A0A087WXZ5_HUMAN Loading...

ANTXR like

AlphaFold DB , UniProt , Accession A0A087WXZ5, Species HUMAN (Homo sapiens, Human), Gene ANTXRL, Length 257 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
1M72.2Confident84Confident89 Ų8960.4 Ų60.444%0.43830%0.296SS..  0148.30179.6176.8-62.700109.1V3 E4 E5 Q47M1-V3 VanDerWaalsContact C-N 3.35Å; M1-V3 PolarHBondContact O-N 3.19Å; M1-E4 HydrophobicContact CB-CB 4.02Å; M1-E4 PolarHBondContact N-OE2 3.45Å; M1-E4 WeakPolarHBondContact O-CB 3.42Å; M1-E4 PolarHBondContact O-N 3.37Å; M1-E5 PolarHBondContact O-N 3.48Å; M1-Q47 HydrophobicContact CE-CB 3.63Å; M1-Q47 HydrophobicContact CE-CG 3.29Å; M1-Q47 HydrophobicContact SD-CG 4Å
2W84.3Confident83.4Confident27 Ų2760 Ų6010%0.10230%0.304CS..Hα-helixtrans-59.9-41.6-175-178.888.7000113.7E4 E5 T6 I82 M84 L114 L144 T147 I148 L151W2-E4 VanDerWaalsContact C-N 3.35Å; W2-E4 PolarHBondContact O-N 3.23Å; W2-E5 PolarHBondContact O-N 2Å; W2-T6 HydrophobicContact CH2-CG2 4.22Å; W2-T6 HydrophobicContact CZ3-CG2 4.47Å; W2-T6 WeakPolarHBondContact O-CB 3.25Å; W2-T6 PolarHBondContact O-N 3.2Å; W2-T6 PolarHBondContact O-OG1 2.83Å; W2-I82 HydrophobicContact CH2-CG2 4.03Å; W2-M84 HydrophobicContact CD2-CE 4.44Å; W2-M84 HydrophobicContact CE3-CE 3.88Å; W2-M84 HydrophobicContact CE3-SD 3.57Å; W2-M84 VanDerWaalsContact CE3-SD 3.57Å; W2-M84 HydrophobicContact CH2-SD 4.34Å; W2-M84 HydrophobicContact CZ3-CE 4.27Å; W2-M84 HydrophobicContact CZ3-SD 3.42Å; W2-M84 WeakPolarHBondContact CZ3-SD 3.48Å; W2-L114 HydrophobicContact CD2-CD2 4.1Å; W2-L114 HydrophobicContact CE3-CD2 4.24Å; W2-L114 HydrophobicContact CH2-CD2 3.71Å; W2-L114 HydrophobicContact CZ2-CD2 3.49Å; W2-L114 VanDerWaalsContact CZ2-CD2 3.49Å; W2-L114 HydrophobicContact CZ3-CD2 4.07Å; W2-L144 HydrophobicContact CB-CD2 3.5Å; W2-L144 VanDerWaalsContact CB-CD2 3.5Å; W2-L144 HydrophobicContact CB-CG 4.24Å; W2-L144 HydrophobicContact CD2-CD2 3.98Å; W2-L144 HydrophobicContact CD2-CG 4.2Å; W2-L144 HydrophobicContact CG-CB 4.3Å; W2-L144 HydrophobicContact CG-CD2 3.34Å; W2-L144 HydrophobicContact CG-CG 3.63Å; W2-L144 PolarHBondContact NE1-O 3.1Å; W2-T147 PolarHBondContact NE1-OG1 3.45Å; W2-I148 HydrophobicContact CG-CD1 4.38Å; W2-I148 HydrophobicContact CG-CG1 4.48Å; W2-I148 HydrophobicContact CZ2-CG1 4.5Å; W2-L151 HydrophobicContact CH2-CD2 3.82Å; W2-L151 HydrophobicContact CZ2-CD2 3.87Å
3V88.4Confident82.5Confident36 Ų3663.7 Ų63.722%0.21833%0.334CS..Hα-helixtrans-61.5-45.2176.6-177.90000110.6M1 T6 V7 F19 L43 L46 M84M1-V3 VanDerWaalsContact C-N 3.35Å; M1-V3 PolarHBondContact O-N 3.19Å; V3-T6 WeakPolarHBondContact O-CB 3.42Å; V3-T6 PolarHBondContact O-N 3.11Å; V3-V7 HydrophobicContact CG1-CG2 4.41Å; V3-V7 WeakPolarHBondContact O-CB 2.99Å; V3-V7 VanDerWaalsContact O-CG2 3.23Å; V3-V7 WeakPolarHBondContact O-CG2 3.47Å; V3-V7 PolarHBondContact O-N 2.85Å; V3-F19 HydrophobicContact CG1-CD1 4.44Å; V3-F19 HydrophobicContact CG1-CE1 4.17Å; V3-L43 HydrophobicContact CB-CD2 4.4Å; V3-L43 HydrophobicContact CG1-CD2 3.83Å; V3-L46 HydrophobicContact CG1-CD1 4.09Å; V3-M84 HydrophobicContact CG2-SD 4.41Å
4E89.4Confident82.1Confident86 Ų8669.5 Ų69.540%0.40237%0.366SS..Hα-helixtrans-60.9-44.9177176.2-175.6-156.300112.5M1 W2 T6 V7 A8 L43M1-E4 HydrophobicContact CB-CB 4.02Å; M1-E4 PolarHBondContact N-OE2 3.45Å; M1-E4 WeakPolarHBondContact O-CB 3.42Å; M1-E4 PolarHBondContact O-N 3.37Å; W2-E4 VanDerWaalsContact C-N 3.35Å; W2-E4 PolarHBondContact O-N 3.23Å; E4-T6 VanDerWaalsContact C-N 3.32Å; E4-T6 PolarHBondContact O-N 3.05Å; E4-V7 PolarHBondContact O-N 2.79Å; E4-A8 WeakPolarHBondContact O-CB 2.74Å; E4-A8 PolarHBondContact O-N 2.93Å; E4-L43 HydrophobicContact CB-CD1 4.25Å; E4-L43 HydrophobicContact CB-CD2 4.23Å; E4-L43 HydrophobicContact CG-CD1 4.22Å
5E87.3Confident82.2Confident53 Ų5368.8 Ų68.825%0.24836%0.362CS..Hα-helixtrans-64.5-38.1176.2-71.1177.5-155.400111.4M1 W2 A8 R9 R145 I148M1-E5 PolarHBondContact O-N 3.48Å; W2-E5 PolarHBondContact O-N 2Å; E5-A8 PolarHBondContact O-N 2.94Å; E5-R9 PolarHBondContact O-N 3.25Å; E5-R145 IonicContact OE1-CZ 3.26Å; E5-R145 VanDerWaalsContact OE1-CZ 3.26Å; E5-R145 IonicContact OE1-NE 3.52Å; E5-R145 PolarHBondContact OE1-NE 3.42Å; E5-R145 IonicContact OE1-NH2 2.76Å; E5-R145 PolarHBondContact OE1-NH2 3.33Å; E5-R145 WeakPolarHBondContact OE2-CG 3.48Å; E5-R145 IonicContact OE2-NE 2.94Å; E5-R145 PolarHBondContact OE2-NE 3.33Å; E5-R145 VanDerWaalsContact OE2-NE 3.17Å; E5-I148 HydrophobicContact CB-CD1 3.46Å; E5-I148 VanDerWaalsContact CB-CD1 3.46Å; E5-I148 HydrophobicContact CG-CD1 4.49Å; E5-I148 WeakPolarHBondContact OE2-CD1 3.28Å
6T87.6Confident82.7Confident9 Ų972.2 Ų72.26%0.05537%0.368CS..Hα-helixtrans-64.5-47.1175.4-58.80000111.1W2 V3 E4 A8 R9 F10 L151W2-T6 HydrophobicContact CH2-CG2 4.22Å; W2-T6 HydrophobicContact CZ3-CG2 4.47Å; W2-T6 WeakPolarHBondContact O-CB 3.25Å; W2-T6 PolarHBondContact O-N 3.2Å; W2-T6 PolarHBondContact O-OG1 2.83Å; V3-T6 WeakPolarHBondContact O-CB 3.42Å; V3-T6 PolarHBondContact O-N 3.11Å; E4-T6 VanDerWaalsContact C-N 3.32Å; E4-T6 PolarHBondContact O-N 3.05Å; T6-A8 PolarHBondContact O-N 3.42Å; T6-R9 WeakPolarHBondContact O-CB 3.43Å; T6-R9 PolarHBondContact O-N 2.77Å; T6-F10 HydrophobicContact CG2-CD2 3.97Å; T6-F10 HydrophobicContact CG2-CE2 3.63Å; T6-F10 WeakPolarHBondContact O-CD2 3.07Å; T6-F10 PolarHBondContact O-N 3.29Å; T6-L151 HydrophobicContact CG2-CD2 4.03Å
7V90.1Very high83.3Confident24 Ų2469.5 Ų69.515%0.14535%0.354CS..Hα-helixtrans-58.2-39.6175.6166.40000111.2V3 E4 R9 F10 M17 F19 I39 L43V3-V7 HydrophobicContact CG1-CG2 4.41Å; V3-V7 WeakPolarHBondContact O-CB 2.99Å; V3-V7 VanDerWaalsContact O-CG2 3.23Å; V3-V7 WeakPolarHBondContact O-CG2 3.47Å; V3-V7 PolarHBondContact O-N 2.85Å; E4-V7 PolarHBondContact O-N 2.79Å; V7-R9 PolarHBondContact O-N 2.92Å; V7-F10 PolarHBondContact O-N 2.91Å; V7-F10 VanDerWaalsContact O-N 3.09Å; V7-M17 HydrophobicContact CB-SD 4.16Å; V7-M17 HydrophobicContact CG1-CE 4.03Å; V7-M17 HydrophobicContact CG1-SD 3.63Å; V7-M17 HydrophobicContact CG2-CE 4.49Å; V7-M17 HydrophobicContact CG2-SD 3.6Å; V7-F19 HydrophobicContact CG2-CE1 3.84Å; V7-F19 HydrophobicContact CG2-CZ 3.75Å; V7-I39 HydrophobicContact CG1-CG2 3.63Å; V7-L43 HydrophobicContact CB-CD1 4.44Å; V7-L43 HydrophobicContact CG1-CD1 4.2Å; V7-L43 HydrophobicContact CG2-CD2 4.26Å
8A87.9Confident84Confident51 Ų5167.8 Ų67.842%0.42135%0.349SS..Hα-helixtrans-64.8-20.1177.300000113.6E4 E5 T6 Q11E4-A8 WeakPolarHBondContact O-CB 2.74Å; E4-A8 PolarHBondContact O-N 2.93Å; E5-A8 PolarHBondContact O-N 2.94Å; T6-A8 PolarHBondContact O-N 3.42Å; A8-Q11 WeakPolarHBondContact O-CG 3.18Å; A8-Q11 PolarHBondContact O-NE2 2.78Å
9R83.6Confident84.7Confident134 Ų13465 Ų6551%0.50633%0.334SS..Hα-helixtrans-82.9-26.2172.5-61.1-59.4-172.5132.214.7112.9E5 T6 V7 Q11 I148 D149 T152E5-R9 PolarHBondContact O-N 3.25Å; T6-R9 WeakPolarHBondContact O-CB 3.43Å; T6-R9 PolarHBondContact O-N 2.77Å; V7-R9 PolarHBondContact O-N 2.92Å; R9-Q11 PolarHBondContact O-N 2.82Å; R9-I148 HydrophobicContact CG-CG2 3.78Å; R9-D149 IonicContact CZ-OD1 2.79Å; R9-D149 IonicContact NH1-OD1 3.17Å; R9-D149 IonicContact NH2-OD1 3.7Å; R9-D149 PolarHBondContact NH2-OD1 3.1Å; R9-T152 HydrophobicContact CB-CG2 4.26Å
10F81.4Confident85.3Confident25 Ų2564 Ų6411%0.1133%0.328CS..  trans-98.666-178.4-65.2-65.1000112.4T6 V7 I15 M17 V155T6-F10 HydrophobicContact CG2-CD2 3.97Å; T6-F10 HydrophobicContact CG2-CE2 3.63Å; T6-F10 WeakPolarHBondContact O-CD2 3.07Å; T6-F10 PolarHBondContact O-N 3.29Å; V7-F10 PolarHBondContact O-N 2.91Å; V7-F10 VanDerWaalsContact O-N 3.09Å; F10-I15 HydrophobicContact CB-CD1 3.96Å; F10-I15 HydrophobicContact CB-CG2 4.37Å; F10-I15 HydrophobicContact CD1-CD1 3.91Å; F10-I15 HydrophobicContact CG-CD1 4.39Å; F10-M17 HydrophobicContact CB-CE 4.45Å; F10-V155 HydrophobicContact CD1-CG1 4.44Å; F10-V155 HydrophobicContact CE1-CB 3.94Å; F10-V155 HydrophobicContact CE1-CG1 3.36Å; F10-V155 HydrophobicContact CZ-CB 3.82Å; F10-V155 HydrophobicContact CZ-CG1 3.56Å; F10-V155 HydrophobicContact CZ-CG2 4.25Å
11Q72.1Confident85.7Confident130 Ų13062.1 Ų62.161%0.60732%0.32SS*.  trans-94.51.3-174.7-56-160.56.200115.7A8 R9A8-Q11 WeakPolarHBondContact O-CG 3.18Å; A8-Q11 PolarHBondContact O-NE2 2.78Å; R9-Q11 PolarHBondContact O-N 2.82Å
12S76.7Confident86.8Confident56 Ų5659.9 Ų59.939%0.39231%0.307SS..  trans-60.7134.9-179.5173.40000110.9N14 I15S12-N14 PolarHBondContact O-N 2.77Å; S12-N14 VanDerWaalsContact O-N 3.09Å; S12-N14 PolarHBondContact OG-N 2.76Å; S12-I15 WeakPolarHBondContact O-CB 3.34Å; S12-I15 PolarHBondContact O-N 3.01Å
13P72.1Confident87.1Confident108 Ų10860 Ų6070%0.70131%0.312SS*.THydrogen-bonded Turntrans-63.2-18.2179.527.5-35.6000112.9I15P13-I15 VanDerWaalsContact C-N 3.33Å
14N76.1Confident87.1Confident145 Ų14561 Ų6178%0.77532%0.318SS*.THydrogen-bonded Turntrans-84.4-8.6177.9-63.2-32.5000112.8S12S12-N14 PolarHBondContact O-N 2.77Å; S12-N14 VanDerWaalsContact O-N 3.09Å; S12-N14 PolarHBondContact OG-N 2.76Å
15I83.9Confident87.2Confident59 Ų5962.8 Ų62.830%0.30333%0.331SS..  trans-88.5135.5177-65.2174.3000109.3F10 S12 P13 M17 S34F10-I15 HydrophobicContact CB-CD1 3.96Å; F10-I15 HydrophobicContact CB-CG2 4.37Å; F10-I15 HydrophobicContact CD1-CD1 3.91Å; F10-I15 HydrophobicContact CG-CD1 4.39Å; S12-I15 WeakPolarHBondContact O-CB 3.34Å; S12-I15 PolarHBondContact O-N 3.01Å; P13-I15 VanDerWaalsContact C-N 3.33Å; I15-M17 HydrophobicContact CG2-CE 4.38Å; I15-S34 WeakPolarHBondContact O-CB 2.81Å
16R90.3Very high87.5Confident123 Ų12361 Ų6146%0.46433%0.327SS..  trans-119.6146.5167.5-54.3175.6-165.1130.34.6108L32 T33R16-L32 HydrophobicContact CB-CD1 4.19Å; R16-L32 HydrophobicContact CB-CD2 4.17Å; R16-L32 HydrophobicContact CB-CG 3.79Å; R16-T33 VanDerWaalsContact CA-O 3.3Å; R16-T33 WeakPolarHBondContact CA-O 3.45Å
