.7-33.1000111.8
239Y34.7Very low36.3Very low226 Ų226132 Ų13289%0.88680%0.802SS**  trans62.783.5172.6-56.9-75.2000117.4
240S28.8Very low36.2Very low119 Ų119131.8 Ų131.883%0.83280%0.8SS**  trans-136.2104.5145.5-79.80000109.5G242S240-G242 PolarHBondContact O-N 2.97Å
241S36.9Very low35.7Very low124 Ų124126.6 Ų126.687%0.86780%0.795SS**  trans-83.792.8-17753.60000111.4F243S241-F243 PolarHBondContact O-N 3.02Å; S241-F243 VanDerWaalsContact O-N 3.13Å
242G30.5Very low35.8Very low76 Ų76132.4 Ų132.478%0.78480%0.798SS**  trans-75.691.917500000112.4S240 N244S240-G242 PolarHBondContact O-N 2.97Å; G242-N244 PolarHBondContact O-N 3.42Å
243F34.1Very low35.3Very low175 Ų175132.8 Ų132.877%0.76880%0.8SS**  trans-78.8106.3166.5-174.9-89.6000109.5S241S241-F243 PolarHBondContact O-N 3.02Å; S241-F243 VanDerWaalsContact O-N 3.13Å
244N33Very low36Very low155 Ų155130.4 Ų130.483%0.82979%0.794SS**  trans-141.492.2170.3-97.7-37000109.3G242G242-N244 PolarHBondContact O-N 3.42Å
245S29.8Very low35.3Very low87 Ų87134.5 Ų134.561%0.60880%0.803SS**  trans-111.5108.7173-61.30000110.1S247S245-S247 PolarHBondContact O-N 3.44Å
246P36.3Very low34.5Very low133 Ų133134.7 Ų134.786%0.86479%0.793SS**  trans-85104.1164.631.8-28.6000109.4
247S28Very low34.5Very low109 Ų109136.9 Ų136.976%0.76279%0.789SS**  trans-116.897.2173.9-176.60000110.3S245S245-S247 PolarHBondContact O-N 3.44Å
248S30Very low34.4Very low125 Ų125137.9 Ų137.987%0.87478%0.783SS**  trans-143.591.9174.3-63.90000111
249T36.8Very low33.4Very low135 Ų135140.3 Ų140.383%0.82879%0.785SS**  trans-78.5170.4153.945.40000109.4
250P41.5Very low33.3Very low110 Ų110135.9 Ų135.971%0.71478%0.776SS**  cis-131170.65.941.8-27.3000115.5
251C27.9Very low33.6Very low111 Ų111137.9 Ų137.975%0.7577%0.774SS**  179.2133.3123.2-97.10000115.7
252R32.8Very low33.9Very low242 Ų242137 Ų13791%0.91377%0.765SS**  trans66.2164.2156.8-61.8-174.3-176.3-100.7-1118.6
253V32.3Very low33.8Very low142 Ų142137.7 Ų137.786%0.86176%0.758SS**  trans-130.1168.7-158.6-102.60000110.9
254P55.5Low33.5Very low115 Ų115136.2 Ų136.275%0.74776%0.758SS**  trans-93.3161.2-144.537.2-39.5000116.2
255I31.7Very low33.4Very low166 Ų166134.6 Ų134.685%0.85176%0.759SS**  trans-177144.3165.1-105.9150.8000106.6
256V30Very low33.4Very low104 Ų104135.7 Ų135.763%0.6376%0.762SS**  cis-168.3164.7-16.4112.40000107.6
257R33.6Very low33.2Very low212 Ų212137.6 Ų137.680%0.876%0.759SS**  trans67.5166169.9-82.2-177.7174100.93.8117.9
258Q29.8Very low33.2Very low123 Ų123141.9 Ų141.958%0.57577%0.767SS**  cis178.4152-31172.4176.29.400109.1
259Q27.5Very low33.2Very low158 Ų158146.3 Ų146.374%0.73876%0.764SS**  trans65.9155.1172.6-74.9144.6-2600114.9
260L32.3Very low32.8Very low133 Ų133147.9 Ų147.970%0.69677%0.768SS**  cis-141.8146.35.9-167.163.9000111.7
261M36.3Very low32.3Very low161 Ų161147.6 Ų147.679%0.79377%0.774SS**  trans-118.4140.5156.1-70.5-80.39900107.2
262P43.1Very low32.3Very low106 Ų106147 Ų14769%0.68878%0.778SS**  -132.7156.4101.812.59.7000111.9
263S27Very low32.3Very low90 Ų90140 Ų14063%0.62977%0.772SS**  cis93.6119.931-58.10000115.6
264N28.8Very low32.2Very low144 Ų144142.3 Ų142.377%0.7777%0.773SS**  trans75112.1145.4-50.9-9.3000121.5
265S31.8Very low31.1Very low121 Ų121148.3 Ų148.385%0.84678%0.781SS**  -170.8136107.647.20000109.3
266V28.3Very low31.3Very low110 Ų110147.6 Ų147.667%0.66778%0.779SS**  cis9689.327-1780000113.6
267H31.8Very low32.4Very low172 Ų172147.8 Ų147.880%0.79678%0.782SS**  trans53.4128.2152.8-48.1-42.5000121.8
268Q28.7Very low32.9Very low200 Ų200143.2 Ų143.294%0.93578%0.78SS**  -137.8155.6123.9-144.2167.5108.600110.7
269R30Very low33Very low217 Ų217142 Ų14282%0.81979%0.79SS**  trans-103.2145.1-172.7-72.5172.9-84.2144.5-6.2110.8
270N27.4Very low33.2Very low168 Ų168142.5 Ų142.590%0.89880%0.797SS**  -172.3163.3116.5-87.3-25.2000109.9
271A31Very low33Very low104 Ų104141.4 Ų141.486%0.8680%0.8SS**  trans-130.8144.9-164.400000113.5
272A28.5Very low33.1Very low99 Ų99139.9 Ų139.982%0.81880%0.802SS**  trans-163.7155155.400000110.7
273A33.7Very low32.6Very low96 Ų96143.3 Ų143.379%0.79381%0.809SS**SBendtrans66.1123166.300000120.2
274E29.4Very low32.9Very low189 Ų189144.3 Ų144.388%0.88382%0.816SS**  trans32.7109.9149.5-47.3-155.5135.900119.7
275R32.6Very low33.2Very low242 Ų242142 Ų14291%0.91381%0.811SS**  cis86.473.836.8-157.1-179.5-173.51633.9116.2
276N35.4Very low33.2Very low150 Ų150142.2 Ų142.280%0.80281%0.807SS**  trans-116.3-178147.7-116.1-73.6000107.5
277P52.6Low33.4Very low108 Ų108143.5 Ų143.570%0.70181%0.81SS**  cis-106.5-107.3-18.822.41.6000110
278P44.8Very low33.9Very low117 Ų117139.6 Ų139.676%0.7680%0.803SS**  cis-106.8-173.77.443-35.1000114.3
279A32.5Very low34.5Very low96 Ų96138 Ų13879%0.79380%0.795SS**  trans-142.5149.7164.600000110.4
280I30.5Very low34.8Very low170 Ų170134.6 Ų134.687%0.87279%0.792SS**  trans-148152.7175.148.8173.1000112.1
281S29.4Very low35.4Very low110 Ų110131.2 Ų131.277%0.76978%0.782SS**  trans-85.4177.7175-47.40000112.3
282P38.8Very low35.6Very low128 Ų128132.6 Ų132.683%0.83178%0.78SS**  -143.9178.790.639.8-24.7000115.7
283Q31.1Very low36.2Very low178 Ų178132.9 Ų132.983%0.83278%0.776SS**  trans-106.9170.5164.9-83.5-98.3-46.900109.6
284S34.4Very low36.3Very low111 Ų111137.1 Ų137.178%0.77678%0.779SS**  trans70150.617177.50000116.9
285S35.4Very low37.5Very low95 Ų95135.4 Ų135.466%0.66477%0.773SS**  cis-173.5142.2-22.249.60000111.6
286V31.6Very low38.1Very low127 Ų127131.7 Ų131.777%0.7777%0.771SS**  trans51.2143.9154.3-53.90000122.1
287D31.3Very low38.9Very low136 Ų136132.7 Ų132.773%0.72777%0.771SS**  trans62.2152.8146.4-97.2-106.2000121.4
288S42.8Very low38.6Very low91 Ų91134.5 Ų134.564%0.63678%0.775SS**  cis-135.9139.5-5.5-53.20000108.8
289E40.8Very low38.5Very low165 Ų165134 Ų13477%0.77177%0.774SS**  59.3142.4101.6-56.4-140.5107.500120
290L37.5Very low39.2Very low147 Ų147136.9 Ų136.977%0.7778%0.781SS**  trans68.7126.9166.3-39.1-175.2000116.2
291S39.7Very low39.9Very low97 Ų97131.3 Ų131.368%0.67877%0.766SS**  cis-160.9132.742.4-53.90000115.1
292T34.7Very low40.6Very low132 Ų132130.4 Ų130.481%0.8176%0.76SS**  52.3104.2128.267.90000123
293S41.8Very low41.1Very low105 Ų105129.1 Ų129.173%0.73475%0.754SS**  trans178153.9131.640.10000107.9
294E36.1Very low41.9Very low186 Ų186126.2 Ų126.287%0.86975%0.748SS**  cis-148.2-167.2-17.750.8-150.59700109.1
295M54.9Low42.5Very low153 Ų153125.8 Ų125.875%0.75474%0.741SS**  trans-100.4124.6-164.8177.3166.259.200112.8E297M295-E297 HydrophobicContact CG-CG 3.92Å; M295-E297 HydrophobicContact SD-CG 4.14Å
296D43.3Very low43.2Very low164 Ų164128.4 Ų128.488%0.87774%0.738SS**  trans-131.5105.8164-97.3-49.4000109.9D298D296-D298 PolarHBondContact O-N 3.28Å
297E52.8Low44.1Very low171 Ų171130.8 Ų130.880%0.79974%0.738SS**  trans-90.360.4-176.3-73.4-90121.600111.7M295M295-E297 HydrophobicContact CG-CG 3.92Å; M295-E297 HydrophobicContact SD-CG 4.14Å
298D46.1Very low45.4Very low145 Ų145127.7 Ų127.778%0.77572%0.721SS**  trans-162.398166-121.6-27.5000115D296D296-D298 PolarHBondContact O-N 3.28Å
299S43.8Very low46.3Very low107 Ų107129.3 Ų129.375%0.74872%0.722SS**  trans-169.162.8163.2-90.90000114.1G301S299-G301 PolarHBondContact O-N 2.85Å
300V46.2Very low47.5Very low156 Ų156126 Ų12695%0.94571%0.71SS**THydrogen-bonded Turntrans-71.126173.4-65.20000114.7
301G45.8Very low49.1Very low54 Ų54123.9 Ų123.956%0.55770%0.703SS**THydrogen-bonded Turntrans-117.9-12.2-171.700000117.1S299 S303S299-G301 PolarHBondContact O-N 2.85Å; G301-S303 VanDerWaalsContact C-N 3.26Å; G301-S303 PolarHBondContact O-N 3.16Å
302S44.1Very low50.8Low90 Ų90123.1 Ų123.163%0.62969%0.694SS**THydrogen-bonded Turntrans-84.736.1-164.6-142.70000115.9
303S48.8Very low52.7Low101 Ų101120.1 Ų120.171%0.70667%0.673SS**THydrogen-bonded Turntrans-97.20.3179.1-157.70000113.9G301G301-S303 VanDerWaalsContact C-N 3.26Å; G301-S303 PolarHBondContact O-N 3.16Å
304T48.8Very low54.5Low117 Ų117118.6 Ų118.672%0.71866%0.659SS**SBendtrans-131.319.9-171.747.50000113.4
305T46.9Very low56.2Low102 Ų102114.9 Ų114.963%0.62664%0.642SS**  trans-92.4-2.3-177.345.80000114.5K307T305-K307 VanDerWaalsContact C-N 3.34Å; T305-K307 PolarHBondContact O-N 3.48Å
306Y49.6Very low57.2Low151 Ų151111 Ų11159%0.59262%0.624SS**  trans-72.990.9160.567.9-83.9000109L308 M317Y306-L308 HydrophobicContact CD2-CD2 3.88Å; Y306-L308 HydrophobicContact CD2-CG 4.08Å; Y306-L308 HydrophobicContact CE2-CD1 4.35Å; Y306-L308 HydrophobicContact CE2-CD2 3.97Å; Y306-L308 HydrophobicContact CE2-CG 4.1Å; Y306-L308 PolarHBondContact O-N 3.27Å; Y306-L308 VanDerWaalsContact O-N 3.1Å; Y306-M317 HydrophobicContact CE2-CE 4.19Å; Y306-M317 HydrophobicContact CE2-SD 4.09Å
