A0A077ZPZ7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZPZ7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 311 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
1M58.4Low63Low119 Ų119119.6 Ų119.659%0.58653%0.532SS*.  0-61.70-118.4167-161.700113.5R3 Y4 L5 T38 A39M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 3.35Å; M1-R3 VanDerWaalsContact O-N 3.15Å; M1-Y4 WeakPolarHBondContact O-CB 3.12Å; M1-Y4 PolarHBondContact O-N 3.12Å; M1-L5 PolarHBondContact O-N 3.02Å; M1-T38 HydrophobicContact CE-CG2 4.03Å; M1-A39 HydrophobicContact SD-CB 4.36Å
2K56.4Low62.6Low126 Ų126118.6 Ų118.655%0.54853%0.534SS..Hα-helixtrans-51.8-40-176.6-69-173.8175.6-173.20115N6 E134K2-N6 WeakPolarHBondContact O-CB 3.39Å; K2-N6 PolarHBondContact O-N 3.02Å; K2-N6 VanDerWaalsContact O-N 3.07Å; K2-E134 WeakPolarHBondContact CE-OE1 3.31Å; K2-E134 WeakPolarHBondContact CE-OE2 3.47Å; K2-E134 IonicContact NZ-OE1 3.32Å; K2-E134 PolarHBondContact NZ-OE1 3.03Å; K2-E134 IonicContact NZ-OE2 2.64Å; K2-E134 PolarHBondContact NZ-OE2 3.19Å
3R66.3Low62.3Low223 Ų223117.8 Ų117.884%0.84254%0.544SS*.Hα-helixtrans-65.5-38.2175.7-67.3-170.6-170.2-178.23.5113.4M1 Q7M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 3.35Å; M1-R3 VanDerWaalsContact O-N 3.15Å; R3-Q7 WeakPolarHBondContact O-CB 3.13Å; R3-Q7 PolarHBondContact O-N 3.5Å
4Y60.9Low61.8Low180 Ų180119.1 Ų119.171%0.70656%0.556SS**Hα-helixtrans-71.5-43179.3-81.7-86.5000111.7M1 N6 Q7 Y8M1-Y4 WeakPolarHBondContact O-CB 3.12Å; M1-Y4 PolarHBondContact O-N 3.12Å; Y4-N6 VanDerWaalsContact C-N 3.34Å; Y4-N6 PolarHBondContact O-N 2.91Å; Y4-Q7 PolarHBondContact O-N 3.21Å; Y4-Y8 WeakPolarHBondContact O-CB 3.44Å; Y4-Y8 PolarHBondContact O-N 2.93Å
5L65Low61.1Low41 Ų41118.8 Ų118.822%0.21555%0.552CS.*Hα-helixtrans-60.8-43174.6-83.7154.3000111.5M1 Y8 A9 Y32 L36M1-L5 PolarHBondContact O-N 3.02Å; L5-Y8 PolarHBondContact O-N 3.34Å; L5-A9 WeakPolarHBondContact O-CB 3.44Å; L5-A9 PolarHBondContact O-N 3.08Å; L5-Y32 HydrophobicContact CD2-CE2 4.24Å; L5-L36 HydrophobicContact CD2-CD2 3.82Å
6N70.3Confident60.7Low102 Ų102117.3 Ų117.355%0.54556%0.556SS.*Hα-helixtrans-69.1-36.4179.8-147.8-14.8000112.2K2 Y4 Y8 Q10K2-N6 WeakPolarHBondContact O-CB 3.39Å; K2-N6 PolarHBondContact O-N 3.02Å; K2-N6 VanDerWaalsContact O-N 3.07Å; Y4-N6 VanDerWaalsContact C-N 3.34Å; Y4-N6 PolarHBondContact O-N 2.91Å; N6-Y8 VanDerWaalsContact C-N 3.35Å; N6-Q10 WeakPolarHBondContact O-CB 3.44Å; N6-Q10 VanDerWaalsContact O-CG 3.3Å; N6-Q10 WeakPolarHBondContact O-CG 3.33Å; N6-Q10 PolarHBondContact O-N 3.42Å
7Q67.3Low59.9Low132 Ų132120.3 Ų120.362%0.61757%0.569SS**Hα-helixtrans-64.3-39171.8-118.3177.3-9.800112.3R3 Y4 Y11R3-Q7 WeakPolarHBondContact O-CB 3.13Å; R3-Q7 PolarHBondContact O-N 3.5Å; Y4-Q7 PolarHBondContact O-N 3.21Å; Q7-Y11 PolarHBondContact O-N 3.41Å; Q7-Y11 VanDerWaalsContact O-N 3.08Å
8Y60.6Low59.2Low88 Ų88119.8 Ų119.835%0.34557%0.57SS.*Hα-helixtrans-70.5-42.3178-128-93.9000112Y4 L5 N6 Q10 Y11 L12 Y32Y4-Y8 WeakPolarHBondContact O-CB 3.44Å; Y4-Y8 PolarHBondContact O-N 2.93Å; L5-Y8 PolarHBondContact O-N 3.34Å; N6-Y8 VanDerWaalsContact C-N 3.35Å; Y8-Q10 VanDerWaalsContact C-N 3.34Å; Y8-Q10 PolarHBondContact O-N 2.85Å; Y8-Y11 WeakPolarHBondContact O-CB 3.37Å; Y8-Y11 PolarHBondContact O-N 3.31Å; Y8-Y11 VanDerWaalsContact O-N 3.13Å; Y8-L12 HydrophobicContact CD1-CD1 4.45Å; Y8-L12 WeakPolarHBondContact O-CG 3.36Å; Y8-L12 PolarHBondContact O-N 3.37Å; Y8-Y32 AromaticContact CD1-CD2 3.75Å; Y8-Y32 HydrophobicContact CD1-CD2 3.75Å; Y8-Y32 HydrophobicContact CD1-CE2 4.08Å; Y8-Y32 HydrophobicContact CE1-CD2 4.18Å; Y8-Y32 HydrophobicContact CG-CD2 4.42Å
9A63.4Low58.3Low39 Ų39119.7 Ų119.732%0.32258%0.58SS.*Hα-helixtrans-62-40175.200000112L5 L12 T13L5-A9 WeakPolarHBondContact O-CB 3.44Å; L5-A9 PolarHBondContact O-N 3.08Å; A9-L12 PolarHBondContact O-N 3.43Å; A9-T13 PolarHBondContact O-N 3.48Å; A9-T13 PolarHBondContact O-OG1 3.3Å
10Q64.9Low57.7Low106 Ų106118.9 Ų118.950%0.49558%0.577SS.*Hα-helixtrans-64-38.4172.3-76.6-179.31.500112.4N6 Y8 L12 T13 L14N6-Q10 WeakPolarHBondContact O-CB 3.44Å; N6-Q10 VanDerWaalsContact O-CG 3.3Å; N6-Q10 WeakPolarHBondContact O-CG 3.33Å; N6-Q10 PolarHBondContact O-N 3.42Å; Y8-Q10 VanDerWaalsContact C-N 3.34Å; Y8-Q10 PolarHBondContact O-N 2.85Å; Q10-L12 VanDerWaalsContact C-N 3.32Å; Q10-L12 PolarHBondContact O-N 2.58Å; Q10-T13 WeakPolarHBondContact CA-OG1 3.4Å; Q10-T13 PolarHBondContact O-N 3.28Å; Q10-T13 PolarHBondContact O-OG1 3.44Å; Q10-L14 WeakPolarHBondContact O-CB 3.38Å; Q10-L14 WeakPolarHBondContact O-CD1 3.39Å; Q10-L14 WeakPolarHBondContact O-CG 3.31Å; Q10-L14 PolarHBondContact O-N 3.18Å; Q10-L14 VanDerWaalsContact O-N 3.1Å
11Y59.4Low56.9Low160 Ų160117.4 Ų117.463%0.62758%0.576SS**Hα-helixtrans-65.6-35.8176.9-158.3-89.1000112.2Q7 Y8Q7-Y11 PolarHBondContact O-N 3.41Å; Q7-Y11 VanDerWaalsContact O-N 3.08Å; Y8-Y11 WeakPolarHBondContact O-CB 3.37Å; Y8-Y11 PolarHBondContact O-N 3.31Å; Y8-Y11 VanDerWaalsContact O-N 3.13Å
12L58.9Low56.4Low107 Ų107121.4 Ų121.456%0.5659%0.591SS**Hα-helixtrans-75-33.7176.9-70.2169.7000113.1Y8 A9 Q10Y8-L12 HydrophobicContact CD1-CD1 4.45Å; Y8-L12 WeakPolarHBondContact O-CG 3.36Å; Y8-L12 PolarHBondContact O-N 3.37Å; A9-L12 PolarHBondContact O-N 3.43Å; Q10-L12 VanDerWaalsContact C-N 3.32Å; Q10-L12 PolarHBondContact O-N 2.58Å
13T58.6Low56Low108 Ų108122.4 Ų122.466%0.66360%0.602SS**Hα-helixtrans-80-27.9179.430.30000114A9 Q10A9-T13 PolarHBondContact O-N 3.48Å; A9-T13 PolarHBondContact O-OG1 3.3Å; Q10-T13 WeakPolarHBondContact CA-OG1 3.4Å; Q10-T13 PolarHBondContact O-N 3.28Å; Q10-T13 PolarHBondContact O-OG1 3.44Å
14L54.7Low55.2Low136 Ų136115.6 Ų115.671%0.71259%0.585SS**SBendtrans-83.3-6.9-174.9-79.2163.2000115.1Q10Q10-L14 WeakPolarHBondContact O-CB 3.38Å; Q10-L14 WeakPolarHBondContact O-CD1 3.39Å; Q10-L14 WeakPolarHBondContact O-CG 3.31Å; Q10-L14 PolarHBondContact O-N 3.18Å; Q10-L14 VanDerWaalsContact O-N 3.1Å
15K52.1Low55Low115 Ų115108.3 Ų108.350%0.556%0.561SS.*  trans-137.365.3-176.5-73.2-179.7169.5-174.50114.4H17 L18K15-H17 PolarHBondContact O-N 3.04Å; K15-L18 HydrophobicContact CD-CD1 3.83Å; K15-L18 HydrophobicContact CG-CD1 4.34Å
16P53.7Low54.6Low95 Ų95110.3 Ų110.362%0.61757%0.569SS**THydrogen-bonded Turntrans-73.90.7177.927.5-32000115.5
17H47.5Very low54.3Low168 Ų168109.2 Ų109.278%0.77857%0.568SS**THydrogen-bonded Turntrans-130.613.2-165.9-54.4-40.6000116.2K15K15-H17 PolarHBondContact O-N 3.04Å
18L47.1Very low54.4Low112 Ų112107.1 Ų107.159%0.58656%0.56SS**  trans-93.7121.3173.2-86.8154.6000109.7K15 M20K15-L18 HydrophobicContact CD-CD1 3.83Å; K15-L18 HydrophobicContact CG-CD1 4.34Å; L18-M20 VanDerWaalsContact C-N 3.33Å; L18-M20 PolarHBondContact O-N 3.34Å
19P41.7Very low54.9Low117 Ų117107.4 Ų107.476%0.7656%0.561SS**  trans-67.298.1170.628.1-30.1000107.1
20M46.4Very low55.5Low104 Ų104109.2 Ų109.251%0.51257%0.568SS.*  trans-66.3129.7171.6-74.1-71.7-75.700107.5L18 F22L18-M20 VanDerWaalsContact C-N 3.33Å; L18-M20 PolarHBondContact O-N 3.34Å; M20-F22 PolarHBondContact O-N 3.45Å
21P42.1Very low56.3Low87 Ų87107.8 Ų107.857%0.56557%0.567SS**  trans-58.4120174.123.7-30.8000107.9N23 T24P21-N23 PolarHBondContact O-N 3.44Å; P21-T24 PolarHBondContact O-N 3.05Å; P21-T24 PolarHBondContact O-OG1 3.32Å
22F46.8Very low57.3Low204 Ų204101.1 Ų101.190%0.89554%0.54SS*.THydrogen-bonded Turntrans-57.69.7-166.1-95.8-92.7000116.7M20M20-F22 PolarHBondContact O-N 3.45Å
23N49.2Very low58.4Low146 Ų14699.4 Ų99.478%0.78153%0.527SS*.THydrogen-bonded Turntrans-131.77.9-175.3-120.1-19.2000115.8P21P21-N23 PolarHBondContact O-N 3.44Å
24T49.2Very low59.8Low80 Ų8099.2 Ų99.249%0.49152%0.518SS..SBendtrans-118.7-0.6178.155.20000114.4P21 P27P21-T24 PolarHBondContact O-N 3.05Å; P21-T24 PolarHBondContact O-OG1 3.32Å; T24-P27 WeakPolarHBondContact O-CD 3.33Å
25S55.3Low61.5Low28 Ų2896.4 Ų96.420%0.19650%0.503CS..SBendtrans-85.8-19.2-177.7590000114.4L28 R29S25-L28 PolarHBondContact O-N 3.23Å; S25-R29 PolarHBondContact O-N 2.7Å
26Q58Low63Low82 Ų8290.9 Ų90.938%0.38348%0.479SS..Hα-helixtrans-50.9-55.3177.3-72.4-82.9-3.800112.8L28 R29 T30 Y153Q26-L28 VanDerWaalsContact C-N 3.28Å; Q26-L28 PolarHBondContact O-N 3.19Å; Q26-R29 PolarHBondContact O-N 3.23Å; Q26-T30 PolarHBondContact O-N 3.13Å; Q26-T30 PolarHBondContact O-OG1 2.68Å; Q26-Y153 PolarHBondContact NE2-OH 2.93Å; Q26-Y153 PolarHBondContact OE1-OH 3.42Å; Q26-Y153 VanDerWaalsContact OE1-OH 3.09Å
27P64.1Low64.6Low80 Ų8087.9 Ų87.952%0.51946%0.458SS..Hα-helixtrans-63.2-33.4-177.323.9-34.6000113T24 T31T24-P27 WeakPolarHBondContact O-CD 3.33Å; P27-T31 VanDerWaalsContact O-CB 3.3Å; P27-T31 WeakPolarHBondContact O-CB 3.39Å; P27-T31 PolarHBondContact O-N 2.81Å; P27-T31 PolarHBondContact O-OG1 3.44Å
28L68.7Low66.6Low87 Ų8782.4 Ų82.446%0.45544%0.436SS..Hα-helixtrans-72.8-39.8179.2-65.2176000111.8S25 Q26 T31 Y32S25-L28 PolarHBondContact O-N 3.23Å; Q26-L28 VanDerWaalsContact C-N 3.28Å; Q26-L28 PolarHBondContact O-N 3.19Å; L28-T31 PolarHBondContact O-N 3.23Å; L28-Y32 WeakPolarHBondContact O-CB 3.45Å; L28-Y32 PolarHBondContact O-N 3.43Å
29R70.1Confident68.4Low94 Ų9477.4 Ų77.436%0.35541%0.411SS..Hα-helixtrans-66-45.8175.9-74.6-176.1174.7-175.7-2.4111.8S25 Q26 T31 Y32 R33S25-R29 PolarHBondContact O-N 2.7Å; Q26-R29 PolarHBondContact O-N 3.23Å; R29-T31 VanDerWaalsContact C-N 3.32Å; R29-T31 PolarHBondContact O-N 3.27Å; R29-Y32 PolarHBondContact O-N 3.47Å; R29-R33 WeakPolarHBondContact O-CB 3.48Å; R29-R33 PolarHBondContact O-N 2.93Å
30T76.5Confident70.5Confident78 Ų7876.2 Ų76.248%0.47939%0.391SS..Hα-helixtrans-61.5-41.8175.9-48.30000111.4Q26 R33 Q34Q26-T30 PolarHBondContact O-N 3.13Å; Q26-T30 PolarHBondContact O-OG1 2.68Å; T30-R33 PolarHBondContact O-N 3.13Å; T30-Q34 WeakPolarHBondContact O-CB 3.38Å; T30-Q34 PolarHBondContact O-N 3.44Å
31T82.6Confident72.6Confident76 Ų7675.9 Ų75.947%0.46639%0.389SS..Hα-helixtrans-63.4-43.6176.8-56.70000111.4P27 L28 R29 Q34 L35P27-T31 VanDerWaalsContact O-CB 3.3Å; P27-T31 WeakPolarHBondContact O-CB 3.39Å; P27-T31 PolarHBondContact O-N 2.81Å; P27-T31 PolarHBondContact O-OG1 3.44Å; L28-T31 PolarHBondContact O-N 3.23Å; R29-T31 VanDerWaalsContact C-N 3.32Å; R29-T31 PolarHBondContact O-N 3.27Å; T31-Q34 PolarHBondContact O-N 3.33Å; T31-L35 HydrophobicContact CG2-CD1 4.33Å; T31-L35 VanDerWaalsContact O-CG 3.31Å; T31-L35 WeakPolarHBondContact O-CG 3.44Å; T31-L35 PolarHBondContact O-N 2.77Å
32Y80.3Confident74.7Confident19 Ų1973.5 Ų73.58%0.07538%0.376CS..Hα-helixtrans-64-46.6177.9-173.5-109.7000112.2L5 Y8 L28 R29 Q34 L35 L36 E141 L145L5-Y32 HydrophobicContact CD2-CE2 4.24Å; Y8-Y32 AromaticContact CD1-CD2 3.75Å; Y8-Y32 HydrophobicContact CD1-CD2 3.75Å; Y8-Y32 HydrophobicContact CD1-CE2 4.08Å; Y8-Y32 HydrophobicContact CE1-CD2 4.18Å; Y8-Y32 HydrophobicContact CG-CD2 4.42Å; L28-Y32 WeakPolarHBondContact O-CB 3.45Å; L28-Y32 PolarHBondContact O-N 3.43Å; R29-Y32 PolarHBondContact O-N 3.47Å; Y32-Q34 VanDerWaalsContact C-N 3.34Å; Y32-Q34 PolarHBondContact O-N 2.76Å; Y32-L35 WeakPolarHBondContact O-CB 3.48Å; Y32-L35 PolarHBondContact O-N 3.1Å; Y32-L35 VanDerWaalsContact O-N 3.15Å; Y32-L36 HydrophobicContact CD1-CD1 3.87Å; Y32-L36 HydrophobicContact CD1-CG 4.44Å; Y32-L36 HydrophobicContact CE1-CD1 3.4Å; Y32-L36 HydrophobicContact CE1-CG 4.07Å; Y32-L36 PolarHBondContact O-N 3.17Å; Y32-E141 WeakPolarHBondContact CE1-OE1 3.5Å; Y32-E141 PolarHBondContact OH-OE1 2.73Å; Y32-L145 HydrophobicContact CD1-CD1 3.85Å; Y32-L145 HydrophobicContact CE1-CD1 4.09Å
33R82.7Confident76.4Confident72 Ų7263.8 Ų63.827%0.27233%0.334SS..Hα-helixtrans-57.9-46.6175.5-175.7172.7-179.5-92.4-0111.4R29 T30 L35 L36 I37 L145 D146 E149R29-R33 WeakPolarHBondContact O-CB 3.48Å; R29-R33 PolarHBondContact O-N 2.93Å; T30-R33 PolarHBondContact O-N 3.13Å; R33-L35 VanDerWaalsContact C-N 3.3Å; R33-L35 PolarHBondContact O-N 3.17Å; R33-L36 PolarHBondContact O-N 3.41Å; R33-I37 HydrophobicContact CG-CD1 3.96Å; R33-I37 WeakPolarHBondContact O-CG1 3.48Å; R33-I37 PolarHBondContact O-N 3.26Å; R33-L145 HydrophobicContact CB-CD1 4.33Å; R33-D146 IonicContact CZ-OD1 2.93Å; R33-D146 VanDerWaalsContact CZ-OD1 3.32Å; R33-D146 IonicContact NE-OD1 2.95Å; R33-D146 PolarHBondContact NE-OD1 3.49Å; R33-D146 IonicContact NH2-OD1 3.89Å; R33-D146 PolarHBondContact NH2-OD1 2.84Å; R33-D146 IonicContact NH2-OD2 3.41Å; R33-E149 WeakPolarHBondContact CD-OE1 3.44Å; R33-E149 IonicContact NE-OE2 2.83Å