17M93.3Very high87.9Confident27 Ų2766 Ų6613%0.13335%0.349CS..EExtended strand (participates in β ladder)trans-136.8151-18062.9-171.670.200111.1V7 F10 I15 F19 L32 T33 I39V7-M17 HydrophobicContact CB-SD 4.16Å; V7-M17 HydrophobicContact CG1-CE 4.03Å; V7-M17 HydrophobicContact CG1-SD 3.63Å; V7-M17 HydrophobicContact CG2-CE 4.49Å; V7-M17 HydrophobicContact CG2-SD 3.6Å; F10-M17 HydrophobicContact CB-CE 4.45Å; I15-M17 HydrophobicContact CG2-CE 4.38Å; M17-F19 HydrophobicContact CG-CE1 4.36Å; M17-F19 HydrophobicContact SD-CE1 4.16Å; M17-F19 HydrophobicContact SD-CZ 4.08Å; M17-L32 WeakPolarHBondContact O-CA 3.35Å; M17-T33 PolarHBondContact N-O 3.31Å; M17-T33 PolarHBondContact O-N 3.06Å; M17-I39 HydrophobicContact CE-CD1 4.1Å; M17-I39 HydrophobicContact CG-CD1 3.79Å; M17-I39 HydrophobicContact CG-CG1 3.82Å; M17-I39 HydrophobicContact CG-CG2 4.47Å; M17-I39 HydrophobicContact SD-CB 4.46Å; M17-I39 HydrophobicContact SD-CD1 3.82Å; M17-I39 HydrophobicContact SD-CG1 3.97Å; M17-I39 HydrophobicContact SD-CG2 3.62Å
18C95.2Very high88.2Confident38 Ų3866.6 Ų66.626%0.25735%0.353SS..EExtended strand (participates in β ladder)trans-128.2153.2173.361.80000108.3L30 L32 Q67C18-L30 CarbonylContact C-O 3.48Å; C18-L30 WeakPolarHBondContact CA-O 3.41Å; C18-L30 WeakPolarHBondContact CB-O 3.37Å; C18-L32 HydrophobicContact CB-CB 4.14Å; C18-L32 HydrophobicContact CB-CD1 3.97Å; C18-Q67 HydrophobicContact CB-CG 4.36Å
19F96.8Very high88.6Confident15 Ų1564.9 Ų64.97%0.06634%0.337CS..EExtended strand (participates in β ladder)trans-116.4129.1173.8-57.1-33000109.4V3 V7 M17 T28 V29 L30 I39 L43 L46V3-F19 HydrophobicContact CG1-CD1 4.44Å; V3-F19 HydrophobicContact CG1-CE1 4.17Å; V7-F19 HydrophobicContact CG2-CE1 3.84Å; V7-F19 HydrophobicContact CG2-CZ 3.75Å; M17-F19 HydrophobicContact CG-CE1 4.36Å; M17-F19 HydrophobicContact SD-CE1 4.16Å; M17-F19 HydrophobicContact SD-CZ 4.08Å; F19-T28 CarbonylContact O-C 3.53Å; F19-V29 HydrophobicContact CB-CB 4.25Å; F19-V29 PolarHBondContact O-N 3.38Å; F19-L30 HydrophobicContact CB-CB 3.87Å; F19-L30 HydrophobicContact CD2-CB 3.66Å; F19-L30 HydrophobicContact CD2-CD2 3.58Å; F19-L30 HydrophobicContact CD2-CG 4.28Å; F19-L30 HydrophobicContact CE2-CB 4.42Å; F19-L30 HydrophobicContact CE2-CD2 3.49Å; F19-L30 VanDerWaalsContact CE2-CD2 3.49Å; F19-L30 HydrophobicContact CG-CB 3.96Å; F19-L30 HydrophobicContact CG-CD2 4.13Å; F19-L30 HydrophobicContact CZ-CD2 3.97Å; F19-L30 PolarHBondContact N-O 2.82Å; F19-L30 PolarHBondContact O-N 3.49Å; F19-L30 VanDerWaalsContact O-N 3.11Å; F19-I39 HydrophobicContact CZ-CG2 4.14Å; F19-L43 HydrophobicContact CE2-CD2 3.76Å; F19-L43 HydrophobicContact CE2-CG 3.72Å; F19-L43 HydrophobicContact CZ-CD2 3.7Å; F19-L43 HydrophobicContact CZ-CG 3.92Å; F19-L46 HydrophobicContact CB-CD1 3.78Å; F19-L46 HydrophobicContact CB-CD2 4.2Å; F19-L46 HydrophobicContact CB-CG 4.17Å; F19-L46 HydrophobicContact CD1-CD1 4.18Å; F19-L46 HydrophobicContact CD2-CD1 3.51Å; F19-L46 HydrophobicContact CD2-CG 4.15Å; F19-L46 HydrophobicContact CE2-CD1 4.16Å; F19-L46 HydrophobicContact CG-CD1 3.56Å; F19-L46 HydrophobicContact CG-CG 4.34Å
20I96.8Very high89.2Confident44 Ų4458.8 Ų58.823%0.22632%0.315CS..EExtended strand (participates in β ladder)trans-130.7129.3-177.4-64.2165.5000107.1Q27 T28 K63 A64 Q67I20-Q27 CarbonylContact C-O 3.51Å; I20-Q27 VanDerWaalsContact CA-O 3.26Å; I20-Q27 WeakPolarHBondContact CA-O 3.31Å; I20-T28 HydrophobicContact CG1-CG2 4.47Å; I20-K63 HydrophobicContact CD1-CB 3.88Å; I20-K63 HydrophobicContact CG1-CB 4.2Å; I20-K63 HydrophobicContact CG2-CB 3.78Å; I20-K63 HydrophobicContact CG2-CG 4.34Å; I20-A64 VanDerWaalsContact CD1-CA 3.47Å; I20-A64 HydrophobicContact CD1-CB 3.81Å; I20-Q67 HydrophobicContact CD1-CG 4.49Å
21T95.2Very high89.8Confident26 Ų2660.3 Ų60.316%0.1633%0.327CS..EExtended strand (participates in β ladder)trans-107.3155.7169.454.60000108.9G26 Q27 V29 L46 I49T21-G26 WeakPolarHBondContact O-CA 3.2Å; T21-Q27 PolarHBondContact N-O 2.96Å; T21-Q27 PolarHBondContact O-N 2.94Å; T21-V29 HydrophobicContact CG2-CG2 3.87Å; T21-L46 HydrophobicContact CG2-CD2 3.58Å; T21-I49 HydrophobicContact CG2-CD1 4.14Å; T21-I49 HydrophobicContact CG2-CG2 4.34Å
22Y94Very high90.8Very high42 Ų4255.8 Ų55.817%0.16531%0.307CS..EExtended strand (participates in β ladder)trans-142.6146.4171.969.6-91.4000110.1D25 T55 F56 M57 M84Y22-D25 VanDerWaalsContact CA-O 3.31Å; Y22-D25 WeakPolarHBondContact CA-O 3.31Å; Y22-T55 HydrophobicContact CE2-CG2 3.79Å; Y22-F56 VanDerWaalsContact CD2-C 3.48Å; Y22-M57 HydrophobicContact CD2-CB 4.39Å; Y22-M57 HydrophobicContact CE1-CB 4.37Å; Y22-M57 HydrophobicContact CE1-CG 4.04Å; Y22-M57 VanDerWaalsContact CE2-CA 3.48Å; Y22-M57 HydrophobicContact CE2-CB 3.83Å; Y22-M57 HydrophobicContact CE2-CG 4.38Å; Y22-M57 WeakPolarHBondContact OH-CE 3.34Å; Y22-M84 PolarHBondContact OH-O 3.24Å
23S90.4Very high91.6Very high28 Ų2853.8 Ų53.820%0.19629%0.292CS..SBendtrans-137.7-114.9159.262.30000106.6D25 D52 H54 F56S23-D25 VanDerWaalsContact C-N 3.25Å; S23-D25 PolarHBondContact N-O 2.69Å; S23-D52 WeakPolarHBondContact CB-O 3.25Å; S23-D52 PolarHBondContact OG-O 3.43Å; S23-H54 CarbonylContact C-O 3.55Å; S23-H54 WeakPolarHBondContact CA-O 3.49Å; S23-F56 WeakPolarHBondContact O-CA 3.49Å; S23-F56 WeakPolarHBondContact O-CB 3.49Å; S23-F56 PolarHBondContact O-N 2.81Å
24T89.6Confident92.5Very high57 Ų5751.6 Ų51.635%0.3528%0.28SS..SBendtrans-63.1-36.7167.6-55.50000110.8H54 F56T24-H54 PolarHBondContact N-O 3.08Å; T24-H54 PolarHBondContact OG1-N 3.11Å; T24-H54 VanDerWaalsContact OG1-N 3.16Å; T24-F56 HydrophobicContact CG2-CD2 4.19Å; T24-F56 HydrophobicContact CG2-CE2 4.05Å; T24-F56 WeakPolarHBondContact O-CD2 3.37Å
25D90.9Very high93.3Very high125 Ų12548 Ų4867%0.66826%0.261SS*.SBendtrans-118.4158.4176.6-68.8-65.5000111.1Y22 S23Y22-D25 VanDerWaalsContact CA-O 3.31Å; Y22-D25 WeakPolarHBondContact CA-O 3.31Å; S23-D25 VanDerWaalsContact C-N 3.25Å; S23-D25 PolarHBondContact N-O 2.69Å
26G93.9Very high93.7Very high16 Ų1652.2 Ų52.217%0.16528%0.277CS..EExtended strand (participates in β ladder)trans-100.2136.6175.100000111T21 K63T21-G26 WeakPolarHBondContact O-CA 3.2Å; G26-K63 WeakPolarHBondContact O-CE 3.39Å
27Q94.7Very high93.9Very high113 Ų11351.9 Ų51.953%0.52828%0.284SS..EExtended strand (participates in β ladder)trans-128.5131.2178.1-175.5179.91.500111.1I20 T21 V29I20-Q27 CarbonylContact C-O 3.51Å; I20-Q27 VanDerWaalsContact CA-O 3.26Å; I20-Q27 WeakPolarHBondContact CA-O 3.31Å; T21-Q27 PolarHBondContact N-O 2.96Å; T21-Q27 PolarHBondContact O-N 2.94Å; Q27-V29 PolarHBondContact O-N 3.4Å
28T96.5Very high94.1Very high37 Ų3755.8 Ų55.823%0.22730%0.297CS..EExtended strand (participates in β ladder)trans-85.8100.6169-54.80000108.8F19 I20 P31 Q67F19-T28 CarbonylContact O-C 3.53Å; I20-T28 HydrophobicContact CG1-CG2 4.47Å; T28-P31 HydrophobicContact CG2-CB 4.49Å; T28-P31 HydrophobicContact CG2-CG 4.29Å; T28-Q67 HydrophobicContact CG2-CG 4.48Å
29V96.1Very high94Very high14 Ų1454.7 Ų54.79%0.08529%0.289CS..EExtended strand (participates in β ladder)trans-72.3-41.8177.9179.50000110.6F19 T21 Q27 Q45 L46 I49F19-V29 HydrophobicContact CB-CB 4.25Å; F19-V29 PolarHBondContact O-N 3.38Å; T21-V29 HydrophobicContact CG2-CG2 3.87Å; Q27-V29 PolarHBondContact O-N 3.4Å; V29-Q45 HydrophobicContact CG1-CB 3.8Å; V29-L46 HydrophobicContact CB-CD2 4.23Å; V29-L46 HydrophobicContact CG1-CD2 4.19Å; V29-L46 HydrophobicContact CG1-CG 4.24Å; V29-L46 HydrophobicContact CG2-CD2 4.03Å; V29-I49 HydrophobicContact CB-CD1 4.49Å; V29-I49 HydrophobicContact CG1-CD1 4.16Å; V29-I49 HydrophobicContact CG2-CD1 3.47Å; V29-I49 VanDerWaalsContact CG2-CD1 3.47Å
30L96.4Very high93.9Very high6 Ų660.3 Ų60.33%0.03131%0.313CS..EExtended strand (participates in β ladder)trans-128.3113.1175.2176.167.2000108.9C18 F19 T33 R38 I39C18-L30 CarbonylContact C-O 3.48Å; C18-L30 WeakPolarHBondContact CA-O 3.41Å; C18-L30 WeakPolarHBondContact CB-O 3.37Å; F19-L30 HydrophobicContact CB-CB 3.87Å; F19-L30 HydrophobicContact CD2-CB 3.66Å; F19-L30 HydrophobicContact CD2-CD2 3.58Å; F19-L30 HydrophobicContact CD2-CG 4.28Å; F19-L30 HydrophobicContact CE2-CB 4.42Å; F19-L30 HydrophobicContact CE2-CD2 3.49Å; F19-L30 VanDerWaalsContact CE2-CD2 3.49Å; F19-L30 HydrophobicContact CG-CB 3.96Å; F19-L30 HydrophobicContact CG-CD2 4.13Å; F19-L30 HydrophobicContact CZ-CD2 3.97Å; F19-L30 PolarHBondContact N-O 2.82Å; F19-L30 PolarHBondContact O-N 3.49Å; F19-L30 VanDerWaalsContact O-N 3.11Å; L30-T33 HydrophobicContact CD1-CG2 3.9Å; L30-T33 HydrophobicContact CD2-CG2 4.31Å; L30-T33 HydrophobicContact CG-CG2 4.26Å; L30-R38 HydrophobicContact CD1-CB 4.14Å; L30-R38 WeakPolarHBondContact CD1-O 3.44Å; L30-I39 HydrophobicContact CD2-CB 4.39Å; L30-I39 HydrophobicContact CD2-CG1 4.01Å
31P95.8Very high93.8Very high57 Ų5762.4 Ų62.437%0.3733%0.325SS..EExtended strand (participates in β ladder)trans-62.1150.1168.3-22.533.5000111.4T28 T33T28-P31 HydrophobicContact CG2-CB 4.49Å; T28-P31 HydrophobicContact CG2-CG 4.29Å; P31-T33 PolarHBondContact O-N 2.77Å
32L93.1Very high93.9Very high35 Ų3561.3 Ų61.318%0.18332%0.318CS..EExtended strand (participates in β ladder)trans-52.8122.5-175.1-163.880.6000111.3R16 M17 C18 F71R16-L32 HydrophobicContact CB-CD1 4.19Å; R16-L32 HydrophobicContact CB-CD2 4.17Å; R16-L32 HydrophobicContact CB-CG 3.79Å; M17-L32 WeakPolarHBondContact O-CA 3.35Å; C18-L32 HydrophobicContact CB-CB 4.14Å; C18-L32 HydrophobicContact CB-CD1 3.97Å; L32-F71 HydrophobicContact CB-CD2 3.9Å; L32-F71 HydrophobicContact CB-CE2 3.55Å; L32-F71 HydrophobicContact CB-CZ 4.01Å; L32-F71 HydrophobicContact CD2-CB 3.98Å; L32-F71 HydrophobicContact CD2-CD1 3.94Å; L32-F71 HydrophobicContact CD2-CD2 3.55Å; L32-F71 HydrophobicContact CD2-CE1 4.3Å; L32-F71 HydrophobicContact CD2-CE2 3.98Å; L32-F71 HydrophobicContact CD2-CG 3.53Å; L32-F71 HydrophobicContact CD2-CZ 4.31Å; L32-F71 HydrophobicContact CG-CD2 4.33Å; L32-F71 HydrophobicContact CG-CE2 4.3Å; L32-F71 VanDerWaalsContact O-CZ 3.25Å; L32-F71 WeakPolarHBondContact O-CZ 3.42Å