307K50.3Low58.8Low176 Ų176107 Ų10777%0.76560%0.6SS**  trans-65.1111.8168.8-85.7-173.9172.1-178.40108.5T305 N309T305-K307 VanDerWaalsContact C-N 3.34Å; T305-K307 PolarHBondContact O-N 3.48Å; K307-N309 PolarHBondContact O-N 2.74Å
308L58.3Low59.8Low71 Ų71101.3 Ų101.337%0.37258%0.583SS.*  trans-67.567.7166.2-61.1168.3000109.4Y306 D313 V314 M317Y306-L308 HydrophobicContact CD2-CD2 3.88Å; Y306-L308 HydrophobicContact CD2-CG 4.08Å; Y306-L308 HydrophobicContact CE2-CD1 4.35Å; Y306-L308 HydrophobicContact CE2-CD2 3.97Å; Y306-L308 HydrophobicContact CE2-CG 4.1Å; Y306-L308 PolarHBondContact O-N 3.27Å; Y306-L308 VanDerWaalsContact O-N 3.1Å; L308-D313 HydrophobicContact CD2-CB 3.62Å; L308-V314 HydrophobicContact CB-CG2 4.01Å; L308-V314 HydrophobicContact CD1-CG2 4.45Å; L308-M317 HydrophobicContact CD1-CE 3.5Å; L308-M317 HydrophobicContact CD2-CE 3.87Å; L308-M317 HydrophobicContact CD2-SD 4.43Å; L308-M317 HydrophobicContact CG-CE 4.3Å
309N62.7Low60.8Low126 Ų126100.7 Ų100.767%0.67457%0.57SS**  trans-78-29.9-173.6-165.593.4000111.2K307K307-N309 PolarHBondContact O-N 2.74Å
310D65.4Low62.2Low96 Ų96101.4 Ų101.451%0.51356%0.563SS.*SBendtrans-106.6135.6-178-63.1-12.9000110.3T312 D313D310-T312 PolarHBondContact O-N 3.25Å; D310-D313 PolarHBondContact O-N 3.1Å
311V72.3Confident63.2Low101 Ų10199.9 Ų99.961%0.61255%0.545SS*.Hα-helixtrans-56.5-25.6178.9-179.60000111.5D313 V314 Q315V311-D313 PolarHBondContact O-N 3.36Å; V311-V314 PolarHBondContact O-N 2.7Å; V311-Q315 HydrophobicContact CG1-CG 4.26Å; V311-Q315 WeakPolarHBondContact O-CB 3.47Å; V311-Q315 VanDerWaalsContact O-CG 3.3Å; V311-Q315 WeakPolarHBondContact O-CG 3.31Å; V311-Q315 PolarHBondContact O-N 2.83Å
312T73.7Confident63.8Low81 Ų81102.6 Ų102.650%0.49754%0.544SS..Hα-helixtrans-56.9-43.6174.3-39.90000112.9D310 Q315 I316D310-T312 PolarHBondContact O-N 3.25Å; T312-Q315 CarbonylContact O-C 3.6Å; T312-Q315 WeakPolarHBondContact O-CB 3.38Å; T312-Q315 PolarHBondContact O-N 3.15Å; T312-I316 HydrophobicContact CG2-CD1 4.07Å; T312-I316 VanDerWaalsContact O-CG1 3.27Å; T312-I316 WeakPolarHBondContact O-CG1 3.49Å; T312-I316 PolarHBondContact O-N 2.82Å
313D75.8Confident64.1Low69 Ų69103.9 Ų103.937%0.36954%0.54SS..Hα-helixtrans-72.6-37.7-178.7-66.9-19.7000111L308 D310 V311 Q315 I316 M317L308-D313 HydrophobicContact CD2-CB 3.62Å; D310-D313 PolarHBondContact O-N 3.1Å; V311-D313 PolarHBondContact O-N 3.36Å; D313-Q315 VanDerWaalsContact C-N 3.29Å; D313-Q315 PolarHBondContact O-N 3.15Å; D313-I316 PolarHBondContact O-N 3.49Å; D313-M317 WeakPolarHBondContact O-CG 3.25Å; D313-M317 PolarHBondContact O-N 3.42Å
314V78.8Confident64.4Low73 Ų73102.3 Ų102.344%0.44253%0.529SS..Hα-helixtrans-61-40.4171.1-175.50000110.3L308 V311 A318L308-V314 HydrophobicContact CB-CG2 4.01Å; L308-V314 HydrophobicContact CD1-CG2 4.45Å; V311-V314 PolarHBondContact O-N 2.7Å; V314-A318 WeakPolarHBondContact O-CB 3.43Å; V314-A318 PolarHBondContact O-N 3.19Å
315Q73.1Confident64.5Low108 Ų108100.4 Ų100.451%0.50551%0.512SS..Hα-helixtrans-69.5-34.2174.9-75175.52.600113.3V311 T312 D313 R319V311-Q315 HydrophobicContact CG1-CG 4.26Å; V311-Q315 WeakPolarHBondContact O-CB 3.47Å; V311-Q315 VanDerWaalsContact O-CG 3.3Å; V311-Q315 WeakPolarHBondContact O-CG 3.31Å; V311-Q315 PolarHBondContact O-N 2.83Å; T312-Q315 CarbonylContact O-C 3.6Å; T312-Q315 WeakPolarHBondContact O-CB 3.38Å; T312-Q315 PolarHBondContact O-N 3.15Å; D313-Q315 VanDerWaalsContact C-N 3.29Å; D313-Q315 PolarHBondContact O-N 3.15Å; Q315-R319 VanDerWaalsContact O-CB 3.23Å; Q315-R319 WeakPolarHBondContact O-CB 3.42Å; Q315-R319 PolarHBondContact O-N 3.37Å
316I75.7Confident64.8Low73 Ų7399.1 Ų99.137%0.37450%0.501SS..Hα-helixtrans-70.3-46.4175.9-71.9162.9000110.1T312 D313 R319 M320T312-I316 HydrophobicContact CG2-CD1 4.07Å; T312-I316 VanDerWaalsContact O-CG1 3.27Å; T312-I316 WeakPolarHBondContact O-CG1 3.49Å; T312-I316 PolarHBondContact O-N 2.82Å; D313-I316 PolarHBondContact O-N 3.49Å; I316-R319 PolarHBondContact O-N 3.12Å; I316-M320 HydrophobicContact CG2-SD 4.22Å; I316-M320 WeakPolarHBondContact O-CG 3.23Å; I316-M320 PolarHBondContact O-N 3.45Å
317M76.6Confident65Low78 Ų7895.6 Ų95.638%0.38450%0.497SS..Hα-helixtrans-66.7-38.9174.9-65.8-148.9-49.300112.1Y306 L308 D313 R319 M320 Q321Y306-M317 HydrophobicContact CE2-CE 4.19Å; Y306-M317 HydrophobicContact CE2-SD 4.09Å; L308-M317 HydrophobicContact CD1-CE 3.5Å; L308-M317 HydrophobicContact CD2-CE 3.87Å; L308-M317 HydrophobicContact CD2-SD 4.43Å; L308-M317 HydrophobicContact CG-CE 4.3Å; D313-M317 WeakPolarHBondContact O-CG 3.25Å; D313-M317 PolarHBondContact O-N 3.42Å; M317-R319 VanDerWaalsContact C-N 3.34Å; M317-R319 PolarHBondContact O-N 3.28Å; M317-M320 PolarHBondContact O-N 3.24Å; M317-Q321 WeakPolarHBondContact O-CB 3.34Å; M317-Q321 PolarHBondContact O-N 2.82Å
318A73.3Confident65Low53 Ų5392.5 Ų92.544%0.43849%0.485SS..Hα-helixtrans-62.4-40.6172.600000111.7V314 Q321 E322V314-A318 WeakPolarHBondContact O-CB 3.43Å; V314-A318 PolarHBondContact O-N 3.19Å; A318-Q321 WeakPolarHBondContact O-CB 3.36Å; A318-Q321 PolarHBondContact O-N 2.86Å; A318-E322 VanDerWaalsContact O-CB 3.3Å; A318-E322 WeakPolarHBondContact O-CB 3.36Å; A318-E322 PolarHBondContact O-N 2.84Å
319R68.1Low64.8Low132 Ų13296.7 Ų96.750%0.49850%0.496SS..Hα-helixtrans-64.4-41.7173.3-172.9-177.7-57.9136.77.6111.7Q315 I316 M317 E322 E323Q315-R319 VanDerWaalsContact O-CB 3.23Å; Q315-R319 WeakPolarHBondContact O-CB 3.42Å; Q315-R319 PolarHBondContact O-N 3.37Å; I316-R319 PolarHBondContact O-N 3.12Å; M317-R319 VanDerWaalsContact C-N 3.34Å; M317-R319 PolarHBondContact O-N 3.28Å; R319-E322 PolarHBondContact O-N 2.88Å; R319-E323 HydrophobicContact CG-CG 4.11Å; R319-E323 VanDerWaalsContact O-CB 3.28Å; R319-E323 WeakPolarHBondContact O-CB 3.43Å; R319-E323 WeakPolarHBondContact O-CG 3.27Å; R319-E323 PolarHBondContact O-N 2.98Å
320M72.1Confident64.5Low122 Ų12297.5 Ų97.560%0.60149%0.494SS*.Hα-helixtrans-65.6-38.3174.9-74.2172.254.400112.5I316 M317 E322 S324I316-M320 HydrophobicContact CG2-SD 4.22Å; I316-M320 WeakPolarHBondContact O-CG 3.23Å; I316-M320 PolarHBondContact O-N 3.45Å; M317-M320 PolarHBondContact O-N 3.24Å; M320-E322 VanDerWaalsContact C-N 3.33Å; M320-S324 WeakPolarHBondContact O-CB 3.47Å; M320-S324 PolarHBondContact O-N 3.45Å; M320-S324 PolarHBondContact O-OG 2.86Å
321Q66.8Low63.9Low123 Ų123100.6 Ų100.658%0.57550%0.499SS*.Hα-helixtrans-64.1-39.7172.9-167.384.69.700110.7M317 A318 S324 M325M317-Q321 WeakPolarHBondContact O-CB 3.34Å; M317-Q321 PolarHBondContact O-N 2.82Å; A318-Q321 WeakPolarHBondContact O-CB 3.36Å; A318-Q321 PolarHBondContact O-N 2.86Å; Q321-S324 PolarHBondContact O-OG 3.49Å; Q321-S324 VanDerWaalsContact O-OG 3.1Å; Q321-M325 WeakPolarHBondContact O-CB 3.06Å; Q321-M325 WeakPolarHBondContact O-CG 3.21Å; Q321-M325 PolarHBondContact O-N 3.23Å; Q321-M325 VanDerWaalsContact O-N 3.15Å
322E58.8Low63.1Low112 Ų11299 Ų9952%0.52349%0.487SS..Hα-helixtrans-75.3-43.7178.9-170159.4-133.100112.1A318 R319 M320 S324 M325 L326A318-E322 VanDerWaalsContact O-CB 3.3Å; A318-E322 WeakPolarHBondContact O-CB 3.36Å; A318-E322 PolarHBondContact O-N 2.84Å; R319-E322 PolarHBondContact O-N 2.88Å; M320-E322 VanDerWaalsContact C-N 3.33Å; E322-S324 VanDerWaalsContact C-N 3.29Å; E322-S324 PolarHBondContact O-N 3.4Å; E322-M325 CarbonylContact O-C 3.56Å; E322-M325 PolarHBondContact O-N 2.74Å; E322-M325 VanDerWaalsContact O-N 3.12Å; E322-L326 HydrophobicContact CG-CD1 3.99Å; E322-L326 HydrophobicContact CG-CG 4.16Å; E322-L326 VanDerWaalsContact O-CB 3.29Å; E322-L326 WeakPolarHBondContact O-CB 3.3Å; E322-L326 WeakPolarHBondContact O-CG 3.5Å; E322-L326 PolarHBondContact O-N 3.38Å
323E50.5Low62.2Low117 Ų117100.4 Ų100.455%0.54749%0.488SS..Hα-helixtrans-70.4-19.4177.1-72.6179.6168.500113.5R319 L326 P327R319-E323 HydrophobicContact CG-CG 4.11Å; R319-E323 VanDerWaalsContact O-CB 3.28Å; R319-E323 WeakPolarHBondContact O-CB 3.43Å; R319-E323 WeakPolarHBondContact O-CG 3.27Å; R319-E323 PolarHBondContact O-N 2.98Å; E323-L326 HydrophobicContact CG-CD1 4.45Å; E323-P327 WeakPolarHBondContact O-CD 3.45Å; E323-P327 WeakPolarHBondContact O-CG 3.32Å
324S56.2Low61.1Low68 Ų68101.1 Ų101.148%0.47649%0.492SS..Hα-helixtrans-84.8-29.2167.253.80000113M320 Q321 E322M320-S324 WeakPolarHBondContact O-CB 3.47Å; M320-S324 PolarHBondContact O-N 3.45Å; M320-S324 PolarHBondContact O-OG 2.86Å; Q321-S324 PolarHBondContact O-OG 3.49Å; Q321-S324 VanDerWaalsContact O-OG 3.1Å; E322-S324 VanDerWaalsContact C-N 3.29Å; E322-S324 PolarHBondContact O-N 3.4Å