34Q87.8Confident78Confident104 Ų10458 Ų5849%0.48631%0.306SS..Hα-helixtrans-61.8-38.5177.3-169.460.341.800112T30 T31 Y32 T38T30-Q34 WeakPolarHBondContact O-CB 3.38Å; T30-Q34 PolarHBondContact O-N 3.44Å; T31-Q34 PolarHBondContact O-N 3.33Å; Y32-Q34 VanDerWaalsContact C-N 3.34Å; Y32-Q34 PolarHBondContact O-N 2.76Å; Q34-T38 WeakPolarHBondContact O-CB 3.34Å; Q34-T38 PolarHBondContact O-N 2.96Å; Q34-T38 PolarHBondContact O-OG1 3.14Å
35L89Confident79.8Confident76 Ų7658.8 Ų58.840%0.39831%0.307SS..Hα-helixtrans-64.1-41.6175.1-75.4169.6000112.2T31 Y32 R33 T38 A39T31-L35 HydrophobicContact CG2-CD1 4.33Å; T31-L35 VanDerWaalsContact O-CG 3.31Å; T31-L35 WeakPolarHBondContact O-CG 3.44Å; T31-L35 PolarHBondContact O-N 2.77Å; Y32-L35 WeakPolarHBondContact O-CB 3.48Å; Y32-L35 PolarHBondContact O-N 3.1Å; Y32-L35 VanDerWaalsContact O-N 3.15Å; R33-L35 VanDerWaalsContact C-N 3.3Å; R33-L35 PolarHBondContact O-N 3.17Å; L35-T38 PolarHBondContact O-N 3.03Å; L35-A39 WeakPolarHBondContact O-CB 3.38Å; L35-A39 PolarHBondContact O-N 2.91Å
36L85.1Confident81.1Confident0 Ų062 Ų620%031%0.314CS..Hα-helixtrans-66.7-44.2176.8-71.1175.4000112.3L5 Y32 R33 T38 A39 W40 L138 E141 I142 L145L5-L36 HydrophobicContact CD2-CD2 3.82Å; Y32-L36 HydrophobicContact CD1-CD1 3.87Å; Y32-L36 HydrophobicContact CD1-CG 4.44Å; Y32-L36 HydrophobicContact CE1-CD1 3.4Å; Y32-L36 HydrophobicContact CE1-CG 4.07Å; Y32-L36 PolarHBondContact O-N 3.17Å; R33-L36 PolarHBondContact O-N 3.41Å; L36-T38 VanDerWaalsContact C-N 3.3Å; L36-T38 PolarHBondContact O-N 3.42Å; L36-A39 PolarHBondContact O-N 3.46Å; L36-W40 WeakPolarHBondContact O-CB 3.37Å; L36-W40 PolarHBondContact O-N 3.4Å; L36-L138 HydrophobicContact CD2-CD2 3.61Å; L36-E141 HydrophobicContact CD1-CB 4.32Å; L36-E141 HydrophobicContact CD1-CG 3.68Å; L36-E141 WeakPolarHBondContact CD2-OE2 3.48Å; L36-I142 HydrophobicContact CB-CD1 4.35Å; L36-I142 HydrophobicContact CB-CG1 3.96Å; L36-L145 HydrophobicContact CD1-CD1 3.55Å
37I86Confident82.2Confident32 Ų3259.6 Ų59.616%0.16430%0.304CS..Hα-helixtrans-59.6-44.9175.2-67.7167.6000110.1R33 A39 W40 Q41 I142R33-I37 HydrophobicContact CG-CD1 3.96Å; R33-I37 WeakPolarHBondContact O-CG1 3.48Å; R33-I37 PolarHBondContact O-N 3.26Å; I37-A39 VanDerWaalsContact C-N 3.34Å; I37-A39 PolarHBondContact O-N 3.37Å; I37-W40 PolarHBondContact O-N 2.95Å; I37-Q41 HydrophobicContact CG2-CG 4.49Å; I37-Q41 WeakPolarHBondContact O-CG 3.43Å; I37-Q41 PolarHBondContact O-N 2.87Å; I37-I142 HydrophobicContact CG1-CD1 4.12Å
38T90.1Very high82.9Confident52 Ų5259.9 Ų59.932%0.31931%0.305SS..Hα-helixtrans-63.2-41.8177.4-53.30000111.2M1 Q34 L35 L36 Q41 A42M1-T38 HydrophobicContact CE-CG2 4.03Å; Q34-T38 WeakPolarHBondContact O-CB 3.34Å; Q34-T38 PolarHBondContact O-N 2.96Å; Q34-T38 PolarHBondContact O-OG1 3.14Å; L35-T38 PolarHBondContact O-N 3.03Å; L36-T38 VanDerWaalsContact C-N 3.3Å; L36-T38 PolarHBondContact O-N 3.42Å; T38-Q41 PolarHBondContact O-N 2.8Å; T38-A42 VanDerWaalsContact O-CB 3.32Å; T38-A42 WeakPolarHBondContact O-CB 3.1Å; T38-A42 PolarHBondContact O-N 3Å
39A85.9Confident83Confident7 Ų762.6 Ų62.66%0.05831%0.314CS..Hα-helixtrans-63.7-4117600000111.8M1 L35 L36 I37 A42 T43 L138M1-A39 HydrophobicContact SD-CB 4.36Å; L35-A39 WeakPolarHBondContact O-CB 3.38Å; L35-A39 PolarHBondContact O-N 2.91Å; L36-A39 PolarHBondContact O-N 3.46Å; I37-A39 VanDerWaalsContact C-N 3.34Å; I37-A39 PolarHBondContact O-N 3.37Å; A39-A42 PolarHBondContact O-N 2.82Å; A39-T43 WeakPolarHBondContact O-CG2 3.12Å; A39-T43 PolarHBondContact O-N 3.23Å; A39-T43 PolarHBondContact O-OG1 2.95Å; A39-L138 HydrophobicContact CB-CD1 4Å; A39-L138 HydrophobicContact CB-CD2 4.27Å
40W85.7Confident82.5Confident93 Ų9360.4 Ų60.435%0.35231%0.308SS..Hα-helixtrans-66.5-40.9177.2179.883.9000112.2L36 I37 T43 A44 L138 I142L36-W40 WeakPolarHBondContact O-CB 3.37Å; L36-W40 PolarHBondContact O-N 3.4Å; I37-W40 PolarHBondContact O-N 2.95Å; W40-T43 WeakPolarHBondContact CA-OG1 3.49Å; W40-T43 PolarHBondContact O-N 2.96Å; W40-T43 PolarHBondContact O-OG1 3.43Å; W40-A44 WeakPolarHBondContact O-CB 3.44Å; W40-A44 PolarHBondContact O-N 2.94Å; W40-L138 HydrophobicContact CB-CB 4.32Å; W40-L138 HydrophobicContact CB-CD1 4.43Å; W40-I142 HydrophobicContact CB-CD1 4.06Å; W40-I142 HydrophobicContact CG-CD1 4.35Å
41Q88.9Confident81.5Confident97 Ų9761.1 Ų61.145%0.45331%0.312SS..Hα-helixtrans-64.5-41.3172.9-72.3174.3-13.600111.3I37 T38 T43 A44 L45I37-Q41 HydrophobicContact CG2-CG 4.49Å; I37-Q41 WeakPolarHBondContact O-CG 3.43Å; I37-Q41 PolarHBondContact O-N 2.87Å; T38-Q41 PolarHBondContact O-N 2.8Å; Q41-T43 PolarHBondContact O-N 2.73Å; Q41-A44 PolarHBondContact O-N 2.87Å; Q41-L45 WeakPolarHBondContact O-CB 3.41Å; Q41-L45 WeakPolarHBondContact O-CG 3.4Å; Q41-L45 PolarHBondContact O-N 2.92Å
42A85.9Confident80Confident36 Ų3663 Ų6330%0.29833%0.326SS..Hα-helixtrans-68.1-32.1178.500000113.4T38 A39 R46T38-A42 VanDerWaalsContact O-CB 3.32Å; T38-A42 WeakPolarHBondContact O-CB 3.1Å; T38-A42 PolarHBondContact O-N 3Å; A39-A42 PolarHBondContact O-N 2.82Å; A42-R46 PolarHBondContact O-N 3.47Å; A42-R46 PolarHBondContact O-NE 3.32Å
43T82.8Confident78.5Confident1 Ų167.7 Ų67.71%0.00636%0.357CS..Hα-helixtrans-73.9-41171.2510000111.4A39 W40 Q41 L45 R46 L47 E134 L138A39-T43 WeakPolarHBondContact O-CG2 3.12Å; A39-T43 PolarHBondContact O-N 3.23Å; A39-T43 PolarHBondContact O-OG1 2.95Å; W40-T43 WeakPolarHBondContact CA-OG1 3.49Å; W40-T43 PolarHBondContact O-N 2.96Å; W40-T43 PolarHBondContact O-OG1 3.43Å; Q41-T43 PolarHBondContact O-N 2.73Å; T43-L45 VanDerWaalsContact C-N 3.33Å; T43-L45 PolarHBondContact O-N 3.33Å; T43-R46 VanDerWaalsContact CG2-NH2 3.26Å; T43-R46 PolarHBondContact O-N 3.46Å; T43-L47 PolarHBondContact O-N 2.88Å; T43-L47 VanDerWaalsContact O-N 3.09Å; T43-E134 HydrophobicContact CG2-CG 4.22Å; T43-L138 HydrophobicContact CG2-CD1 4.19Å
44A83.8Confident76.7Confident24 Ų2473.1 Ų73.120%0.19839%0.386CS..Hα-helixtrans-58.5-44.8175.300000111.9W40 Q41 R46 L47 T48W40-A44 WeakPolarHBondContact O-CB 3.44Å; W40-A44 PolarHBondContact O-N 2.94Å; Q41-A44 PolarHBondContact O-N 2.87Å; A44-R46 PolarHBondContact O-N 2.87Å; A44-L47 PolarHBondContact O-N 3.15Å; A44-T48 WeakPolarHBondContact O-CG2 3.32Å; A44-T48 PolarHBondContact O-N 2.74Å; A44-T48 PolarHBondContact O-OG1 3.2Å
45L86.2Confident74.8Confident97 Ų9779.3 Ų79.351%0.50841%0.406SS..Hα-helixtrans-61.2-43.7177.4-75.1171.6000111.8Q41 T43 L47 T48 H49Q41-L45 WeakPolarHBondContact O-CB 3.41Å; Q41-L45 WeakPolarHBondContact O-CG 3.4Å; Q41-L45 PolarHBondContact O-N 2.92Å; T43-L45 VanDerWaalsContact C-N 3.33Å; T43-L45 PolarHBondContact O-N 3.33Å; L45-L47 VanDerWaalsContact C-N 3.35Å; L45-L47 PolarHBondContact O-N 3.23Å; L45-T48 WeakPolarHBondContact CA-OG1 3.48Å; L45-T48 PolarHBondContact O-N 2.96Å; L45-T48 VanDerWaalsContact O-N 3.15Å; L45-T48 PolarHBondContact O-OG1 3.32Å; L45-H49 PolarHBondContact O-CD2 3.41Å; L45-H49 PolarHBondContact O-N 3.47Å
46R83.3Confident72.7Confident95 Ų9578.4 Ų78.436%0.35842%0.415SS..Hα-helixtrans-57.7-47.2175.7-79-177.6-81.7152.1-9.3111.8A42 T43 A44 T48 H49 H50 E131A42-R46 PolarHBondContact O-N 3.47Å; A42-R46 PolarHBondContact O-NE 3.32Å; T43-R46 VanDerWaalsContact CG2-NH2 3.26Å; T43-R46 PolarHBondContact O-N 3.46Å; A44-R46 PolarHBondContact O-N 2.87Å; R46-T48 VanDerWaalsContact C-N 3.29Å; R46-T48 PolarHBondContact O-N 2.64Å; R46-H49 PolarHBondContact O-N 2.94Å; R46-H49 VanDerWaalsContact O-N 3.16Å; R46-H50 PolarHBondContact O-CD2 2.97Å; R46-H50 PolarHBondContact O-N 3.42Å; R46-H50 VanDerWaalsContact O-N 3.13Å; R46-E131 WeakPolarHBondContact CD-OE1 3.44Å; R46-E131 IonicContact CZ-OE1 3.08Å; R46-E131 IonicContact NE-OE1 3.26Å; R46-E131 IonicContact NH1-OE1 3.78Å; R46-E131 PolarHBondContact NH1-OE1 3.49Å
47L81.9Confident70.6Confident31 Ų3184.2 Ų84.216%0.16246%0.456CS..Hα-helixtrans-59.9-37.5176.3-70169.5000112.8T43 A44 L45 E131 E132 Q135T43-L47 PolarHBondContact O-N 2.88Å; T43-L47 VanDerWaalsContact O-N 3.09Å; A44-L47 PolarHBondContact O-N 3.15Å; L45-L47 VanDerWaalsContact C-N 3.35Å; L45-L47 PolarHBondContact O-N 3.23Å; L47-E131 HydrophobicContact CD2-CB 3.89Å; L47-E131 HydrophobicContact CG-CB 4.3Å; L47-E132 HydrophobicContact CD1-CG 4.09Å; L47-E132 HydrophobicContact CD2-CG 3.91Å; L47-Q135 VanDerWaalsContact CD1-OE1 3.29Å
48T78.3Confident68.8Low87 Ų8792 Ų9253%0.53449%0.488SS..Hα-helixtrans-72.2-33176.757.80000113.6A44 L45 R46 H50A44-T48 WeakPolarHBondContact O-CG2 3.32Å; A44-T48 PolarHBondContact O-N 2.74Å; A44-T48 PolarHBondContact O-OG1 3.2Å; L45-T48 WeakPolarHBondContact CA-OG1 3.48Å; L45-T48 PolarHBondContact O-N 2.96Å; L45-T48 VanDerWaalsContact O-N 3.15Å; L45-T48 PolarHBondContact O-OG1 3.32Å; R46-T48 VanDerWaalsContact C-N 3.29Å; R46-T48 PolarHBondContact O-N 2.64Å; T48-H50 VanDerWaalsContact C-N 3.29Å; T48-H50 PolarHBondContact O-N 2.96Å
49H69.6Low66.6Low143 Ų14394.6 Ų94.666%0.66251%0.509SS*.Hα-helixtrans-79.8-10.9177.9-71.3-64000113.4L45 R46 T51L45-H49 PolarHBondContact O-CD2 3.41Å; L45-H49 PolarHBondContact O-N 3.47Å; R46-H49 PolarHBondContact O-N 2.94Å; R46-H49 VanDerWaalsContact O-N 3.16Å; H49-T51 PolarHBondContact O-N 2.95Å; H49-T51 VanDerWaalsContact O-N 3.15Å
50H61.3Low64.7Low48 Ų48102.6 Ų102.622%0.22254%0.543CS..THydrogen-bonded Turntrans-79.122.1172.6-69.4-49.3000114R46 T48 H124 R128 E131R46-H50 PolarHBondContact O-CD2 2.97Å; R46-H50 PolarHBondContact O-N 3.42Å; R46-H50 VanDerWaalsContact O-N 3.13Å; T48-H50 VanDerWaalsContact C-N 3.29Å; T48-H50 PolarHBondContact O-N 2.96Å; H50-H124 AromaticContact CG-CE1 3.77Å; H50-H124 AromaticContact ND1-CE1 3.56Å; H50-R128 HydrophobicContact CB-CG 4.37Å; H50-E131 IonicContact CD2-OE2 3.47Å; H50-E131 PolarHBondContact CD2-OE2 2.78Å; H50-E131 IonicContact NE2-OE2 2.78Å; H50-E131 PolarHBondContact NE2-OE2 2.99Å
51T54.2Low62.7Low93 Ų93102.1 Ų102.157%0.57155%0.547SS*.SBendtrans-57.9127.3160.650.50000108H49 T53H49-T51 PolarHBondContact O-N 2.95Å; H49-T51 VanDerWaalsContact O-N 3.15Å; T51-T53 PolarHBondContact O-N 3.31Å
52P50.9Low61Low116 Ų116107.2 Ų107.275%0.75356%0.562SS**  trans-67.489.8172.727.9-30.5000106.7E54P52-E54 VanDerWaalsContact C-N 3.29Å; P52-E54 PolarHBondContact O-N 3.36Å
53T49.2Very low59.3Low118 Ų118109.2 Ų109.272%0.72457%0.574SS**  trans-54.4106.816014.20000105.2T51 Y55T51-T53 PolarHBondContact O-N 3.31Å; T53-Y55 PolarHBondContact O-N 2.95Å
54E45.8Very low58Low186 Ų186119.2 Ų119.287%0.86961%0.611SS**  trans-987.1170.8-62.4-179.5156.400112.2P52 G56P52-E54 VanDerWaalsContact C-N 3.29Å; P52-E54 PolarHBondContact O-N 3.36Å; E54-G56 PolarHBondContact O-N 2.88Å
55Y46.1Very low56.4Low233 Ų233128.4 Ų128.491%0.91464%0.643SS**  trans-7184.9165.6-112.6-84.6000106.3T53 S57T53-Y55 PolarHBondContact O-N 2.95Å; Y55-S57 PolarHBondContact O-N 3.48Å
56G45.1Very low54.9Low58 Ų58132.2 Ų132.260%0.59866%0.655SS**  trans8.880.8169.200000115E54 K58E54-G56 PolarHBondContact O-N 2.88Å; G56-K58 PolarHBondContact O-N 3.37Å
57S41.7Very low53.2Low121 Ų121139.1 Ų139.185%0.84668%0.681SS**  trans-65.471.2139.6-76.10000107.1Y55 S59Y55-S57 PolarHBondContact O-N 3.48Å; S57-S59 PolarHBondContact O-N 3.01Å
58K48.3Very low51.7Low195 Ų195146 Ų14685%0.84872%0.717SS**  trans-6287.7150.9-75.7-177.9-179.7176.50103.7G56 F60G56-K58 PolarHBondContact O-N 3.37Å; K58-F60 PolarHBondContact O-N 2.97Å
59S43.4Very low50.7Low107 Ų107151.6 Ų151.675%0.74873%0.734SS**  trans-49.9100.9163.554.40000105S57 D61S57-S59 PolarHBondContact O-N 3.01Å; S59-D61 VanDerWaalsContact C-N 3.25Å; S59-D61 PolarHBondContact O-N 3.21Å
60F45.6Very low50.1Low175 Ų175150.3 Ų150.377%0.76874%0.739SS**  trans-62.3101.4174.7-166.2-88.5000104.4K58 R62K58-F60 PolarHBondContact O-N 2.97Å; F60-R62 HydrophobicContact CD1-CG 4.45Å; F60-R62 PolarHBondContact O-N 3.32Å
61D44.7Very low49.7Very low84 Ų84159.7 Ų159.745%0.44977%0.772SS.*  trans-62.582.7-176-173.910.8000108.6S59 S63 R64S59-D61 VanDerWaalsContact C-N 3.25Å; S59-D61 PolarHBondContact O-N 3.21Å; D61-S63 VanDerWaalsContact CG-OG 3.31Å; D61-S63 PolarHBondContact O-N 2.66Å; D61-S63 WeakPolarHBondContact OD1-CB 3.48Å; D61-S63 PolarHBondContact OD1-N 2.92Å; D61-S63 PolarHBondContact OD1-OG 2.84Å; D61-S63 PolarHBondContact OD2-OG 3.47Å; D61-R64 IonicContact OD2-NE 3.97Å