33T92.5Very high93.9Very high14 Ų1460 Ų609%0.08631%0.314CS..EExtended strand (participates in β ladder)trans-155.1155.8-177.4-168.10000111.7R16 M17 L30 P31 D35 R38 I39R16-T33 VanDerWaalsContact CA-O 3.3Å; R16-T33 WeakPolarHBondContact CA-O 3.45Å; M17-T33 PolarHBondContact N-O 3.31Å; M17-T33 PolarHBondContact O-N 3.06Å; L30-T33 HydrophobicContact CD1-CG2 3.9Å; L30-T33 HydrophobicContact CD2-CG2 4.31Å; L30-T33 HydrophobicContact CG-CG2 4.26Å; P31-T33 PolarHBondContact O-N 2.77Å; T33-D35 WeakPolarHBondContact OG1-CB 3.26Å; T33-D35 PolarHBondContact OG1-N 2.91Å; T33-D35 VanDerWaalsContact OG1-N 3.16Å; T33-R38 HydrophobicContact CG2-CB 3.97Å; T33-I39 HydrophobicContact CG2-CG1 4.05Å
34S91.6Very high94.1Very high63 Ų6361.8 Ų61.844%0.44132%0.322SS..  trans-102.21.1166.8510000112.5I15 K36I15-S34 WeakPolarHBondContact O-CB 2.81Å; S34-K36 PolarHBondContact O-N 3.11Å
35D93.3Very high94.3Very high69 Ų6963.9 Ų63.937%0.36933%0.328SS..  trans-72.3113179.8-178.7-34.8000110.4T33 N37 R38 I39T33-D35 WeakPolarHBondContact OG1-CB 3.26Å; T33-D35 PolarHBondContact OG1-N 2.91Å; T33-D35 VanDerWaalsContact OG1-N 3.16Å; D35-N37 VanDerWaalsContact C-N 3.29Å; D35-N37 PolarHBondContact O-N 2.83Å; D35-N37 WeakPolarHBondContact OD1-CA 3.48Å; D35-N37 WeakPolarHBondContact OD1-CB 3.03Å; D35-N37 PolarHBondContact OD1-N 2.69Å; D35-R38 HydrophobicContact CB-CB 4Å; D35-R38 HydrophobicContact CB-CG 3.95Å; D35-R38 PolarHBondContact O-N 3.43Å; D35-R38 PolarHBondContact OD1-N 3.5Å; D35-I39 VanDerWaalsContact O-CG1 3.27Å; D35-I39 WeakPolarHBondContact O-CG1 3.36Å; D35-I39 PolarHBondContact O-N 2.8Å
36K91.9Very high94.4Very high148 Ų14859.3 Ų59.364%0.64330%0.303SS*.Hα-helixtrans-60.9-34-177.7-64.8-172.4178.8-173.90113.4S34 K40S34-K36 PolarHBondContact O-N 3.11Å; K36-K40 WeakPolarHBondContact O-CB 3.45Å; K36-K40 PolarHBondContact O-N 2.02Å
37N94.4Very high94.1Very high116 Ų11663.3 Ų63.362%0.6232%0.317SS*.Hα-helixtrans-71.3-41.8178.5-65.8-36.1000110.4D35 I39 K40 N41D35-N37 VanDerWaalsContact C-N 3.29Å; D35-N37 PolarHBondContact O-N 2.83Å; D35-N37 WeakPolarHBondContact OD1-CA 3.48Å; D35-N37 WeakPolarHBondContact OD1-CB 3.03Å; D35-N37 PolarHBondContact OD1-N 2.69Å; N37-I39 VanDerWaalsContact C-N 3.35Å; N37-K40 PolarHBondContact O-N 3.24Å; N37-N41 WeakPolarHBondContact O-CB 3.3Å; N37-N41 PolarHBondContact O-N 3.12Å; N37-N41 PolarHBondContact O-ND2 2.83Å
38R96.1Very high93.9Very high109 Ų10966 Ų6641%0.41133%0.327SS..Hα-helixtrans-64.6-40.4174.6-67-178.463-168.6-3.1111.8L30 T33 D35 N41 G42L30-R38 HydrophobicContact CD1-CB 4.14Å; L30-R38 WeakPolarHBondContact CD1-O 3.44Å; T33-R38 HydrophobicContact CG2-CB 3.97Å; D35-R38 HydrophobicContact CB-CB 4Å; D35-R38 HydrophobicContact CB-CG 3.95Å; D35-R38 PolarHBondContact O-N 3.43Å; D35-R38 PolarHBondContact OD1-N 3.5Å; R38-N41 PolarHBondContact O-N 2.9Å; R38-G42 PolarHBondContact O-N 2.83Å
39I94.9Very high93.5Very high15 Ų1566.9 Ų66.98%0.07733%0.33CS..Hα-helixtrans-60.5-48.7175.3-69.9163.3000110.7V7 M17 F19 L30 T33 D35 N37 N41 G42 L43V7-I39 HydrophobicContact CG1-CG2 3.63Å; M17-I39 HydrophobicContact CE-CD1 4.1Å; M17-I39 HydrophobicContact CG-CD1 3.79Å; M17-I39 HydrophobicContact CG-CG1 3.82Å; M17-I39 HydrophobicContact CG-CG2 4.47Å; M17-I39 HydrophobicContact SD-CB 4.46Å; M17-I39 HydrophobicContact SD-CD1 3.82Å; M17-I39 HydrophobicContact SD-CG1 3.97Å; M17-I39 HydrophobicContact SD-CG2 3.62Å; F19-I39 HydrophobicContact CZ-CG2 4.14Å; L30-I39 HydrophobicContact CD2-CB 4.39Å; L30-I39 HydrophobicContact CD2-CG1 4.01Å; T33-I39 HydrophobicContact CG2-CG1 4.05Å; D35-I39 VanDerWaalsContact O-CG1 3.27Å; D35-I39 WeakPolarHBondContact O-CG1 3.36Å; D35-I39 PolarHBondContact O-N 2.8Å; N37-I39 VanDerWaalsContact C-N 3.35Å; I39-N41 PolarHBondContact O-N 2.85Å; I39-G42 PolarHBondContact O-N 2.84Å; I39-G42 VanDerWaalsContact O-N 3.16Å; I39-L43 HydrophobicContact CG2-CD1 4.47Å; I39-L43 PolarHBondContact O-N 2.92Å
40K94.1Very high92.8Very high132 Ų13272.5 Ų72.557%0.57436%0.364SS*.Hα-helixtrans-57.8-48.8176.5-174.2-179.6178.5-177.40111.7K36 N37 G42 L43 D44K36-K40 WeakPolarHBondContact O-CB 3.45Å; K36-K40 PolarHBondContact O-N 2.02Å; N37-K40 PolarHBondContact O-N 3.24Å; K40-G42 VanDerWaalsContact C-N 3.28Å; K40-G42 PolarHBondContact O-N 2.96Å; K40-L43 WeakPolarHBondContact O-CB 3.23Å; K40-L43 PolarHBondContact O-N 2.81Å; K40-L43 VanDerWaalsContact O-N 3.14Å; K40-D44 PolarHBondContact O-N 2.81Å
41N95.4Very high91.8Very high89 Ų8976.2 Ų76.248%0.47639%0.389SS..Hα-helixtrans-62.3-36.1177.3-68.3-14.5000112.3N37 R38 I39 D44 Q45N37-N41 WeakPolarHBondContact O-CB 3.3Å; N37-N41 PolarHBondContact O-N 3.12Å; N37-N41 PolarHBondContact O-ND2 2.83Å; R38-N41 PolarHBondContact O-N 2.9Å; I39-N41 PolarHBondContact O-N 2.85Å; N41-D44 PolarHBondContact O-N 3.17Å; N41-Q45 WeakPolarHBondContact O-CG 3.37Å; N41-Q45 PolarHBondContact O-N 2.81Å
42G95.9Very high90.9Very high2 Ų280.5 Ų80.52%0.02141%0.408CS..Hα-helixtrans-64.5-40.3174.500000112.5R38 I39 K40 Q45 L46R38-G42 PolarHBondContact O-N 2.83Å; I39-G42 PolarHBondContact O-N 2.84Å; I39-G42 VanDerWaalsContact O-N 3.16Å; K40-G42 VanDerWaalsContact C-N 3.28Å; K40-G42 PolarHBondContact O-N 2.96Å; G42-Q45 PolarHBondContact O-N 3.26Å; G42-L46 WeakPolarHBondContact O-CG 3.25Å; G42-L46 PolarHBondContact O-N 2.98Å
43L95Very high90.4Very high15 Ų1581.2 Ų81.28%0.07942%0.424CS..Hα-helixtrans-62.3-46.3173-71.2170.7000110.7V3 E4 V7 F19 I39 K40 Q45 L46 Q47V3-L43 HydrophobicContact CB-CD2 4.4Å; V3-L43 HydrophobicContact CG1-CD2 3.83Å; E4-L43 HydrophobicContact CB-CD1 4.25Å; E4-L43 HydrophobicContact CB-CD2 4.23Å; E4-L43 HydrophobicContact CG-CD1 4.22Å; V7-L43 HydrophobicContact CB-CD1 4.44Å; V7-L43 HydrophobicContact CG1-CD1 4.2Å; V7-L43 HydrophobicContact CG2-CD2 4.26Å; F19-L43 HydrophobicContact CE2-CD2 3.76Å; F19-L43 HydrophobicContact CE2-CG 3.72Å; F19-L43 HydrophobicContact CZ-CD2 3.7Å; F19-L43 HydrophobicContact CZ-CG 3.92Å; I39-L43 HydrophobicContact CG2-CD1 4.47Å; I39-L43 PolarHBondContact O-N 2.92Å; K40-L43 WeakPolarHBondContact O-CB 3.23Å; K40-L43 PolarHBondContact O-N 2.81Å; K40-L43 VanDerWaalsContact O-N 3.14Å; L43-Q45 PolarHBondContact O-N 2.9Å; L43-L46 HydrophobicContact CD2-CD1 4.42Å; L43-L46 WeakPolarHBondContact O-CB 3.38Å; L43-L46 PolarHBondContact O-N 3.14Å; L43-L46 VanDerWaalsContact O-N 3.13Å; L43-Q47 WeakPolarHBondContact O-CG 3.5Å; L43-Q47 PolarHBondContact O-N 3.47Å; L43-Q47 VanDerWaalsContact O-N 3.11Å
44D94.5Very high90Very high65 Ų6585.9 Ų85.935%0.34845%0.445SS..Hα-helixtrans-60.5-34177.8-66.8-21.5000112.5K40 N41K40-D44 PolarHBondContact O-N 2.81Å; N41-D44 PolarHBondContact O-N 3.17Å
45Q93.7Very high89.8Confident102 Ų10284.9 Ų84.948%0.47744%0.436SS..Hα-helixtrans-70.9-44.9173.4-73.8-178.933.800111.8V29 N41 G42 L43 Q47 K48 I49V29-Q45 HydrophobicContact CG1-CB 3.8Å; N41-Q45 WeakPolarHBondContact O-CG 3.37Å; N41-Q45 PolarHBondContact O-N 2.81Å; G42-Q45 PolarHBondContact O-N 3.26Å; L43-Q45 PolarHBondContact O-N 2.9Å; Q45-Q47 PolarHBondContact O-N 2.89Å; Q45-K48 PolarHBondContact O-N 2.82Å; Q45-I49 PolarHBondContact O-N 2.8Å
46L91.6Very high89.8Confident29 Ų2983.2 Ų83.215%0.15243%0.425CS..Hα-helixtrans-55.4-39.3177.1-77.5175.8000112.1V3 F19 T21 V29 G42 L43 K48 I49V3-L46 HydrophobicContact CG1-CD1 4.09Å; F19-L46 HydrophobicContact CB-CD1 3.78Å; F19-L46 HydrophobicContact CB-CD2 4.2Å; F19-L46 HydrophobicContact CB-CG 4.17Å; F19-L46 HydrophobicContact CD1-CD1 4.18Å; F19-L46 HydrophobicContact CD2-CD1 3.51Å; F19-L46 HydrophobicContact CD2-CG 4.15Å; F19-L46 HydrophobicContact CE2-CD1 4.16Å; F19-L46 HydrophobicContact CG-CD1 3.56Å; F19-L46 HydrophobicContact CG-CG 4.34Å; T21-L46 HydrophobicContact CG2-CD2 3.58Å; V29-L46 HydrophobicContact CB-CD2 4.23Å; V29-L46 HydrophobicContact CG1-CD2 4.19Å; V29-L46 HydrophobicContact CG1-CG 4.24Å; V29-L46 HydrophobicContact CG2-CD2 4.03Å; G42-L46 WeakPolarHBondContact O-CG 3.25Å; G42-L46 PolarHBondContact O-N 2.98Å; L43-L46 HydrophobicContact CD2-CD1 4.42Å; L43-L46 WeakPolarHBondContact O-CB 3.38Å; L43-L46 PolarHBondContact O-N 3.14Å; L43-L46 VanDerWaalsContact O-N 3.13Å; L46-K48 PolarHBondContact O-N 2.93Å; L46-K48 VanDerWaalsContact O-N 3.13Å; L46-I49 HydrophobicContact CD2-CD1 4.45Å; L46-I49 PolarHBondContact O-N 3.43Å; L46-I49 VanDerWaalsContact O-N 3.17Å
47Q89.3Confident90Very high100 Ų10076.3 Ų76.347%0.46740%0.395SS..THydrogen-bonded Turntrans-62.5-22.2-179.9-41.7-157.1-25.500113.6M1 L43 Q45M1-Q47 HydrophobicContact CE-CB 3.63Å; M1-Q47 HydrophobicContact CE-CG 3.29Å; M1-Q47 HydrophobicContact SD-CG 4Å; L43-Q47 WeakPolarHBondContact O-CG 3.5Å; L43-Q47 PolarHBondContact O-N 3.47Å; L43-Q47 VanDerWaalsContact O-N 3.11Å; Q45-Q47 PolarHBondContact O-N 2.89Å
48K89.3Confident90.2Very high170 Ų17071.3 Ų71.374%0.73937%0.368SS*.THydrogen-bonded Turntrans-95.6-8.7-176.7-61.2171.9-172.8174.60112.6Q45 L46Q45-K48 PolarHBondContact O-N 2.82Å; L46-K48 PolarHBondContact O-N 2.93Å; L46-K48 VanDerWaalsContact O-N 3.13Å
49I87.8Confident90.3Very high54 Ų5466.7 Ų66.728%0.27735%0.353SS..  trans-85.8122.3-178.6-66.3170.1000108.6T21 V29 Q45 L46 P51T21-I49 HydrophobicContact CG2-CD1 4.14Å; T21-I49 HydrophobicContact CG2-CG2 4.34Å; V29-I49 HydrophobicContact CB-CD1 4.49Å; V29-I49 HydrophobicContact CG1-CD1 4.16Å; V29-I49 HydrophobicContact CG2-CD1 3.47Å; V29-I49 VanDerWaalsContact CG2-CD1 3.47Å; Q45-I49 PolarHBondContact O-N 2.8Å; L46-I49 HydrophobicContact CD2-CD1 4.45Å; L46-I49 PolarHBondContact O-N 3.43Å; L46-I49 VanDerWaalsContact O-N 3.17Å; I49-P51 HydrophobicContact CG2-CG 4.34Å