325M50.3Low59.6Low76 Ų7698.9 Ų98.937%0.37448%0.479SS..Hα-helixtrans-79.7-28.6172.9-71.8-82179.900113.5Q321 E322 Q328 R329Q321-M325 WeakPolarHBondContact O-CB 3.06Å; Q321-M325 WeakPolarHBondContact O-CG 3.21Å; Q321-M325 PolarHBondContact O-N 3.23Å; Q321-M325 VanDerWaalsContact O-N 3.15Å; E322-M325 CarbonylContact O-C 3.56Å; E322-M325 PolarHBondContact O-N 2.74Å; E322-M325 VanDerWaalsContact O-N 3.12Å; M325-Q328 PolarHBondContact O-N 3.47Å; M325-R329 WeakPolarHBondContact O-CB 3.11Å; M325-R329 WeakPolarHBondContact O-CG 3.47Å; M325-R329 PolarHBondContact O-N 3.09Å
326L52.7Low58.7Low75 Ų7597 Ų9739%0.39348%0.478SS..Hα-helixtrans-63.1-44.4-176-87167.2000113.2E322 E323 Q328 R329 F330E322-L326 HydrophobicContact CG-CD1 3.99Å; E322-L326 HydrophobicContact CG-CG 4.16Å; E322-L326 VanDerWaalsContact O-CB 3.29Å; E322-L326 WeakPolarHBondContact O-CB 3.3Å; E322-L326 WeakPolarHBondContact O-CG 3.5Å; E322-L326 PolarHBondContact O-N 3.38Å; E323-L326 HydrophobicContact CG-CD1 4.45Å; L326-Q328 VanDerWaalsContact C-N 3.32Å; L326-Q328 PolarHBondContact O-N 2.7Å; L326-R329 PolarHBondContact O-N 2.86Å; L326-F330 PolarHBondContact O-N 3.39Å
327P54.5Low57.4Low78 Ų7899 Ų9951%0.50649%0.489SS..Hα-helixtrans-56.3-44.6171.2-27.134.9000112.3E323 Y331E323-P327 WeakPolarHBondContact O-CD 3.45Å; E323-P327 WeakPolarHBondContact O-CG 3.32Å; P327-Y331 WeakPolarHBondContact O-CB 3.35Å; P327-Y331 PolarHBondContact O-N 3.06Å
328Q49Very low56.2Low110 Ų11099.7 Ų99.751%0.51450%0.498SS..Hα-helixtrans-65.3-44.5178.1-63.6-174.7-1.400111.6M325 L326 Y331 L332M325-Q328 PolarHBondContact O-N 3.47Å; L326-Q328 VanDerWaalsContact C-N 3.32Å; L326-Q328 PolarHBondContact O-N 2.7Å; Q328-Y331 PolarHBondContact O-N 3.36Å; Q328-L332 WeakPolarHBondContact O-CB 3.37Å; Q328-L332 VanDerWaalsContact O-CG 3.25Å; Q328-L332 WeakPolarHBondContact O-CG 3.42Å; Q328-L332 PolarHBondContact O-N 2.92Å
329R55.2Low54.9Low160 Ų160100.7 Ų100.760%0.60450%0.495SS*.Hα-helixtrans-64-41.4178-77.6179163.9174.4-5.1112.5M325 L326 Q333M325-R329 WeakPolarHBondContact O-CB 3.11Å; M325-R329 WeakPolarHBondContact O-CG 3.47Å; M325-R329 PolarHBondContact O-N 3.09Å; L326-R329 PolarHBondContact O-N 2.86Å; R329-Q333 WeakPolarHBondContact O-CB 3.4Å; R329-Q333 PolarHBondContact O-N 2.93Å
330F55.4Low54Low142 Ų14298.6 Ų98.662%0.62350%0.499SS*.Hα-helixtrans-66.2-40174-110-88.4000112.3L326 L334L326-F330 PolarHBondContact O-N 3.39Å; F330-L334 HydrophobicContact CD1-CD1 4.23Å; F330-L334 WeakPolarHBondContact O-CB 3.38Å; F330-L334 VanDerWaalsContact O-CG 3.26Å; F330-L334 WeakPolarHBondContact O-CG 3.3Å; F330-L334 PolarHBondContact O-N 3Å
331Y53.1Low53Low161 Ų16197.9 Ų97.963%0.63150%0.503SS*.Hα-helixtrans-64.9-45175.7-123.5-92.9000112P327 Q328 L334 C335P327-Y331 WeakPolarHBondContact O-CB 3.35Å; P327-Y331 PolarHBondContact O-N 3.06Å; Q328-Y331 PolarHBondContact O-N 3.36Å; Y331-L334 PolarHBondContact O-N 3.44Å; Y331-C335 WeakPolarHBondContact O-CB 3.47Å; Y331-C335 PolarHBondContact O-N 3.2Å; Y331-C335 PolarHBondContact O-SG 2.88Å; Y331-C335 VanDerWaalsContact O-SG 3.39Å
332L56.2Low51.8Low68 Ų68100.5 Ų100.536%0.35651%0.512SS..Hα-helixtrans-65.3-39.8179.2-71.2168.7000112Q328 S336 F344Q328-L332 WeakPolarHBondContact O-CB 3.37Å; Q328-L332 VanDerWaalsContact O-CG 3.25Å; Q328-L332 WeakPolarHBondContact O-CG 3.42Å; Q328-L332 PolarHBondContact O-N 2.92Å; L332-S336 WeakPolarHBondContact O-CB 3.38Å; L332-S336 PolarHBondContact O-N 3.04Å; L332-S336 PolarHBondContact O-OG 3.44Å; L332-F344 HydrophobicContact CD2-CE2 3.83Å; L332-F344 HydrophobicContact CD2-CZ 3.86Å
333Q53.5Low51.2Low111 Ų11196.8 Ų96.852%0.51950%0.501SS..Hα-helixtrans-62.1-52.1172.7-172.962.851.700111.2R329 C335 S336 D337R329-Q333 WeakPolarHBondContact O-CB 3.4Å; R329-Q333 PolarHBondContact O-N 2.93Å; Q333-C335 VanDerWaalsContact C-N 3.29Å; Q333-C335 PolarHBondContact O-N 2.93Å; Q333-S336 PolarHBondContact O-N 3.25Å; Q333-S336 VanDerWaalsContact O-N 3.08Å; Q333-D337 PolarHBondContact NE2-OD1 3.01Å; Q333-D337 PolarHBondContact NE2-OD2 2.76Å; Q333-D337 PolarHBondContact O-N 3.23Å; Q333-D337 VanDerWaalsContact O-N 3.13Å
334L53.4Low51.3Low84 Ų8494.3 Ų94.344%0.4449%0.489SS..Hα-helixtrans-64.5-29.4-179.6-71.7170.1000113.6F330 Y331 V338F330-L334 HydrophobicContact CD1-CD1 4.23Å; F330-L334 WeakPolarHBondContact O-CB 3.38Å; F330-L334 VanDerWaalsContact O-CG 3.26Å; F330-L334 WeakPolarHBondContact O-CG 3.3Å; F330-L334 PolarHBondContact O-N 3Å; Y331-L334 PolarHBondContact O-N 3.44Å; L334-V338 WeakPolarHBondContact O-CG2 3.44Å
335C48Very low51.2Low25 Ų2597.3 Ų97.317%0.16950%0.497CS..Hα-helixtrans-74.8-37.5171.2-76.40000112.3Y331 Q333 D337 V338 L339Y331-C335 WeakPolarHBondContact O-CB 3.47Å; Y331-C335 PolarHBondContact O-N 3.2Å; Y331-C335 PolarHBondContact O-SG 2.88Å; Y331-C335 VanDerWaalsContact O-SG 3.39Å; Q333-C335 VanDerWaalsContact C-N 3.29Å; Q333-C335 PolarHBondContact O-N 2.93Å; C335-D337 VanDerWaalsContact C-N 3.31Å; C335-D337 PolarHBondContact O-N 2.95Å; C335-V338 PolarHBondContact O-N 3.1Å; C335-L339 WeakPolarHBondContact O-CB 3.45Å; C335-L339 PolarHBondContact O-N 3.03Å
336S54Low51.3Low69 Ų6999.8 Ų99.848%0.48351%0.511SS..Hα-helixtrans-65.3-35.8-179.9-59.10000112.1L332 Q333 V338L332-S336 WeakPolarHBondContact O-CB 3.38Å; L332-S336 PolarHBondContact O-N 3.04Å; L332-S336 PolarHBondContact O-OG 3.44Å; Q333-S336 PolarHBondContact O-N 3.25Å; Q333-S336 VanDerWaalsContact O-N 3.08Å; S336-V338 VanDerWaalsContact C-N 3.29Å; S336-V338 PolarHBondContact O-N 3.02Å
337D47.8Very low51.3Low114 Ų114100.1 Ų100.161%0.6151%0.51SS*.THydrogen-bonded Turntrans-80-2-179.7-63.6-34.8000114Q333 C335Q333-D337 PolarHBondContact NE2-OD1 3.01Å; Q333-D337 PolarHBondContact NE2-OD2 2.76Å; Q333-D337 PolarHBondContact O-N 3.23Å; Q333-D337 VanDerWaalsContact O-N 3.13Å; C335-D337 VanDerWaalsContact C-N 3.31Å; C335-D337 PolarHBondContact O-N 2.95Å
338V52.1Low51.3Low94 Ų94100.9 Ų100.957%0.5751%0.507SS*.THydrogen-bonded Turntrans-138.6-23.3-169.3-175.60000115L334 C335 S336L334-V338 WeakPolarHBondContact O-CG2 3.44Å; C335-V338 PolarHBondContact O-N 3.1Å; S336-V338 VanDerWaalsContact C-N 3.29Å; S336-V338 PolarHBondContact O-N 3.02Å
339L44.5Very low51.3Low74 Ų7499.2 Ų99.239%0.38751%0.507SS..SBendtrans-110.4134.6-173.4-121.366.6000112.9C335 A343C335-L339 WeakPolarHBondContact O-CB 3.45Å; C335-L339 PolarHBondContact O-N 3.03Å; L339-A343 HydrophobicContact CD2-CB 3.59Å; L339-A343 HydrophobicContact CG-CB 3.81Å
340P48.9Very low51Low88 Ų8896 Ų9657%0.57151%0.508SS*.  trans-64.8147.4172.627.5-34.5000111K342 A343P340-K342 PolarHBondContact O-N 3.48Å; P340-A343 PolarHBondContact O-N 2.87Å
341P51.5Low51Low107 Ų10793.9 Ų93.970%0.69550%0.503SS*.Hα-helixtrans-60.2-25.4-163.219-32.5000115.3A343 F344 M345P341-A343 VanDerWaalsContact C-N 3.34Å; P341-A343 PolarHBondContact O-N 3.38Å; P341-F344 PolarHBondContact O-N 3.31Å; P341-M345 PolarHBondContact O-N 3.27Å
342K41.5Very low50.9Low177 Ų17788.7 Ų88.777%0.7749%0.49SS*.Hα-helixtrans-64.6-36174.7-64.6-171.7176.9-1730112.8P340 L346P340-K342 PolarHBondContact O-N 3.48Å; K342-L346 PolarHBondContact O-N 3.45Å
343A47.3Very low50.6Low34 Ų3488 Ų8828%0.28149%0.494SS..Hα-helixtrans-76-32.117900000112.2L339 P340 P341 L346 H347L339-A343 HydrophobicContact CD2-CB 3.59Å; L339-A343 HydrophobicContact CG-CB 3.81Å; P340-A343 PolarHBondContact O-N 2.87Å; P341-A343 VanDerWaalsContact C-N 3.34Å; P341-A343 PolarHBondContact O-N 3.38Å; A343-L346 PolarHBondContact O-N 2.9Å; A343-H347 WeakPolarHBondContact O-CB 3.48Å; A343-H347 PolarHBondContact O-N 2.88Å
344F52Low50.8Low66 Ų6684 Ų8429%0.28948%0.483SS..Hα-helixtrans-59.1-47.6174-176.2-91000111.5L332 P341 H347 H348L332-F344 HydrophobicContact CD2-CE2 3.83Å; L332-F344 HydrophobicContact CD2-CZ 3.86Å; P341-F344 PolarHBondContact O-N 3.31Å; F344-H347 PolarHBondContact O-N 2.78Å; F344-H348 WeakPolarHBondContact O-CB 3.32Å; F344-H348 PolarHBondContact O-N 2.83Å
345M54Low50.7Low131 Ų13184.4 Ų84.465%0.64549%0.485SS*.Hα-helixtrans-63.5-43.6177.9-64.6-151-56.500112.9P341 H347 H348 S349P341-M345 PolarHBondContact O-N 3.27Å; M345-H347 PolarHBondContact O-N 2.97Å; M345-H348 PolarHBondContact O-N 3.24Å; M345-S349 WeakPolarHBondContact O-CB 3.5Å; M345-S349 PolarHBondContact O-N 2.89Å; M345-S349 PolarHBondContact O-OG 2.75Å