62R52.3Low49.7Very low203 Ų203166.3 Ų166.377%0.76679%0.786SS**G310 helixtrans-66.82.9175.8-111178.5175-172.9-2.3111.5F60 R64F60-R62 HydrophobicContact CD1-CG 4.45Å; F60-R62 PolarHBondContact O-N 3.32Å; R62-R64 VanDerWaalsContact C-N 3.32Å
63S50.5Low49.8Very low78 Ų78165.4 Ų165.455%0.54579%0.789SS.*G310 helixtrans-74.9-17.2176.8830000113.5D61 Y65D61-S63 VanDerWaalsContact CG-OG 3.31Å; D61-S63 PolarHBondContact O-N 2.66Å; D61-S63 WeakPolarHBondContact OD1-CB 3.48Å; D61-S63 PolarHBondContact OD1-N 2.92Å; D61-S63 PolarHBondContact OD1-OG 2.84Å; D61-S63 PolarHBondContact OD2-OG 3.47Å; S63-Y65 PolarHBondContact O-N 3.09Å
64R55.1Low49.9Very low211 Ų211165.9 Ų165.980%0.79679%0.792SS**G310 helixtrans-85.50.2-177.7-83.3-168.1-115.7-163.8-1.6117.5D61 R62D61-R64 IonicContact OD2-NE 3.97Å; R62-R64 VanDerWaalsContact C-N 3.32Å
65Y50.6Low50.2Low217 Ų217166.1 Ų166.185%0.85179%0.793SS**G310 helixtrans-111.624.6174.6-78-81.8000114.2S63S63-Y65 PolarHBondContact O-N 3.09Å
66K55.1Low50.5Low178 Ų178158.3 Ų158.377%0.77478%0.784SS**  trans-119.668.2173.6-73.1-173179.8178.30111.9
67R48.1Very low50.8Low240 Ų240165.3 Ų165.391%0.90680%0.798SS**  trans-179.292.1154.6-106.8164.8-163.7-142.25.5110.8
68L49.9Very low51.5Low176 Ų176168.9 Ų168.992%0.92180%0.798SS**  trans-162.271.8145.9-97.7160.1000105P70L68-P70 WeakPolarHBondContact O-CD 3.44Å
69K58Low51.7Low204 Ų204169.6 Ų169.689%0.88780%0.801SS**  trans-70.4123.8165.9-79.8-168.8177.3-177.10106.7R71K69-R71 PolarHBondContact O-N 3.4Å
70P56.9Low52.5Low116 Ų116169.3 Ų169.375%0.75379%0.794SS**  trans-65.3121.7171.624.9-29.3000108.4L68 R72L68-P70 WeakPolarHBondContact O-CD 3.44Å; P70-R72 PolarHBondContact O-N 2.95Å
71R52.5Low53Low245 Ų245169.7 Ų169.793%0.92580%0.798SS**  trans-6394.1173.1-162.7177-179.8-177.9-0.6107.3K69 A73K69-R71 PolarHBondContact O-N 3.4Å; R71-A73 PolarHBondContact O-N 3.28Å
72R52.9Low53.7Low231 Ų231170.7 Ų170.787%0.87280%0.804SS**  trans-66.999.9169.2-87.1-174.9172.9-176.9-2.7107.8P70 T74P70-R72 PolarHBondContact O-N 2.95Å; R72-T74 PolarHBondContact O-N 3.32Å
73A53.5Low54.2Low97 Ų97166.2 Ų166.280%0.80280%0.801SS**  trans-69103.3160.100000107.6R71 Q75R71-A73 PolarHBondContact O-N 3.28Å; A73-Q75 PolarHBondContact O-N 2.96Å
74T51.8Low54.6Low129 Ų129166 Ų16679%0.79180%0.804SS**  trans-76.199.9163.641.80000108.2R72R72-T74 PolarHBondContact O-N 3.32Å
75Q52.9Low54.6Low190 Ų190164.5 Ų164.589%0.88880%0.799SS**  trans-146.4133.8154.8-78-151.3-200110.3A73A73-Q75 PolarHBondContact O-N 2.96Å
76G51.6Low54.9Low70 Ų70158.9 Ų158.972%0.72278%0.781SS**  trans85.888.5142.200000117.2
77K50.9Low55Low205 Ų205156.8 Ų156.889%0.89177%0.774SS**  29.8105.2123.1-61.7-178.5176.4-179.90116.6
78K57.1Low55.4Low196 Ų196147.4 Ų147.485%0.85275%0.752SS**  -176.5119.5123.6-102.4171.7-177.2-178.30108.9V80K78-V80 HydrophobicContact CB-CG2 4.41Å; K78-V80 PolarHBondContact O-N 3.16Å; K78-V80 VanDerWaalsContact O-N 3.12Å
79K52.7Low55.8Low209 Ų209144 Ų14491%0.90973%0.729SS**  trans-73.793.8171.4-135.9-176.3-177.2-169.10105.8
80V59Low55.8Low101 Ų101142.6 Ų142.661%0.61272%0.719SS**  trans-111.5115.9166.4179.20000105.1K78 D82K78-V80 HydrophobicContact CB-CG2 4.41Å; K78-V80 PolarHBondContact O-N 3.16Å; K78-V80 VanDerWaalsContact O-N 3.12Å; V80-D82 PolarHBondContact O-N 3.49Å
81E57.3Low55.9Low183 Ų183141.6 Ų141.686%0.85571%0.707SS**  trans-70.581.2174-70.4179.5162.400108.3P83E81-P83 WeakPolarHBondContact O-CD 3.17Å
82D59.7Low56.1Low106 Ų106139.5 Ų139.557%0.56770%0.699SS**  trans-83.9117.5175.1-102-29.2000110.1V80 A84 Y85V80-D82 PolarHBondContact O-N 3.49Å; D82-A84 PolarHBondContact O-N 3.13Å; D82-Y85 PolarHBondContact O-N 3.15Å; D82-Y85 VanDerWaalsContact O-N 3.08Å
83P61.6Low56.4Low108 Ų108138 Ų13870%0.70169%0.693SS**THydrogen-bonded Turntrans-63.3-9.9176.423.9-31.7000113.4E81 Y85E81-P83 WeakPolarHBondContact O-CD 3.17Å; P83-Y85 PolarHBondContact O-N 3.01Å
84A60.1Low56.7Low73 Ų73135.8 Ų135.860%0.60368%0.675SS**Hα-helixtrans-64.9-22.4171.500000113.6D82 E86D82-A84 PolarHBondContact O-N 3.13Å; A84-E86 PolarHBondContact O-N 3.32Å
85Y55.1Low56.9Low180 Ų180137.6 Ų137.671%0.70667%0.669SS**Hα-helixtrans-74.1-25.5-178.1-155.5-99.3000113.4D82 P83D82-Y85 PolarHBondContact O-N 3.15Å; D82-Y85 VanDerWaalsContact O-N 3.08Å; P83-Y85 PolarHBondContact O-N 3.01Å
86E55.8Low57.1Low100 Ų100132.2 Ų132.247%0.46765%0.649SS.*Hα-helixtrans-79.9-30177.1-82.4-67128.600112.6A84 G88 K89 R90A84-E86 PolarHBondContact O-N 3.32Å; E86-G88 VanDerWaalsContact C-N 3.32Å; E86-G88 PolarHBondContact O-N 3.33Å; E86-K89 PolarHBondContact O-N 3.38Å; E86-K89 IonicContact OE1-NZ 2.85Å; E86-K89 PolarHBondContact OE1-NZ 3.4Å; E86-R90 PolarHBondContact O-N 2.94Å
87H57.2Low57.6Low133 Ų133136.4 Ų136.462%0.61665%0.65SS**Hα-helixtrans-65.5-34.2173.3-103.852.3000112.6K89 R90 N91H87-K89 VanDerWaalsContact C-N 3.33Å; H87-K89 PolarHBondContact O-N 2.91Å; H87-R90 PolarHBondContact O-N 3.49Å; H87-N91 PolarHBondContact O-N 3.23Å
88G57.9Low58.1Low43 Ų43133.5 Ų133.544%0.44364%0.639SS.*Hα-helixtrans-65.3-31.7175.100000114E86 R92E86-G88 VanDerWaalsContact C-N 3.32Å; E86-G88 PolarHBondContact O-N 3.33Å; G88-R92 PolarHBondContact O-N 3.49Å
89K58.2Low58.4Low105 Ų105126 Ų12646%0.45761%0.612SS.*Hα-helixtrans-75.5-36.4177.1-70-176.1-167.4158.50112.5E86 H87 R92 R93E86-K89 PolarHBondContact O-N 3.38Å; E86-K89 IonicContact OE1-NZ 2.85Å; E86-K89 PolarHBondContact OE1-NZ 3.4Å; H87-K89 VanDerWaalsContact C-N 3.33Å; H87-K89 PolarHBondContact O-N 2.91Å; K89-R92 PolarHBondContact O-N 3.32Å; K89-R93 PolarHBondContact O-N 3.36Å
90R58Low59.4Low175 Ų175120.2 Ų120.266%0.6659%0.588SS**Hα-helixtrans-66.4-41.9176.1-71.9-174.7-176.2-179.70.7111.5E86 H87 R92 R93 A94E86-R90 PolarHBondContact O-N 2.94Å; H87-R90 PolarHBondContact O-N 3.49Å; R90-R92 PolarHBondContact O-N 3Å; R90-R93 PolarHBondContact O-N 2.93Å; R90-A94 PolarHBondContact O-N 2.95Å
91N58.3Low60.3Low95 Ų95119.2 Ų119.251%0.50858%0.583SS.*Hα-helixtrans-63.6-39.2175.5-86.7-12.1000112.9H87 R93 A94 Y95H87-N91 PolarHBondContact O-N 3.23Å; N91-R93 VanDerWaalsContact C-N 3.29Å; N91-R93 PolarHBondContact O-N 3.25Å; N91-A94 PolarHBondContact O-N 3.42Å; N91-Y95 HydrophobicContact CB-CE2 4.39Å; N91-Y95 WeakPolarHBondContact O-CD2 3.2Å; N91-Y95 PolarHBondContact O-N 2.96Å
92R57.8Low61.3Low201 Ų201117.6 Ų117.676%0.75857%0.574SS**Hα-helixtrans-60.1-37175.5-90.5-171.8-179.5-172.81.2113.4G88 K89 R90 T96G88-R92 PolarHBondContact O-N 3.49Å; K89-R92 PolarHBondContact O-N 3.32Å; R90-R92 PolarHBondContact O-N 3Å; R92-T96 PolarHBondContact O-N 2.88Å; R92-T96 VanDerWaalsContact O-N 3.13Å; R92-T96 PolarHBondContact O-OG1 3.47Å
93R58.4Low62.4Low199 Ų199117.9 Ų117.975%0.75157%0.57SS**Hα-helixtrans-68.8-38.7177-70.8-175.7178.9-176.40111.7K89 R90 N91 T96 Q97K89-R93 PolarHBondContact O-N 3.36Å; R90-R93 PolarHBondContact O-N 2.93Å; N91-R93 VanDerWaalsContact C-N 3.29Å; N91-R93 PolarHBondContact O-N 3.25Å; R93-T96 PolarHBondContact O-N 3.39Å; R93-Q97 PolarHBondContact O-N 3.27Å; R93-Q97 VanDerWaalsContact O-N 3.13Å
94A58.7Low63.5Low51 Ų51117.1 Ų117.142%0.42156%0.563SS.*Hα-helixtrans-64.1-44.6176.700000112.7R90 N91 T96 Q97 Q98R90-A94 PolarHBondContact O-N 2.95Å; N91-A94 PolarHBondContact O-N 3.42Å; A94-T96 VanDerWaalsContact C-N 3.32Å; A94-T96 PolarHBondContact O-N 3.44Å; A94-Q97 PolarHBondContact O-N 2.99Å; A94-Q98 PolarHBondContact O-N 2.81Å
95Y56.1Low64.7Low167 Ų167119.4 Ų119.466%0.65557%0.565SS**Hα-helixtrans-67-31.7175.9-75.2-71.2000113.2N91 S99N91-Y95 HydrophobicContact CB-CE2 4.39Å; N91-Y95 WeakPolarHBondContact O-CD2 3.2Å; N91-Y95 PolarHBondContact O-N 2.96Å; Y95-S99 WeakPolarHBondContact O-CB 3.15Å; Y95-S99 PolarHBondContact O-N 3.41Å
96T58.5Low66.4Low76 Ų76115.4 Ų115.447%0.46656%0.555SS.*Hα-helixtrans-67.9-45.7177.9-51.20000110.3R92 R93 A94 Q98 S99 E100R92-T96 PolarHBondContact O-N 2.88Å; R92-T96 VanDerWaalsContact O-N 3.13Å; R92-T96 PolarHBondContact O-OG1 3.47Å; R93-T96 PolarHBondContact O-N 3.39Å; A94-T96 VanDerWaalsContact C-N 3.32Å; A94-T96 PolarHBondContact O-N 3.44Å; T96-Q98 PolarHBondContact O-N 2.84Å; T96-S99 PolarHBondContact O-N 3.4Å; T96-S99 PolarHBondContact O-OG 3.04Å; T96-E100 PolarHBondContact O-N 2.88Å
97Q60.5Low68Low159 Ų159116 Ų11674%0.74356%0.561SS**Hα-helixtrans-62.9-37.2179-82.2-177.7-4.200113.6R93 A94R93-Q97 PolarHBondContact O-N 3.27Å; R93-Q97 VanDerWaalsContact O-N 3.13Å; A94-Q97 PolarHBondContact O-N 2.99Å
98Q61.4Low69.6Low144 Ų144113 Ų11367%0.67356%0.555SS**Hα-helixtrans-74.5-23.1176.4-73.9-167.2-2.800113.7A94 T96 P101 F102A94-Q98 PolarHBondContact O-N 2.81Å; T96-Q98 PolarHBondContact O-N 2.84Å; Q98-P101 WeakPolarHBondContact O-CD 3.4Å; Q98-P101 WeakPolarHBondContact O-CG 3.26Å; Q98-F102 WeakPolarHBondContact O-CD2 3.33Å
99S65.1Low71.2Confident39 Ų39115.6 Ų115.627%0.27356%0.555SS.*Hα-helixtrans-81.8-24.3-177.3760000114.5Y95 T96 F102 K103Y95-S99 WeakPolarHBondContact O-CB 3.15Å; Y95-S99 PolarHBondContact O-N 3.41Å; T96-S99 PolarHBondContact O-N 3.4Å; T96-S99 PolarHBondContact O-OG 3.04Å; S99-F102 PolarHBondContact O-N 3.47Å; S99-K103 WeakPolarHBondContact O-CG 3.48Å; S99-K103 PolarHBondContact O-N 3.38Å; S99-K103 PolarHBondContact OG-NZ 3.25Å
100E72.7Confident72.8Confident86 Ų86117.4 Ų117.440%0.40256%0.559SS.*Hα-helixtrans-60.7-47.6-178.6-65.7-51.7127.200113.9T96 F102 K103 T104T96-E100 PolarHBondContact O-N 2.88Å; E100-F102 VanDerWaalsContact C-N 3.28Å; E100-F102 PolarHBondContact O-N 3.03Å; E100-K103 PolarHBondContact O-N 3.47Å; E100-K103 VanDerWaalsContact O-N 3.1Å; E100-K103 IonicContact OE1-NZ 2.73Å; E100-K103 PolarHBondContact OE1-NZ 3.43Å; E100-T104 PolarHBondContact O-N 2.73Å; E100-T104 PolarHBondContact O-OG1 3.46Å
101P77.7Confident74.5Confident80 Ų80113.3 Ų113.352%0.51955%0.554SS.*Hα-helixtrans-61.5-35179.723.3-34.3000113Q98 T104 L105Q98-P101 WeakPolarHBondContact O-CD 3.4Å; Q98-P101 WeakPolarHBondContact O-CG 3.26Å; P101-T104 PolarHBondContact O-N 3.15Å; P101-L105 WeakPolarHBondContact O-CB 3.5Å; P101-L105 PolarHBondContact O-N 3.28Å
102F79.1Confident76.2Confident150 Ų150112.8 Ų112.866%0.65855%0.548SS*.Hα-helixtrans-68.3-37.1176-71.9-77000112.6Q98 S99 E100 L106Q98-F102 WeakPolarHBondContact O-CD2 3.33Å; S99-F102 PolarHBondContact O-N 3.47Å; E100-F102 VanDerWaalsContact C-N 3.28Å; E100-F102 PolarHBondContact O-N 3.03Å; F102-L106 VanDerWaalsContact O-CB 3.31Å; F102-L106 WeakPolarHBondContact O-CB 3.45Å; F102-L106 PolarHBondContact O-N 3.43Å
103K82.4Confident77.8Confident112 Ų112108.1 Ų108.149%0.48754%0.535SS..Hα-helixtrans-65.7-42.8174.7-69173.6-165.1163.60111.1S99 E100 L106 L107S99-K103 WeakPolarHBondContact O-CG 3.48Å; S99-K103 PolarHBondContact O-N 3.38Å; S99-K103 PolarHBondContact OG-NZ 3.25Å; E100-K103 PolarHBondContact O-N 3.47Å; E100-K103 VanDerWaalsContact O-N 3.1Å; E100-K103 IonicContact OE1-NZ 2.73Å; E100-K103 PolarHBondContact OE1-NZ 3.43Å; K103-L106 PolarHBondContact O-N 2.9Å; K103-L107 WeakPolarHBondContact O-CB 3.39Å; K103-L107 PolarHBondContact O-N 3.5Å
104T83.8Confident79.5Confident91 Ų91101.3 Ų101.356%0.55852%0.521SS*.Hα-helixtrans-64.1-43.4178.2-41.40000111.1E100 P101 L107 S108E100-T104 PolarHBondContact O-N 2.73Å; E100-T104 PolarHBondContact O-OG1 3.46Å; P101-T104 PolarHBondContact O-N 3.15Å; T104-L107 PolarHBondContact O-N 2.92Å; T104-S108 WeakPolarHBondContact O-CB 3.32Å; T104-S108 PolarHBondContact O-N 3.31Å
105L87.1Confident81.1Confident121 Ų121104.1 Ų104.163%0.63453%0.525SS*.Hα-helixtrans-63.1-45.1176-173.369.1000111.9P101 L107 S108 H109P101-L105 WeakPolarHBondContact O-CB 3.5Å; P101-L105 PolarHBondContact O-N 3.28Å; L105-L107 VanDerWaalsContact C-N 3.33Å; L105-L107 PolarHBondContact O-N 2.94Å; L105-S108 PolarHBondContact O-N 3.09Å; L105-H109 PolarHBondContact O-N 3.11Å
106L89.8Confident82.9Confident96 Ų96103.1 Ų103.150%0.50352%0.52SS..Hα-helixtrans-63.5-39.8177.6-17570.2000111.8F102 K103 R110F102-L106 VanDerWaalsContact O-CB 3.31Å; F102-L106 WeakPolarHBondContact O-CB 3.45Å; F102-L106 PolarHBondContact O-N 3.43Å; K103-L106 PolarHBondContact O-N 2.9Å; L106-R110 WeakPolarHBondContact O-CG 3.35Å; L106-R110 PolarHBondContact O-N 3.41Å; L106-R110 VanDerWaalsContact O-N 3.14Å