50V82.4Confident90.4Very high133 Ų13366.4 Ų66.481%0.80635%0.354SS*.  trans-107.7104.8164.5-1780000105.9D52V50-D52 PolarHBondContact O-N 3.46Å
51P75.1Confident90.6Very high84 Ų8460.3 Ų60.355%0.54533%0.327SS..  trans-61.2136.2176.7-17.730.3000109.7I49I49-P51 HydrophobicContact CG2-CG 4.34Å
52D77.5Confident90.7Very high147 Ų14761 Ų6179%0.78632%0.323SS*.  trans-129.7146.1173.2-176.334.3000109.6S23 V50S23-D52 WeakPolarHBondContact CB-O 3.25Å; S23-D52 PolarHBondContact OG-O 3.43Å; V50-D52 PolarHBondContact O-N 3.46Å
53G81.8Confident90.8Very high49 Ų4963.9 Ų63.951%0.50534%0.336SS..SBendtrans105.7-156.8-175.200000114.5
54H84.4Confident90.9Very high113 Ų11363.7 Ų63.752%0.52334%0.336SS..  trans-83.2165.9-173.1-64.2-61.5000113.1S23 T24 F56S23-H54 CarbonylContact C-O 3.55Å; S23-H54 WeakPolarHBondContact CA-O 3.49Å; T24-H54 PolarHBondContact N-O 3.08Å; T24-H54 PolarHBondContact OG1-N 3.11Å; T24-H54 VanDerWaalsContact OG1-N 3.16Å; H54-F56 VanDerWaalsContact C-N 3.35Å; H54-F56 HydrophobicContact CB-CD1 3.78Å; H54-F56 HydrophobicContact CB-CD2 4.47Å; H54-F56 HydrophobicContact CB-CE1 3.49Å; H54-F56 VanDerWaalsContact CB-CE1 3.49Å; H54-F56 HydrophobicContact CB-CE2 4.21Å; H54-F56 HydrophobicContact CB-CG 4.27Å; H54-F56 HydrophobicContact CB-CZ 3.72Å; H54-F56 AromaticContact CD2-CZ 3.89Å; H54-F56 AromaticContact CG-CZ 3.98Å; H54-F56 PolarHBondContact O-N 3.42Å; H54-F56 VanDerWaalsContact O-N 3.14Å
55T86.9Confident91Very high41 Ų4161.1 Ų61.125%0.25232%0.322SS..  trans-88.963.9178.5-46.30000111.3Y22 M57 L89Y22-T55 HydrophobicContact CE2-CG2 3.79Å; T55-M57 PolarHBondContact O-N 3.33Å; T55-M57 VanDerWaalsContact O-N 3.1Å; T55-L89 HydrophobicContact CG2-CD1 4.33Å; T55-L89 HydrophobicContact CG2-CG 4.46Å
56F94.3Very high91.1Very high35 Ų3561 Ų6115%0.15432%0.321CS..  trans-86.872.9-178.8-63.3-13.4000112.4Y22 S23 T24 H54 Q58 A59 V90 H92 A93Y22-F56 VanDerWaalsContact CD2-C 3.48Å; S23-F56 WeakPolarHBondContact O-CA 3.49Å; S23-F56 WeakPolarHBondContact O-CB 3.49Å; S23-F56 PolarHBondContact O-N 2.81Å; T24-F56 HydrophobicContact CG2-CD2 4.19Å; T24-F56 HydrophobicContact CG2-CE2 4.05Å; T24-F56 WeakPolarHBondContact O-CD2 3.37Å; H54-F56 VanDerWaalsContact C-N 3.35Å; H54-F56 HydrophobicContact CB-CD1 3.78Å; H54-F56 HydrophobicContact CB-CD2 4.47Å; H54-F56 HydrophobicContact CB-CE1 3.49Å; H54-F56 VanDerWaalsContact CB-CE1 3.49Å; H54-F56 HydrophobicContact CB-CE2 4.21Å; H54-F56 HydrophobicContact CB-CG 4.27Å; H54-F56 HydrophobicContact CB-CZ 3.72Å; H54-F56 AromaticContact CD2-CZ 3.89Å; H54-F56 AromaticContact CG-CZ 3.98Å; H54-F56 PolarHBondContact O-N 3.42Å; H54-F56 VanDerWaalsContact O-N 3.14Å; F56-Q58 VanDerWaalsContact CB-NE2 3.34Å; F56-Q58 PolarHBondContact O-N 2.75Å; F56-Q58 VanDerWaalsContact O-N 3.09Å; F56-A59 VanDerWaalsContact O-CB 3.27Å; F56-A59 WeakPolarHBondContact O-CB 3.44Å; F56-A59 PolarHBondContact O-N 3.42Å; F56-V90 HydrophobicContact CD1-CG2 4.45Å; F56-V90 HydrophobicContact CE1-CG2 3.88Å; F56-H92 AromaticContact CE1-NE2 3.59Å; F56-H92 AromaticContact CZ-NE2 3.72Å; F56-A93 HydrophobicContact CD1-CB 3.66Å; F56-A93 HydrophobicContact CE1-CB 4.12Å
57M96.3Very high91.2Very high3 Ų361 Ų612%0.01532%0.321CS..Hα-helixtrans-54.8-30.1179.7-168.8-175.9-76.100113.3Y22 T55 A59 G60 F61 A83 T85 L89 T97 I127Y22-M57 HydrophobicContact CD2-CB 4.39Å; Y22-M57 HydrophobicContact CE1-CB 4.37Å; Y22-M57 HydrophobicContact CE1-CG 4.04Å; Y22-M57 VanDerWaalsContact CE2-CA 3.48Å; Y22-M57 HydrophobicContact CE2-CB 3.83Å; Y22-M57 HydrophobicContact CE2-CG 4.38Å; Y22-M57 WeakPolarHBondContact OH-CE 3.34Å; T55-M57 PolarHBondContact O-N 3.33Å; T55-M57 VanDerWaalsContact O-N 3.1Å; M57-A59 PolarHBondContact O-N 3.24Å; M57-G60 WeakPolarHBondContact O-CA 3.32Å; M57-G60 PolarHBondContact O-N 2.85Å; M57-F61 HydrophobicContact CG-CD2 3.92Å; M57-F61 HydrophobicContact CG-CE2 3.85Å; M57-F61 PolarHBondContact O-N 3.14Å; M57-F61 HydrophobicContact SD-CD2 4.42Å; M57-F61 HydrophobicContact SD-CE2 3.76Å; M57-A83 HydrophobicContact CE-CB 4.49Å; M57-A83 HydrophobicContact SD-CB 4.07Å; M57-T85 HydrophobicContact CE-CG2 3.95Å; M57-L89 HydrophobicContact CB-CD2 3.72Å; M57-L89 HydrophobicContact CB-CG 4.41Å; M57-L89 HydrophobicContact CE-CD1 4.06Å; M57-L89 HydrophobicContact CE-CD2 4.46Å; M57-L89 HydrophobicContact SD-CD2 4.29Å; M57-T97 HydrophobicContact CB-CG2 4.02Å; M57-T97 HydrophobicContact CG-CG2 3.94Å; M57-T97 HydrophobicContact SD-CG2 3.71Å; M57-I127 HydrophobicContact SD-CD1 3.95Å; M57-I127 HydrophobicContact SD-CG2 4.35Å
58Q97.8Very high91.3Very high10 Ų1057 Ų575%0.04730%0.302CS..Hα-helixtrans-56.9-31.917471.8-79.61500112.7F56 F61 R62 A93 D96 T97 E100F56-Q58 VanDerWaalsContact CB-NE2 3.34Å; F56-Q58 PolarHBondContact O-N 2.75Å; F56-Q58 VanDerWaalsContact O-N 3.09Å; Q58-F61 PolarHBondContact O-N 3.16Å; Q58-R62 VanDerWaalsContact O-CG 3.28Å; Q58-R62 WeakPolarHBondContact O-CG 3.29Å; Q58-R62 PolarHBondContact O-N 3Å; Q58-A93 PolarHBondContact OE1-O 3Å; Q58-D96 HydrophobicContact CB-CB 3.92Å; Q58-D96 HydrophobicContact CG-CB 3.87Å; Q58-T97 PolarHBondContact N-OG1 2.95Å; Q58-T97 VanDerWaalsContact N-OG1 3.11Å; Q58-E100 HydrophobicContact CB-CG 4.2Å
59A97.2Very high91.4Very high12 Ų1253.7 Ų53.710%0.09929%0.29CS..Hα-helixtrans-68.4-39.2176.700000111.2F56 M57 R62 K63F56-A59 VanDerWaalsContact O-CB 3.27Å; F56-A59 WeakPolarHBondContact O-CB 3.44Å; F56-A59 PolarHBondContact O-N 3.42Å; M57-A59 PolarHBondContact O-N 3.24Å; A59-R62 PolarHBondContact O-N 2.55Å; A59-K63 PolarHBondContact O-N 3.37Å
60G97.4Very high91.5Very high9 Ų954.9 Ų54.99%0.09330%0.303CS..Hα-helixtrans-62.6-47.3171.500000112.4M57 R62 K63 A64M57-G60 WeakPolarHBondContact O-CA 3.32Å; M57-G60 PolarHBondContact O-N 2.85Å; G60-R62 VanDerWaalsContact C-N 3.33Å; G60-R62 PolarHBondContact O-N 3.11Å; G60-K63 WeakPolarHBondContact O-CB 3.09Å; G60-K63 PolarHBondContact O-N 2.89Å; G60-K63 VanDerWaalsContact O-N 3.13Å; G60-A64 PolarHBondContact O-N 3.04Å
61F98.3Very high91.5Very high4 Ų452.6 Ų52.62%0.01828%0.282CS..Hα-helixtrans-59.7-40.9176.4-88.8-85.5000112.6M57 Q58 K63 A64 I65 I81 A83 T97 E100 A101 A104 V111 I127M57-F61 HydrophobicContact CG-CD2 3.92Å; M57-F61 HydrophobicContact CG-CE2 3.85Å; M57-F61 PolarHBondContact O-N 3.14Å; M57-F61 HydrophobicContact SD-CD2 4.42Å; M57-F61 HydrophobicContact SD-CE2 3.76Å; Q58-F61 PolarHBondContact O-N 3.16Å; F61-K63 VanDerWaalsContact C-N 3.3Å; F61-K63 PolarHBondContact O-N 2.87Å; F61-A64 WeakPolarHBondContact O-CB 3.04Å; F61-A64 PolarHBondContact O-N 3.11Å; F61-A64 VanDerWaalsContact O-N 3.1Å; F61-I65 WeakPolarHBondContact O-CB 3.42Å; F61-I65 VanDerWaalsContact O-CG1 3.28Å; F61-I65 WeakPolarHBondContact O-CG1 3.4Å; F61-I65 PolarHBondContact O-N 2.85Å; F61-I81 HydrophobicContact CD1-CD1 3.97Å; F61-I81 HydrophobicContact CE1-CD1 3.97Å; F61-I81 HydrophobicContact CE1-CG2 3.99Å; F61-I81 HydrophobicContact CZ-CG2 4.3Å; F61-A83 HydrophobicContact CE2-CB 4.09Å; F61-A83 HydrophobicContact CZ-CB 4.12Å; F61-T97 HydrophobicContact CD2-CG2 3.85Å; F61-T97 HydrophobicContact CE2-CG2 3.76Å; F61-E100 HydrophobicContact CB-CB 3.58Å; F61-E100 HydrophobicContact CB-CG 4.49Å; F61-E100 HydrophobicContact CG-CB 4.28Å; F61-A101 HydrophobicContact CD1-CB 4.34Å; F61-A101 HydrophobicContact CE1-CB 3.84Å; F61-A101 HydrophobicContact CZ-CB 4.01Å; F61-A104 HydrophobicContact CD1-CB 4.41Å; F61-V111 HydrophobicContact CE1-CG1 3.94Å; F61-V111 HydrophobicContact CE1-CG2 4.2Å; F61-V111 HydrophobicContact CZ-CG1 3.72Å; F61-I127 HydrophobicContact CE2-CG2 3.93Å; F61-I127 HydrophobicContact CZ-CG2 3.77Å
62R98.3Very high91.6Very high103 Ų10349.9 Ų49.939%0.38926%0.263SS..Hα-helixtrans-58.7-41.4175.5-73.4167.7-172.9154.64.1111.7Q58 A59 G60 Q66 D96 E100Q58-R62 VanDerWaalsContact O-CG 3.28Å; Q58-R62 WeakPolarHBondContact O-CG 3.29Å; Q58-R62 PolarHBondContact O-N 3Å; A59-R62 PolarHBondContact O-N 2.55Å; G60-R62 VanDerWaalsContact C-N 3.33Å; G60-R62 PolarHBondContact O-N 3.11Å; R62-Q66 VanDerWaalsContact O-CG 3.27Å; R62-Q66 WeakPolarHBondContact O-CG 3.37Å; R62-Q66 PolarHBondContact O-N 2.95Å; R62-D96 IonicContact NH2-OD2 3.59Å; R62-E100 HydrophobicContact CG-CG 4.05Å; R62-E100 IonicContact NE-OE1 3.43Å
63K97.9Very high90.9Very high64 Ų6448 Ų4828%0.27826%0.261SS..Hα-helixtrans-65.7-39.7173.9-65.7-55.1-173.1-177.80112.1I20 G26 A59 G60 F61 Q66 Q67I20-K63 HydrophobicContact CD1-CB 3.88Å; I20-K63 HydrophobicContact CG1-CB 4.2Å; I20-K63 HydrophobicContact CG2-CB 3.78Å; I20-K63 HydrophobicContact CG2-CG 4.34Å; G26-K63 WeakPolarHBondContact O-CE 3.39Å; A59-K63 PolarHBondContact O-N 3.37Å; G60-K63 WeakPolarHBondContact O-CB 3.09Å; G60-K63 PolarHBondContact O-N 2.89Å; G60-K63 VanDerWaalsContact O-N 3.13Å; F61-K63 VanDerWaalsContact C-N 3.3Å; F61-K63 PolarHBondContact O-N 2.87Å; K63-Q66 WeakPolarHBondContact O-CB 3.29Å; K63-Q66 PolarHBondContact O-N 3.37Å; K63-Q67 WeakPolarHBondContact O-CG 3.35Å; K63-Q67 PolarHBondContact O-N 3.06Å; K63-Q67 VanDerWaalsContact O-N 3.1Å
64A97.2Very high89.9Confident11 Ų1148.9 Ų48.99%0.09127%0.271CS..Hα-helixtrans-64.9-44.1178.300000111.3I20 G60 F61 Q66 Q67 I68 I81I20-A64 VanDerWaalsContact CD1-CA 3.47Å; I20-A64 HydrophobicContact CD1-CB 3.81Å; G60-A64 PolarHBondContact O-N 3.04Å; F61-A64 WeakPolarHBondContact O-CB 3.04Å; F61-A64 PolarHBondContact O-N 3.11Å; F61-A64 VanDerWaalsContact O-N 3.1Å; A64-Q66 VanDerWaalsContact C-N 3.34Å; A64-Q66 PolarHBondContact O-N 3.44Å; A64-Q67 PolarHBondContact O-N 2.76Å; A64-I68 VanDerWaalsContact O-CG1 3.31Å; A64-I68 WeakPolarHBondContact O-CG1 3.28Å; A64-I68 PolarHBondContact O-N 3.14Å; A64-I81 HydrophobicContact CB-CD1 3.81Å; A64-I81 HydrophobicContact CB-CG1 4.25Å