346L52.5Low50.9Low128 Ų12892.9 Ų92.967%0.6751%0.513SS*.Hα-helixtrans-62.6-41.2177.4-71.9174.4000112.1K342 A343 C350K342-L346 PolarHBondContact O-N 3.45Å; A343-L346 PolarHBondContact O-N 2.9Å; L346-C350 VanDerWaalsContact O-CB 3.27Å; L346-C350 WeakPolarHBondContact O-CB 3.3Å; L346-C350 PolarHBondContact O-N 3.39Å
347H53.3Low50.5Low82 Ų8296.6 Ų96.638%0.3852%0.523SS..Hα-helixtrans-64.2-42.9174.5-169.1-96.9000111.5A343 F344 M345 C350 L351A343-H347 WeakPolarHBondContact O-CB 3.48Å; A343-H347 PolarHBondContact O-N 2.88Å; F344-H347 PolarHBondContact O-N 2.78Å; M345-H347 PolarHBondContact O-N 2.97Å; H347-C350 PolarHBondContact O-N 3.35Å; H347-L351 WeakPolarHBondContact O-CB 3.36Å; H347-L351 PolarHBondContact O-N 3.02Å
348H52.9Low50.3Low94 Ų9497.2 Ų97.244%0.43552%0.522SS..Hα-helixtrans-68-36.6179.9-143.4-76.5000112.9F344 M345 S352F344-H348 WeakPolarHBondContact O-CB 3.32Å; F344-H348 PolarHBondContact O-N 2.83Å; M345-H348 PolarHBondContact O-N 3.24Å; H348-S352 VanDerWaalsContact O-CB 3.31Å; H348-S352 WeakPolarHBondContact O-CB 3.41Å; H348-S352 PolarHBondContact O-N 3.35Å; H348-S352 PolarHBondContact O-OG 3.28Å
349S49.6Very low50Low75 Ų75102 Ų10252%0.52453%0.531SS..Hα-helixtrans-67.6-42.3171.6-67.60000111.9M345 S352 A353M345-S349 WeakPolarHBondContact O-CB 3.5Å; M345-S349 PolarHBondContact O-N 2.89Å; M345-S349 PolarHBondContact O-OG 2.75Å; S349-S352 PolarHBondContact O-OG 3.47Å; S349-A353 VanDerWaalsContact O-CB 3.24Å; S349-A353 WeakPolarHBondContact O-CB 3.33Å; S349-A353 PolarHBondContact O-N 2.92Å
350C49.2Very low50Low92 Ų92101.5 Ų101.562%0.62254%0.538SS*.Hα-helixtrans-64.6-44.2176.3-170.40000111.8L346 H347 A353 G354L346-C350 VanDerWaalsContact O-CB 3.27Å; L346-C350 WeakPolarHBondContact O-CB 3.3Å; L346-C350 PolarHBondContact O-N 3.39Å; H347-C350 PolarHBondContact O-N 3.35Å; C350-A353 PolarHBondContact O-N 2.93Å; C350-G354 PolarHBondContact O-N 3.1Å
351L55.8Low49.7Very low98 Ų9899.4 Ų99.451%0.51353%0.528SS..Hα-helixtrans-68.6-38179.7-144.975.7000112.1H347 G354 L355H347-L351 WeakPolarHBondContact O-CB 3.36Å; H347-L351 PolarHBondContact O-N 3.02Å; L351-G354 PolarHBondContact O-N 2.96Å; L351-L355 WeakPolarHBondContact O-CB 3.39Å; L351-L355 VanDerWaalsContact O-CG 3.29Å; L351-L355 WeakPolarHBondContact O-CG 3.33Å; L351-L355 PolarHBondContact O-N 3.42Å
352S50.7Low49.5Very low52 Ų5298.3 Ų98.336%0.36452%0.52SS..Hα-helixtrans-74.9-30.4176.158.40000113.4H348 S349 R356H348-S352 VanDerWaalsContact O-CB 3.31Å; H348-S352 WeakPolarHBondContact O-CB 3.41Å; H348-S352 PolarHBondContact O-N 3.35Å; H348-S352 PolarHBondContact O-OG 3.28Å; S349-S352 PolarHBondContact O-OG 3.47Å; S352-R356 WeakPolarHBondContact O-CB 3.35Å; S352-R356 VanDerWaalsContact O-CG 3.27Å; S352-R356 WeakPolarHBondContact O-CG 3.35Å; S352-R356 PolarHBondContact O-N 2.89Å
353A50.8Low49.2Very low52 Ų5293 Ų9343%0.4351%0.508SS..Hα-helixtrans-66.6-46.5167.700000111.3S349 C350 R356 Q357S349-A353 VanDerWaalsContact O-CB 3.24Å; S349-A353 WeakPolarHBondContact O-CB 3.33Å; S349-A353 PolarHBondContact O-N 2.92Å; C350-A353 PolarHBondContact O-N 2.93Å; A353-R356 PolarHBondContact O-N 2.96Å; A353-Q357 WeakPolarHBondContact O-CB 3.32Å; A353-Q357 PolarHBondContact O-N 3.35Å
354G56.4Low49Very low28 Ų2895.1 Ų95.129%0.28952%0.521SS..Hα-helixtrans-56.6-52174.800000112.1C350 L351 R356 Q357 E358C350-G354 PolarHBondContact O-N 3.1Å; L351-G354 PolarHBondContact O-N 2.96Å; G354-R356 VanDerWaalsContact C-N 3.34Å; G354-R356 PolarHBondContact O-N 3.48Å; G354-Q357 CarbonylContact O-C 3.5Å; G354-Q357 PolarHBondContact O-N 3.29Å; G354-Q357 VanDerWaalsContact O-N 3.12Å; G354-E358 WeakPolarHBondContact O-CB 3.36Å; G354-E358 WeakPolarHBondContact O-CG 3.49Å; G354-E358 PolarHBondContact O-N 2.94Å
355L52.4Low48.6Very low93 Ų93101.6 Ų101.649%0.48754%0.544SS..Hα-helixtrans-61-37.9176.6-74.2168.7000112.9L351 Y359L351-L355 WeakPolarHBondContact O-CB 3.39Å; L351-L355 VanDerWaalsContact O-CG 3.29Å; L351-L355 WeakPolarHBondContact O-CG 3.33Å; L351-L355 PolarHBondContact O-N 3.42Å; L355-Y359 WeakPolarHBondContact O-CB 3.25Å; L355-Y359 PolarHBondContact O-N 2.96Å
356R51Low48.1Very low202 Ų202106 Ų10676%0.76255%0.553SS**Hα-helixtrans-65.3-40.9173.4-80.5172.7170.3-95.70.3112.1S352 A353 G354 Y359 A360S352-R356 WeakPolarHBondContact O-CB 3.35Å; S352-R356 VanDerWaalsContact O-CG 3.27Å; S352-R356 WeakPolarHBondContact O-CG 3.35Å; S352-R356 PolarHBondContact O-N 2.89Å; A353-R356 PolarHBondContact O-N 2.96Å; G354-R356 VanDerWaalsContact C-N 3.34Å; G354-R356 PolarHBondContact O-N 3.48Å; R356-Y359 PolarHBondContact O-N 3.26Å; R356-A360 PolarHBondContact O-N 2.91Å
357Q46.9Very low47.5Very low148 Ų148104.9 Ų104.969%0.69256%0.556SS**Hα-helixtrans-72.5-34.9179.4-169149.17.500112.1A353 G354 A360 A361A353-Q357 WeakPolarHBondContact O-CB 3.32Å; A353-Q357 PolarHBondContact O-N 3.35Å; G354-Q357 CarbonylContact O-C 3.5Å; G354-Q357 PolarHBondContact O-N 3.29Å; G354-Q357 VanDerWaalsContact O-N 3.12Å; Q357-A360 PolarHBondContact O-N 3.43Å; Q357-A361 VanDerWaalsContact O-CB 3.29Å; Q357-A361 WeakPolarHBondContact O-CB 3.38Å; Q357-A361 PolarHBondContact O-N 2.85Å
358E42.5Very low46.5Very low126 Ų126105.6 Ų105.659%0.58957%0.57SS**Hα-helixtrans-69.8-36.9171.2-74.7-179.4-167.900112.3G354 A361 T362G354-E358 WeakPolarHBondContact O-CB 3.36Å; G354-E358 WeakPolarHBondContact O-CG 3.49Å; G354-E358 PolarHBondContact O-N 2.94Å; E358-A361 PolarHBondContact O-N 3.31Å; E358-T362 WeakPolarHBondContact O-CB 3.35Å; E358-T362 PolarHBondContact O-N 2.89Å; E358-T362 PolarHBondContact O-OG1 2.95Å
359Y46.2Very low45.6Very low194 Ų194104.4 Ų104.476%0.76158%0.584SS**Hα-helixtrans-63.7-42.8173.1-137.4-97.6000111.2L355 R356 T362 A363L355-Y359 WeakPolarHBondContact O-CB 3.25Å; L355-Y359 PolarHBondContact O-N 2.96Å; R356-Y359 PolarHBondContact O-N 3.26Å; Y359-T362 PolarHBondContact O-N 3.17Å; Y359-A363 WeakPolarHBondContact O-CB 3.3Å; Y359-A363 PolarHBondContact O-N 3.13Å
360A44.8Very low44.9Very low64 Ų64106.8 Ų106.853%0.52960%0.6SS.*Hα-helixtrans-64.1-43.7173.900000112.4R356 Q357 T362 A363 S364R356-A360 PolarHBondContact O-N 2.91Å; Q357-A360 PolarHBondContact O-N 3.43Å; A360-T362 VanDerWaalsContact C-N 3.35Å; A360-T362 PolarHBondContact O-N 3.08Å; A360-A363 PolarHBondContact O-N 3.26Å; A360-S364 WeakPolarHBondContact O-CB 3.28Å; A360-S364 PolarHBondContact O-N 3.32Å
361A43.1Very low44.2Very low45 Ų45107.7 Ų107.737%0.37261%0.608SS.*Hα-helixtrans-66.7-34.5176.800000112.6Q357 E358 S364 R365Q357-A361 VanDerWaalsContact O-CB 3.29Å; Q357-A361 WeakPolarHBondContact O-CB 3.38Å; Q357-A361 PolarHBondContact O-N 2.85Å; E358-A361 PolarHBondContact O-N 3.31Å; A361-S364 PolarHBondContact O-N 3.25Å; A361-R365 WeakPolarHBondContact O-CB 3.5Å; A361-R365 WeakPolarHBondContact O-CG 3.45Å; A361-R365 PolarHBondContact O-N 3.29Å
362T45.6Very low43.2Very low84 Ų84108.7 Ų108.752%0.51562%0.622SS.*Hα-helixtrans-76.5-37178.6-54.80000111.4E358 Y359 A360 S364 R365 R366E358-T362 WeakPolarHBondContact O-CB 3.35Å; E358-T362 PolarHBondContact O-N 2.89Å; E358-T362 PolarHBondContact O-OG1 2.95Å; Y359-T362 PolarHBondContact O-N 3.17Å; A360-T362 VanDerWaalsContact C-N 3.35Å; A360-T362 PolarHBondContact O-N 3.08Å; T362-S364 VanDerWaalsContact C-N 3.34Å; T362-R365 PolarHBondContact O-N 3.15Å; T362-R366 PolarHBondContact O-N 2.91Å
363A37.1Very low42.3Very low64 Ų64114.9 Ų114.953%0.52965%0.645SS.*Hα-helixtrans-59.5-45.1168.100000111.2Y359 A360 R366Y359-A363 WeakPolarHBondContact O-CB 3.3Å; Y359-A363 PolarHBondContact O-N 3.13Å; A360-A363 PolarHBondContact O-N 3.26Å; A363-R366 PolarHBondContact O-N 3.34Å
364S41.3Very low41.4Very low79 Ų79116.9 Ų116.955%0.55266%0.655SS**Hα-helixtrans-61.5-43.7174.9-178.60000112.6A360 A361 T362 R366 S367A360-S364 WeakPolarHBondContact O-CB 3.28Å; A360-S364 PolarHBondContact O-N 3.32Å; A361-S364 PolarHBondContact O-N 3.25Å; T362-S364 VanDerWaalsContact C-N 3.34Å; S364-R366 PolarHBondContact O-N 3.15Å; S364-S367 PolarHBondContact O-N 3.13Å
365R44.1Very low40.3Very low202 Ų202122.2 Ų122.276%0.76268%0.676SS**Hα-helixtrans-65.5-19.7177.9-76.8177.7-179-82.51.2114.4A361 T362 S367A361-R365 WeakPolarHBondContact O-CB 3.5Å; A361-R365 WeakPolarHBondContact O-CG 3.45Å; A361-R365 PolarHBondContact O-N 3.29Å; T362-R365 PolarHBondContact O-N 3.15Å; R365-S367 PolarHBondContact O-N 3.09Å
366R43.5Very low39.4Very low224 Ų224129 Ų12985%0.84570%0.695SS**THydrogen-bonded Turntrans-74.4-6169.7-72.5-173.970.1-126.51.7114T362 A363 S364T362-R366 PolarHBondContact O-N 2.91Å; A363-R366 PolarHBondContact O-N 3.34Å; S364-R366 PolarHBondContact O-N 3.15Å