107L90.3Very high84.6Confident112 Ų112106 Ų10659%0.58653%0.528SS*.Hα-helixtrans-67.3-43.6176.9-16966.5000110.8K103 T104 L105 R110 V111K103-L107 WeakPolarHBondContact O-CB 3.39Å; K103-L107 PolarHBondContact O-N 3.5Å; T104-L107 PolarHBondContact O-N 2.92Å; L105-L107 VanDerWaalsContact C-N 3.33Å; L105-L107 PolarHBondContact O-N 2.94Å; L107-R110 PolarHBondContact O-N 3.4Å; L107-V111 WeakPolarHBondContact O-CG2 3.32Å; L107-V111 PolarHBondContact O-N 3.15Å
108S90.1Very high86.2Confident70 Ų70105.3 Ų105.349%0.4952%0.523SS..Hα-helixtrans-60-47.7176.2175.30000112T104 L105 R110 V111 E112T104-S108 WeakPolarHBondContact O-CB 3.32Å; T104-S108 PolarHBondContact O-N 3.31Å; L105-S108 PolarHBondContact O-N 3.09Å; S108-R110 VanDerWaalsContact C-N 3.28Å; S108-R110 PolarHBondContact O-N 3Å; S108-V111 PolarHBondContact O-N 3.42Å; S108-V111 VanDerWaalsContact O-N 3.15Å; S108-E112 WeakPolarHBondContact O-CB 3.48Å; S108-E112 PolarHBondContact O-N 3.49Å
109H90.3Very high87.8Confident98 Ų98103.9 Ų103.945%0.45452%0.516SS..Hα-helixtrans-60.5-36.9176.2-179.9-83000112.5L105 Q113L105-H109 PolarHBondContact O-N 3.11Å; H109-Q113 WeakPolarHBondContact O-CB 3.24Å; H109-Q113 PolarHBondContact O-N 3.1Å
110R92.6Very high89.1Confident143 Ų143108 Ų10854%0.5454%0.535SS..Hα-helixtrans-67.9-40.6175.2-78-179.4177.3-178.40.9112.6L106 L107 S108 Q113 A114L106-R110 WeakPolarHBondContact O-CG 3.35Å; L106-R110 PolarHBondContact O-N 3.41Å; L106-R110 VanDerWaalsContact O-N 3.14Å; L107-R110 PolarHBondContact O-N 3.4Å; S108-R110 VanDerWaalsContact C-N 3.28Å; S108-R110 PolarHBondContact O-N 3Å; R110-Q113 PolarHBondContact O-N 3.42Å; R110-A114 WeakPolarHBondContact O-CB 3.38Å; R110-A114 PolarHBondContact O-N 3.49Å
111V93.8Very high90.1Very high90 Ų90109.5 Ų109.555%0.54554%0.541SS..Hα-helixtrans-63.9-44.6175.41720000110L107 S108 Q113 A114 E115L107-V111 WeakPolarHBondContact O-CG2 3.32Å; L107-V111 PolarHBondContact O-N 3.15Å; S108-V111 PolarHBondContact O-N 3.42Å; S108-V111 VanDerWaalsContact O-N 3.15Å; V111-Q113 PolarHBondContact O-N 3.1Å; V111-A114 PolarHBondContact O-N 3.43Å; V111-E115 WeakPolarHBondContact O-CB 3.26Å; V111-E115 PolarHBondContact O-N 3Å
112E93Very high90.9Very high84 Ų84108.6 Ų108.639%0.39353%0.534SS..Hα-helixtrans-60.9-43.8176.4-171.7-172.2161.900111.9S108 E115 R116S108-E112 WeakPolarHBondContact O-CB 3.48Å; S108-E112 PolarHBondContact O-N 3.49Å; E112-E115 PolarHBondContact O-N 2.7Å; E112-R116 WeakPolarHBondContact O-CG 3.34Å; E112-R116 PolarHBondContact O-N 3.33Å; E112-R116 IonicContact OE1-CZ 3.86Å; E112-R116 VanDerWaalsContact OE1-CZ 3.26Å; E112-R116 IonicContact OE1-NE 2.78Å; E112-R116 IonicContact OE1-NH2 3.63Å; E112-R116 PolarHBondContact OE1-NH2 2.96Å
113Q92.6Very high91.5Very high103 Ų103103.8 Ų103.848%0.48152%0.523SS..Hα-helixtrans-61.8-44.3174.1-100.1-171.3-27.300112.5H109 R110 V111 E115 R116 Q117H109-Q113 WeakPolarHBondContact O-CB 3.24Å; H109-Q113 PolarHBondContact O-N 3.1Å; R110-Q113 PolarHBondContact O-N 3.42Å; V111-Q113 PolarHBondContact O-N 3.1Å; Q113-E115 VanDerWaalsContact C-N 3.31Å; Q113-E115 PolarHBondContact O-N 2.8Å; Q113-R116 PolarHBondContact O-N 3.33Å; Q113-Q117 WeakPolarHBondContact O-CG 3.46Å; Q113-Q117 PolarHBondContact O-N 2.93Å
114A92.9Very high92Very high55 Ų55101.4 Ų101.446%0.45551%0.513SS..Hα-helixtrans-64.1-38.1178.300000111.5R110 V111 Q117 K118R110-A114 WeakPolarHBondContact O-CB 3.38Å; R110-A114 PolarHBondContact O-N 3.49Å; V111-A114 PolarHBondContact O-N 3.43Å; A114-Q117 PolarHBondContact O-N 2.9Å; A114-K118 WeakPolarHBondContact O-CB 3.48Å; A114-K118 PolarHBondContact O-N 3.46Å
115E94.2Very high92.4Very high110 Ų110101.6 Ų101.651%0.51451%0.508SS..Hα-helixtrans-66-44.2175.4-171.3176-176.600111.8V111 E112 Q113 Q117 K118 Q119V111-E115 WeakPolarHBondContact O-CB 3.26Å; V111-E115 PolarHBondContact O-N 3Å; E112-E115 PolarHBondContact O-N 2.7Å; Q113-E115 VanDerWaalsContact C-N 3.31Å; Q113-E115 PolarHBondContact O-N 2.8Å; E115-Q117 VanDerWaalsContact C-N 3.33Å; E115-Q117 PolarHBondContact O-N 3.45Å; E115-K118 WeakPolarHBondContact O-CB 3.17Å; E115-K118 PolarHBondContact O-N 2.92Å; E115-Q119 WeakPolarHBondContact O-CG 3.32Å; E115-Q119 PolarHBondContact O-N 3.24Å
116R93.2Very high92.7Very high147 Ų147101.5 Ų101.556%0.55550%0.504SS*.Hα-helixtrans-59.3-42.8173.7-74.8-177-176.11705.6112.1E112 Q113 Q119 L120E112-R116 WeakPolarHBondContact O-CG 3.34Å; E112-R116 PolarHBondContact O-N 3.33Å; E112-R116 IonicContact OE1-CZ 3.86Å; E112-R116 VanDerWaalsContact OE1-CZ 3.26Å; E112-R116 IonicContact OE1-NE 2.78Å; E112-R116 IonicContact OE1-NH2 3.63Å; E112-R116 PolarHBondContact OE1-NH2 2.96Å; Q113-R116 PolarHBondContact O-N 3.33Å; R116-Q119 PolarHBondContact O-N 3.49Å; R116-L120 WeakPolarHBondContact O-CG 3.47Å; R116-L120 PolarHBondContact O-N 2.87Å
117Q93.5Very high92.7Very high135 Ų135101.1 Ų101.163%0.63150%0.499SS*.Hα-helixtrans-62.3-43.2175.9-76.1-177-17.700111.8Q113 A114 E115 Q119 L120 Q121Q113-Q117 WeakPolarHBondContact O-CG 3.46Å; Q113-Q117 PolarHBondContact O-N 2.93Å; A114-Q117 PolarHBondContact O-N 2.9Å; E115-Q117 VanDerWaalsContact C-N 3.33Å; E115-Q117 PolarHBondContact O-N 3.45Å; Q117-Q119 VanDerWaalsContact C-N 3.34Å; Q117-Q119 PolarHBondContact O-N 3.25Å; Q117-L120 PolarHBondContact O-N 2.95Å; Q117-Q121 PolarHBondContact O-N 2.78Å
118K94.2Very high92.7Very high145 Ų145100.2 Ų100.263%0.6349%0.488SS*.Hα-helixtrans-61.2-42.8175.1-173.7-177.4177.7-175.20111.8A114 E115 Q121 V122A114-K118 WeakPolarHBondContact O-CB 3.48Å; A114-K118 PolarHBondContact O-N 3.46Å; E115-K118 WeakPolarHBondContact O-CB 3.17Å; E115-K118 PolarHBondContact O-N 2.92Å; K118-Q121 PolarHBondContact O-N 3.01Å; K118-V122 WeakPolarHBondContact O-CG2 3.5Å; K118-V122 PolarHBondContact O-N 3.29Å
119Q94.6Very high92.8Very high114 Ų114102.9 Ų102.953%0.53349%0.491SS..Hα-helixtrans-63.4-42.7176.9-71.8175.96.600112E115 R116 Q117 Q121 V122 A123E115-Q119 WeakPolarHBondContact O-CG 3.32Å; E115-Q119 PolarHBondContact O-N 3.24Å; R116-Q119 PolarHBondContact O-N 3.49Å; Q117-Q119 VanDerWaalsContact C-N 3.34Å; Q117-Q119 PolarHBondContact O-N 3.25Å; Q119-Q121 VanDerWaalsContact C-N 3.34Å; Q119-Q121 PolarHBondContact O-N 3.4Å; Q119-V122 PolarHBondContact O-N 3.45Å; Q119-A123 WeakPolarHBondContact O-CB 3.49Å; Q119-A123 PolarHBondContact O-N 2.88Å
120L94Very high93Very high126 Ų126105.2 Ų105.266%0.6650%0.496SS*.Hα-helixtrans-61.9-41.6174.9-73.3171.7000111.9R116 Q117 A123 H124R116-L120 WeakPolarHBondContact O-CG 3.47Å; R116-L120 PolarHBondContact O-N 2.87Å; Q117-L120 PolarHBondContact O-N 2.95Å; L120-A123 PolarHBondContact O-N 3.25Å; L120-H124 WeakPolarHBondContact O-CB 3.46Å; L120-H124 PolarHBondContact O-N 3.03Å
121Q93.2Very high92.8Very high117 Ų11798.9 Ų98.955%0.54747%0.473SS..Hα-helixtrans-62-47.7176-176.7-179.9-300111.5Q117 K118 Q119 A123 H124 E125Q117-Q121 PolarHBondContact O-N 2.78Å; K118-Q121 PolarHBondContact O-N 3.01Å; Q119-Q121 VanDerWaalsContact C-N 3.34Å; Q119-Q121 PolarHBondContact O-N 3.4Å; Q121-A123 VanDerWaalsContact C-N 3.32Å; Q121-A123 PolarHBondContact O-N 3.3Å; Q121-H124 PolarHBondContact O-N 3.48Å; Q121-E125 WeakPolarHBondContact CG-OE1 3.32Å; Q121-E125 PolarHBondContact NE2-OE1 2.64Å; Q121-E125 WeakPolarHBondContact O-CG 3.39Å; Q121-E125 PolarHBondContact O-N 2.93Å
122V93.7Very high92.7Very high61 Ų6198.9 Ų98.937%0.3747%0.467SS..Hα-helixtrans-61.4-41.5177.5171.60000111.1K118 Q119 H124 E125 Q126K118-V122 WeakPolarHBondContact O-CG2 3.5Å; K118-V122 PolarHBondContact O-N 3.29Å; Q119-V122 PolarHBondContact O-N 3.45Å; V122-H124 VanDerWaalsContact C-N 3.35Å; V122-H124 PolarHBondContact O-N 2.96Å; V122-E125 PolarHBondContact O-N 3.11Å; V122-Q126 WeakPolarHBondContact O-CB 3.37Å; V122-Q126 VanDerWaalsContact O-CG 3.32Å; V122-Q126 WeakPolarHBondContact O-CG 3.48Å; V122-Q126 PolarHBondContact O-N 2.95Å
123A93.1Very high92.7Very high50 Ų5098.6 Ų98.641%0.41347%0.466SS..Hα-helixtrans-62.7-41.9176.800000112Q119 L120 Q121 Q126 E127Q119-A123 WeakPolarHBondContact O-CB 3.49Å; Q119-A123 PolarHBondContact O-N 2.88Å; L120-A123 PolarHBondContact O-N 3.25Å; Q121-A123 VanDerWaalsContact C-N 3.32Å; Q121-A123 PolarHBondContact O-N 3.3Å; A123-Q126 PolarHBondContact O-N 3.04Å; A123-E127 WeakPolarHBondContact O-CB 3.35Å; A123-E127 PolarHBondContact O-N 2.68Å
124H91.6Very high92.7Very high62 Ų6296 Ų9629%0.28745%0.453SS..Hα-helixtrans-64.8-43.5176.5-179.462.3000112.3H50 L120 Q121 V122 E127 R128H50-H124 AromaticContact CG-CE1 3.77Å; H50-H124 AromaticContact ND1-CE1 3.56Å; L120-H124 WeakPolarHBondContact O-CB 3.46Å; L120-H124 PolarHBondContact O-N 3.03Å; Q121-H124 PolarHBondContact O-N 3.48Å; V122-H124 VanDerWaalsContact C-N 3.35Å; V122-H124 PolarHBondContact O-N 2.96Å; H124-E127 PolarHBondContact O-N 3.18Å; H124-R128 PolarHBondContact O-N 2.92Å
125E92.1Very high92.5Very high94 Ų9495.5 Ų95.544%0.43944%0.441SS..Hα-helixtrans-63.2-41.1175.9-73172.1-170.900111.9Q121 V122 E127 R128 F129Q121-E125 WeakPolarHBondContact CG-OE1 3.32Å; Q121-E125 PolarHBondContact NE2-OE1 2.64Å; Q121-E125 WeakPolarHBondContact O-CG 3.39Å; Q121-E125 PolarHBondContact O-N 2.93Å; V122-E125 PolarHBondContact O-N 3.11Å; E125-E127 VanDerWaalsContact C-N 3.34Å; E125-E127 PolarHBondContact O-N 2.93Å; E125-R128 PolarHBondContact O-N 3.25Å; E125-F129 PolarHBondContact O-N 3.2Å
126Q94Very high92.5Very high120 Ų12094.2 Ų94.256%0.56144%0.438SS*.Hα-helixtrans-63.7-38.2173.9-75-179.83.100112.7V122 A123 R130V122-Q126 WeakPolarHBondContact O-CB 3.37Å; V122-Q126 VanDerWaalsContact O-CG 3.32Å; V122-Q126 WeakPolarHBondContact O-CG 3.48Å; V122-Q126 PolarHBondContact O-N 2.95Å; A123-Q126 PolarHBondContact O-N 3.04Å; Q126-R130 WeakPolarHBondContact O-CB 3.18Å; Q126-R130 PolarHBondContact O-N 3.44Å; Q126-R130 VanDerWaalsContact O-N 3.1Å
127E90.7Very high92.5Very high87 Ų8791.2 Ų91.241%0.40744%0.435SS..Hα-helixtrans-65.3-47.5175.6-175167.7-142.900111.5A123 H124 E125 F129 R130 E131A123-E127 WeakPolarHBondContact O-CB 3.35Å; A123-E127 PolarHBondContact O-N 2.68Å; H124-E127 PolarHBondContact O-N 3.18Å; E125-E127 VanDerWaalsContact C-N 3.34Å; E125-E127 PolarHBondContact O-N 2.93Å; E127-F129 VanDerWaalsContact C-N 3.34Å; E127-F129 PolarHBondContact O-N 2.87Å; E127-R130 VanDerWaalsContact O-CB 3.32Å; E127-R130 WeakPolarHBondContact O-CB 3.35Å; E127-R130 PolarHBondContact O-N 2.93Å; E127-R130 VanDerWaalsContact O-N 3.11Å; E127-E131 WeakPolarHBondContact O-CG 3.34Å; E127-E131 PolarHBondContact O-N 3.45Å
128R88.8Confident92.4Very high93 Ų9385.3 Ų85.335%0.35141%0.408SS..Hα-helixtrans-57.3-46.1175-72.6-148.1-64.2176.8-1.4112.3H50 H124 E125 R130 E131 E132H50-R128 HydrophobicContact CB-CG 4.37Å; H124-R128 PolarHBondContact O-N 2.92Å; E125-R128 PolarHBondContact O-N 3.25Å; R128-R130 VanDerWaalsContact C-N 3.27Å; R128-R130 PolarHBondContact O-N 2.82Å; R128-E131 PolarHBondContact O-N 3.47Å; R128-E131 VanDerWaalsContact O-N 3.15Å; R128-E132 WeakPolarHBondContact O-CG 3.06Å; R128-E132 PolarHBondContact O-N 3.32Å
129F93.2Very high92.3Very high127 Ų12783.6 Ų83.656%0.55740%0.401SS*.Hα-helixtrans-58.7-40.2177.2-177.9-102.7000112.2E125 E127 Q133E125-F129 PolarHBondContact O-N 3.2Å; E127-F129 VanDerWaalsContact C-N 3.34Å; E127-F129 PolarHBondContact O-N 2.87Å; F129-Q133 HydrophobicContact CD1-CG 4.46Å; F129-Q133 HydrophobicContact CE1-CG 4.09Å; F129-Q133 HydrophobicContact CZ-CG 4.19Å; F129-Q133 WeakPolarHBondContact O-CG 3.38Å; F129-Q133 PolarHBondContact O-N 3.43Å; F129-Q133 VanDerWaalsContact O-N 3.1Å
130R93.9Very high92.3Very high147 Ų14785.7 Ų85.756%0.55540%0.404SS*.Hα-helixtrans-64.2-42.4176.7-163.6-159.3-31.6-91.6-5.1112Q126 E127 R128 Q133 E134Q126-R130 WeakPolarHBondContact O-CB 3.18Å; Q126-R130 PolarHBondContact O-N 3.44Å; Q126-R130 VanDerWaalsContact O-N 3.1Å; E127-R130 VanDerWaalsContact O-CB 3.32Å; E127-R130 WeakPolarHBondContact O-CB 3.35Å; E127-R130 PolarHBondContact O-N 2.93Å; E127-R130 VanDerWaalsContact O-N 3.11Å; R128-R130 VanDerWaalsContact C-N 3.27Å; R128-R130 PolarHBondContact O-N 2.82Å; R130-Q133 PolarHBondContact O-N 2.93Å; R130-E134 PolarHBondContact O-N 3.35Å