65I95.9Very high88.7Confident11 Ų1149 Ų496%0.05628%0.275CS..Hα-helixtrans-57.4-46.8174.4-70.8163.4000110.7F61 Q67 I68 E69 E100 K103 A104 L107F61-I65 WeakPolarHBondContact O-CB 3.42Å; F61-I65 VanDerWaalsContact O-CG1 3.28Å; F61-I65 WeakPolarHBondContact O-CG1 3.4Å; F61-I65 PolarHBondContact O-N 2.85Å; I65-Q67 VanDerWaalsContact C-N 3.31Å; I65-Q67 PolarHBondContact O-N 2.72Å; I65-I68 PolarHBondContact O-N 3.41Å; I65-I68 VanDerWaalsContact O-N 3.15Å; I65-E69 HydrophobicContact CG2-CG 4.22Å; I65-E69 WeakPolarHBondContact O-CB 3.06Å; I65-E69 WeakPolarHBondContact O-CG 3.31Å; I65-E69 PolarHBondContact O-N 3.11Å; I65-E100 HydrophobicContact CD1-CB 4.18Å; I65-E100 WeakPolarHBondContact CD1-O 3.46Å; I65-E100 WeakPolarHBondContact CD1-OE2 3.3Å; I65-K103 HydrophobicContact CD1-CB 3.92Å; I65-K103 HydrophobicContact CD1-CD 4.5Å; I65-A104 HydrophobicContact CG1-CB 4.08Å; I65-L107 HydrophobicContact CB-CD1 4.49Å; I65-L107 HydrophobicContact CG1-CD1 4.47Å; I65-L107 HydrophobicContact CG2-CD1 3.76Å
66Q95.3Very high87.9Confident98 Ų9854.5 Ų54.546%0.45830%0.296SS..Hα-helixtrans-57.6-41.6176.5-73.8170.4-3.700112.5R62 K63 A64 S70R62-Q66 VanDerWaalsContact O-CG 3.27Å; R62-Q66 WeakPolarHBondContact O-CG 3.37Å; R62-Q66 PolarHBondContact O-N 2.95Å; K63-Q66 WeakPolarHBondContact O-CB 3.29Å; K63-Q66 PolarHBondContact O-N 3.37Å; A64-Q66 VanDerWaalsContact C-N 3.34Å; A64-Q66 PolarHBondContact O-N 3.44Å; Q66-S70 VanDerWaalsContact O-CB 3.31Å; Q66-S70 WeakPolarHBondContact O-CB 3.38Å; Q66-S70 PolarHBondContact O-N 3.32Å
67Q94.6Very high86.9Confident29 Ų2955.8 Ų55.814%0.13631%0.306CS..Hα-helixtrans-65.7-44.6175.9-64.5-59.8-67.900111.7C18 I20 T28 K63 A64 I65 S70 F71C18-Q67 HydrophobicContact CB-CG 4.36Å; I20-Q67 HydrophobicContact CD1-CG 4.49Å; T28-Q67 HydrophobicContact CG2-CG 4.48Å; K63-Q67 WeakPolarHBondContact O-CG 3.35Å; K63-Q67 PolarHBondContact O-N 3.06Å; K63-Q67 VanDerWaalsContact O-N 3.1Å; A64-Q67 PolarHBondContact O-N 2.76Å; I65-Q67 VanDerWaalsContact C-N 3.31Å; I65-Q67 PolarHBondContact O-N 2.72Å; Q67-S70 PolarHBondContact O-N 3.05Å; Q67-F71 WeakPolarHBondContact O-CD2 3.28Å; Q67-F71 PolarHBondContact O-N 3.33Å
68I92.3Very high86Confident16 Ų1661 Ų618%0.08234%0.34CS..Hα-helixtrans-60.6-49.1178.8-69165.8000110.3A64 I65 F71 N72 I81 L107 A109A64-I68 VanDerWaalsContact O-CG1 3.31Å; A64-I68 WeakPolarHBondContact O-CG1 3.28Å; A64-I68 PolarHBondContact O-N 3.14Å; I65-I68 PolarHBondContact O-N 3.41Å; I65-I68 VanDerWaalsContact O-N 3.15Å; I68-F71 PolarHBondContact O-N 3.29Å; I68-N72 WeakPolarHBondContact CG2-ND2 3.31Å; I68-N72 WeakPolarHBondContact O-CB 3.4Å; I68-N72 VanDerWaalsContact O-CG 3.24Å; I68-N72 PolarHBondContact O-N 3.37Å; I68-N72 PolarHBondContact O-ND2 2.9Å; I68-I81 HydrophobicContact CD1-CD1 4.05Å; I68-I81 HydrophobicContact CD1-CG1 4.29Å; I68-L107 HydrophobicContact CG2-CB 3.98Å; I68-L107 HydrophobicContact CG2-CD1 4.26Å; I68-A109 HydrophobicContact CD1-CB 4.01Å
69E91.4Very high85.5Confident102 Ų10261.6 Ų61.648%0.47735%0.346SS..Hα-helixtrans-63.1-44.9-179.7-71.2176.7156.300111.8I65 F71 N72 L107I65-E69 HydrophobicContact CG2-CG 4.22Å; I65-E69 WeakPolarHBondContact O-CB 3.06Å; I65-E69 WeakPolarHBondContact O-CG 3.31Å; I65-E69 PolarHBondContact O-N 3.11Å; E69-F71 PolarHBondContact O-N 2.93Å; E69-N72 PolarHBondContact O-N 3.11Å; E69-L107 HydrophobicContact CG-CD1 3.75Å; E69-L107 HydrophobicContact CG-CD2 4.21Å
70S88.4Confident85.2Confident79 Ų7964.2 Ų64.255%0.55236%0.356SS*.Hα-helixtrans-57.2-37.9178.8-177.20000112.5Q66 Q67 S73Q66-S70 VanDerWaalsContact O-CB 3.31Å; Q66-S70 WeakPolarHBondContact O-CB 3.38Å; Q66-S70 PolarHBondContact O-N 3.32Å; Q67-S70 PolarHBondContact O-N 3.05Å; S70-S73 PolarHBondContact O-OG 3.13Å; S70-S73 VanDerWaalsContact O-OG 3.11Å
71F82.1Confident85.1Confident84 Ų8464.6 Ų64.637%0.36836%0.356SS..Hα-helixtrans-91-17.8-178.5-83.6-93.5000114.2L32 Q67 I68 E69 S73L32-F71 HydrophobicContact CB-CD2 3.9Å; L32-F71 HydrophobicContact CB-CE2 3.55Å; L32-F71 HydrophobicContact CB-CZ 4.01Å; L32-F71 HydrophobicContact CD2-CB 3.98Å; L32-F71 HydrophobicContact CD2-CD1 3.94Å; L32-F71 HydrophobicContact CD2-CD2 3.55Å; L32-F71 HydrophobicContact CD2-CE1 4.3Å; L32-F71 HydrophobicContact CD2-CE2 3.98Å; L32-F71 HydrophobicContact CD2-CG 3.53Å; L32-F71 HydrophobicContact CD2-CZ 4.31Å; L32-F71 HydrophobicContact CG-CD2 4.33Å; L32-F71 HydrophobicContact CG-CE2 4.3Å; L32-F71 VanDerWaalsContact O-CZ 3.25Å; L32-F71 WeakPolarHBondContact O-CZ 3.42Å; Q67-F71 WeakPolarHBondContact O-CD2 3.28Å; Q67-F71 PolarHBondContact O-N 3.33Å; I68-F71 PolarHBondContact O-N 3.29Å; E69-F71 PolarHBondContact O-N 2.93Å; F71-S73 VanDerWaalsContact C-N 3.28Å; F71-S73 PolarHBondContact O-N 2.75Å
72N78Confident84.9Confident28 Ų2867 Ų6715%0.1537%0.368CS..  trans-8918.1179.2-78.4-17.9000113.9I68 E69 G74 N75 V77I68-N72 WeakPolarHBondContact CG2-ND2 3.31Å; I68-N72 WeakPolarHBondContact O-CB 3.4Å; I68-N72 VanDerWaalsContact O-CG 3.24Å; I68-N72 PolarHBondContact O-N 3.37Å; I68-N72 PolarHBondContact O-ND2 2.9Å; E69-N72 PolarHBondContact O-N 3.11Å; N72-G74 PolarHBondContact O-N 3.34Å; N72-N75 PolarHBondContact OD1-O 3.1Å; N72-V77 WeakPolarHBondContact OD1-CB 3.42Å; N72-V77 WeakPolarHBondContact OD1-CG2 3.46Å; N72-V77 PolarHBondContact OD1-N 2.94Å
73S63.2Low84.8Confident107 Ų10762.5 Ų62.575%0.74835%0.354SS*.SBendtrans-67.454.2179.3-54.10000113.8S70 F71S70-S73 PolarHBondContact O-OG 3.13Å; S70-S73 VanDerWaalsContact O-OG 3.11Å; F71-S73 VanDerWaalsContact C-N 3.28Å; F71-S73 PolarHBondContact O-N 2.75Å
74G59.8Low84.5Confident68 Ų6862.2 Ų62.270%0.70135%0.354SS*.SBendtrans156.5-34174.100000114.9N72N72-G74 PolarHBondContact O-N 3.34Å
75N60.8Low84.3Confident114 Ų11462 Ų6261%0.6135%0.351SS*.SBendtrans-141.8133.3176.7-82.9-54.3000109.7N72 V77N72-N75 PolarHBondContact OD1-O 3.1Å; N75-V77 PolarHBondContact O-N 3.39Å
76K68.8Low83.8Confident158 Ų15866.5 Ų66.569%0.68738%0.376SS*.  trans-65.5108.2172.5-69.8-169179.3-168.20109.2K106K76-K106 PolarHBondContact NZ-O 3.34Å
77V72.9Confident83.5Confident62 Ų6262.5 Ų62.538%0.37636%0.361SS..  trans-84.9131.2172.9-1760000108.5N72 N75 S79N72-V77 WeakPolarHBondContact OD1-CB 3.42Å; N72-V77 WeakPolarHBondContact OD1-CG2 3.46Å; N72-V77 PolarHBondContact OD1-N 2.94Å; N75-V77 PolarHBondContact O-N 3.39Å; V77-S79 PolarHBondContact O-N 3.1Å; V77-S79 VanDerWaalsContact O-N 3.1Å; V77-S79 PolarHBondContact O-OG 3.06Å
78P77.7Confident83.3Confident113 Ų11366.6 Ų66.673%0.73438%0.38SS*.  trans-50.1120.8170-26.335000110
79S87.8Confident83.4Confident22 Ų2265.9 Ų65.915%0.15438%0.376CS..EExtended strand (participates in β ladder)trans-119.9155.2-173.6-62.90000110.1V77 A109 N110V77-S79 PolarHBondContact O-N 3.1Å; V77-S79 VanDerWaalsContact O-N 3.1Å; V77-S79 PolarHBondContact O-OG 3.06Å; S79-A109 CarbonylContact O-C 3.59Å; S79-A109 VanDerWaalsContact O-CA 3.29Å; S79-A109 WeakPolarHBondContact O-CA 3.43Å; S79-N110 PolarHBondContact O-N 2.95Å
80M90.6Very high83.4Confident66 Ų6664.3 Ų64.333%0.32537%0.374SS..EExtended strand (participates in β ladder)trans-137.5137.5179-177.9168.7-59.300110.2I82 N110 Y112 V155M80-I82 HydrophobicContact CG-CG1 4.2Å; M80-I82 HydrophobicContact SD-CD1 4.27Å; M80-I82 HydrophobicContact SD-CG1 4.24Å; M80-N110 WeakPolarHBondContact CA-O 3.33Å; M80-Y112 HydrophobicContact CE-CD2 4.36Å; M80-Y112 HydrophobicContact CE-CE2 3.44Å; M80-Y112 VanDerWaalsContact CE-CE2 3.44Å; M80-Y112 HydrophobicContact CG-CD2 3.75Å; M80-Y112 HydrophobicContact CG-CE2 3.71Å; M80-Y112 HydrophobicContact SD-CD2 3.87Å; M80-Y112 HydrophobicContact SD-CE2 3.51Å; M80-Y112 VanDerWaalsContact SD-CE2 3.51Å; M80-V155 HydrophobicContact CE-CB 3.79Å; M80-V155 HydrophobicContact CE-CG1 3.27Å; M80-V155 HydrophobicContact CE-CG2 3.5Å; M80-V155 HydrophobicContact SD-CB 4Å; M80-V155 HydrophobicContact SD-CG1 3.52Å; M80-V155 VanDerWaalsContact SD-CG1 3.52Å; M80-V155 HydrophobicContact SD-CG2 3.28Å; M80-V155 WeakPolarHBondContact SD-CG2 3.2Å
81I95.4Very high83.7Confident17 Ų1764.2 Ų64.29%0.08738%0.377CS..EExtended strand (participates in β ladder)trans-120.1123.8170.4-59.5177.6000107.2F61 A64 I68 A104 A109 N110 Y112F61-I81 HydrophobicContact CD1-CD1 3.97Å; F61-I81 HydrophobicContact CE1-CD1 3.97Å; F61-I81 HydrophobicContact CE1-CG2 3.99Å; F61-I81 HydrophobicContact CZ-CG2 4.3Å; A64-I81 HydrophobicContact CB-CD1 3.81Å; A64-I81 HydrophobicContact CB-CG1 4.25Å; I68-I81 HydrophobicContact CD1-CD1 4.05Å; I68-I81 HydrophobicContact CD1-CG1 4.29Å; I81-A104 HydrophobicContact CD1-CB 3.59Å; I81-A109 HydrophobicContact CD1-CB 4.32Å; I81-A109 HydrophobicContact CG1-CB 4.35Å; I81-N110 PolarHBondContact N-O 2.85Å; I81-Y112 PolarHBondContact O-N 3.42Å
82I94.9Very high84.2Confident54 Ų5465.5 Ų65.528%0.27738%0.384SS..EExtended strand (participates in β ladder)trans-107.8100168.9-58155000106.3W2 M80 Y112 L151W2-I82 HydrophobicContact CH2-CG2 4.03Å; M80-I82 HydrophobicContact CG-CG1 4.2Å; M80-I82 HydrophobicContact SD-CD1 4.27Å; M80-I82 HydrophobicContact SD-CG1 4.24Å; I82-Y112 HydrophobicContact CG1-CD2 4.46Å; I82-L151 HydrophobicContact CD1-CD1 4.3Å; I82-L151 HydrophobicContact CD1-CD2 3.76Å; I82-L151 HydrophobicContact CG1-CD1 4.32Å; I82-L151 HydrophobicContact CG1-CD2 4.45Å
83A95.9Very high85Confident10 Ų1064.2 Ų64.28%0.08338%0.377CS..EExtended strand (participates in β ladder)trans-87.9128.1178.800000109.7M57 F61 Y112 T113 L114M57-A83 HydrophobicContact CE-CB 4.49Å; M57-A83 HydrophobicContact SD-CB 4.07Å; F61-A83 HydrophobicContact CE2-CB 4.09Å; F61-A83 HydrophobicContact CZ-CB 4.12Å; A83-Y112 PolarHBondContact N-O 2.98Å; A83-T113 CarbonylContact O-C 3.57Å; A83-T113 VanDerWaalsContact O-CA 3.28Å; A83-T113 WeakPolarHBondContact O-CA 3.43Å; A83-L114 PolarHBondContact O-N 3.44Å