367S39.6Very low38.4Very low104 Ų104131.3 Ų131.373%0.72770%0.704SS**THydrogen-bonded Turntrans-108.86.1178.3-159.10000114.7S364 R365S364-S367 PolarHBondContact O-N 3.13Å; R365-S367 PolarHBondContact O-N 3.09Å
368S33.6Very low37.6Very low97 Ų97129.3 Ų129.368%0.67871%0.707SS**  trans-142.792.7178.1-68.20000111.4
369G34.5Very low37.2Very low70 Ų70128.9 Ų128.972%0.72271%0.713SS**  trans-89.5159.4176.800000113.8
370S34.9Very low36.3Very low124 Ų124129 Ų12987%0.86772%0.717SS**  trans66154.9-173.281.80000114.6
371S34.3Very low35.8Very low112 Ų112130.1 Ų130.178%0.78372%0.722SS**  cis-131.3156.67.6-173.30000112.1
372C34.6Very low35.4Very low118 Ų118134.2 Ų134.280%0.79774%0.737SS**  trans-99.5128.7176.8-58.60000110.7
373H31.7Very low35Very low183 Ų183137.9 Ų137.985%0.84775%0.749SS**  trans-138137.1146.9-134.368.2000111.9
374S31.8Very low34.9Very low94 Ų94142.9 Ų142.966%0.65776%0.761SS**  trans-107.9-167.2176.4-1720000108.6
375L32.6Very low35Very low139 Ų139145.6 Ų145.673%0.72877%0.769SS**  trans72.498.1178.1-52.3163.8000112.2
376R33.1Very low34.8Very low235 Ų235142.4 Ų142.489%0.88777%0.767SS**  80.2125.567.5-75.8-171.9175.1-148.60.7113.7
377R31.3Very low34.4Very low251 Ų251135.2 Ų135.295%0.94776%0.755SS**  trans-63.8135.1165.7-70164.5152-110.91111.7
378S29.4Very low34.1Very low106 Ų106137.9 Ų137.974%0.74176%0.756SS**  trans-176.9146.9147.4-124.10000107.3
379T33.4Very low34.4Very low118 Ų118138.6 Ų138.672%0.72476%0.761SS**  cis163.7143.3-13.328.20000104.5
380F28.1Very low34.9Very low195 Ų195141.1 Ų141.186%0.85576%0.757SS**  trans70.5135.1177.7-91.4-128.2000114.7
381S33.7Very low34.8Very low89 Ų89142.6 Ų142.662%0.62275%0.75SS**  73.613861.1-84.70000112.6
382D34.4Very low35.5Very low130 Ų130143.7 Ų143.770%0.69575%0.748SS**  cis-138.3151.38.8-99.5-8000109.6
383Q38Very low36.3Very low162 Ų162146.5 Ų146.576%0.75775%0.749SS**  70.2147.783-164.3168.9-23.100115.2
384E35Very low37.2Very low169 Ų169146.6 Ų146.679%0.7975%0.75SS**  trans76.9149.1-178.3-54.8-162.4132.500116.7
385L43.1Very low37.8Very low135 Ų135150 Ų15071%0.70776%0.756SS**  cis-171.7169.5-46-114.1170.4000107.5
386D40.8Very low37.8Very low136 Ų136147 Ų14773%0.72775%0.75SS**  trans63.3157.5168.5-66.4-12.6000117.9
387A34Very low37.8Very low73 Ų73141.6 Ų141.660%0.60374%0.743SS**  cis-144.5145.97.700000113.8
388H34Very low37.8Very low159 Ų159137 Ų13774%0.73673%0.732SS**  trans46.3116.7140.4-55.1-39.2000120.8
389S40Very low37.7Very low113 Ų113139.8 Ų139.879%0.7974%0.735SS**  91.9149.296.9-145.40000111.4
390L45.1Very low37.4Very low123 Ų123139 Ų13964%0.64474%0.735SS**  cis-170.3144.444.9157.5144000110.9
391E33.5Very low37.5Very low154 Ų154139.9 Ų139.972%0.7274%0.739SS**  trans47.7157.6164.8-72.4124.6-13000119
392D48.8Very low37.2Very low136 Ų136139.5 Ų139.573%0.72774%0.741SS**  cis-149.9129.520.2-152.2-148.7000106.4
393E50.6Low36.9Very low177 Ų177138.1 Ų138.183%0.82774%0.742SS**  51.5138.884.7-50.4-148.392.300115.1
394E51.2Low36.5Very low184 Ų184137.7 Ų137.786%0.8675%0.745SS**  cis-114.9167.9-4.263.2-176.1176.700110.7
395E43.4Very low36.3Very low167 Ų167137.3 Ų137.378%0.7875%0.747SS**  cis89.1140.816.1-167.661.1119.600118.3
396A33Very low36.2Very low74 Ų74136.1 Ų136.161%0.61275%0.747SS**  trans68.3141.916400000120.5
397V32.4Very low35.7Very low123 Ų123134.5 Ų134.575%0.74575%0.747SS**  cis-160.7166.3-15.7-95.70000111.5
398H31.1Very low35.3Very low155 Ų155135 Ų13572%0.71875%0.746SS**  trans86.2112.9142.3-86.4-50000123.8
399M27.7Very low35.1Very low163 Ų163137.1 Ų137.180%0.80375%0.748SS**  87.8146124.7-141.37092.400120.4
400S27.3Very low34.5Very low103 Ų103140.9 Ų140.972%0.7275%0.75SS**  trans-87.1175.3179.6-47.90000113.8
401F30Very low33.9Very low212 Ų212140 Ų14093%0.9375%0.754SS**  trans91.4151.4168.5-94.5-94.4000119.5
402A27.7Very low34.4Very low82 Ų82138.6 Ų138.668%0.67876%0.759SS**  trans79.889162.200000121.1
403S28.3Very low33.6Very low101 Ų101137.3 Ų137.371%0.70676%0.76SS**  79.5145.4120.9740000123.2
404N28.9Very low33.2Very low152 Ų152133.7 Ų133.781%0.81375%0.752SS**  trans76.6109.6150.9-60.6-18.1000121.5
405L30.8Very low32.4Very low161 Ų161135 Ų13584%0.84375%0.749SS**  trans-56.7163.4142.3-108.871.3000110.7
406P42.7Very low31.7Very low110 Ų110134.9 Ų134.971%0.71475%0.748SS**  cis-154.2171.146.343.4-22.7000120.3
407S28.9Very low31.5Very low103 Ų103136.3 Ų136.372%0.7275%0.754SS**  trans72.9140.7139.1-80.60000123.4
408S26.3Very low32.1Very low83 Ų83135.4 Ų135.458%0.5875%0.75SS**  trans76.1143.4151.2-66.90000119.1
409R29Very low32.1Very low204 Ų204138.7 Ų138.777%0.7776%0.757SS**  cis-163.4152.2-13-124174.3-79.2-170-2111.1
410F28.7Very low32.2Very low191 Ų191137 Ų13784%0.83876%0.755SS**  trans59.6123.7157.6-82-77.3000122.6
411S32.8Very low32.4Very low105 Ų105137.1 Ų137.173%0.73476%0.756SS**  trans-73.4164.6149.5-300000110.9
412P43.8Very low32.9Very low125 Ų125132 Ų13281%0.81274%0.744SS**  -150.2171.57939.7-21.3000116.7
413S31.6Very low33.2Very low109 Ų109139.2 Ų139.276%0.76275%0.754SS**  trans-97.6148.6162.9-176.50000109.6
414P42.3Very low33.3Very low101 Ų101141.1 Ų141.166%0.65676%0.756SS**  -160.3142.2109.136.6-16000119.1
415R34.5Very low33.2Very low211 Ų211138.7 Ų138.780%0.79675%0.751SS**  trans66.6169.9146.7-59.8166.8-175-97.70.7116.6
416H27Very low33.7Very low165 Ų165136.4 Ų136.476%0.76475%0.746SS**  cis-140.3172.45.5-119.7128.3000111.9
417S29.3Very low33.3Very low104 Ų104143.1 Ų143.173%0.72776%0.757SS**  trans-98.6-163.5174.5-146.50000110.1
418P44.5Very low33.4Very low104 Ų104144 Ų14468%0.67576%0.763SS**  cis-141.6177.6-8.141-22000117.1
419R31.1Very low33.7Very low224 Ų224151 Ų15185%0.84578%0.776SS**  trans163.4119.2131.6-92.1176.2-179.3-92-1112.6
420V29.7Very low33.6Very low126 Ų126146.6 Ų146.676%0.76478%0.777SS**  91.311690.3167.10000115.1
421S32.6Very low33.9Very low106 Ų106143.7 Ų143.774%0.74178%0.778SS**  trans-79.6-172.5170.6-20.70000111.6
422P40.4Very low33.5Very low106 Ų106143 Ų14369%0.68878%0.778SS**  cis-157-166.834.146.2-23.3000118.8
423R35Very low33.1Very low232 Ų232147.7 Ų147.788%0.87578%0.779SS**  trans72157.6155-69.116283.9153.62.9119.6
424N29Very low32.7Very low141 Ų141146.7 Ų146.775%0.75477%0.772SS**  cis-170.4149.3-41.8-147.9-8.3000111.9
425S27.8Very low32.7Very low101 Ų101149.7 Ų149.771%0.70678%0.781SS**  trans65.1166.2159-78.70000120.6
426P40.7Very low32.6Very low113 Ų113144.6 Ų144.673%0.73477%0.77SS**  cis-140.1145.1-26.134.2-14.6000117.8
427R33.7Very low32.8Very low251 Ų251147.7 Ų147.795%0.94778%0.776SS**  trans29.5114.3132.9-165.4-176.3-160.61695.4122
428S30.9Very low32.9Very low121 Ų121145.6 Ų145.685%0.84677%0.771SS**  trans-166.6178.8145.162.40000111.6
429R34.1Very low32.3Very low230 Ų230149.1 Ų149.187%0.86878%0.778SS**  -165.392.5-64.7-179.5-176.8-179.8-106.35.6109.9
430S26.6Very low32.1Very low112 Ų112143.5 Ų143.578%0.78377%0.774SS**  trans62.7159.8167.8-59.10000118.7
431P33.8Very low32.4Very low131 Ų131149.1 Ų149.185%0.85178%0.781SS**  trans-79.7157.5-174.1-11.329.1000113.7
432A25.6Very low32.2Very low89 Ų89148 Ų14874%0.73679%0.786SS**  trans-145171.4169.600000110.3
433R34.3Very low31.6Very low225 Ų225147.7 Ų147.785%0.84979%0.787SS**  trans77.5130.8179.8-42.7-169.871.81226.5113.6
434S24.8Very low32.1Very low87 Ų87142.8 Ų142.861%0.60879%0.785SS**  cis71.6110.234.4-172.20000112.6D436S434-D436 PolarHBondContact OG-OD2 3.34Å
435I40.3Very low32.3Very low164 Ų164144 Ų14484%0.84179%0.786SS**  trans-131.5126.3157-172.8157.8000108.8
436D33.1Very low33.4Very low104 Ų104144.1 Ų144.156%0.55678%0.784SS**  trans-96.1-162.8-176.7-58.3-95.6000110.8S434S434-D436 PolarHBondContact OG-OD2 3.34Å
437Y31.9Very low33Very low230 Ų230145.4 Ų145.490%0.90278%0.784SS**  trans70.9132.1-178.6-44.7-77000113.6
438G30Very low33Very low61 Ų61140.3 Ų140.363%0.62977%0.774SS**  cis154138.13.800000107.1
439H32.2Very low32.9Very low177 Ų177139.2 Ų139.282%0.81977%0.766SS**  -168.8152.467.5-79.476.6000111.2
440S27.9Very low32.9Very low107 Ų107139 Ų13975%0.74877%0.765SS**  trans63145.2150.2-63.80000119.1
441R34.8Very low33.5Very low243 Ų243140.8 Ų140.892%0.91777%0.765SS**  cis-161.9144-5.5-123.7178.9179.6-119.74107.9
442G29.5Very low33.4Very low83 Ų83143 Ų14386%0.85676%0.764SS**  trans139.3109.2162.700000116.2
443S28.6Very low33.9Very low100 Ų100147.2 Ų147.270%0.69977%0.769SS**  trans-150.9154.7166.3-161.40000107.7
444P45.3Very low34.2Very low129 Ų129142 Ų14284%0.83876%0.764SS**  -139.5168.587.323.6-1.5000117
445Q32.3Very low34.4Very low165 Ų165148.4 Ų148.477%0.77178%0.775SS**  trans-82.3-164.8172.3-74-78.5-1.900111.4