131E89.5Confident92.1Very high10 Ų1082.7 Ų82.75%0.04739%0.387CS..Hα-helixtrans-68.4-38.3179.3-68.8-167.4145.200112.3R46 L47 H50 E127 R128 E134 Q135R46-E131 WeakPolarHBondContact CD-OE1 3.44Å; R46-E131 IonicContact CZ-OE1 3.08Å; R46-E131 IonicContact NE-OE1 3.26Å; R46-E131 IonicContact NH1-OE1 3.78Å; R46-E131 PolarHBondContact NH1-OE1 3.49Å; L47-E131 HydrophobicContact CD2-CB 3.89Å; L47-E131 HydrophobicContact CG-CB 4.3Å; H50-E131 IonicContact CD2-OE2 3.47Å; H50-E131 PolarHBondContact CD2-OE2 2.78Å; H50-E131 IonicContact NE2-OE2 2.78Å; H50-E131 PolarHBondContact NE2-OE2 2.99Å; E127-E131 WeakPolarHBondContact O-CG 3.34Å; E127-E131 PolarHBondContact O-N 3.45Å; R128-E131 PolarHBondContact O-N 3.47Å; R128-E131 VanDerWaalsContact O-N 3.15Å; E131-E134 PolarHBondContact O-N 3.39Å; E131-Q135 WeakPolarHBondContact O-CB 3.34Å; E131-Q135 PolarHBondContact O-N 3.03Å
132E90.9Very high91.9Very high89 Ų8978.1 Ų78.142%0.41637%0.365SS..Hα-helixtrans-60.9-42.7172.1-73.2175.4-177.900111.7L47 R128 Q135 L136L47-E132 HydrophobicContact CD1-CG 4.09Å; L47-E132 HydrophobicContact CD2-CG 3.91Å; R128-E132 WeakPolarHBondContact O-CG 3.06Å; R128-E132 PolarHBondContact O-N 3.32Å; E132-Q135 PolarHBondContact O-N 3.23Å; E132-L136 WeakPolarHBondContact O-CG 3.37Å; E132-L136 PolarHBondContact O-N 3.08Å
133Q93.4Very high91.8Very high79 Ų7978.9 Ų78.937%0.36937%0.368SS..Hα-helixtrans-63.1-42.2174.1-68.3-61.2-36.600112F129 R130 Q135 L136 V137F129-Q133 HydrophobicContact CD1-CG 4.46Å; F129-Q133 HydrophobicContact CE1-CG 4.09Å; F129-Q133 HydrophobicContact CZ-CG 4.19Å; F129-Q133 WeakPolarHBondContact O-CG 3.38Å; F129-Q133 PolarHBondContact O-N 3.43Å; F129-Q133 VanDerWaalsContact O-N 3.1Å; R130-Q133 PolarHBondContact O-N 2.93Å; Q133-Q135 VanDerWaalsContact C-N 3.31Å; Q133-Q135 PolarHBondContact O-N 3.1Å; Q133-L136 PolarHBondContact O-N 3.11Å; Q133-V137 WeakPolarHBondContact O-CG2 3.35Å; Q133-V137 PolarHBondContact O-N 3Å
134E91.5Very high91.7Very high47 Ų4781.1 Ų81.122%0.2238%0.376CS..Hα-helixtrans-60.3-42.3175-173.9171.6175.200111K2 T43 R130 E131 V137 L138K2-E134 WeakPolarHBondContact CE-OE1 3.31Å; K2-E134 WeakPolarHBondContact CE-OE2 3.47Å; K2-E134 IonicContact NZ-OE1 3.32Å; K2-E134 PolarHBondContact NZ-OE1 3.03Å; K2-E134 IonicContact NZ-OE2 2.64Å; K2-E134 PolarHBondContact NZ-OE2 3.19Å; T43-E134 HydrophobicContact CG2-CG 4.22Å; R130-E134 PolarHBondContact O-N 3.35Å; E131-E134 PolarHBondContact O-N 3.39Å; E134-V137 PolarHBondContact O-N 2.9Å; E134-L138 HydrophobicContact CG-CD1 4.33Å; E134-L138 WeakPolarHBondContact O-CG 3.41Å; E134-L138 PolarHBondContact O-N 3.31Å
135Q89.4Confident91.6Very high45 Ų4579.3 Ų79.321%0.2137%0.368CS..Hα-helixtrans-64.3-40.7176.9-166.1-175.830.800112.5L47 E131 E132 Q133 L138 K139L47-Q135 VanDerWaalsContact CD1-OE1 3.29Å; E131-Q135 WeakPolarHBondContact O-CB 3.34Å; E131-Q135 PolarHBondContact O-N 3.03Å; E132-Q135 PolarHBondContact O-N 3.23Å; Q133-Q135 VanDerWaalsContact C-N 3.31Å; Q133-Q135 PolarHBondContact O-N 3.1Å; Q135-L138 PolarHBondContact O-N 3.19Å; Q135-K139 WeakPolarHBondContact O-CB 3.31Å; Q135-K139 PolarHBondContact O-N 3.36Å
136L93.1Very high91.4Very high83 Ų8376.4 Ų76.444%0.43536%0.356SS..Hα-helixtrans-65-38.5175.9-76.5172000112.5E132 Q133 R140E132-L136 WeakPolarHBondContact O-CG 3.37Å; E132-L136 PolarHBondContact O-N 3.08Å; Q133-L136 PolarHBondContact O-N 3.11Å; L136-R140 WeakPolarHBondContact O-CG 3.4Å; L136-R140 PolarHBondContact O-N 3.44Å; L136-R140 VanDerWaalsContact O-N 3.1Å
137V93.4Very high91.2Very high84 Ų8476 Ų7651%0.50935%0.354SS..Hα-helixtrans-65.5-49175.6171.50000110.4Q133 E134 K139 R140 E141Q133-V137 WeakPolarHBondContact O-CG2 3.35Å; Q133-V137 PolarHBondContact O-N 3Å; E134-V137 PolarHBondContact O-N 2.9Å; V137-K139 VanDerWaalsContact C-N 3.28Å; V137-K139 PolarHBondContact O-N 3.24Å; V137-R140 PolarHBondContact O-N 3.43Å; V137-E141 PolarHBondContact O-N 3.37Å
138L91.2Very high90.9Very high12 Ų1275.9 Ų75.96%0.06335%0.353CS..Hα-helixtrans-58.8-41.1177.5-72171.5000111.7L36 A39 W40 T43 E134 Q135 E141 I142L36-L138 HydrophobicContact CD2-CD2 3.61Å; A39-L138 HydrophobicContact CB-CD1 4Å; A39-L138 HydrophobicContact CB-CD2 4.27Å; W40-L138 HydrophobicContact CB-CB 4.32Å; W40-L138 HydrophobicContact CB-CD1 4.43Å; T43-L138 HydrophobicContact CG2-CD1 4.19Å; E134-L138 HydrophobicContact CG-CD1 4.33Å; E134-L138 WeakPolarHBondContact O-CG 3.41Å; E134-L138 PolarHBondContact O-N 3.31Å; Q135-L138 PolarHBondContact O-N 3.19Å; L138-E141 PolarHBondContact O-N 2.7Å; L138-I142 VanDerWaalsContact O-CG1 3.31Å; L138-I142 WeakPolarHBondContact O-CG1 3.41Å; L138-I142 PolarHBondContact O-N 3.48Å
139K93.4Very high90.6Very high109 Ų10974.1 Ų74.147%0.47435%0.349SS..Hα-helixtrans-61.1-49.2176.7-176.5177.9176.6-177.90111.8Q135 V137 E141 I142 D143Q135-K139 WeakPolarHBondContact O-CB 3.31Å; Q135-K139 PolarHBondContact O-N 3.36Å; V137-K139 VanDerWaalsContact C-N 3.28Å; V137-K139 PolarHBondContact O-N 3.24Å; K139-E141 PolarHBondContact O-N 2.97Å; K139-I142 PolarHBondContact O-N 2.93Å; K139-D143 VanDerWaalsContact O-CG 3.27Å; K139-D143 PolarHBondContact O-N 3.15Å
140R93.8Very high90.2Very high157 Ų15774.8 Ų74.859%0.59235%0.348SS*.Hα-helixtrans-59.1-38.3177.5-71.9-177.9-135.2-179.92.6112L136 V137 D143 V144L136-R140 WeakPolarHBondContact O-CG 3.4Å; L136-R140 PolarHBondContact O-N 3.44Å; L136-R140 VanDerWaalsContact O-N 3.1Å; V137-R140 PolarHBondContact O-N 3.43Å; R140-D143 PolarHBondContact O-N 3Å; R140-V144 VanDerWaalsContact O-CG2 3.31Å; R140-V144 WeakPolarHBondContact O-CG2 3.33Å; R140-V144 PolarHBondContact O-N 3.19Å
141E90.5Very high89.6Confident64 Ų6471.8 Ų71.830%0.29935%0.349SS..Hα-helixtrans-67.7-40.2178.6-167.8171.9-169.400112.2Y32 L36 V137 L138 K139 V144 L145Y32-E141 WeakPolarHBondContact CE1-OE1 3.5Å; Y32-E141 PolarHBondContact OH-OE1 2.73Å; L36-E141 HydrophobicContact CD1-CB 4.32Å; L36-E141 HydrophobicContact CD1-CG 3.68Å; L36-E141 WeakPolarHBondContact CD2-OE2 3.48Å; V137-E141 PolarHBondContact O-N 3.37Å; L138-E141 PolarHBondContact O-N 2.7Å; K139-E141 PolarHBondContact O-N 2.97Å; E141-V144 PolarHBondContact O-N 3.04Å; E141-L145 WeakPolarHBondContact O-CG 3.44Å; E141-L145 PolarHBondContact O-N 2.83Å; E141-L145 VanDerWaalsContact O-N 3.07Å
142I88.9Confident89.1Confident20 Ų2074.5 Ų74.510%0.10336%0.364CS..Hα-helixtrans-62.2-45.7172.1-66.8164.6000110.4L36 I37 W40 L138 K139 V144 L145 D146L36-I142 HydrophobicContact CB-CD1 4.35Å; L36-I142 HydrophobicContact CB-CG1 3.96Å; I37-I142 HydrophobicContact CG1-CD1 4.12Å; W40-I142 HydrophobicContact CB-CD1 4.06Å; W40-I142 HydrophobicContact CG-CD1 4.35Å; L138-I142 VanDerWaalsContact O-CG1 3.31Å; L138-I142 WeakPolarHBondContact O-CG1 3.41Å; L138-I142 PolarHBondContact O-N 3.48Å; K139-I142 PolarHBondContact O-N 2.93Å; I142-V144 VanDerWaalsContact C-N 3.29Å; I142-V144 PolarHBondContact O-N 2.93Å; I142-L145 PolarHBondContact O-N 2.93Å; I142-L145 VanDerWaalsContact O-N 3.11Å; I142-D146 PolarHBondContact O-N 3.43Å
143D92Very high88.2Confident78 Ų7875.9 Ų75.942%0.41737%0.366SS..Hα-helixtrans-59.7-39.3179.3-65.9-27.2000111.7K139 R140 D146 E147K139-D143 VanDerWaalsContact O-CG 3.27Å; K139-D143 PolarHBondContact O-N 3.15Å; R140-D143 PolarHBondContact O-N 3Å; D143-D146 PolarHBondContact O-N 3.42Å; D143-E147 WeakPolarHBondContact O-CB 3.38Å; D143-E147 PolarHBondContact O-N 3.23Å
144V90.9Very high86.8Confident97 Ų9774.3 Ų74.359%0.58837%0.371SS*.Hα-helixtrans-65.5-41.6175169.50000111.8R140 E141 I142 E147 Q148R140-V144 VanDerWaalsContact O-CG2 3.31Å; R140-V144 WeakPolarHBondContact O-CG2 3.33Å; R140-V144 PolarHBondContact O-N 3.19Å; E141-V144 PolarHBondContact O-N 3.04Å; I142-V144 VanDerWaalsContact C-N 3.29Å; I142-V144 PolarHBondContact O-N 2.93Å; V144-E147 PolarHBondContact O-N 3.47Å; V144-Q148 WeakPolarHBondContact O-CB 3.48Å; V144-Q148 PolarHBondContact O-N 3.15Å
145L88.2Confident85.2Confident23 Ų2378.7 Ų78.712%0.1240%0.396CS..Hα-helixtrans-66.4-42.1176.3-71.5174.1000111.6Y32 R33 L36 E141 I142 E147 Q148 E149Y32-L145 HydrophobicContact CD1-CD1 3.85Å; Y32-L145 HydrophobicContact CE1-CD1 4.09Å; R33-L145 HydrophobicContact CB-CD1 4.33Å; L36-L145 HydrophobicContact CD1-CD1 3.55Å; E141-L145 WeakPolarHBondContact O-CG 3.44Å; E141-L145 PolarHBondContact O-N 2.83Å; E141-L145 VanDerWaalsContact O-N 3.07Å; I142-L145 PolarHBondContact O-N 2.93Å; I142-L145 VanDerWaalsContact O-N 3.11Å; L145-E147 VanDerWaalsContact C-N 3.29Å; L145-E147 PolarHBondContact O-N 2.85Å; L145-Q148 PolarHBondContact O-N 2.94Å; L145-E149 WeakPolarHBondContact O-CB 3.5Å; L145-E149 WeakPolarHBondContact O-CG 3.5Å; L145-E149 PolarHBondContact O-N 3.32Å
146D88.4Confident83.6Confident33 Ų3381.3 Ų81.318%0.17641%0.411CS..Hα-helixtrans-63.3-37.3176.9-75.3-7.9000111R33 I142 D143 E149 R150R33-D146 IonicContact CZ-OD1 2.93Å; R33-D146 VanDerWaalsContact CZ-OD1 3.32Å; R33-D146 IonicContact NE-OD1 2.95Å; R33-D146 PolarHBondContact NE-OD1 3.49Å; R33-D146 IonicContact NH2-OD1 3.89Å; R33-D146 PolarHBondContact NH2-OD1 2.84Å; R33-D146 IonicContact NH2-OD2 3.41Å; I142-D146 PolarHBondContact O-N 3.43Å; D143-D146 PolarHBondContact O-N 3.42Å; D146-E149 PolarHBondContact O-N 2.97Å; D146-R150 WeakPolarHBondContact O-CB 3.43Å; D146-R150 WeakPolarHBondContact O-CG 3.3Å; D146-R150 PolarHBondContact O-N 3.41Å
147E89Confident81.8Confident112 Ų11285.3 Ų85.352%0.52343%0.427SS..Hα-helixtrans-69.5-39.2174.1-165.959.2-158.400112.7D143 V144 L145 E149 R150 S151D143-E147 WeakPolarHBondContact O-CB 3.38Å; D143-E147 PolarHBondContact O-N 3.23Å; V144-E147 PolarHBondContact O-N 3.47Å; L145-E147 VanDerWaalsContact C-N 3.29Å; L145-E147 PolarHBondContact O-N 2.85Å; E147-E149 VanDerWaalsContact C-N 3.34Å; E147-R150 PolarHBondContact O-N 2.95Å; E147-R150 IonicContact OE2-CZ 3.69Å; E147-R150 IonicContact OE2-NE 3.5Å; E147-R150 PolarHBondContact OE2-NE 2.94Å; E147-R150 IonicContact OE2-NH2 3.74Å; E147-R150 PolarHBondContact OE2-NH2 3.26Å; E147-R150 VanDerWaalsContact OE2-NH2 3.08Å; E147-S151 PolarHBondContact O-N 2.65Å
148Q86.3Confident79.7Confident84 Ų8489.3 Ų89.339%0.39345%0.445SS..Hα-helixtrans-64.7-39.4174.3-175.3173.837.700111.7V144 L145 S151 I152V144-Q148 WeakPolarHBondContact O-CB 3.48Å; V144-Q148 PolarHBondContact O-N 3.15Å; L145-Q148 PolarHBondContact O-N 2.94Å; Q148-S151 PolarHBondContact O-N 3.11Å; Q148-I152 HydrophobicContact CG-CD1 4.08Å; Q148-I152 WeakPolarHBondContact O-CD1 3.31Å; Q148-I152 VanDerWaalsContact O-CG1 3.25Å; Q148-I152 WeakPolarHBondContact O-CG1 3.45Å; Q148-I152 PolarHBondContact O-N 3.07Å; Q148-I152 VanDerWaalsContact O-N 3.16Å
149E81.8Confident77.7Confident56 Ų5695.7 Ų95.726%0.26248%0.475SS..Hα-helixtrans-64.5-44.7173.8-75.5-178.6-177.400110.7R33 L145 D146 E147 S151 I152 Y153R33-E149 WeakPolarHBondContact CD-OE1 3.44Å; R33-E149 IonicContact NE-OE2 2.83Å; L145-E149 WeakPolarHBondContact O-CB 3.5Å; L145-E149 WeakPolarHBondContact O-CG 3.5Å; L145-E149 PolarHBondContact O-N 3.32Å; D146-E149 PolarHBondContact O-N 2.97Å; E147-E149 VanDerWaalsContact C-N 3.34Å; E149-S151 VanDerWaalsContact C-N 3.32Å; E149-S151 PolarHBondContact O-N 2.92Å; E149-I152 PolarHBondContact O-N 3.33Å; E149-I152 VanDerWaalsContact O-N 3.14Å; E149-Y153 WeakPolarHBondContact O-CD2 3.39Å; E149-Y153 PolarHBondContact O-N 3.47Å
150R83.6Confident75.4Confident142 Ų14294.1 Ų94.154%0.53648%0.482SS..Hα-helixtrans-58.5-40.8173.6-79.2-171.7-78.2-93.8-0.7112.8D146 E147 I152 G154D146-R150 WeakPolarHBondContact O-CB 3.43Å; D146-R150 WeakPolarHBondContact O-CG 3.3Å; D146-R150 PolarHBondContact O-N 3.41Å; E147-R150 PolarHBondContact O-N 2.95Å; E147-R150 IonicContact OE2-CZ 3.69Å; E147-R150 IonicContact OE2-NE 3.5Å; E147-R150 PolarHBondContact OE2-NE 2.94Å; E147-R150 IonicContact OE2-NH2 3.74Å; E147-R150 PolarHBondContact OE2-NH2 3.26Å; E147-R150 VanDerWaalsContact OE2-NH2 3.08Å; R150-I152 VanDerWaalsContact C-N 3.3Å; R150-I152 PolarHBondContact O-N 3Å; R150-G154 VanDerWaalsContact O-CA 3.29Å; R150-G154 WeakPolarHBondContact O-CA 3.37Å; R150-G154 PolarHBondContact O-N 3.45Å
151S81.9Confident73.1Confident83 Ų8396.4 Ų96.458%0.5850%0.499SS*.Hα-helixtrans-67.7-27.7177.1177.50000113.5E147 Q148 E149E147-S151 PolarHBondContact O-N 2.65Å; Q148-S151 PolarHBondContact O-N 3.11Å; E149-S151 VanDerWaalsContact C-N 3.32Å; E149-S151 PolarHBondContact O-N 2.92Å