84M92.6Very high86.7Confident57 Ų5760.6 Ų60.628%0.28135%0.348SS..EExtended strand (participates in β ladder)trans-114.6136.6180-60.5-177.954.700109.6W2 V3 Y22 L114 L144W2-M84 HydrophobicContact CD2-CE 4.44Å; W2-M84 HydrophobicContact CE3-CE 3.88Å; W2-M84 HydrophobicContact CE3-SD 3.57Å; W2-M84 VanDerWaalsContact CE3-SD 3.57Å; W2-M84 HydrophobicContact CH2-SD 4.34Å; W2-M84 HydrophobicContact CZ3-CE 4.27Å; W2-M84 HydrophobicContact CZ3-SD 3.42Å; W2-M84 WeakPolarHBondContact CZ3-SD 3.48Å; V3-M84 HydrophobicContact CG2-SD 4.41Å; Y22-M84 PolarHBondContact OH-O 3.24Å; M84-L114 VanDerWaalsContact CA-O 3.31Å; M84-L114 WeakPolarHBondContact CA-O 3.33Å; M84-L114 HydrophobicContact CE-CD2 3.75Å; M84-L114 HydrophobicContact CG-CB 4.05Å; M84-L114 HydrophobicContact CG-CD2 4Å; M84-L114 HydrophobicContact CG-CG 4.49Å; M84-L114 HydrophobicContact SD-CD2 4.07Å; M84-L144 HydrophobicContact CE-CD2 4.25Å
85T91.6Very high88.5Confident6 Ų662.1 Ų62.14%0.03734%0.337CS..EExtended strand (participates in β ladder)trans-141.5143.5171.8-166.30000110.4M57 G87 L89 L114 G115 V116 I124M57-T85 HydrophobicContact CE-CG2 3.95Å; T85-G87 PolarHBondContact OG1-N 2.99Å; T85-G87 PolarHBondContact OG1-O 3.37Å; T85-L89 HydrophobicContact CG2-CD1 4.42Å; T85-L114 PolarHBondContact N-O 3.42Å; T85-G115 WeakPolarHBondContact O-CA 3.5Å; T85-V116 PolarHBondContact O-N 3.39Å; T85-I124 HydrophobicContact CG2-CG2 3.73Å
86D86.6Confident90.3Very high106 Ų10658.6 Ų58.657%0.56732%0.318SS*.EExtended strand (participates in β ladder)trans-106.1-0.4173.762.5-17.6000113.2V116 D118D86-V116 CarbonylContact C-O 3.58Å; D86-V116 WeakPolarHBondContact CA-O 2.93Å; D86-D118 CarbonylContact O-C 3.57Å; D86-D118 WeakPolarHBondContact O-CB 3.4Å; D86-D118 PolarHBondContact O-N 3.36Å
87G87.6Confident91.7Very high14 Ų1451 Ų5114%0.14429%0.285CS..EExtended strand (participates in β ladder)trans-144.7168.2-179.100000113.7T85 D118T85-G87 PolarHBondContact OG1-N 2.99Å; T85-G87 PolarHBondContact OG1-O 3.37Å; G87-D118 CarbonylContact C-O 3.58Å; G87-D118 WeakPolarHBondContact CA-O 3.37Å
88E91.4Very high92.9Very high115 Ų11550 Ų5054%0.53728%0.277SS..PPolyproline II helixtrans-68.9137.4172.1-177.6169.3-149.200111.9D118 N120E88-D118 PolarHBondContact N-O 2.99Å; E88-N120 HydrophobicContact CB-CB 4.21Å; E88-N120 HydrophobicContact CG-CB 3.85Å; E88-N120 PolarHBondContact OE1-ND2 3.3Å
89L93.1Very high93.9Very high2 Ų251.5 Ų51.51%0.0127%0.269CS..PPolyproline II helixtrans-81.1134.9172.5-72.566.5000109T55 M57 T85 F94 T97 Q123 I127T55-L89 HydrophobicContact CG2-CD1 4.33Å; T55-L89 HydrophobicContact CG2-CG 4.46Å; M57-L89 HydrophobicContact CB-CD2 3.72Å; M57-L89 HydrophobicContact CB-CG 4.41Å; M57-L89 HydrophobicContact CE-CD1 4.06Å; M57-L89 HydrophobicContact CE-CD2 4.46Å; M57-L89 HydrophobicContact SD-CD2 4.29Å; T85-L89 HydrophobicContact CG2-CD1 4.42Å; L89-F94 HydrophobicContact CB-CB 4.05Å; L89-T97 HydrophobicContact CD2-CG2 4.22Å; L89-Q123 PolarHBondContact O-NE2 2.82Å; L89-I127 HydrophobicContact CD2-CD1 4.09Å
90V93Very high94.4Very high69 Ų6951.2 Ų51.242%0.41827%0.265SS..PPolyproline II helixtrans-62.8148.4170.7-65.10000111.2F56 H92 A93 F94F56-V90 HydrophobicContact CD1-CG2 4.45Å; F56-V90 HydrophobicContact CE1-CG2 3.88Å; V90-H92 VanDerWaalsContact C-N 3.34Å; V90-H92 WeakPolarHBondContact CG2-CE1 3.27Å; V90-H92 PolarHBondContact O-N 3.39Å; V90-H92 VanDerWaalsContact O-N 3.11Å; V90-A93 HydrophobicContact CG2-CB 3.61Å; V90-A93 WeakPolarHBondContact O-CA 3.29Å; V90-A93 WeakPolarHBondContact O-CB 3.12Å; V90-A93 PolarHBondContact O-N 2.78Å; V90-F94 PolarHBondContact O-N 2.91Å
91A93.3Very high94.7Very high76 Ų7648 Ų4863%0.62825%0.249SC*.Hα-helixtrans-51.1-44.1-167.300000115.1F94 Q95A91-F94 PolarHBondContact O-N 3.27Å; A91-Q95 WeakPolarHBondContact O-CG 2.98Å; A91-Q95 PolarHBondContact O-N 2.69Å; A91-Q95 VanDerWaalsContact O-N 3.11Å
92H93.6Very high94.8Very high112 Ų11252.2 Ų52.252%0.51927%0.268SS..Hα-helixtrans-69.3-40.3179.265.8-90.8000112.2F56 V90 F94 Q95 D96F56-H92 AromaticContact CE1-NE2 3.59Å; F56-H92 AromaticContact CZ-NE2 3.72Å; V90-H92 VanDerWaalsContact C-N 3.34Å; V90-H92 WeakPolarHBondContact CG2-CE1 3.27Å; V90-H92 PolarHBondContact O-N 3.39Å; V90-H92 VanDerWaalsContact O-N 3.11Å; H92-F94 VanDerWaalsContact C-N 3.33Å; H92-Q95 PolarHBondContact O-N 2.95Å; H92-D96 PolarHBondContact O-N 2.77Å
93A95.6Very high94.9Very high0 Ų054.4 Ų54.40%028%0.276CS..Hα-helixtrans-65.5-38.8176.800000111F56 Q58 V90 D96 T97F56-A93 HydrophobicContact CD1-CB 3.66Å; F56-A93 HydrophobicContact CE1-CB 4.12Å; Q58-A93 PolarHBondContact OE1-O 3Å; V90-A93 HydrophobicContact CG2-CB 3.61Å; V90-A93 WeakPolarHBondContact O-CA 3.29Å; V90-A93 WeakPolarHBondContact O-CB 3.12Å; V90-A93 PolarHBondContact O-N 2.78Å; A93-D96 PolarHBondContact O-N 2.63Å; A93-T97 VanDerWaalsContact O-CB 3.3Å; A93-T97 WeakPolarHBondContact O-CB 3.34Å; A93-T97 PolarHBondContact O-N 3.11Å; A93-T97 PolarHBondContact O-OG1 2.7Å
94F97.4Very high94.9Very high32 Ų3254 Ų5414%0.1427%0.272CS..Hα-helixtrans-60.5-49.4173.9177.3-123.9000111.8L89 V90 A91 H92 D96 T97 L98 Q123 A126 I127L89-F94 HydrophobicContact CB-CB 4.05Å; V90-F94 PolarHBondContact O-N 2.91Å; A91-F94 PolarHBondContact O-N 3.27Å; H92-F94 VanDerWaalsContact C-N 3.33Å; F94-D96 VanDerWaalsContact C-N 3.34Å; F94-D96 PolarHBondContact O-N 2.73Å; F94-T97 WeakPolarHBondContact O-CB 3.12Å; F94-T97 PolarHBondContact O-N 3.45Å; F94-T97 VanDerWaalsContact O-N 3.12Å; F94-L98 HydrophobicContact CD1-CD1 4.49Å; F94-L98 HydrophobicContact CD2-CG 4.45Å; F94-L98 HydrophobicContact CE1-CD1 3.97Å; F94-L98 HydrophobicContact CE2-CD1 4.25Å; F94-L98 HydrophobicContact CE2-CD2 3.94Å; F94-L98 HydrophobicContact CE2-CG 4.05Å; F94-L98 HydrophobicContact CZ-CD1 3.84Å; F94-L98 HydrophobicContact CZ-CD2 4.11Å; F94-L98 HydrophobicContact CZ-CG 4.15Å; F94-L98 WeakPolarHBondContact O-CG 3.26Å; F94-L98 PolarHBondContact O-N 2.99Å; F94-Q123 HydrophobicContact CD1-CG 4.33Å; F94-Q123 HydrophobicContact CD2-CB 3.87Å; F94-Q123 HydrophobicContact CD2-CG 3.81Å; F94-Q123 HydrophobicContact CE1-CG 4.28Å; F94-Q123 VanDerWaalsContact CE2-CA 3.46Å; F94-Q123 HydrophobicContact CE2-CB 3.61Å; F94-Q123 HydrophobicContact CE2-CG 3.77Å; F94-Q123 HydrophobicContact CG-CG 4.1Å; F94-Q123 HydrophobicContact CZ-CB 4.17Å; F94-Q123 HydrophobicContact CZ-CG 4.01Å; F94-A126 HydrophobicContact CE2-CB 4.26Å; F94-A126 HydrophobicContact CZ-CB 3.84Å; F94-I127 HydrophobicContact CD2-CD1 4.04Å; F94-I127 HydrophobicContact CD2-CG1 4.39Å; F94-I127 HydrophobicContact CE2-CD1 3.99Å; F94-I127 HydrophobicContact CE2-CG1 3.98Å
95Q97.7Very high94.9Very high99 Ų9954.5 Ų54.546%0.46327%0.271SS..Hα-helixtrans-59.7-42.4177.8-70.5-61.7-39.800112.8A91 H92 L98 R99A91-Q95 WeakPolarHBondContact O-CG 2.98Å; A91-Q95 PolarHBondContact O-N 2.69Å; A91-Q95 VanDerWaalsContact O-N 3.11Å; H92-Q95 PolarHBondContact O-N 2.95Å; Q95-L98 PolarHBondContact O-N 2.68Å; Q95-R99 WeakPolarHBondContact O-CG 3.19Å; Q95-R99 PolarHBondContact O-N 3.17Å
96D98.1Very high94.8Very high40 Ų4061 Ų6121%0.21430%0.299CS..Hα-helixtrans-67.5-37.5175.4-81.1-9.6000112.2Q58 R62 H92 A93 F94 L98 R99 E100Q58-D96 HydrophobicContact CB-CB 3.92Å; Q58-D96 HydrophobicContact CG-CB 3.87Å; R62-D96 IonicContact NH2-OD2 3.59Å; H92-D96 PolarHBondContact O-N 2.77Å; A93-D96 PolarHBondContact O-N 2.63Å; F94-D96 VanDerWaalsContact C-N 3.34Å; F94-D96 PolarHBondContact O-N 2.73Å; D96-L98 VanDerWaalsContact C-N 3.31Å; D96-L98 PolarHBondContact O-N 3.24Å; D96-R99 WeakPolarHBondContact O-CB 3.49Å; D96-R99 PolarHBondContact O-N 3.42Å; D96-R99 VanDerWaalsContact O-N 3.13Å; D96-R99 IonicContact OD1-CZ 3.65Å; D96-R99 IonicContact OD1-NH1 2.82Å; D96-R99 PolarHBondContact OD1-NH1 2.91Å; D96-E100 WeakPolarHBondContact O-CG 3.45Å; D96-E100 PolarHBondContact O-N 3.33Å
97T98.4Very high94.9Very high0 Ų057.9 Ų57.90%028%0.282CS..Hα-helixtrans-61.3-41.3176.8-60.30000110.9M57 Q58 F61 L89 A93 F94 R99 E100 A101 I127M57-T97 HydrophobicContact CB-CG2 4.02Å; M57-T97 HydrophobicContact CG-CG2 3.94Å; M57-T97 HydrophobicContact SD-CG2 3.71Å; Q58-T97 PolarHBondContact N-OG1 2.95Å; Q58-T97 VanDerWaalsContact N-OG1 3.11Å; F61-T97 HydrophobicContact CD2-CG2 3.85Å; F61-T97 HydrophobicContact CE2-CG2 3.76Å; L89-T97 HydrophobicContact CD2-CG2 4.22Å; A93-T97 VanDerWaalsContact O-CB 3.3Å; A93-T97 WeakPolarHBondContact O-CB 3.34Å; A93-T97 PolarHBondContact O-N 3.11Å; A93-T97 PolarHBondContact O-OG1 2.7Å; F94-T97 WeakPolarHBondContact O-CB 3.12Å; F94-T97 PolarHBondContact O-N 3.45Å; F94-T97 VanDerWaalsContact O-N 3.12Å; T97-R99 VanDerWaalsContact C-N 3.31Å; T97-R99 PolarHBondContact O-N 3.34Å; T97-E100 PolarHBondContact O-N 3.38Å; T97-A101 VanDerWaalsContact O-CB 3.28Å; T97-A101 WeakPolarHBondContact O-CB 3.49Å; T97-A101 PolarHBondContact O-N 3.47Å; T97-I127 HydrophobicContact CG2-CD1 3.68Å; T97-I127 HydrophobicContact CG2-CG1 3.91Å; T97-I127 HydrophobicContact CG2-CG2 4.2Å
98L98.4Very high94.8Very high40 Ų4058.5 Ų58.521%0.20929%0.288CS..Hα-helixtrans-59.6-40.8174.6-66.1177000112.2F94 Q95 D96 Q102 A126 I127F94-L98 HydrophobicContact CD1-CD1 4.49Å; F94-L98 HydrophobicContact CD2-CG 4.45Å; F94-L98 HydrophobicContact CE1-CD1 3.97Å; F94-L98 HydrophobicContact CE2-CD1 4.25Å; F94-L98 HydrophobicContact CE2-CD2 3.94Å; F94-L98 HydrophobicContact CE2-CG 4.05Å; F94-L98 HydrophobicContact CZ-CD1 3.84Å; F94-L98 HydrophobicContact CZ-CD2 4.11Å; F94-L98 HydrophobicContact CZ-CG 4.15Å; F94-L98 WeakPolarHBondContact O-CG 3.26Å; F94-L98 PolarHBondContact O-N 2.99Å; Q95-L98 PolarHBondContact O-N 2.68Å; D96-L98 VanDerWaalsContact C-N 3.31Å; D96-L98 PolarHBondContact O-N 3.24Å; L98-Q102 WeakPolarHBondContact O-CB 3.48Å; L98-Q102 PolarHBondContact O-N 2.81Å; L98-A126 HydrophobicContact CD2-CB 3.9Å; L98-A126 WeakPolarHBondContact CD2-O 3.46Å; L98-I127 HydrophobicContact CD2-CG1 3.9Å