446P50.8Low34Very low104 Ų104148.7 Ų148.768%0.67577%0.772SS**  cis-125.7-152.11.925.82.7000113
447I31.8Very low34Very low141 Ų141149.3 Ų149.372%0.72379%0.785SS**  cis-150125.226.9-67.5175.4000114.3
448I35Very low34.6Very low144 Ų144145.8 Ų145.874%0.73878%0.78SS**  trans16.1145.3135.1-17.7169.9000123.4
449S28.1Very low34.7Very low97 Ų97152.1 Ų152.168%0.67879%0.794SS**  trans81151.3146.6-75.60000119.7
450R34.6Very low34.7Very low226 Ų226146.3 Ų146.385%0.85378%0.782SS**  cis-159.7151.5-5.3-123.6169.4-179.3177.20.2111.9
451L39.1Very low34.9Very low150 Ų150150.8 Ų150.879%0.78579%0.791SS**  trans39.9134.3140.6-142.475.4000122.6
452Q30.4Very low35Very low176 Ų176142 Ų14282%0.82278%0.775SS**  147.9133.4113.6-163.2148.636.800114.8
453Q38Very low35.4Very low179 Ų179146.8 Ų146.884%0.83678%0.775SS**  trans-96.7167170.9-53.8-177.3-14.600110.9
454P38.9Very low35.6Very low115 Ų115149.2 Ų149.275%0.74778%0.781SS**  -161.416287.741.2-20.4000120.6
455R30Very low35.7Very low221 Ų221150.4 Ų150.483%0.83478%0.779SS**  trans72.4125.2143.8-68.1-99.5-165.4144.43.8124.6
456H31.2Very low36.2Very low171 Ų171150.6 Ų150.679%0.79278%0.78SS**  trans27.2150.5130.5-65.7-95.1000122.2
457S32.8Very low36Very low116 Ų116152 Ų15281%0.81179%0.787SS**  -164.1-176.650.6-159.50000116.2
458L44.2Very low36.5Very low156 Ų156150.1 Ų150.182%0.81779%0.786SS**  trans-94.9163.3-176.4-64.6156.4000114.7
459Q32.7Very low37.1Very low194 Ų194148.6 Ų148.691%0.90778%0.783SS**  trans-167.6155.4149.6-159.359.817.400113
460G31.8Very low38.1Very low56 Ų56150 Ų15058%0.57779%0.787SS**  trans179.5159.9168.900000116
461H33.1Very low38.6Very low200 Ų200148.3 Ų148.393%0.92679%0.786SS**  trans-167.3177169.4-115.460.8000112.8
462G37.3Very low39.1Very low58 Ų58145.8 Ų145.860%0.59877%0.774SS**  trans-144.6-150.4-173.200000116.9
463H38Very low40.3Very low185 Ų185143 Ų14386%0.85676%0.761SS**  trans76.9155.4-162.5-64.6-98.8000114.1
464D31.2Very low40.8Very low151 Ų151140.7 Ų140.781%0.80775%0.75SS**  cis-144.6175.315.7-154.9-5.7000113.4
465L47.5Very low41.5Very low153 Ų153142.8 Ų142.880%0.80175%0.747SS**  trans-142.8110.5-171-125.2170.9000112
466Q43.8Very low43Very low169 Ų169137 Ų13779%0.7973%0.732SS**  trans160.1124157.2-91.9-69.47.400109.8
467T45.8Very low44.2Very low135 Ų135137.5 Ų137.583%0.82873%0.727SS**  trans168.5-24.7158.524.60000114.4V469T467-V469 PolarHBondContact O-N 3.24Å
468S42.2Very low45.4Very low100 Ų100141.9 Ų141.970%0.69973%0.726SS**  trans-71.9-20.1-159.756.10000116.9
469V49.3Very low45.8Very low112 Ų112138.2 Ų138.268%0.67971%0.713SS**SBendtrans-66.1-45.9-163.5-177.60000113.7T467 K471 N472T467-V469 PolarHBondContact O-N 3.24Å; V469-K471 VanDerWaalsContact C-N 3.29Å; V469-K471 PolarHBondContact O-N 3.41Å; V469-N472 PolarHBondContact O-N 3.31Å
470V47.5Very low47Very low127 Ų127134.4 Ų134.477%0.7770%0.699SS**Hα-helixtrans-67.4-28.6-169.6-174.40000112.6N472V470-N472 PolarHBondContact O-N 3.14Å
471K45.6Very low47.8Very low190 Ų190137.3 Ų137.383%0.82671%0.707SS**Hα-helixtrans-81.21.1-174.8-135.2169.7-171.1171.50114.3V469V469-K471 VanDerWaalsContact C-N 3.29Å; V469-K471 PolarHBondContact O-N 3.41Å
472N50.7Low48.2Very low98 Ų98134.7 Ų134.752%0.52470%0.7SS.*Hα-helixtrans-93.3-41.2179.3-166.720.2000112.7V469 V470 E474 K475 L476V469-N472 PolarHBondContact O-N 3.31Å; V470-N472 PolarHBondContact O-N 3.14Å; N472-E474 PolarHBondContact O-N 3.41Å; N472-K475 WeakPolarHBondContact O-CB 3.31Å; N472-K475 PolarHBondContact O-N 3.09Å; N472-K475 VanDerWaalsContact O-N 3.13Å; N472-L476 WeakPolarHBondContact O-CD1 3.41Å; N472-L476 PolarHBondContact O-N 3.46Å; N472-L476 WeakPolarHBondContact OD1-CD1 3.42Å
473E53.9Low48.4Very low118 Ų118139 Ų13955%0.55171%0.709SS**Hα-helixtrans-53.7-53.2-174.2-172-164.8143.400111.9K475 L476 R477E473-K475 PolarHBondContact O-N 3.02Å; E473-K475 VanDerWaalsContact O-N 3.11Å; E473-L476 PolarHBondContact O-N 3.33Å; E473-R477 HydrophobicContact CG-CG 4.47Å; E473-R477 WeakPolarHBondContact O-CG 3.44Å; E473-R477 PolarHBondContact O-N 3.41Å; E473-R477 VanDerWaalsContact O-N 3.14Å; E473-R477 IonicContact OE1-CZ 3.89Å; E473-R477 IonicContact OE1-NH1 2.92Å; E473-R477 PolarHBondContact OE1-NH1 3.11Å
474E49Very low48.3Very low129 Ų129137.1 Ų137.160%0.60371%0.71SS**Hα-helixtrans-66.9-17.6-173.4-154.6177179.900113.2N472N472-E474 PolarHBondContact O-N 3.41Å
475K54.2Low48.6Very low160 Ų160139.7 Ų139.770%0.69671%0.709SS**Hα-helixtrans-74.3-44170.3-104.2-180173.9-177.90112.1N472 E473 R477 R478 S479N472-K475 WeakPolarHBondContact O-CB 3.31Å; N472-K475 PolarHBondContact O-N 3.09Å; N472-K475 VanDerWaalsContact O-N 3.13Å; E473-K475 PolarHBondContact O-N 3.02Å; E473-K475 VanDerWaalsContact O-N 3.11Å; K475-R477 VanDerWaalsContact C-N 3.27Å; K475-R477 PolarHBondContact O-N 3.01Å; K475-R478 PolarHBondContact O-N 3.47Å; K475-S479 PolarHBondContact O-N 3.28Å
476L60.5Low47.7Very low99 Ų99138.1 Ų138.152%0.51871%0.71SS.*Hα-helixtrans-62.7-36.5174.8-83.479.8000111.5N472 E473 R478 S479N472-L476 WeakPolarHBondContact O-CD1 3.41Å; N472-L476 PolarHBondContact O-N 3.46Å; N472-L476 WeakPolarHBondContact OD1-CD1 3.42Å; E473-L476 PolarHBondContact O-N 3.33Å; L476-R478 PolarHBondContact O-N 3.13Å; L476-S479 PolarHBondContact O-N 3.27Å; L476-S479 PolarHBondContact O-OG 3.38Å
477R57.7Low47.1Very low181 Ų181135.5 Ų135.568%0.68371%0.706SS**THydrogen-bonded Turntrans-65.5-17.3178.1-61-17783.1102.111.6114E473 K475E473-R477 HydrophobicContact CG-CG 4.47Å; E473-R477 WeakPolarHBondContact O-CG 3.44Å; E473-R477 PolarHBondContact O-N 3.41Å; E473-R477 VanDerWaalsContact O-N 3.14Å; E473-R477 IonicContact OE1-CZ 3.89Å; E473-R477 IonicContact OE1-NH1 2.92Å; E473-R477 PolarHBondContact OE1-NH1 3.11Å; K475-R477 VanDerWaalsContact C-N 3.27Å; K475-R477 PolarHBondContact O-N 3.01Å
478R57Low46.5Very low208 Ų208133.5 Ų133.579%0.78570%0.703SS**THydrogen-bonded Turntrans-100.4-8.3176.9-68.7-174-177.2-151.32.5114.1K475 L476K475-R478 PolarHBondContact O-N 3.47Å; L476-R478 PolarHBondContact O-N 3.13Å
479S53.7Low46.1Very low79 Ų79134.7 Ų134.755%0.55271%0.706SS**SBendtrans-96.6-3.1-178.956.60000115K475 L476K475-S479 PolarHBondContact O-N 3.28Å; L476-S479 PolarHBondContact O-N 3.27Å; L476-S479 PolarHBondContact O-OG 3.38Å
480L58.3Low45.3Very low115 Ų115135.7 Ų135.760%0.60271%0.712SS**  trans-132.287.2-175.3-66.4175.8000111.7N482L480-N482 VanDerWaalsContact C-N 3.31Å; L480-N482 PolarHBondContact O-N 3.45Å
481P47.1Very low44.6Very low117 Ų117133.7 Ų133.776%0.7671%0.71SS**THydrogen-bonded Turntrans-76.6-7.7-174.329.8-35.6000115.4
482N42.1Very low43.9Very low145 Ų145134.2 Ų134.278%0.77572%0.715SS**THydrogen-bonded Turntrans-119.828.7-164.1-70-32.2000115.3L480L480-N482 VanDerWaalsContact C-N 3.31Å; L480-N482 PolarHBondContact O-N 3.45Å
483L40.9Very low42.8Very low149 Ų149134.9 Ų134.978%0.7873%0.727SS**  trans-11485.7170.1-75176.5000111.2R485L483-R485 PolarHBondContact O-N 3.2Å; L483-R485 VanDerWaalsContact O-N 3.16Å
484T37.2Very low42.3Very low144 Ų144134.9 Ų134.988%0.88374%0.737SS**  trans-66.2111.5174.8-55.10000110.7
485R36.4Very low41.3Very low206 Ų206137.1 Ų137.178%0.77775%0.748SS**  trans-43.2132.7171.5172.6-172.9-177.2-98.25.3113.7L483L483-R485 PolarHBondContact O-N 3.2Å; L483-R485 VanDerWaalsContact O-N 3.16Å
486S28.6Very low41Very low119 Ų119134.2 Ų134.283%0.83275%0.745SS**  trans-146.4142.2144.9-940000110.2
487T31.4Very low39.5Very low114 Ų114135.9 Ų135.970%0.69976%0.759SS**  trans-156.1130-172.3-48.50000110.1
488A33.6Very low38.2Very low93 Ų93136.4 Ų136.477%0.76977%0.767SS**  trans64.7162179.400000114.7
489V33.8Very low36.7Very low126 Ų126133.3 Ų133.376%0.76477%0.766SS**  cis-142.416014.7-160.20000111.4
490T32.4Very low35.6Very low132 Ų132134.8 Ų134.881%0.8178%0.776SS**  trans85.8126.6151.310.50000123
491A31.9Very low34.6Very low86 Ų86141.1 Ų141.171%0.71179%0.792SS**  trans85.9109134.800000123.5
492Q32.3Very low33.8Very low201 Ų201140.9 Ų140.994%0.93979%0.793SS**  trans79.8171.8140.7-64.5-171.5-7.600121
493S26.1Very low33.3Very low112 Ų112139.9 Ų139.978%0.78380%0.796SS**  trans-143.4164.8-153.9-1780000108.3
494P43.9Very low32.9Very low117 Ų117141 Ų14176%0.7680%0.797SS**  cis-129.8-168.29.725.40.7000115.9
495E28.5Very low32.5Very low177 Ų177139.2 Ų139.283%0.82779%0.791SS**  trans-45178.3164.3-85.1-160137.300118.2
496P48.1Very low32.5Very low98 Ų98135 Ų13564%0.63678%0.784SS**  cis-140.8144.8-33.735.2-18.2000114.4
497V28Very low32.8Very low134 Ų134137.5 Ų137.581%0.81279%0.787SS**  trans-156.5131.2163.4-113.30000117.2