152I80.3Confident70.9Confident68 Ų68104.2 Ų104.235%0.34953%0.526SS..Hα-helixtrans-81.4-41.6179.8-68.4162.2000111Q148 E149 R150Q148-I152 HydrophobicContact CG-CD1 4.08Å; Q148-I152 WeakPolarHBondContact O-CD1 3.31Å; Q148-I152 VanDerWaalsContact O-CG1 3.25Å; Q148-I152 WeakPolarHBondContact O-CG1 3.45Å; Q148-I152 PolarHBondContact O-N 3.07Å; Q148-I152 VanDerWaalsContact O-N 3.16Å; E149-I152 PolarHBondContact O-N 3.33Å; E149-I152 VanDerWaalsContact O-N 3.14Å; R150-I152 VanDerWaalsContact C-N 3.3Å; R150-I152 PolarHBondContact O-N 3Å
153Y70.9Confident68.8Low117 Ų117109 Ų10946%0.45956%0.556SS.*Hα-helixtrans-91.4-19-177.3-64.7-68.2000113.7Q26 E149 D155 D156Q26-Y153 PolarHBondContact NE2-OH 2.93Å; Q26-Y153 PolarHBondContact OE1-OH 3.42Å; Q26-Y153 VanDerWaalsContact OE1-OH 3.09Å; E149-Y153 WeakPolarHBondContact O-CD2 3.39Å; E149-Y153 PolarHBondContact O-N 3.47Å; Y153-D155 VanDerWaalsContact C-N 3.3Å; Y153-D155 PolarHBondContact O-N 2.88Å; Y153-D156 PolarHBondContact O-N 3.24Å
154G65Low66.7Low46 Ų46116.1 Ų116.147%0.47458%0.577SS.*THydrogen-bonded Turntrans-67.5-26.2-178.900000114.2R150R150-G154 VanDerWaalsContact O-CA 3.29Å; R150-G154 WeakPolarHBondContact O-CA 3.37Å; R150-G154 PolarHBondContact O-N 3.45Å
155D58.2Low64.4Low140 Ų140116.9 Ų116.975%0.74959%0.587SS**THydrogen-bonded Turntrans-82.1-18174.8-84.3-18000113.1Y153Y153-D155 VanDerWaalsContact C-N 3.3Å; Y153-D155 PolarHBondContact O-N 2.88Å
156D55.9Low62.8Low99 Ų99121.5 Ų121.553%0.52961%0.611SS.*G310 helixtrans-86.5-11-179-92.6-21.4000113.6Y153 L158 Q159 A160Y153-D156 PolarHBondContact O-N 3.24Å; D156-L158 PolarHBondContact O-N 3.01Å; D156-L158 VanDerWaalsContact O-N 3.14Å; D156-Q159 PolarHBondContact O-N 2.99Å; D156-A160 PolarHBondContact O-N 2.98Å
157E53.3Low61.3Low167 Ų167122.7 Ų122.778%0.7862%0.622SS**G310 helixtrans-67.1-12.4176.8-120.9-178.3176.900113.1
158L50.7Low59.8Low169 Ų169126.1 Ų126.189%0.88563%0.632SS**G310 helixtrans-94.2-5.1171.2-69.7174.3000114.5D156D156-L158 PolarHBondContact O-N 3.01Å; D156-L158 VanDerWaalsContact O-N 3.14Å
159Q48.8Very low59Low146 Ų146127.3 Ų127.368%0.68264%0.641SS**THydrogen-bonded Turntrans-108.4-8.7175.4-82.3-146.113.800115.3D156 Q161 R162D156-Q159 PolarHBondContact O-N 2.99Å; Q159-Q161 PolarHBondContact O-N 3.36Å; Q159-R162 PolarHBondContact O-N 3.48Å
160A46Very low58.2Low76 Ų76128.3 Ų128.363%0.62865%0.648SS**THydrogen-bonded Turntrans-66.1-1.6-174.100000116.3D156D156-A160 PolarHBondContact O-N 2.98Å
161Q43.6Very low57.3Low204 Ų204125 Ų12595%0.95364%0.643SS**THydrogen-bonded Turntrans-94-0.6173.5-84.9-168.6-19.500115.4Q159Q159-Q161 PolarHBondContact O-N 3.36Å
162R44.7Very low56.6Low228 Ų228123.9 Ų123.986%0.8663%0.633SS**SBendtrans-112-8.3-173.6-135.3175.5-166.6163.24.1116.8Q159 R164Q159-R162 PolarHBondContact O-N 3.48Å; R162-R164 PolarHBondContact O-N 3.06Å
163T45.9Very low56Low120 Ų120126.3 Ų126.374%0.73664%0.643SS**SBendtrans-99.489.4173.1370000110S165T163-S165 PolarHBondContact O-N 3.07Å
164R46.8Very low56.1Low228 Ų228126.9 Ų126.986%0.8665%0.65SS**  trans-2109.7148.7-137.5176.7-165.71732.2112R162 L166R162-R164 PolarHBondContact O-N 3.06Å; R164-L166 PolarHBondContact O-N 2.86Å
165S44.2Very low56.4Low114 Ų114133.1 Ų133.180%0.79766%0.659SS**  trans-33.495.8170.547.20000111.9T163 S167T163-S165 PolarHBondContact O-N 3.07Å; S165-S167 PolarHBondContact O-N 3.09Å
166L54Low56.9Low119 Ų119130.2 Ų130.262%0.62364%0.643SS**  trans-73.1111168.4-76.8162.9000105.6R164 D170 T171R164-L166 PolarHBondContact O-N 2.86Å; L166-D170 HydrophobicContact CB-CB 4.29Å; L166-D170 HydrophobicContact CD2-CB 3.63Å; L166-T171 HydrophobicContact CB-CG2 4.38Å
167S56.4Low57.6Low58 Ų58130 Ų13041%0.40665%0.649SS.*  trans-52.6151.2170.7175.50000109.3S165 D169 D170 T171S165-S167 PolarHBondContact O-N 3.09Å; S167-D169 PolarHBondContact O-N 3.05Å; S167-D169 PolarHBondContact OG-N 3.14Å; S167-D170 WeakPolarHBondContact O-CB 3.5Å; S167-D170 PolarHBondContact O-N 3.16Å; S167-T171 PolarHBondContact O-N 2.49Å; S167-T171 PolarHBondContact O-OG1 2.85Å
168Y57.9Low58.2Low185 Ų185126.7 Ų126.773%0.72564%0.64SS**Hα-helixtrans-50.6-31.7171-176.4-97.5000111.5T171 V172Y168-T171 PolarHBondContact O-OG1 3.21Å; Y168-V172 HydrophobicContact CD1-CG2 4.4Å; Y168-V172 HydrophobicContact CE1-CG2 4.09Å; Y168-V172 WeakPolarHBondContact O-CG2 3.46Å; Y168-V172 PolarHBondContact O-N 3.4Å
169D68.4Low58.7Low108 Ų108123.1 Ų123.158%0.57862%0.622SS**Hα-helixtrans-67.6-35.7174.9-69.6-35.7000113.5S167 Q173S167-D169 PolarHBondContact O-N 3.05Å; S167-D169 PolarHBondContact OG-N 3.14Å; D169-Q173 WeakPolarHBondContact O-CB 3.49Å; D169-Q173 WeakPolarHBondContact O-CG 3.36Å; D169-Q173 PolarHBondContact O-N 3.39Å
170D65.4Low58.6Low78 Ų78118.9 Ų118.942%0.41762%0.617SS.*Hα-helixtrans-73.1-36.5-179.8-74-29.5000111.9L166 S167 H174L166-D170 HydrophobicContact CB-CB 4.29Å; L166-D170 HydrophobicContact CD2-CB 3.63Å; S167-D170 WeakPolarHBondContact O-CB 3.5Å; S167-D170 PolarHBondContact O-N 3.16Å; D170-H174 VanDerWaalsContact O-CB 3.28Å; D170-H174 WeakPolarHBondContact O-CB 3.37Å; D170-H174 PolarHBondContact O-N 2.85Å
171T64.2Low58.8Low71 Ų71118.1 Ų118.144%0.43661%0.611SS.*Hα-helixtrans-67.8-40.4176.334.60000111.4L166 S167 Y168 W175L166-T171 HydrophobicContact CB-CG2 4.38Å; S167-T171 PolarHBondContact O-N 2.49Å; S167-T171 PolarHBondContact O-OG1 2.85Å; Y168-T171 PolarHBondContact O-OG1 3.21Å; T171-W175 WeakPolarHBondContact O-CB 3.21Å; T171-W175 PolarHBondContact O-N 3.41Å
172V68.1Low59.1Low60 Ų60119.8 Ų119.836%0.36461%0.609SS.*Hα-helixtrans-68.6-42.2175.6176.60000111.5Y168 W175 L176Y168-V172 HydrophobicContact CD1-CG2 4.4Å; Y168-V172 HydrophobicContact CE1-CG2 4.09Å; Y168-V172 WeakPolarHBondContact O-CG2 3.46Å; Y168-V172 PolarHBondContact O-N 3.4Å; V172-W175 PolarHBondContact O-N 2.79Å; V172-L176 HydrophobicContact CG1-CD1 3.91Å; V172-L176 HydrophobicContact CG1-CG 4.39Å; V172-L176 WeakPolarHBondContact O-CB 3.42Å; V172-L176 VanDerWaalsContact O-CG 3.31Å; V172-L176 WeakPolarHBondContact O-CG 3.25Å; V172-L176 PolarHBondContact O-N 3.42Å
173Q68.5Low59.6Low119 Ų119117.2 Ų117.256%0.55660%0.604SS**Hα-helixtrans-65.9-38176.4-78.6-15917.800113.2D169 S177D169-Q173 WeakPolarHBondContact O-CB 3.49Å; D169-Q173 WeakPolarHBondContact O-CG 3.36Å; D169-Q173 PolarHBondContact O-N 3.39Å; Q173-S177 WeakPolarHBondContact O-CB 3.29Å; Q173-S177 PolarHBondContact O-N 2.88Å; Q173-S177 PolarHBondContact O-OG 3.04Å
174H73.1Confident59.8Low130 Ų130120 Ų12060%0.60261%0.606SS**Hα-helixtrans-64.2-44.4174.6-176.129.6000110.7D170 L176 S177 V178D170-H174 VanDerWaalsContact O-CB 3.28Å; D170-H174 WeakPolarHBondContact O-CB 3.37Å; D170-H174 PolarHBondContact O-N 2.85Å; H174-L176 PolarHBondContact O-N 3.06Å; H174-S177 PolarHBondContact O-N 3.24Å; H174-V178 WeakPolarHBondContact CE1-CG2 3.42Å; H174-V178 WeakPolarHBondContact ND1-CG2 3.5Å; H174-V178 WeakPolarHBondContact O-CB 3.18Å; H174-V178 VanDerWaalsContact O-CG2 3.28Å; H174-V178 WeakPolarHBondContact O-CG2 3.34Å; H174-V178 PolarHBondContact O-N 3.23Å
175W70.9Confident60Low177 Ų177116 Ų11667%0.6760%0.601SS**Hα-helixtrans-63.1-42178.4-161.886.6000112.5T171 V172 N179T171-W175 WeakPolarHBondContact O-CB 3.21Å; T171-W175 PolarHBondContact O-N 3.41Å; V172-W175 PolarHBondContact O-N 2.79Å; W175-N179 WeakPolarHBondContact CH2-ND2 3.49Å; W175-N179 WeakPolarHBondContact CZ2-ND2 3.44Å; W175-N179 WeakPolarHBondContact CZ3-ND2 3.3Å; W175-N179 WeakPolarHBondContact O-CB 3.35Å; W175-N179 PolarHBondContact O-N 3.34Å; W175-N179 VanDerWaalsContact O-N 3.08Å; W175-N179 PolarHBondContact O-ND2 3.4Å
176L68Low60Low78 Ų78118.5 Ų118.541%0.40860%0.601SS.*Hα-helixtrans-67.6-35.6175.4-70.3171.1000112.8V172 H174 A181V172-L176 HydrophobicContact CG1-CD1 3.91Å; V172-L176 HydrophobicContact CG1-CG 4.39Å; V172-L176 WeakPolarHBondContact O-CB 3.42Å; V172-L176 VanDerWaalsContact O-CG 3.31Å; V172-L176 WeakPolarHBondContact O-CG 3.25Å; V172-L176 PolarHBondContact O-N 3.42Å; H174-L176 PolarHBondContact O-N 3.06Å; L176-A181 HydrophobicContact CD2-CB 4.45Å; L176-A181 PolarHBondContact O-N 3.25Å
177S70.8Confident59.5Low94 Ų94118.9 Ų118.966%0.65761%0.608SS**Hα-helixtrans-71.5-38.6176.6-62.80000112.8Q173 H174 G180Q173-S177 WeakPolarHBondContact O-CB 3.29Å; Q173-S177 PolarHBondContact O-N 2.88Å; Q173-S177 PolarHBondContact O-OG 3.04Å; H174-S177 PolarHBondContact O-N 3.24Å; S177-G180 PolarHBondContact O-N 3.24Å
178V66.8Low58.9Low99 Ų99121.8 Ų121.860%0.663%0.628SS**Hα-helixtrans-71-34.8178.2172.20000111.4H174 G180H174-V178 WeakPolarHBondContact CE1-CG2 3.42Å; H174-V178 WeakPolarHBondContact ND1-CG2 3.5Å; H174-V178 WeakPolarHBondContact O-CB 3.18Å; H174-V178 VanDerWaalsContact O-CG2 3.28Å; H174-V178 WeakPolarHBondContact O-CG2 3.34Å; H174-V178 PolarHBondContact O-N 3.23Å; V178-G180 PolarHBondContact O-N 2.81Å
179N60.3Low58Low93 Ų93122.3 Ų122.350%0.49764%0.637SS.*THydrogen-bonded Turntrans-85.414.2179-68.9-31.1000114.3W175 A181W175-N179 WeakPolarHBondContact CH2-ND2 3.49Å; W175-N179 WeakPolarHBondContact CZ2-ND2 3.44Å; W175-N179 WeakPolarHBondContact CZ3-ND2 3.3Å; W175-N179 WeakPolarHBondContact O-CB 3.35Å; W175-N179 PolarHBondContact O-N 3.34Å; W175-N179 VanDerWaalsContact O-N 3.08Å; W175-N179 PolarHBondContact O-ND2 3.4Å; N179-A181 VanDerWaalsContact C-N 3.28Å; N179-A181 PolarHBondContact O-N 3.22Å
180G47.7Very low56.9Low57 Ų57123.1 Ų123.159%0.58865%0.651SS**THydrogen-bonded Turntrans68.121.2168.200000115.2S177 V178 R182S177-G180 PolarHBondContact O-N 3.24Å; V178-G180 PolarHBondContact O-N 2.81Å; G180-R182 PolarHBondContact O-N 3.23Å
181A50.3Low55.5Low61 Ų61127.5 Ų127.550%0.50467%0.669SS.*  trans-7381.5172.300000109.3L176 N179 K183L176-A181 HydrophobicContact CD2-CB 4.45Å; L176-A181 PolarHBondContact O-N 3.25Å; N179-A181 VanDerWaalsContact C-N 3.28Å; N179-A181 PolarHBondContact O-N 3.22Å; A181-K183 PolarHBondContact O-N 3.02Å
182R49.5Very low54.4Low239 Ų239130.6 Ų130.690%0.90268%0.682SS**  trans-58107.8172.3-81-171.5171.6-157.8-1.9109.1G180 K184G180-R182 PolarHBondContact O-N 3.23Å; R182-K184 PolarHBondContact O-N 3.28Å; R182-K184 VanDerWaalsContact O-N 3.14Å
183K55Low53.2Low174 Ų174133.3 Ų133.376%0.75770%0.699SS**  trans-58.7112.8159-78.5-170.5173.9-177.70107.5A181 D185A181-K183 PolarHBondContact O-N 3.02Å; K183-D185 PolarHBondContact O-N 3.25Å
184K49.9Very low52.1Low178 Ų178134.7 Ų134.777%0.77471%0.71SS**  trans-81.295.5171.7-167-178.7-177.1-1680106.2R182 E186R182-K184 PolarHBondContact O-N 3.28Å; R182-K184 VanDerWaalsContact O-N 3.14Å; K184-E186 PolarHBondContact O-N 3.02Å; K184-E186 VanDerWaalsContact O-N 3.11Å
185D50.1Low50.5Low144 Ų144136.9 Ų136.977%0.7772%0.72SS**  trans-66.5105.1169.1-78.5-29.5000108.3K183 T187K183-D185 PolarHBondContact O-N 3.25Å; D185-T187 PolarHBondContact O-N 3.35Å
186E44Very low49.1Very low167 Ų167134.7 Ų134.778%0.7873%0.726SS**  trans-78.598.9170.2-74.7-175.8157.100109.2K184K184-E186 PolarHBondContact O-N 3.02Å; K184-E186 VanDerWaalsContact O-N 3.11Å
187T44.5Very low47.9Very low126 Ų126137.8 Ų137.877%0.77375%0.749SS**  trans-141.8100.6153.319.70000107.6D185D185-T187 PolarHBondContact O-N 3.35Å
188S44.1Very low46.2Very low120 Ų120138.7 Ų138.784%0.83976%0.755SS**  trans162.591.3143-73.20000109.9
189H38.1Very low44.8Very low196 Ų196139.9 Ų139.991%0.90777%0.766SS**  31.1100.5126.5-116.756.2000117.3
190S44.7Very low43.7Very low124 Ų124139.9 Ų139.987%0.86778%0.779SS**  trans-154.8144.4135.3640000111.2
191H37.2Very low43.1Very low170 Ų170142.5 Ų142.579%0.78779%0.786SS**  trans-75.9162.7-165.3-129-93000112.9
192D39.9Very low42.7Very low136 Ų136146.4 Ų146.473%0.72780%0.798SS**  trans95.8135.2148.4-81.6-6.6000121.5
193V42.9Very low42.3Very low117 Ų117145.7 Ų145.771%0.70980%0.796SS**  trans100.288.1154.9-163.20000116.8
194L45.9Very low41.7Very low149 Ų149142.9 Ų142.978%0.7880%0.798SS**  trans74.795.6140.7-54.6171.6000117.1
195Q39.8Very low41Very low176 Ų176139.9 Ų139.982%0.82280%0.799SS**  56.1132.980-71.9-159.1-4.500116.8
196T40.9Very low40.6Very low130 Ų130138.9 Ų138.980%0.79880%0.8SS**  trans85.8113.8169.771.50000114.2
197T42.5Very low40.6Very low144 Ų144135.9 Ų135.988%0.88380%0.804SS**  cis-152.1141.439.138.50000111.8