99R98.4Very high94.8Very high145 Ų14553 Ų5355%0.54726%0.263SS..Hα-helixtrans-65-46.3177.2-64.8170.9-174.6159.5-4.7111.5Q95 D96 T97 Q102 K103Q95-R99 WeakPolarHBondContact O-CG 3.19Å; Q95-R99 PolarHBondContact O-N 3.17Å; D96-R99 WeakPolarHBondContact O-CB 3.49Å; D96-R99 PolarHBondContact O-N 3.42Å; D96-R99 VanDerWaalsContact O-N 3.13Å; D96-R99 IonicContact OD1-CZ 3.65Å; D96-R99 IonicContact OD1-NH1 2.82Å; D96-R99 PolarHBondContact OD1-NH1 2.91Å; T97-R99 VanDerWaalsContact C-N 3.31Å; T97-R99 PolarHBondContact O-N 3.34Å; R99-Q102 PolarHBondContact O-N 3.47Å; R99-K103 WeakPolarHBondContact O-CG 3.21Å; R99-K103 PolarHBondContact O-N 3.1Å
100E98.4Very high94.7Very high15 Ų1553.8 Ų53.87%0.0727%0.266CS..Hα-helixtrans-68.7-40.1179.3-58.4-55.8146.200111.7Q58 F61 R62 I65 D96 T97 Q102 K103 A104Q58-E100 HydrophobicContact CB-CG 4.2Å; F61-E100 HydrophobicContact CB-CB 3.58Å; F61-E100 HydrophobicContact CB-CG 4.49Å; F61-E100 HydrophobicContact CG-CB 4.28Å; R62-E100 HydrophobicContact CG-CG 4.05Å; R62-E100 IonicContact NE-OE1 3.43Å; I65-E100 HydrophobicContact CD1-CB 4.18Å; I65-E100 WeakPolarHBondContact CD1-O 3.46Å; I65-E100 WeakPolarHBondContact CD1-OE2 3.3Å; D96-E100 WeakPolarHBondContact O-CG 3.45Å; D96-E100 PolarHBondContact O-N 3.33Å; T97-E100 PolarHBondContact O-N 3.38Å; E100-Q102 VanDerWaalsContact C-N 3.3Å; E100-Q102 PolarHBondContact O-N 3.3Å; E100-K103 VanDerWaalsContact CD-NZ 3.3Å; E100-K103 WeakPolarHBondContact O-CB 3.35Å; E100-K103 PolarHBondContact O-N 3.14Å; E100-K103 VanDerWaalsContact O-N 3.1Å; E100-K103 IonicContact OE1-NZ 3.76Å; E100-K103 PolarHBondContact OE1-NZ 3.46Å; E100-K103 WeakPolarHBondContact OE2-CD 3.18Å; E100-K103 IonicContact OE2-NZ 2.69Å; E100-K103 PolarHBondContact OE2-NZ 3.48Å; E100-K103 VanDerWaalsContact OE2-NZ 3.14Å; E100-A104 PolarHBondContact O-N 3.21Å
101A98.2Very high94.9Very high0 Ų050.5 Ų50.50%025%0.246CC..Hα-helixtrans-58.6-42.4172.700000111.4F61 T97 K103 A104 R105 I127F61-A101 HydrophobicContact CD1-CB 4.34Å; F61-A101 HydrophobicContact CE1-CB 3.84Å; F61-A101 HydrophobicContact CZ-CB 4.01Å; T97-A101 VanDerWaalsContact O-CB 3.28Å; T97-A101 WeakPolarHBondContact O-CB 3.49Å; T97-A101 PolarHBondContact O-N 3.47Å; A101-K103 VanDerWaalsContact C-N 3.35Å; A101-K103 PolarHBondContact O-N 3.41Å; A101-A104 PolarHBondContact O-N 2.87Å; A101-R105 WeakPolarHBondContact O-CG 3.44Å; A101-R105 PolarHBondContact O-N 3.11Å; A101-I127 HydrophobicContact CB-CG2 4.34Å
102Q97.3Very high94.9Very high105 Ų10546.9 Ų46.949%0.49122%0.217SC..Hα-helixtrans-63.1-38174.7-166.2-176.116.300112.7L98 R99 E100 R105 K106L98-Q102 WeakPolarHBondContact O-CB 3.48Å; L98-Q102 PolarHBondContact O-N 2.81Å; R99-Q102 PolarHBondContact O-N 3.47Å; E100-Q102 VanDerWaalsContact C-N 3.3Å; E100-Q102 PolarHBondContact O-N 3.3Å; Q102-R105 PolarHBondContact O-N 2.82Å; Q102-K106 WeakPolarHBondContact O-CG 3.49Å; Q102-K106 PolarHBondContact O-N 3.24Å; Q102-K106 VanDerWaalsContact O-N 3.08Å
103K96.2Very high95Very high100 Ų10041.6 Ų41.644%0.43519%0.192SC..Hα-helixtrans-63.4-45.8173.9-69.3172.7-169.9169.50111.3I65 R99 E100 A101 R105 K106 L107I65-K103 HydrophobicContact CD1-CB 3.92Å; I65-K103 HydrophobicContact CD1-CD 4.5Å; R99-K103 WeakPolarHBondContact O-CG 3.21Å; R99-K103 PolarHBondContact O-N 3.1Å; E100-K103 VanDerWaalsContact CD-NZ 3.3Å; E100-K103 WeakPolarHBondContact O-CB 3.35Å; E100-K103 PolarHBondContact O-N 3.14Å; E100-K103 VanDerWaalsContact O-N 3.1Å; E100-K103 IonicContact OE1-NZ 3.76Å; E100-K103 PolarHBondContact OE1-NZ 3.46Å; E100-K103 WeakPolarHBondContact OE2-CD 3.18Å; E100-K103 IonicContact OE2-NZ 2.69Å; E100-K103 PolarHBondContact OE2-NZ 3.48Å; E100-K103 VanDerWaalsContact OE2-NZ 3.14Å; A101-K103 VanDerWaalsContact C-N 3.35Å; A101-K103 PolarHBondContact O-N 3.41Å; K103-R105 VanDerWaalsContact C-N 3.3Å; K103-R105 PolarHBondContact O-N 2.94Å; K103-K106 WeakPolarHBondContact O-CB 3.4Å; K103-K106 PolarHBondContact O-N 3.23Å; K103-K106 VanDerWaalsContact O-N 3.11Å; K103-L107 PolarHBondContact O-N 3.07Å; K103-L107 VanDerWaalsContact O-N 3.11Å
104A95.2Very high94.9Very high0 Ų041.7 Ų41.70%019%0.193CC..Hα-helixtrans-57.4-43.417600000111.9F61 I65 I81 E100 A101 K106 L107 G108 A109F61-A104 HydrophobicContact CD1-CB 4.41Å; I65-A104 HydrophobicContact CG1-CB 4.08Å; I81-A104 HydrophobicContact CD1-CB 3.59Å; E100-A104 PolarHBondContact O-N 3.21Å; A101-A104 PolarHBondContact O-N 2.87Å; A104-K106 PolarHBondContact O-N 2.85Å; A104-L107 WeakPolarHBondContact O-CA 3.29Å; A104-L107 WeakPolarHBondContact O-CB 3.43Å; A104-L107 PolarHBondContact O-N 3.33Å; A104-L107 VanDerWaalsContact O-N 3.11Å; A104-G108 PolarHBondContact O-N 3.03Å; A104-A109 HydrophobicContact CB-CB 4.15Å; A104-A109 VanDerWaalsContact O-CB 3.29Å; A104-A109 WeakPolarHBondContact O-CB 3.34Å; A104-A109 PolarHBondContact O-N 3.47Å
105R93.2Very high94.6Very high69 Ų6940.1 Ų40.126%0.2619%0.186SC..Hα-helixtrans-60.3-41.5174.7-68.1171.4-169.5132.4-17.8112.8A101 Q102 K103 L107 G108 V111 I127 A128 D129A101-R105 WeakPolarHBondContact O-CG 3.44Å; A101-R105 PolarHBondContact O-N 3.11Å; Q102-R105 PolarHBondContact O-N 2.82Å; K103-R105 VanDerWaalsContact C-N 3.3Å; K103-R105 PolarHBondContact O-N 2.94Å; R105-L107 PolarHBondContact O-N 3.15Å; R105-G108 WeakPolarHBondContact O-CA 3.49Å; R105-G108 PolarHBondContact O-N 2.93Å; R105-V111 HydrophobicContact CG-CG2 4.1Å; R105-I127 PolarHBondContact NH2-O 3.24Å; R105-A128 PolarHBondContact NH2-O 3.35Å; R105-D129 VanDerWaalsContact CD-OD1 3.3Å; R105-D129 WeakPolarHBondContact CD-OD1 3.38Å; R105-D129 WeakPolarHBondContact CG-OD1 3.43Å; R105-D129 IonicContact CZ-OD1 2.63Å; R105-D129 IonicContact NE-OD1 3.88Å; R105-D129 PolarHBondContact NE-OD1 3.17Å; R105-D129 IonicContact NH2-OD1 3.6Å
106K90.4Very high94.1Very high143 Ų14335.7 Ų35.762%0.62217%0.166SC*.Hα-helixtrans-63-29.4175.9-72.7176.1179.6179.20112.6K76 Q102 K103 A104 G108K76-K106 PolarHBondContact NZ-O 3.34Å; Q102-K106 WeakPolarHBondContact O-CG 3.49Å; Q102-K106 PolarHBondContact O-N 3.24Å; Q102-K106 VanDerWaalsContact O-N 3.08Å; K103-K106 WeakPolarHBondContact O-CB 3.4Å; K103-K106 PolarHBondContact O-N 3.23Å; K103-K106 VanDerWaalsContact O-N 3.11Å; A104-K106 PolarHBondContact O-N 2.85Å; K106-G108 PolarHBondContact O-N 3.44Å
107L88.6Confident93.4Very high40 Ų4036.2 Ų36.221%0.20918%0.176CC..THydrogen-bonded Turntrans-77-4.6172.4-64.6171.4000113.2I65 I68 E69 K103 A104 R105I65-L107 HydrophobicContact CB-CD1 4.49Å; I65-L107 HydrophobicContact CG1-CD1 4.47Å; I65-L107 HydrophobicContact CG2-CD1 3.76Å; I68-L107 HydrophobicContact CG2-CB 3.98Å; I68-L107 HydrophobicContact CG2-CD1 4.26Å; E69-L107 HydrophobicContact CG-CD1 3.75Å; E69-L107 HydrophobicContact CG-CD2 4.21Å; K103-L107 PolarHBondContact O-N 3.07Å; K103-L107 VanDerWaalsContact O-N 3.11Å; A104-L107 WeakPolarHBondContact O-CA 3.29Å; A104-L107 WeakPolarHBondContact O-CB 3.43Å; A104-L107 PolarHBondContact O-N 3.33Å; A104-L107 VanDerWaalsContact O-N 3.11Å; R105-L107 PolarHBondContact O-N 3.15Å
108G85.4Confident92.8Very high27 Ų2742.8 Ų42.828%0.27821%0.21SC..THydrogen-bonded Turntrans94.913.517800000114.1A104 R105 K106A104-G108 PolarHBondContact O-N 3.03Å; R105-G108 WeakPolarHBondContact O-CA 3.49Å; R105-G108 PolarHBondContact O-N 2.93Å; K106-G108 PolarHBondContact O-N 3.44Å
109A91Very high92.4Very high0 Ų042.3 Ų42.30%021%0.206CC..EExtended strand (participates in β ladder)trans-77.7139.5175.200000111.8I68 S79 I81 A104I68-A109 HydrophobicContact CD1-CB 4.01Å; S79-A109 CarbonylContact O-C 3.59Å; S79-A109 VanDerWaalsContact O-CA 3.29Å; S79-A109 WeakPolarHBondContact O-CA 3.43Å; I81-A109 HydrophobicContact CD1-CB 4.32Å; I81-A109 HydrophobicContact CG1-CB 4.35Å; A104-A109 HydrophobicContact CB-CB 4.15Å; A104-A109 VanDerWaalsContact O-CB 3.29Å; A104-A109 WeakPolarHBondContact O-CB 3.34Å; A104-A109 PolarHBondContact O-N 3.47Å
110N91.6Very high92.2Very high17 Ų1737.7 Ų37.79%0.09119%0.192CC..EExtended strand (participates in β ladder)trans-88.3130.6160.5-69.6-51.6000109.9S79 M80 I81 Y112 D129 N184 K186S79-N110 PolarHBondContact O-N 2.95Å; M80-N110 WeakPolarHBondContact CA-O 3.33Å; I81-N110 PolarHBondContact N-O 2.85Å; N110-Y112 HydrophobicContact CB-CE2 4.04Å; N110-D129 WeakPolarHBondContact CA-OD2 3.44Å; N110-D129 PolarHBondContact OD1-OD2 3.09Å; N110-N184 PolarHBondContact ND2-O 2.85Å; N110-N184 PolarHBondContact OD1-O 3.12Å; N110-K186 WeakPolarHBondContact OD1-CE 3.28Å; N110-K186 PolarHBondContact OD1-NZ 3.39Å
111V95.8Very high92Very high0 Ų041.2 Ų41.20%021%0.211CC..EExtended strand (participates in β ladder)trans-106118.6-178.3-174.40000110.8F61 R105 I127 D129 H133F61-V111 HydrophobicContact CE1-CG1 3.94Å; F61-V111 HydrophobicContact CE1-CG2 4.2Å; F61-V111 HydrophobicContact CZ-CG1 3.72Å; R105-V111 HydrophobicContact CG-CG2 4.1Å; V111-I127 HydrophobicContact CG1-CG2 4.29Å; V111-I127 WeakPolarHBondContact CG1-O 3.04Å; V111-D129 WeakPolarHBondContact CB-OD1 3.49Å; V111-D129 VanDerWaalsContact N-CG 3.27Å; V111-D129 PolarHBondContact N-OD1 2.97Å; V111-D129 PolarHBondContact N-OD2 3.27Å; V111-D129 VanDerWaalsContact N-OD2 3.11Å; V111-D129 PolarHBondContact O-N 2.99Å; V111-H133 WeakPolarHBondContact O-CB 3.34Å