498K30.3Very low32.9Very low193 Ų193138.6 Ų138.684%0.83978%0.784SS**  trans38.7112.7139.1-67.5169.5-175.3173.20120.9
499N25.9Very low32.9Very low143 Ų143139.7 Ų139.777%0.76578%0.781SS**  39.9112.5124.3175.463.6000119.8
500S30.4Very low33.4Very low110 Ų110138.5 Ų138.577%0.76978%0.775SS**  -170.6160.6122.4-86.80000115
501R37.9Very low33.4Very low247 Ų247140.1 Ų140.193%0.93278%0.779SS**  trans-72.3151.9-179.2-59.4159.5163.1175.3-8.1114.3
502S30.2Very low33.4Very low112 Ų112139.9 Ų139.978%0.78379%0.785SS**  trans-162.2157.5148.659.90000109.2
503C30.4Very low33.4Very low125 Ų125134.5 Ų134.585%0.84578%0.784SS**  cis-151.4164.9-9.629.30000112.2
504E33.8Very low33.7Very low171 Ų171134.8 Ų134.880%0.79979%0.786SS**  trans-77.8154.6175.217662.7-98.800113.1
505S29.6Very low34Very low108 Ų108134.6 Ų134.676%0.75579%0.785SS**  trans-166.899.6159.3-157.90000110.3
506N34.5Very low34.1Very low117 Ų117137 Ų13763%0.62679%0.786SS**  92.1122.165.2-176-3.5000114.3Q508N506-Q508 PolarHBondContact OD1-N 3.41Å
507L36.8Very low33.5Very low171 Ų171140.7 Ų140.790%0.89580%0.795SS**  trans-139.788.5163.4-75.5179.8000113.4
508Q31.9Very low33.7Very low138 Ų138142.7 Ų142.765%0.64580%0.795SS**  75.594115.5-143.444.230.400121.6N506N506-Q508 PolarHBondContact OD1-N 3.41Å
509V33.3Very low33.9Very low115 Ų115137.9 Ų137.970%0.69779%0.786SS**  trans63.3166.8142.7-65.50000121.8
510P45Very low34.4Very low101 Ų101139.9 Ų139.966%0.65679%0.791SS**  cis-131.7174.2-2.419.56.2000118.5
511N31.9Very low34.7Very low166 Ų166140.4 Ų140.489%0.88879%0.794SS**  trans78.1130151.4-66.6-18.8000121.9
512G32.8Very low34.4Very low81 Ų81132.1 Ų132.184%0.83578%0.779SS**  trans139.196.1140.300000118.7
513G32.7Very low34.6Very low88 Ų88133.7 Ų133.791%0.90778%0.784SS**  trans89.3114144.100000119.9
514S32.4Very low34.9Very low118 Ų118132.3 Ų132.383%0.82578%0.781SS**  trans-123.4175.7151.5-142.20000106.5
515P49.2Very low34.9Very low114 Ų114128.5 Ų128.574%0.7478%0.779SS**  cis-143-166.79.237.4-14.2000115.9
516R31.4Very low35.2Very low227 Ų227132 Ų13286%0.85778%0.783SS**  123.991.2128.2-161173.6-173.9159.22.1118.9
517H35.5Very low35.2Very low176 Ų176133.9 Ų133.982%0.81579%0.792SS**  64.7157.1126.3-115.7-90.7000123.3
518Q31.2Very low35.8Very low175 Ų175130.3 Ų130.382%0.81878%0.78SS**  trans81.3146.9156.4-152.4173.352.200117.5
519S35.9Very low35.7Very low93 Ų93133.2 Ų133.265%0.6578%0.784SS**  -178.5164.9-56.6-87.70000108.9
520Q35Very low35.7Very low185 Ų185136.5 Ų136.586%0.86479%0.786SS**  trans93.7154158.7-48.3-160.636.800120.1
521S36.4Very low35Very low120 Ų120137 Ų13784%0.83979%0.791SS**  trans-101.9-165.3-167.6-34.30000110.8
522A33Very low34.9Very low74 Ų74132.2 Ų132.261%0.61278%0.782SS**  cis-165.6159.3100000110.5
523T34.2Very low34.8Very low145 Ų145135 Ų13589%0.8978%0.783SS**  trans60.6167.4151.8520000117.8
524A35.8Very low34.6Very low96 Ų96136 Ų13679%0.79378%0.776SS**  cis-148.4-178.34.400000108.1
525A35.1Very low34.5Very low90 Ų90142 Ų14274%0.74478%0.78SS**  cis-160.4-160.1-4.200000106.2
526Q34.6Very low33.6Very low182 Ų182142.2 Ų142.285%0.8578%0.784SS**  cis-138.9-113.35.7-62.2-176.617.600112.5
527L35.7Very low33.7Very low156 Ų156136.9 Ų136.982%0.81778%0.782SS**  trans-167.9175.7-150.3-82.5176.5000109.3
528P48.2Very low34.1Very low97 Ų97134.7 Ų134.763%0.6378%0.783SS**  cis-146.2170.2-31.938.8-20.4000118.1
529R30.7Very low34.1Very low198 Ų198135.8 Ų135.875%0.74779%0.785SS**  trans76.5142.4134.3-85.5165.6178.3-173.71.7125.5
530Y32.8Very low34.7Very low184 Ų184136.5 Ų136.572%0.72279%0.788SS**  trans61.1116.6149.9-60.3-43.9000119.4
531S30Very low34.6Very low111 Ų111137.1 Ų137.178%0.77679%0.787SS**  73.3131.963.5750000115.4
532G29.4Very low34.3Very low66 Ų66139.8 Ų139.868%0.6879%0.787SS**  cis171.9172.7-4.200000113.9
533T30.6Very low34.1Very low140 Ų140143.7 Ų143.786%0.85980%0.796SS**  trans59.9126161.556.10000123.7
534S28.8Very low34.1Very low109 Ų109143.9 Ų143.976%0.76279%0.791SS**  trans100.1130.8130.7-71.30000124.8
535R30.4Very low33.9Very low245 Ų245148.5 Ų148.593%0.92580%0.797SS**  trans70.2124.6145.9-75-178168.2-137.9-0.9122.6
536S31.2Very low33.7Very low117 Ų117153.3 Ų153.382%0.81880%0.801SS**  -166165.4118.862.80000112.5
537S32.3Very low34.2Very low116 Ų116150.2 Ų150.281%0.81180%0.796SS**  trans-158.9150.2172.2-55.30000110.3
538P44.3Very low33.9Very low129 Ų129149.5 Ų149.584%0.83880%0.798SS**  -145.7-175129.534-15.3000115.2
539K31.9Very low32.9Very low198 Ų198149.6 Ų149.686%0.86181%0.807SS**  trans-117-158174-48.9173.8179.8174.50107.9
540P49.2Very low33.1Very low108 Ų108148.4 Ų148.470%0.70182%0.815SS**  cis-142.8169.5-17.539.3-20000118.2
541K32.2Very low33Very low198 Ų198151.5 Ų151.586%0.86183%0.825SS**  trans72.9168.3142.5-80.6175.6178.7-173.10123
542Q30.5Very low33.2Very low177 Ų177151.7 Ų151.783%0.82782%0.822SS**  trans80.6145.2-177.5-56.9-72.243.100115.4
543L28.5Very low33.3Very low155 Ų155154.4 Ų154.481%0.81283%0.828SS**  cis-143.9166.7-2.6-173.558.8000110.5
544L33.8Very low33.3Very low150 Ų150152.7 Ų152.779%0.78582%0.821SS**  trans-105.2132.7179.1169.770.7000112.8
545Q31Very low34Very low193 Ų193153 Ų15390%0.90282%0.821SS**  trans-161.8158.2147.6-116.4167.518.200114.2
546K32.5Very low34Very low191 Ų191146.5 Ų146.583%0.8381%0.812SS**  trans-134.6153.1177.4-98.9-176.1177.7-177.80106.1
547P43.9Very low34Very low117 Ų117150.2 Ų150.276%0.7681%0.814SS**  -156.8166.98041.1-20.3000119.1
548T29.3Very low34.1Very low140 Ų140151.4 Ų151.486%0.85981%0.811SS**  trans40.4116.9140.4-52.80000122.3
549A27.8Very low33.6Very low99 Ų99156.1 Ų156.182%0.81881%0.812SS**  -164.1144.2116.300000111.7
550L34.2Very low33.7Very low174 Ų174152.7 Ų152.791%0.91181%0.808SS**  trans-108.6130.4169.8-74.1166.7000109.4
551R30.5Very low33.1Very low248 Ų248153.7 Ų153.794%0.93681%0.814SS**  trans-161.7131.4148.8-128.6177.5-175.8125.94.7113.7
552V34.3Very low33.1Very low115 Ų115149 Ų14970%0.69781%0.812SS**  trans-86.7147.3159175.40000108.1
553P32.6Very low33.4Very low124 Ų124146.5 Ų146.581%0.80581%0.809SS**  trans-130.6133.9133.634.9-25.9000112.2
554S30.6Very low34.3Very low104 Ų104145.1 Ų145.173%0.72781%0.809SS**  trans-95.3-163.6167.3-50.50000109.7
555P44.1Very low34.1Very low115 Ų115143.4 Ų143.475%0.74781%0.81SS**  -95.6163.3-122.239.9-31000114.5
556S28.6Very low34.6Very low108 Ų108140.2 Ų140.276%0.75581%0.806SS**  trans153128.5131-74.20000112.6
557K31.8Very low34.7Very low195 Ų195139.6 Ų139.685%0.84881%0.811SS**  -176.7137.1118.1-102.1161.9-175.31730114.1
558L33.7Very low34.3Very low142 Ų142138.8 Ų138.874%0.74381%0.814SS**  trans75.7101147-64.5168.8000121
559R33.9Very low34.6Very low227 Ų227139.3 Ų139.386%0.85781%0.811SS**  112.3119.4108.1-159.6173.8-148.5122.95117.6
560T34.3Very low35.2Very low127 Ų127146.6 Ų146.678%0.77982%0.817SS**  trans-82.7161.3167.742.50000112.7
561P37.3Very low35.7Very low129 Ų129145.4 Ų145.484%0.83881%0.807SS**  -121.1165.3129.736.4-31.7000111.9
562A31.6Very low36.4Very low99 Ų99139.8 Ų139.882%0.81880%0.802SS**  trans-110.3176.7-173.200000113.8
563T36.4Very low36.4Very low125 Ų125140.1 Ų140.177%0.76780%0.804SS**  trans-63.8149-17847.30000115
564P48Very low36.3Very low125 Ų125144 Ų14481%0.81281%0.808SS**  trans-93.8128.4164.134.4-29.3000112.7
565S30.2Very low36.2Very low115 Ų115142.9 Ų142.980%0.80481%0.806SS**  trans-116.4125.1165.8-70.90000110
566P41Very low35.7Very low126 Ų126143.4 Ų143.482%0.81881%0.807SS**  trans-107.991.5179.736.3-28.7000113.2
567L35.3Very low35.6Very low178 Ų178143 Ų14393%0.93280%0.804SS**  trans-133.7107.9157.4-82.1177.6000109.3
568A35.3Very low35.5Very low99 Ų99139.9 Ų139.982%0.81880%0.802SS**  trans-144.2135.4174.300000110
569L35.4Very low36.2Very low152 Ų152138.6 Ų138.680%0.79680%0.802SS**  trans-78.9156.4-172-75.168000112.2
570R40.9Very low36Very low251 Ų251133.6 Ų133.695%0.94780%0.802SS**  trans-120.6117.6147-67.2-173.871.2-160.31.7109.1
571Q44.1Very low35.7Very low150 Ų150133.2 Ų133.270%0.70180%0.804SS**  trans-115.3155.8159-75.6-165.5-5.900109.1
572P44.8Very low35.5Very low129 Ų129131.5 Ų131.584%0.83880%0.801SS**  trans-114.7161.4134.935.4-30000110.8
573V35.4Very low35.4Very low122 Ų122132.9 Ų132.974%0.73980%0.8SS**  trans-111.4154.2-167.4-69.60000113.8
574K30.1Very low35.2Very low205 Ų205132.6 Ų132.689%0.89180%0.803SS**  139.2153.2120.6-163.7171-176.7-1790114.4
575A28.7Very low34.5Very low82 Ų82132.9 Ų132.968%0.67880%0.802SS**  trans96.189.8157.300000120.2