198S36Very low40.5Very low112 Ų112138.8 Ų138.878%0.78381%0.809SS**  trans-106.5160175.41500000109.2
199C37.6Very low40.6Very low124 Ų124145 Ų14584%0.83881%0.814SS**  trans118.3121.1167.4-61.30000110.9
200A36.5Very low40.8Very low94 Ų94140.9 Ų140.978%0.77781%0.805SS**  cis-161.8149.715.400000110.8
201P35.9Very low41.3Very low112 Ų112143 Ų14373%0.72781%0.805SS**  trans-106.4141.5160.935.3-24.9000110.1
202N41.2Very low41.9Very low142 Ų142140.4 Ų140.476%0.75980%0.804SS**  trans-167.9123.8155.3-96.6-40.2000112.3
203R42Very low42.3Very low225 Ų225142.2 Ų142.285%0.84981%0.812SS**  trans63.5127.4137.9-61.7174.5174-135.7-3.3116.1
204S41.3Very low42.1Very low115 Ų115139.8 Ų139.880%0.80481%0.811SS**  cis177.8133.834.532.10000108.9
205S35.5Very low42.2Very low115 Ų115139 Ų13980%0.80481%0.814SS**  trans-87.5-175.7151.6-58.10000108.6
206P43Very low42.2Very low122 Ų122135.2 Ų135.279%0.79281%0.814SS**  cis-131.1171.1-17.528.2-7.2000112.4
207A42.1Very low42.6Very low104 Ų104135.7 Ų135.786%0.8682%0.816SS**  trans-154.2107.4154.300000111.5
208Q43.4Very low42.8Very low188 Ų188134.4 Ų134.488%0.87981%0.81SS**  trans-66.7139.4167.3-70.2169-43.400110.7
209R46.7Very low43Very low249 Ų249135.6 Ų135.694%0.9481%0.813SS**  trans-137.3114.3150.4-91.5-172.1-179.3165.60.9108.6
210P41.4Very low43.2Very low111 Ų111137 Ų13772%0.72181%0.812SS**  trans-96.7161.3157.833.5-23.7000110.3
211L56.3Low43.7Very low167 Ų167137.5 Ų137.587%0.87481%0.805SS**  trans148.9154.4154-81.2168.9000109.4
212P49.7Very low44.1Very low116 Ų116139.6 Ų139.675%0.75381%0.81SS**  cis-135.6170.2-2231.8-11000114.6
213I47.6Very low44.1Very low174 Ų174137.5 Ų137.589%0.89281%0.812SS**  trans-73.4139.8177.4-71.9153.4000112.6
214G39.5Very low44Very low67 Ų67131.4 Ų131.469%0.69181%0.81SS**  trans105166.3137.100000118
215P47.2Very low44.2Very low131 Ų131133.9 Ų133.985%0.85181%0.814SS**  cis-129.7175.6-3.737-18.5000114.8
216A40.2Very low44.9Very low98 Ų98133.9 Ų133.981%0.8181%0.811SS**  trans-57.1154.1-179.700000116.2
217V49Very low45.1Very low140 Ų140132.2 Ų132.285%0.84881%0.807SS**  trans-126.4140.5156.4175.60000107.9
218P45.5Very low44.9Very low116 Ų116134 Ų13475%0.75380%0.802SS**  trans-88.6156.4-161.82.418.1000114
219T40.8Very low45.1Very low137 Ų137131.7 Ų131.784%0.8480%0.801SS**  trans-38.4130.3163-51.80000114
220D42.8Very low45.1Very low153 Ų153125.2 Ų125.282%0.81879%0.789SS**  trans-119.6150.9160.1-149.7-5.1000110.1
221V47.3Very low45.4Very low105 Ų105128.7 Ų128.764%0.63680%0.796SS**  trans-100.2158.6-149.5-124.60000112.6
222N43.6Very low44.6Very low156 Ų156125.4 Ų125.483%0.83478%0.784SS**  trans71.6107.3150-72.4-20.6000120.5
223A41.5Very low44Very low98 Ų98130 Ų13081%0.8179%0.788SS**  trans-150.598.5133.200000108
224A40.3Very low43.9Very low97 Ų97130.4 Ų130.480%0.80279%0.791SS**  71.495.3104.900000114.4
225L44Very low44Very low168 Ų168131.2 Ų131.288%0.8879%0.791SS**  trans-68.1157.1156.8-75.9162.1000110
226P50.1Low44.1Very low115 Ų115131 Ų13175%0.74779%0.79SS**  -144.4152.9110.936.1-21.4000115.8
227A47.4Very low44.7Very low86 Ų86137.2 Ų137.271%0.71179%0.792SS**  trans51.8107.6140.100000118.4
228D38.5Very low44.4Very low141 Ų141136.4 Ų136.475%0.75479%0.79SS**  67.889.879.1-158.914.4000112.5
229V48.5Very low44.3Very low141 Ų141140.9 Ų140.986%0.85580%0.798SS**  trans-138.9103.7157.3-179.80000108.4
230T45.5Very low44.7Very low113 Ų113140.6 Ų140.669%0.69380%0.796SS**  trans-69.2136.1165.4-58.20000109.8
231Q47.4Very low44.7Very low184 Ų184138.9 Ų138.986%0.8680%0.796SS**  trans-166.7150.1139.2-89.1-116.80.100111.8
232P40.1Very low44.6Very low98 Ų98141.2 Ų141.264%0.63681%0.805SS**  trans-112.5156.4-152.437.5-24.4000115.6
233Y37.1Very low44.6Very low213 Ų213142 Ų14284%0.83580%0.801SS**  trans38.3113.7144.6-96.3-96.4000120.3
234L46.4Very low44.9Very low182 Ų182143.5 Ų143.595%0.95380%0.804SS**  trans-145.5116.4135-84.1179.8000110.2
235A41.1Very low45Very low83 Ų83146.6 Ų146.669%0.68681%0.807SS**  trans-83.3160.2177.200000112.4
236P48.1Very low45.1Very low127 Ų127141.6 Ų141.683%0.82580%0.796SS**  trans-128.6117.7140.412.59.2000113.8
237R53.9Low44.9Very low229 Ų229145.1 Ų145.186%0.86480%0.802SS**  trans13.3133.6149.8-65.4-178.6174.2-163.9-2.1120.7
238P42.2Very low44.5Very low123 Ų123152.5 Ų152.580%0.79981%0.812SS**PPolyproline II helixtrans-87.5134.3160.933.7-26.8000111.2
239F44.6Very low44.9Very low210 Ų210151.8 Ų151.892%0.92182%0.818SS**PPolyproline II helixtrans-74131.2169.2-97.1-89.4000110.6
240T49.1Very low44.5Very low130 Ų130150.4 Ų150.480%0.79881%0.814SS**PPolyproline II helixtrans-75.1138179.845.60000111.8
241S41.6Very low44.2Very low117 Ų117149.6 Ų149.682%0.81882%0.819SS**PPolyproline II helixtrans-51.8132.4165.2-170.10000111.4
242D46.4Very low44Very low154 Ų154146 Ų14682%0.82481%0.812SS**  trans-120.2134.1160.6-152.8-5.6000109.9
243K43.4Very low43.6Very low172 Ų172148 Ų14875%0.74882%0.822SS**  trans-93.6128.6-175.4-72.7-175.9173.4-173.40108.1
244C47Very low43.8Very low131 Ų131142.6 Ų142.689%0.88582%0.822SS**  trans-140105.2151-850000109.7
245D42.7Very low43.6Very low162 Ų162141.4 Ų141.487%0.86681%0.811SS**  trans-52.9142.3154.3-71.7-57.9000110.3
246G45Very low43.7Very low62 Ų62142.9 Ų142.964%0.63981%0.814SS**  trans16987.817200000115.8
247H47Very low43.4Very low190 Ų190143.8 Ų143.888%0.8881%0.81SS**  trans74.899.9146.6-59.6-70.9000120S249H247-S249 PolarHBondContact O-N 3.47Å
248R38.1Very low42.9Very low240 Ų240141.2 Ų141.291%0.90681%0.808SS**  trans-21.4124137.5-74.8176.1165.3-135.3-2.2113.2
249S47.6Very low42.8Very low127 Ų127141.4 Ų141.489%0.88880%0.802SS**  trans-150.6130.1142.9-82.20000109.8H247H247-S249 PolarHBondContact O-N 3.47Å
250S39.4Very low42.7Very low111 Ų111135.9 Ų135.978%0.77679%0.789SS**  trans-94.6144.3-166.2-48.20000111.6
251A40.7Very low42.4Very low96 Ų96135.5 Ų135.579%0.79378%0.778SS**  trans74.2159.2149.600000119.1
252P42Very low42.7Very low110 Ų110134.8 Ų134.871%0.71477%0.77SS**  cis-126.1149.5-2.433.5-14.8000115.4A254P252-A254 PolarHBondContact O-N 3.13Å
253T33.1Very low42.6Very low138 Ų138131.2 Ų131.285%0.84776%0.757SS**  trans12.387.8142-35.80000117.7
254A39.5Very low42.6Very low100 Ų100130 Ų13083%0.82675%0.753SS**  trans-89.9114160.900000109.1P252P252-A254 PolarHBondContact O-N 3.13Å
255Q43.2Very low42.8Very low158 Ų158128.4 Ų128.474%0.73874%0.744SS**  trans-50.1148.7172.4-66.6-108.9-4.300111.3I257Q255-I257 PolarHBondContact O-N 3.08Å
256P42.9Very low43.2Very low114 Ų114126.3 Ų126.374%0.7473%0.732SS**  trans-66.5102170.628.9-30000107.4Q258P256-Q258 VanDerWaalsContact C-N 3.3Å; P256-Q258 PolarHBondContact O-N 3.36Å
257I41.4Very low43.6Very low146 Ų146129.1 Ų129.175%0.74973%0.732SS**  trans-60.6102.4168.2-63.6173.5000105.1Q255 L259Q255-I257 PolarHBondContact O-N 3.08Å; I257-L259 HydrophobicContact CG2-CG 4.39Å; I257-L259 PolarHBondContact O-N 3.46Å
258Q43.8Very low44Very low174 Ų174123.5 Ų123.581%0.81372%0.718SS**  trans-57.294.7161.3-71.9-167.8-17.800106.2P256 S260P256-Q258 VanDerWaalsContact C-N 3.3Å; P256-Q258 PolarHBondContact O-N 3.36Å; Q258-S260 PolarHBondContact O-N 3.43Å
259L39.6Very low45Very low128 Ų128116.3 Ų116.367%0.6771%0.705SS**  trans-67.173.1162.2-87.4155.3000106.8I257 H261I257-L259 HydrophobicContact CG2-CG 4.39Å; I257-L259 PolarHBondContact O-N 3.46Å; L259-H261 PolarHBondContact O-N 3.1Å
260S42.8Very low45.4Very low93 Ų93120.3 Ų120.365%0.6570%0.7SS**  trans-65.385.4163.7540000106.6Q258 P262Q258-S260 PolarHBondContact O-N 3.43Å; S260-P262 WeakPolarHBondContact O-CD 3.44Å; S260-P262 VanDerWaalsContact O-N 3.11Å
261H42.5Very low46.3Very low122 Ų122121 Ų12157%0.56570%0.695SS**  trans-57112.6173.8-71.2-63.7000108.8L259 C263L259-H261 PolarHBondContact O-N 3.1Å; H261-C263 PolarHBondContact O-N 3.01Å
262P49.1Very low47.3Very low102 Ų102121.9 Ų121.966%0.66269%0.692SS**THydrogen-bonded Turntrans-72.24.2-178.6-13.830.1000113.3S260S260-P262 WeakPolarHBondContact O-CD 3.44Å; S260-P262 VanDerWaalsContact O-N 3.11Å
263C43.7Very low48.3Very low79 Ų79125.6 Ų125.653%0.53470%0.697SS.*THydrogen-bonded Turntrans-96.9-10.9-158.6-44.80000114.5H261H261-C263 PolarHBondContact O-N 3.01Å
264H44.1Very low49.8Very low147 Ų147124.2 Ų124.268%0.68169%0.69SS**SBendtrans-98.9-20.3-174.6-66.3-70.2000114.4
265S50Low50.9Low97 Ų97127.8 Ų127.868%0.67869%0.69SS**Hα-helixtrans-82.8-20.5-178.8-53.50000114
266L52.3Low52Low118 Ų118127 Ų12762%0.61869%0.689SS**Hα-helixtrans-87.5-16.4-175.8-72.3169.2000114.4S269L266-S269 PolarHBondContact O-OG 3.01Å
267L54Low53.2Low121 Ų121126.9 Ų126.963%0.63469%0.689SS**Hα-helixtrans-88-35.4177.9-65.6177.9000111.9S269 R270L267-S269 VanDerWaalsContact C-N 3.26Å; L267-S269 PolarHBondContact O-N 3.42Å; L267-R270 PolarHBondContact O-N 3.21Å; L267-R270 VanDerWaalsContact O-N 3.16Å
268A54.1Low54.4Low72 Ų72129.7 Ų129.760%0.59570%0.696SS**Hα-helixtrans-65.2-29.5176.400000112.6R270A268-R270 VanDerWaalsContact C-N 3.3Å; A268-R270 PolarHBondContact O-N 2.94Å
269S58.7Low55.7Low89 Ų89127 Ų12762%0.62268%0.681SS**THydrogen-bonded Turntrans-78.8-8.8176.463.80000114.3L266 L267L266-S269 PolarHBondContact O-OG 3.01Å; L267-S269 VanDerWaalsContact C-N 3.26Å; L267-S269 PolarHBondContact O-N 3.42Å
270R57.1Low57.4Low211 Ų211125 Ų12580%0.79667%0.671SS**THydrogen-bonded Turntrans-102-7.7-179.5-73.3-172172.1-147.2-1.4114L267 A268L267-R270 PolarHBondContact O-N 3.21Å; L267-R270 VanDerWaalsContact O-N 3.16Å; A268-R270 VanDerWaalsContact C-N 3.3Å; A268-R270 PolarHBondContact O-N 2.94Å
271L58.5Low58.6Low126 Ų126122.9 Ų122.966%0.6667%0.665SS**SBendtrans-73.3133.5170.9-69.4170.9000108.6K273L271-K273 PolarHBondContact O-N 3.14Å
272P60.6Low59.8Low115 Ų115123.5 Ų123.575%0.74767%0.666SS**  trans-54.1118168.5-11.822.4000106.4P274P272-P274 WeakPolarHBondContact O-CD 3.42Å
273K63.5Low60.6Low188 Ų188123.3 Ų123.382%0.81766%0.663SS**  trans-55.2112.9173.9-76176.2179.7173.30106.2L271 E275L271-K273 PolarHBondContact O-N 3.14Å; K273-E275 PolarHBondContact O-N 3.01Å
274P64.5Low61.7Low108 Ų108130.9 Ų130.970%0.70168%0.68SS**  trans-7194171.229.3-28.4000105.6P272 I276P272-P274 WeakPolarHBondContact O-CD 3.42Å; P274-I276 HydrophobicContact CB-CG1 4.41Å; P274-I276 PolarHBondContact O-N 2.68Å
275E62.9Low62.5Low175 Ų175128 Ų12882%0.81867%0.67SS**  trans-66.884.3160.5-79.1-173.117200106.3K273 P277K273-E275 PolarHBondContact O-N 3.01Å; E275-P277 WeakPolarHBondContact O-CD 3.37Å
276I66.8Low63.2Low142 Ų142129.5 Ų129.573%0.72866%0.66SS**  trans-63.3115.2166.5-60.1172.7000104.8P274 K278P274-I276 HydrophobicContact CB-CG1 4.41Å; P274-I276 PolarHBondContact O-N 2.68Å; I276-K278 PolarHBondContact O-N 2.84Å
277P67.3Low63.5Low111 Ų111127.9 Ų127.972%0.72166%0.657SS**  trans-54.2132.5177-23.934.5000108.7E275 F279E275-P277 WeakPolarHBondContact O-CD 3.37Å; P277-F279 PolarHBondContact O-N 2.86Å
278K67.5Low63.6Low206 Ų206131 Ų13190%0.89667%0.671SS**  trans-55.6114175.7-74.2-175.6-179.8-179.90108.1I276 N280I276-K278 PolarHBondContact O-N 2.84Å; K278-N280 PolarHBondContact O-N 2.97Å
279F71.2Confident63.4Low116 Ų116132.4 Ų132.451%0.50966%0.664SS.*  trans-64.6120177.5179.8-109.7000108.9P277 G281 W286P277-F279 PolarHBondContact O-N 2.86Å; F279-G281 VanDerWaalsContact C-N 3.31Å; F279-G281 PolarHBondContact O-N 2.93Å; F279-W286 AromaticContact CE2-CD1 3.82Å; F279-W286 HydrophobicContact CE2-CG 4.31Å; F279-W286 AromaticContact CZ-CD1 3.56Å; F279-W286 HydrophobicContact CZ-CD2 4.36Å; F279-W286 AromaticContact CZ-CE2 3.83Å; F279-W286 HydrophobicContact CZ-CG 4.23Å; F279-W286 HydrophobicContact CZ-CZ2 4.41Å; F279-W286 AromaticContact CZ-NE1 3.39Å
280N75Confident62.8Low86 Ų86134.1 Ų134.146%0.4666%0.664SS.*  trans-908.4-172.565.29.6000113.3K278 K282 D285K278-N280 PolarHBondContact O-N 2.97Å; N280-K282 PolarHBondContact O-N 3.24Å; N280-K282 VanDerWaalsContact OD1-CB 3.32Å; N280-K282 WeakPolarHBondContact OD1-CB 3.43Å; N280-K282 PolarHBondContact OD1-N 3.02Å; N280-D285 VanDerWaalsContact CG-OD2 3.32Å; N280-D285 PolarHBondContact ND2-OD2 2.93Å; N280-D285 PolarHBondContact OD1-OD2 3.33Å; N280-D285 VanDerWaalsContact OD1-OD2 3.11Å
281G67.1Low62.4Low50 Ų50129.8 Ų129.852%0.51566%0.662SS.*  trans72.9-2.5-178.800000115.2F279 T283F279-G281 VanDerWaalsContact C-N 3.31Å; F279-G281 PolarHBondContact O-N 2.93Å; G281-T283 PolarHBondContact O-N 3.48Å
282K67.9Low62Low135 Ų135127.4 Ų127.459%0.58766%0.656SS**  trans-76.8127.5-178.8-65-176.1-179.6177.90110.1N280 R284 D285N280-K282 PolarHBondContact O-N 3.24Å; N280-K282 VanDerWaalsContact OD1-CB 3.32Å; N280-K282 WeakPolarHBondContact OD1-CB 3.43Å; N280-K282 PolarHBondContact OD1-N 3.02Å; K282-R284 PolarHBondContact O-N 3.44Å; K282-D285 PolarHBondContact O-N 3.34Å
283T65.9Low61.7Low98 Ų98127 Ų12760%0.60164%0.642SS**THydrogen-bonded Turntrans-53.8-22.8179.5-32.20000113.8G281 W286G281-T283 PolarHBondContact O-N 3.48Å; T283-W286 VanDerWaalsContact CA-CD1 3.45Å
284R66.1Low61.1Low237 Ų237123.9 Ų123.989%0.89463%0.626SS**THydrogen-bonded Turntrans-77.3-24.2179.3-134.5179-179.4178.8-0.9113.9K282K282-R284 PolarHBondContact O-N 3.44Å
285D62.5Low60.6Low87 Ų87124.4 Ų124.447%0.46562%0.619SS.*SBendtrans-100.74.9-177.8-60.1-36.6000112.2N280 K282N280-D285 VanDerWaalsContact CG-OD2 3.32Å; N280-D285 PolarHBondContact ND2-OD2 2.93Å; N280-D285 PolarHBondContact OD1-OD2 3.33Å; N280-D285 VanDerWaalsContact OD1-OD2 3.11Å; K282-D285 PolarHBondContact O-N 3.34Å
286W63.1Low60.2Low128 Ų128119.5 Ų119.549%0.48560%0.603SS.*SBendtrans-61.2129.7166.8-78.359.4000107.8F279 T283 M288 F289F279-W286 AromaticContact CE2-CD1 3.82Å; F279-W286 HydrophobicContact CE2-CG 4.31Å; F279-W286 AromaticContact CZ-CD1 3.56Å; F279-W286 HydrophobicContact CZ-CD2 4.36Å; F279-W286 AromaticContact CZ-CE2 3.83Å; F279-W286 HydrophobicContact CZ-CG 4.23Å; F279-W286 HydrophobicContact CZ-CZ2 4.41Å; F279-W286 AromaticContact CZ-NE1 3.39Å; T283-W286 VanDerWaalsContact CA-CD1 3.45Å; W286-M288 PolarHBondContact O-N 3.22Å; W286-M288 VanDerWaalsContact O-N 3.11Å; W286-F289 HydrophobicContact CE3-CD2 4.41Å; W286-F289 HydrophobicContact CE3-CE2 4.38Å
287P60.3Low59.7Low85 Ų85114.9 Ų114.955%0.55258%0.582SS**  trans-49.9129165.34.4-4.6000106.6F289P287-F289 HydrophobicContact CB-CE2 4.36Å; P287-F289 HydrophobicContact CG-CE2 3.85Å; P287-F289 HydrophobicContact CG-CZ 4.14Å; P287-F289 WeakPolarHBondContact O-CD2 3.38Å; P287-F289 PolarHBondContact O-N 2.72Å
288M54.4Low59.1Low187 Ų187114.3 Ų114.392%0.92157%0.569SS**  trans-60.783.7174.7-81.3-173.1-65.600107.6W286 I290W286-M288 PolarHBondContact O-N 3.22Å; W286-M288 VanDerWaalsContact O-N 3.11Å; M288-I290 PolarHBondContact O-N 3.48Å
289F49.5Very low58.6Low101 Ų101109.2 Ų109.244%0.44355%0.552SS.*  trans-58.7115.4158.9-66.2-78.1000104W286 P287 T291 F293W286-F289 HydrophobicContact CE3-CD2 4.41Å; W286-F289 HydrophobicContact CE3-CE2 4.38Å; P287-F289 HydrophobicContact CB-CE2 4.36Å; P287-F289 HydrophobicContact CG-CE2 3.85Å; P287-F289 HydrophobicContact CG-CZ 4.14Å; P287-F289 WeakPolarHBondContact O-CD2 3.38Å; P287-F289 PolarHBondContact O-N 2.72Å; F289-T291 PolarHBondContact O-N 3.23Å; F289-F293 HydrophobicContact CB-CB 3.95Å; F289-F293 HydrophobicContact CB-CD1 3.52Å; F289-F293 HydrophobicContact CB-CE1 4.34Å; F289-F293 HydrophobicContact CB-CG 4.01Å; F289-F293 HydrophobicContact CD1-CD1 4.3Å; F289-F293 HydrophobicContact CD1-CE1 4.45Å; F289-F293 AromaticContact CG-CD1 3.91Å; F289-F293 HydrophobicContact CG-CD1 3.91Å; F289-F293 HydrophobicContact CG-CE1 4.25Å
290I47.5Very low58Low124 Ų124107.7 Ų107.764%0.63655%0.552SS**  trans-26.3131.9178.5-55.7167.1000108.7M288 S292 F293M288-I290 PolarHBondContact O-N 3.48Å; I290-S292 WeakPolarHBondContact CG2-OG 3.43Å; I290-S292 CarbonylContact O-C 3.57Å; I290-S292 PolarHBondContact O-N 3Å; I290-F293 WeakPolarHBondContact O-CA 3.07Å; I290-F293 WeakPolarHBondContact O-CB 3.31Å; I290-F293 PolarHBondContact O-N 3.28Å
291T48.7Very low57.1Low120 Ų120106.9 Ų106.974%0.73655%0.547SS*.Hα-helixtrans-49.4-21.5-173.5480000114.6F289 R294 Q295F289-T291 PolarHBondContact O-N 3.23Å; T291-R294 PolarHBondContact O-N 3.16Å; T291-Q295 PolarHBondContact O-N 2.95Å
292S50.4Low56.5Low77 Ų77111.7 Ų111.754%0.53856%0.556SS.*Hα-helixtrans-66.9-35.2169.145.30000115I290 Q295 S296I290-S292 WeakPolarHBondContact CG2-OG 3.43Å; I290-S292 CarbonylContact O-C 3.57Å; I290-S292 PolarHBondContact O-N 3Å; S292-Q295 PolarHBondContact O-N 2.91Å; S292-S296 WeakPolarHBondContact O-CB 3.45Å; S292-S296 PolarHBondContact O-N 3.26Å
293F53.4Low56Low106 Ų106109.6 Ų109.647%0.46556%0.558SS.*Hα-helixtrans-70.3-35.2172.8-167.7-101.8000111.5F289 I290 S296 V297F289-F293 HydrophobicContact CB-CB 3.95Å; F289-F293 HydrophobicContact CB-CD1 3.52Å; F289-F293 HydrophobicContact CB-CE1 4.34Å; F289-F293 HydrophobicContact CB-CG 4.01Å; F289-F293 HydrophobicContact CD1-CD1 4.3Å; F289-F293 HydrophobicContact CD1-CE1 4.45Å; F289-F293 AromaticContact CG-CD1 3.91Å; F289-F293 HydrophobicContact CG-CD1 3.91Å; F289-F293 HydrophobicContact CG-CE1 4.25Å; I290-F293 WeakPolarHBondContact O-CA 3.07Å; I290-F293 WeakPolarHBondContact O-CB 3.31Å; I290-F293 PolarHBondContact O-N 3.28Å; F293-S296 PolarHBondContact O-N 2.92Å; F293-V297 HydrophobicContact CD1-CG2 3.77Å; F293-V297 HydrophobicContact CD2-CG2 4.12Å; F293-V297 HydrophobicContact CE1-CG2 3.48Å; F293-V297 VanDerWaalsContact CE1-CG2 3.48Å; F293-V297 HydrophobicContact CE2-CG2 3.83Å; F293-V297 HydrophobicContact CG-CG2 4.1Å; F293-V297 HydrophobicContact CZ-CG2 3.51Å; F293-V297 VanDerWaalsContact O-CB 3.24Å; F293-V297 WeakPolarHBondContact O-CB 3.47Å; F293-V297 VanDerWaalsContact O-CG2 3.26Å; F293-V297 WeakPolarHBondContact O-CG2 3.36Å; F293-V297 PolarHBondContact O-N 3.08Å
294R51.3Low55.5Low123 Ų123107.5 Ų107.546%0.46454%0.543SS..Hα-helixtrans-60.8-45.6172-86.4-172.3169-128.71.4111.2T291 H298T291-R294 PolarHBondContact O-N 3.16Å; R294-H298 WeakPolarHBondContact O-CB 3.5Å; R294-H298 PolarHBondContact O-CD2 3.11Å; R294-H298 PolarHBondContact O-N 3.49Å
295Q53.2Low54.9Low119 Ų11999.8 Ų99.856%0.55652%0.523SS*.Hα-helixtrans-67.2-44.4179.2-152.267.547.400112.1T291 S292 V297 H298 D299T291-Q295 PolarHBondContact O-N 2.95Å; S292-Q295 PolarHBondContact O-N 2.91Å; Q295-V297 VanDerWaalsContact C-N 3.35Å; Q295-V297 PolarHBondContact O-N 3.32Å; Q295-H298 PolarHBondContact O-N 3.45Å; Q295-D299 WeakPolarHBondContact O-CB 3.23Å; Q295-D299 PolarHBondContact O-N 3.27Å
296S55.7Low54.5Low71 Ų71102.2 Ų102.250%0.49754%0.536SS..Hα-helixtrans-65.2-33.4178.51670000113.8S292 F293 V300S292-S296 WeakPolarHBondContact O-CB 3.45Å; S292-S296 PolarHBondContact O-N 3.26Å; F293-S296 PolarHBondContact O-N 2.92Å; S296-V300 VanDerWaalsContact O-CG2 3.26Å; S296-V300 WeakPolarHBondContact O-CG2 3.43Å
297V56.4Low54Low46 Ų46104.6 Ų104.628%0.27955%0.545SS..Hα-helixtrans-85-33.7177.5174.30000110.9F293 Q295 V300 L301F293-V297 HydrophobicContact CD1-CG2 3.77Å; F293-V297 HydrophobicContact CD2-CG2 4.12Å; F293-V297 HydrophobicContact CE1-CG2 3.48Å; F293-V297 VanDerWaalsContact CE1-CG2 3.48Å; F293-V297 HydrophobicContact CE2-CG2 3.83Å; F293-V297 HydrophobicContact CG-CG2 4.1Å; F293-V297 HydrophobicContact CZ-CG2 3.51Å; F293-V297 VanDerWaalsContact O-CB 3.24Å; F293-V297 WeakPolarHBondContact O-CB 3.47Å; F293-V297 VanDerWaalsContact O-CG2 3.26Å; F293-V297 WeakPolarHBondContact O-CG2 3.36Å; F293-V297 PolarHBondContact O-N 3.08Å; Q295-V297 VanDerWaalsContact C-N 3.35Å; Q295-V297 PolarHBondContact O-N 3.32Å; V297-V300 PolarHBondContact O-N 3.14Å; V297-L301 HydrophobicContact CG1-CD1 3.3Å; V297-L301 HydrophobicContact CG1-CG 3.71Å; V297-L301 WeakPolarHBondContact O-CB 3.28Å; V297-L301 WeakPolarHBondContact O-CG 3.36Å; V297-L301 PolarHBondContact O-N 3.15Å
298H54.3Low53.8Low99 Ų99104.8 Ų104.846%0.45854%0.541SS..Hα-helixtrans-64.3-42.6172.2-81.6-66.5000111.6R294 Q295 V300 L301 E302R294-H298 WeakPolarHBondContact O-CB 3.5Å; R294-H298 PolarHBondContact O-CD2 3.11Å; R294-H298 PolarHBondContact O-N 3.49Å; Q295-H298 PolarHBondContact O-N 3.45Å; H298-V300 VanDerWaalsContact C-N 3.27Å; H298-V300 PolarHBondContact O-N 3.07Å; H298-L301 PolarHBondContact O-N 2.89Å; H298-E302 WeakPolarHBondContact O-CB 3.37Å; H298-E302 PolarHBondContact O-N 2.99Å
299D57.7Low53.6Low98 Ų98102.5 Ų102.552%0.52453%0.532SS..Hα-helixtrans-65.4-29.6178.9-65.2-15.8000112.8Q295 S303Q295-D299 WeakPolarHBondContact O-CB 3.23Å; Q295-D299 PolarHBondContact O-N 3.27Å; D299-S303 PolarHBondContact O-OG 2.85Å
300V57.7Low53.8Low84 Ų84104.5 Ų104.551%0.50955%0.546SS..Hα-helixtrans-84.7-37.3176.6175.60000111.9S296 V297 H298 S303 D304S296-V300 VanDerWaalsContact O-CG2 3.26Å; S296-V300 WeakPolarHBondContact O-CG2 3.43Å; V297-V300 PolarHBondContact O-N 3.14Å; H298-V300 VanDerWaalsContact C-N 3.27Å; H298-V300 PolarHBondContact O-N 3.07Å; V300-S303 PolarHBondContact O-OG 3.31Å; V300-S303 VanDerWaalsContact O-OG 3.09Å; V300-D304 PolarHBondContact O-N 2.87Å
301L56.1Low53.7Low70 Ų70108.3 Ų108.337%0.36657%0.567SS.*Hα-helixtrans-84.3-19.9-178.2-65.5-175.1000113.6V297 H298 S303 D304 T305 L308V297-L301 HydrophobicContact CG1-CD1 3.3Å; V297-L301 HydrophobicContact CG1-CG 3.71Å; V297-L301 WeakPolarHBondContact O-CB 3.28Å; V297-L301 WeakPolarHBondContact O-CG 3.36Å; V297-L301 PolarHBondContact O-N 3.15Å; H298-L301 PolarHBondContact O-N 2.89Å; L301-S303 VanDerWaalsContact C-N 3.31Å; L301-D304 CarbonylContact O-C 3.55Å; L301-D304 PolarHBondContact O-N 3.36Å; L301-T305 WeakPolarHBondContact O-CA 3.29Å; L301-T305 WeakPolarHBondContact O-CB 3.47Å; L301-T305 PolarHBondContact O-N 3.01Å; L301-T305 PolarHBondContact O-OG1 2.85Å; L301-L308 HydrophobicContact CD2-CD1 3.46Å; L301-L308 VanDerWaalsContact CD2-CD1 3.46Å
302E55.2Low53.9Low151 Ų151107.8 Ų107.871%0.70656%0.558SS**THydrogen-bonded Turntrans-77.2-20.2176.1-162.1157.9-148.300111.9H298 T305H298-E302 WeakPolarHBondContact O-CB 3.37Å; H298-E302 PolarHBondContact O-N 2.99Å; E302-T305 WeakPolarHBondContact CA-OG1 3.28Å; E302-T305 PolarHBondContact O-OG1 2.8Å
303S56.7Low54.1Low90 Ų90109.4 Ų109.463%0.62956%0.559SS**THydrogen-bonded Turntrans-88.7-22.416949.10000113.6D299 V300 L301D299-S303 PolarHBondContact O-OG 2.85Å; V300-S303 PolarHBondContact O-OG 3.31Å; V300-S303 VanDerWaalsContact O-OG 3.09Å; L301-S303 VanDerWaalsContact C-N 3.31Å
304D55.1Low54.1Low54 Ų54109.6 Ų109.629%0.28957%0.565SS.*SBendtrans-109.710.8-179.3-87.3-19.7000114V300 L301 D306 R307 L308V300-D304 PolarHBondContact O-N 2.87Å; L301-D304 CarbonylContact O-C 3.55Å; L301-D304 PolarHBondContact O-N 3.36Å; D304-D306 PolarHBondContact O-N 2.89Å; D304-R307 HydrophobicContact CB-CB 4.5Å; D304-R307 WeakPolarHBondContact O-CA 3.49Å; D304-R307 PolarHBondContact O-N 2.78Å; D304-R307 WeakPolarHBondContact OD1-CD 3.08Å; D304-R307 IonicContact OD1-NH1 3.49Å; D304-L308 PolarHBondContact O-N 3.23Å
305T52.9Low54.3Low75 Ų75108.8 Ų108.846%0.4657%0.571SS.*Hα-helixtrans-63-28.8-178.8-14.70000112L301 E302L301-T305 WeakPolarHBondContact O-CA 3.29Å; L301-T305 WeakPolarHBondContact O-CB 3.47Å; L301-T305 PolarHBondContact O-N 3.01Å; L301-T305 PolarHBondContact O-OG1 2.85Å; E302-T305 WeakPolarHBondContact CA-OG1 3.28Å; E302-T305 PolarHBondContact O-OG1 2.8Å
306D55.9Low54.4Low139 Ų139108.1 Ų108.174%0.74357%0.571SS**Hα-helixtrans-74.3-24.3172.1-72.9-20.4000113.1D304D304-D306 PolarHBondContact O-N 2.89Å
307R52.3Low54.3Low178 Ų178110.6 Ų110.667%0.67258%0.576SS**Hα-helixtrans-89.7-26.3-179.5-63.1-178.590.8-166.13.6112.9D304D304-R307 HydrophobicContact CB-CB 4.5Å; D304-R307 WeakPolarHBondContact O-CA 3.49Å; D304-R307 PolarHBondContact O-N 2.78Å; D304-R307 WeakPolarHBondContact OD1-CD 3.08Å; D304-R307 IonicContact OD1-NH1 3.49Å
308L55.4Low54.1Low88 Ų88115.2 Ų115.246%0.46160%0.598SS.*Hα-helixtrans-81.1-16.1176.3-85.1158.3000114.1L301 D304 I310 L311L301-L308 HydrophobicContact CD2-CD1 3.46Å; L301-L308 VanDerWaalsContact CD2-CD1 3.46Å; D304-L308 PolarHBondContact O-N 3.23Å; L308-I310 PolarHBondContact O-N 3.46Å; L308-L311 HydrophobicContact CD2-CD1 4.42Å
309N49.7Very low54.1Low139 Ų139116.5 Ų116.574%0.74361%0.608SS**THydrogen-bonded Turntrans-75.3-1.2170.7-84.2-28.2000113.7
310I54.1Low53.8Low143 Ų143118 Ų11873%0.73362%0.615SS**THydrogen-bonded Turntrans-100.2-11.3-179.7-60.3174.1000112L308L308-I310 PolarHBondContact O-N 3.46Å
311L44.8Very low53.5Low205 Ų205121.1 Ų121.1100%1.07363%0.625SS**  trans-98.10175.1-75.7169.1000111.5L308L308-L311 HydrophobicContact CD2-CD1 4.42Å

Retrieved 311 of 311 residues in 62.3 ms (Link to these results)