576T32.1Very low35.4Very low126 Ų126132.5 Ų132.577%0.77380%0.797SS**  85.1127.8116.4-149.40000123.5
577S27.8Very low35Very low98 Ų98132.3 Ų132.369%0.68579%0.794SS**  trans55.1123.9138.859.30000122.9
578T30.3Very low35Very low131 Ų131135.1 Ų135.180%0.80479%0.792SS**  trans-68.3-175.414855.80000110.9
579P47.7Very low34.9Very low115 Ų115135 Ų13575%0.74779%0.785SS**  cis-133.5179.6-1.143.1-27.4000115.1
580S28.5Very low34.9Very low122 Ų122135 Ų13585%0.85379%0.785SS**  trans-167.9140.7141.322.60000111.7
581S29.4Very low34.8Very low118 Ų118127.2 Ų127.283%0.82577%0.774SS**  trans-117.8174.4170.9-68.80000109.4
582A33.3Very low34.7Very low94 Ų94125.8 Ų125.878%0.77778%0.778SS**  trans71.8156.1165.300000116.6
583T28.7Very low34.8Very low128 Ų128125.6 Ų125.679%0.78578%0.777SS**  cis-165.8133.9-24.5-93.10000108
584S33Very low34.8Very low119 Ų119131.3 Ų131.383%0.83279%0.785SS**  trans-176.8126.2141.2310000112.8
585T33.1Very low35Very low130 Ų130127.3 Ų127.380%0.79878%0.783SS**  trans-112.4-171159.656.20000107
586P48.5Very low35.2Very low107 Ų107127 Ų12770%0.69579%0.788SS**  cis-114.3-175-31.919.35.3000109.6
587T32.2Very low35.7Very low123 Ų123129.4 Ų129.476%0.75580%0.795SS**  -176.9144.770.436.70000114
588R35.8Very low36.5Very low236 Ų236130.4 Ų130.489%0.89180%0.799SS**  trans50.3121.8132.4-155.5175.7-168.4-1141.8117.3
589S32.1Very low36.7Very low96 Ų96135.1 Ų135.167%0.67180%0.802SS**  cis-177.2-1739.4-104.90000108.3
590L36.9Very low36.3Very low153 Ų153135.3 Ų135.380%0.80180%0.804SS**  cis-161151.34.6-129162.2000110.2
591A37.4Very low36.5Very low87 Ų87135.4 Ų135.472%0.71980%0.804SS**  trans64.6159.1152.600000121.5
592P43.4Very low36.8Very low120 Ų120134.9 Ų134.978%0.77981%0.807SS**  trans-106.2168.3-162.2519.3000116
593P46.3Very low36.9Very low125 Ų125135.4 Ų135.481%0.81281%0.811SS**  trans-85.4159.5-173.335.3-37.3000114.7
594R35.4Very low37.2Very low243 Ų243134.4 Ų134.492%0.91782%0.816SS**  trans-136.3144.3165.1-60.5-168.585.1156.24.9112.9
595S34.4Very low37.2Very low121 Ų121132.8 Ų132.885%0.84682%0.818SS**  trans-41.8144.7178.452.10000118.5
596G32.3Very low37.3Very low76 Ų76130.5 Ų130.578%0.78482%0.821SS**  trans-153.5116.4159.700000112.2
597L42.8Very low36.8Very low175 Ų175129.1 Ų129.192%0.91683%0.826SS**PPolyproline II helixtrans-94.2133.7176.2-77163.9000111
598P44.2Very low37.1Very low120 Ų120130.5 Ų130.578%0.77983%0.827SS**PPolyproline II helixtrans-82.6132.3160.532.2-30.3000110.8
599R36.3Very low37.3Very low230 Ų230124.9 Ų124.987%0.86882%0.821SS**PPolyproline II helixtrans-86139177.7-179.8-178.1179.7177.40.6110.3
600P37.5Very low37.8Very low119 Ų119127.4 Ų127.477%0.77383%0.826SS**PPolyproline II helixtrans-71.9139.8176.429.8-34.7000111.5
601S33.3Very low37.8Very low124 Ų124126.1 Ų126.187%0.86783%0.827SS**  trans-104.2130.6168.7-65.40000109.7
602A35.5Very low37.6Very low107 Ų107133.1 Ų133.188%0.88484%0.835SS**  trans-96.4141.217600000110.9
603A35Very low37.3Very low105 Ų105132.2 Ų132.287%0.86883%0.831SS**  trans-112.3156.5165.700000109.3
604A35.4Very low36.9Very low106 Ų106135.9 Ų135.988%0.87684%0.835SS**  trans-115.5157-155.800000115.5
605G34Very low36.8Very low85 Ų85131.1 Ų131.188%0.87683%0.827SS**  trans94.9158.5149.700000117.3
606G34.1Very low36.9Very low83 Ų83130 Ų13086%0.85682%0.824SS**  trans113.9119.4171.700000114.4
607G37.6Very low37.5Very low78 Ų78133.5 Ų133.580%0.80482%0.82SS**  trans-85.5158.917000000112.7
608I39.9Very low37.1Very low151 Ų151130.5 Ų130.577%0.77481%0.811SS**  trans-68.4152.3-179.8-11.1177.7000111.6L610I608-L610 HydrophobicContact CG2-CD1 4.03Å
609P38.8Very low36.8Very low118 Ų118131.3 Ų131.377%0.76681%0.814SS**  -139.9162.392.838.1-25.4000115.2
610L43.3Very low36.8Very low149 Ų149131.1 Ų131.178%0.7881%0.813SS**PPolyproline II helixtrans-85.5137.9-179-6483.1000112.8I608I608-L610 HydrophobicContact CG2-CD1 4.03Å
611P37.3Very low36.8Very low127 Ų127137 Ų13783%0.82582%0.82SS**PPolyproline II helixtrans-82.8159.5154.434-31.8000111.7
612R33.3Very low36.9Very low234 Ų234136.1 Ų136.188%0.88381%0.814SS**PPolyproline II helixtrans-103.9135.2-168.3-64.4162.966131.1-6.1113.8
613S37Very low37.3Very low101 Ų101138.6 Ų138.671%0.70681%0.811SS**  trans47.1122.8140.964.10000121.8
614K37Very low37.4Very low202 Ų202139.1 Ų139.188%0.87881%0.806SS**  trans-165.196133.7-102.2159-174.4-179.80107.7
615L34.3Very low37.6Very low143 Ų143138.4 Ų138.475%0.74980%0.8SS**  84.292.482.8-174.670.4000112.9Q617L615-Q617 HydrophobicContact CD1-CG 3.91Å
616A36.2Very low37.7Very low96 Ų96140.1 Ų140.179%0.79380%0.796SS**  trans-131.1132.5152.200000107.2
617Q43.9Very low37.8Very low150 Ų150145.9 Ų145.970%0.70179%0.792SS**  trans-104.8115.2-172.6-74.8-84.6-13.800111.1L615L615-Q617 HydrophobicContact CD1-CG 3.91Å
618P35.7Very low37.8Very low112 Ų112148.1 Ų148.173%0.72780%0.795SS**  trans-78.8136156.431.7-30.3000109.8R620P618-R620 PolarHBondContact O-N 3.11Å
619V36.6Very low37.7Very low137 Ų137150.4 Ų150.483%0.8380%0.795SS**  trans-59.7126.6-170.6175.70000112.7R621V619-R621 PolarHBondContact O-N 3.03Å
620R36.8Very low37.5Very low227 Ų227148 Ų14886%0.85779%0.792SS**  trans-67.595.8166.8-80.7-172.3169.3-136.2-0.9110.9P618 S622P618-R620 PolarHBondContact O-N 3.11Å; R620-S622 PolarHBondContact O-N 3.14Å
621R37.7Very low37.4Very low241 Ų241146.9 Ų146.991%0.90980%0.797SS**  trans-79.494.8149.6-86.5-172.6168.3-178.3-3.2108.5V619 L623V619-R621 PolarHBondContact O-N 3.03Å; R621-L623 PolarHBondContact O-N 3.23Å; R621-L623 VanDerWaalsContact O-N 3.16Å
622S35.7Very low37.5Very low107 Ų107147.7 Ų147.775%0.74880%0.799SS**  trans-71.4102.2171.7510000110.1R620R620-S622 PolarHBondContact O-N 3.14Å
623L42.8Very low37.7Very low158 Ų158139.6 Ų139.683%0.82779%0.788SS**PPolyproline II helixtrans-67.8137.6160.3-66.2174000108.6R621R621-L623 PolarHBondContact O-N 3.23Å; R621-L623 VanDerWaalsContact O-N 3.16Å
624P39Very low38.2Very low116 Ų116141.8 Ų141.875%0.75379%0.792SS**PPolyproline II helixtrans-67.2146.8175.129-34.2000110.4
625A37.8Very low38.6Very low91 Ų91138.7 Ų138.775%0.75279%0.785SS**PPolyproline II helixtrans-64.2138.1172.100000110.1R627A625-R627 PolarHBondContact O-N 3.33Å
626P36.3Very low39.3Very low121 Ų121140.8 Ų140.879%0.78678%0.783SS**PPolyproline II helixtrans-64.5121.9176.926.5-33.2000109.8S628P626-S628 PolarHBondContact O-N 3.21Å
627R36.8Very low40Very low205 Ų205145.3 Ų145.377%0.77478%0.78SS**PPolyproline II helixtrans-62.6126.6167.2-88.6-177.9162.7-171.8-4.2108.9A625 Y629A625-R627 PolarHBondContact O-N 3.33Å; R627-Y629 HydrophobicContact CB-CD2 4.26Å; R627-Y629 HydrophobicContact CB-CE2 4.23Å; R627-Y629 PolarHBondContact O-N 3.27Å
628S36.9Very low40.2Very low125 Ų125145.7 Ų145.787%0.87478%0.782SS**  trans-68.394.2169.5-49.50000110.1P626P626-S628 PolarHBondContact O-N 3.21Å
629Y37.6Very low41Very low199 Ų199143.8 Ų143.878%0.7878%0.783SS**  trans-81.2123.4156.8-83.5-90.9000107.8R627R627-Y629 HydrophobicContact CB-CD2 4.26Å; R627-Y629 HydrophobicContact CB-CE2 4.23Å; R627-Y629 PolarHBondContact O-N 3.27Å
630G35.2Very low41.4Very low68 Ų68143.4 Ų143.470%0.70179%0.785SS**  trans-90148.9-179.500000112.8
631S42Very low41.5Very low125 Ų125147.4 Ų147.487%0.87480%0.802SS**  trans65.767.2147.9-172.50000118.9
632T39Very low41.7Very low144 Ų144142.8 Ų142.888%0.88380%0.797SS**  trans-147.2132.3149.6-33.90000112.6
633G36.8Very low42.1Very low63 Ų63144.6 Ų144.665%0.64980%0.799SS**  trans82.1109.8147.400000119.1N635G633-N635 PolarHBondContact O-N 2.92Å
634D47.8Very low42Very low148 Ų148143.9 Ų143.979%0.79180%0.798SS**  trans-62.2109.8156.1-65.3-96.9000110.5
635N46.4Very low42.2Very low137 Ų137145.5 Ų145.573%0.73380%0.8SS**  trans-138.758.2-173.9-138.165000112.7G633G633-N635 PolarHBondContact O-N 2.92Å
636W49.2Very low42.5Very low187 Ų187148.9 Ų148.971%0.70880%0.803SS**  trans-107.614.1-177.756-94.4000114.5
637R50.4Low42.9Very low191 Ų191150.8 Ų150.872%0.72180%0.804SS**  trans-107.6-24.9-171.5-78.9-170.4168.1-85.82.7116.7G639R637-G639 PolarHBondContact O-N 3.16Å
638E48.4Very low43.3Very low157 Ų157146.9 Ų146.973%0.73481%0.807SS**  trans-87.2102.5174.3-71.663.1-134.600110.9
639G52.1Low43.8Very low73 Ų73148.6 Ų148.675%0.75380%0.801SS**  trans-174.88.2-178.300000119.6R637R637-G639 PolarHBondContact O-N 3.16Å
640C44.9Very low44.3Very low129 Ų129144.4 Ų144.487%0.87280%0.803SS**  trans-140.8113.4174.4-74.40000111.4
641Y39.6Very low45.1Very low311 Ų311151.4 Ų151.4100%1.2281%0.813SS**  trans-140.70164-106.1-71.3000107.7

Retrieved 641 of 641 residues in 424 ms (Link to these results)