112Y94.9Very high91.9Very high0 Ų047.3 Ų47.30%024%0.244CC..EExtended strand (participates in β ladder)trans-107.1147.7170.3-60.3-98000109.8M80 I81 I82 A83 N110 H133 F135 L151 K154 V155 N184M80-Y112 HydrophobicContact CE-CD2 4.36Å; M80-Y112 HydrophobicContact CE-CE2 3.44Å; M80-Y112 VanDerWaalsContact CE-CE2 3.44Å; M80-Y112 HydrophobicContact CG-CD2 3.75Å; M80-Y112 HydrophobicContact CG-CE2 3.71Å; M80-Y112 HydrophobicContact SD-CD2 3.87Å; M80-Y112 HydrophobicContact SD-CE2 3.51Å; M80-Y112 VanDerWaalsContact SD-CE2 3.51Å; I81-Y112 PolarHBondContact O-N 3.42Å; I82-Y112 HydrophobicContact CG1-CD2 4.46Å; A83-Y112 PolarHBondContact N-O 2.98Å; N110-Y112 HydrophobicContact CB-CE2 4.04Å; Y112-H133 WeakPolarHBondContact CA-O 3.2Å; Y112-H133 HydrophobicContact CD1-CB 3.79Å; Y112-H133 AromaticContact CD1-CD2 3.52Å; Y112-H133 AromaticContact CD1-CG 3.98Å; Y112-H133 HydrophobicContact CE1-CB 4.24Å; Y112-H133 AromaticContact CE1-CD2 3.17Å; Y112-H133 WeakPolarHBondContact CE1-CD2 3.45Å; Y112-H133 AromaticContact CE1-CG 3.92Å; Y112-H133 AromaticContact CE1-NE2 3.97Å; Y112-H133 AromaticContact CE2-CD2 3.85Å; Y112-H133 HydrophobicContact CG-CB 4.34Å; Y112-H133 AromaticContact CZ-CD2 3.37Å; Y112-H133 AromaticContact CZ-NE2 3.89Å; Y112-F135 AromaticContact CD1-CE2 3.81Å; Y112-F135 HydrophobicContact CD1-CE2 3.81Å; Y112-L151 HydrophobicContact CD1-CD1 4.07Å; Y112-L151 HydrophobicContact CE1-CD1 4.39Å; Y112-L151 HydrophobicContact CG-CD1 4.24Å; Y112-K154 HydrophobicContact CE1-CB 4.26Å; Y112-V155 HydrophobicContact CE1-CG2 4.48Å; Y112-V155 HydrophobicContact CE2-CG2 4.27Å; Y112-N184 PolarHBondContact OH-ND2 2.87Å; Y112-N184 PolarHBondContact OH-OD1 3.09Å
113T95.2Very high91.8Very high1 Ų143 Ų431%0.00622%0.224CC..EExtended strand (participates in β ladder)trans-125.7136.9175.658.60000110.9A83 I124 I127 A128 H133 F135A83-T113 CarbonylContact O-C 3.57Å; A83-T113 VanDerWaalsContact O-CA 3.28Å; A83-T113 WeakPolarHBondContact O-CA 3.43Å; T113-I124 HydrophobicContact CG2-CB 4.4Å; T113-I124 WeakPolarHBondContact CG2-O 3.29Å; T113-I124 PolarHBondContact OG1-O 3.32Å; T113-I124 VanDerWaalsContact OG1-O 3.09Å; T113-I127 HydrophobicContact CG2-CB 3.91Å; T113-I127 HydrophobicContact CG2-CG2 3.72Å; T113-A128 HydrophobicContact CG2-CB 3.99Å; T113-H133 PolarHBondContact N-O 3.1Å; T113-F135 PolarHBondContact O-N 2.71Å
114L92.2Very high91.9Very high2 Ų238.3 Ų38.31%0.0120%0.203CC..EExtended strand (participates in β ladder)trans-123.4108.3176.9-177.165.6000108.9W2 A83 M84 T85 V116 F135 V137 L144 T147W2-L114 HydrophobicContact CD2-CD2 4.1Å; W2-L114 HydrophobicContact CE3-CD2 4.24Å; W2-L114 HydrophobicContact CH2-CD2 3.71Å; W2-L114 HydrophobicContact CZ2-CD2 3.49Å; W2-L114 VanDerWaalsContact CZ2-CD2 3.49Å; W2-L114 HydrophobicContact CZ3-CD2 4.07Å; A83-L114 PolarHBondContact O-N 3.44Å; M84-L114 VanDerWaalsContact CA-O 3.31Å; M84-L114 WeakPolarHBondContact CA-O 3.33Å; M84-L114 HydrophobicContact CE-CD2 3.75Å; M84-L114 HydrophobicContact CG-CB 4.05Å; M84-L114 HydrophobicContact CG-CD2 4Å; M84-L114 HydrophobicContact CG-CG 4.49Å; M84-L114 HydrophobicContact SD-CD2 4.07Å; T85-L114 PolarHBondContact N-O 3.42Å; L114-V116 HydrophobicContact CG-CG2 4.45Å; L114-F135 CarbonylContact C-O 2.72Å; L114-F135 VanDerWaalsContact CA-O 3.28Å; L114-F135 WeakPolarHBondContact CA-O 3.46Å; L114-F135 HydrophobicContact CD1-CB 3.32Å; L114-F135 HydrophobicContact CD1-CG 4.33Å; L114-V137 HydrophobicContact CD1-CG2 4.02Å; L114-L144 HydrophobicContact CD1-CD1 3.73Å; L114-L144 HydrophobicContact CD2-CD1 3.72Å; L114-L144 HydrophobicContact CD2-CD2 4.39Å; L114-L144 HydrophobicContact CD2-CG 4.14Å; L114-L144 HydrophobicContact CG-CD1 3.85Å; L114-T147 HydrophobicContact CD1-CG2 4.16Å
115G91.4Very high91.9Very high0 Ų040.7 Ų40.70%022%0.218CC..EExtended strand (participates in β ladder)trans-91.8132.917300000110.6T85 Y119 F135 V137T85-G115 WeakPolarHBondContact O-CA 3.5Å; G115-Y119 WeakPolarHBondContact O-CE1 3.17Å; G115-F135 PolarHBondContact N-O 3.44Å; G115-V137 PolarHBondContact O-N 3.1Å
116V86.8Confident92.1Very high6 Ų639.7 Ų39.74%0.03622%0.224CC..EExtended strand (participates in β ladder)trans-123.3123.9175.3-170.70000109.7T85 D86 L114 D118 F141 L144T85-V116 PolarHBondContact O-N 3.39Å; D86-V116 CarbonylContact C-O 3.58Å; D86-V116 WeakPolarHBondContact CA-O 2.93Å; L114-V116 HydrophobicContact CG-CG2 4.45Å; V116-D118 PolarHBondContact O-N 3.05Å; V116-D118 VanDerWaalsContact O-N 3.11Å; V116-F141 HydrophobicContact CG1-CD2 4.41Å; V116-F141 HydrophobicContact CG1-CE1 4.36Å; V116-F141 HydrophobicContact CG1-CE2 4.19Å; V116-F141 HydrophobicContact CG1-CZ 4.17Å; V116-L144 HydrophobicContact CG2-CD1 3.5Å; V116-L144 VanDerWaalsContact CG2-CD1 3.5Å; V116-L144 HydrophobicContact CG2-CD2 4.29Å
117A83.5Confident92.5Very high51 Ų5132.9 Ų32.942%0.42120%0.195SC..EExtended strand (participates in β ladder)trans60.1-104.6-17900000114.4Y119 V137A117-Y119 VanDerWaalsContact C-N 3.27Å; A117-Y119 VanDerWaalsContact O-CD1 3.28Å; A117-Y119 WeakPolarHBondContact O-CD1 3.3Å; A117-Y119 WeakPolarHBondContact O-CE1 3.47Å; A117-Y119 PolarHBondContact O-N 2.82Å; A117-Y119 VanDerWaalsContact O-N 3.1Å; A117-V137 PolarHBondContact N-O 3.38Å
118D85.8Confident92.8Very high137 Ų13731.2 Ų31.273%0.73319%0.187SC*.EExtended strand (participates in β ladder)trans-88.230.5-162-59.6-44.7000114.4D86 G87 E88 V116D86-D118 CarbonylContact O-C 3.57Å; D86-D118 WeakPolarHBondContact O-CB 3.4Å; D86-D118 PolarHBondContact O-N 3.36Å; G87-D118 CarbonylContact C-O 3.58Å; G87-D118 WeakPolarHBondContact CA-O 3.37Å; E88-D118 PolarHBondContact N-O 2.99Å; V116-D118 PolarHBondContact O-N 3.05Å; V116-D118 VanDerWaalsContact O-N 3.11Å
119Y91.3Very high93.2Very high31 Ų3131.5 Ų31.512%0.12218%0.182CC..  trans-76.4156177.562.6-88.6000112.3G115 A117 L121 I124 A136 V137G115-Y119 WeakPolarHBondContact O-CE1 3.17Å; A117-Y119 VanDerWaalsContact C-N 3.27Å; A117-Y119 VanDerWaalsContact O-CD1 3.28Å; A117-Y119 WeakPolarHBondContact O-CD1 3.3Å; A117-Y119 WeakPolarHBondContact O-CE1 3.47Å; A117-Y119 PolarHBondContact O-N 2.82Å; A117-Y119 VanDerWaalsContact O-N 3.1Å; Y119-L121 HydrophobicContact CE2-CB 4.31Å; Y119-L121 HydrophobicContact CE2-CD1 4.28Å; Y119-I124 HydrophobicContact CD2-CD1 3.47Å; Y119-I124 VanDerWaalsContact CD2-CD1 3.47Å; Y119-I124 HydrophobicContact CD2-CG1 4.21Å; Y119-I124 HydrophobicContact CE2-CD1 3.72Å; Y119-I124 HydrophobicContact CG-CD1 4.24Å; Y119-A136 HydrophobicContact CE2-CB 3.96Å; Y119-A136 WeakPolarHBondContact OH-CA 3.45Å; Y119-A136 WeakPolarHBondContact OH-CB 3.48Å; Y119-V137 PolarHBondContact OH-N 3.17Å
120N93.9Very high93.1Very high47 Ų4733.6 Ų33.625%0.25120%0.197SC..  trans-91.2118.5167.3-177.5-50.7000110.1E88 D122 Q123 I124E88-N120 HydrophobicContact CB-CB 4.21Å; E88-N120 HydrophobicContact CG-CB 3.85Å; E88-N120 PolarHBondContact OE1-ND2 3.3Å; N120-D122 PolarHBondContact O-N 3.36Å; N120-D122 WeakPolarHBondContact OD1-CB 3.32Å; N120-D122 PolarHBondContact OD1-N 3.48Å; N120-Q123 HydrophobicContact CB-CB 4.07Å; N120-Q123 HydrophobicContact CB-CG 3.82Å; N120-Q123 PolarHBondContact O-N 3.11Å; N120-Q123 PolarHBondContact OD1-N 3.44Å; N120-Q123 VanDerWaalsContact OD1-N 3.15Å; N120-I124 PolarHBondContact O-N 2.93Å; N120-I124 VanDerWaalsContact O-N 3.17Å
121L93.7Very high92.8Very high89 Ų8937.8 Ų37.847%0.46623%0.225SC..Hα-helixtrans-61.8-40.3-175.8-178.960.4000112.8Y119 Q123 I124 T125 V134 A136Y119-L121 HydrophobicContact CE2-CB 4.31Å; Y119-L121 HydrophobicContact CE2-CD1 4.28Å; L121-Q123 VanDerWaalsContact C-N 3.3Å; L121-Q123 PolarHBondContact O-N 3Å; L121-I124 HydrophobicContact CD1-CD1 4.19Å; L121-I124 HydrophobicContact CD1-CG1 4.3Å; L121-I124 WeakPolarHBondContact O-CG1 3.31Å; L121-T125 VanDerWaalsContact O-CB 3.24Å; L121-T125 WeakPolarHBondContact O-CB 3.33Å; L121-T125 PolarHBondContact O-N 2.81Å; L121-T125 PolarHBondContact O-OG1 2.9Å; L121-V134 HydrophobicContact CD1-CG1 4.32Å; L121-A136 HydrophobicContact CD1-CB 4.15Å
122D95.8Very high92.3Very high129 Ų12939.3 Ų39.369%0.6924%0.24SC*.Hα-helixtrans-65.9-38.2179.9-67.3-27.3000110.7N120 T125 A126N120-D122 PolarHBondContact O-N 3.36Å; N120-D122 WeakPolarHBondContact OD1-CB 3.32Å; N120-D122 PolarHBondContact OD1-N 3.48Å; D122-T125 PolarHBondContact O-N 2.83Å; D122-A126 WeakPolarHBondContact O-CB 3.42Å; D122-A126 PolarHBondContact O-N 3.3Å
123Q96.8Very high92.1Very high14 Ų1439.5 Ų39.57%0.06524%0.241CC..Hα-helixtrans-64.9-52.4178.3-68-175-10.400112L89 F94 N120 L121 T125 A126 I127L89-Q123 PolarHBondContact O-NE2 2.82Å; F94-Q123 HydrophobicContact CD1-CG 4.33Å; F94-Q123 HydrophobicContact CD2-CB 3.87Å; F94-Q123 HydrophobicContact CD2-CG 3.81Å; F94-Q123 HydrophobicContact CE1-CG 4.28Å; F94-Q123 VanDerWaalsContact CE2-CA 3.46Å; F94-Q123 HydrophobicContact CE2-CB 3.61Å; F94-Q123 HydrophobicContact CE2-CG 3.77Å; F94-Q123 HydrophobicContact CG-CG 4.1Å; F94-Q123 HydrophobicContact CZ-CB 4.17Å; F94-Q123 HydrophobicContact CZ-CG 4.01Å; N120-Q123 HydrophobicContact CB-CB 4.07Å; N120-Q123 HydrophobicContact CB-CG 3.82Å; N120-Q123 PolarHBondContact O-N 3.11Å; N120-Q123 PolarHBondContact OD1-N 3.44Å; N120-Q123 VanDerWaalsContact OD1-N 3.15Å; L121-Q123 VanDerWaalsContact C-N 3.3Å; L121-Q123 PolarHBondContact O-N 3Å; Q123-T125 VanDerWaalsContact C-N 3.25Å; Q123-T125 PolarHBondContact O-N 3.06Å; Q123-A126 PolarHBondContact O-N 3.25Å; Q123-I127 WeakPolarHBondContact O-CD1 2.93Å; Q123-I127 VanDerWaalsContact O-CG1 3.26Å; Q123-I127 WeakPolarHBondContact O-CG1 3.12Å; Q123-I127 PolarHBondContact O-N 2.95Å
124I96.4Very high92Very high1 Ų140.5 Ų40.51%0.00525%0.247CC..Hα-helixtrans-64.4-35179.964.8170.5000111T85 T113 Y119 N120 L121 I127 A128 V134T85-I124 HydrophobicContact CG2-CG2 3.73Å; T113-I124 HydrophobicContact CG2-CB 4.4Å; T113-I124 WeakPolarHBondContact CG2-O 3.29Å; T113-I124 PolarHBondContact OG1-O 3.32Å; T113-I124 VanDerWaalsContact OG1-O 3.09Å; Y119-I124 HydrophobicContact CD2-CD1 3.47Å; Y119-I124 VanDerWaalsContact CD2-CD1 3.47Å; Y119-I124 HydrophobicContact CD2-CG1 4.21Å; Y119-I124 HydrophobicContact CE2-CD1 3.72Å; Y119-I124 HydrophobicContact CG-CD1 4.24Å; N120-I124 PolarHBondContact O-N 2.93Å; N120-I124 VanDerWaalsContact O-N 3.17Å; L121-I124 HydrophobicContact CD1-CD1 4.19Å; L121-I124 HydrophobicContact CD1-CG1 4.3Å; L121-I124 WeakPolarHBondContact O-CG1 3.31Å; I124-I127 PolarHBondContact O-N 3.36Å; I124-A128 WeakPolarHBondContact O-CB 3.34Å; I124-A128 PolarHBondContact O-N 3.48Å; I124-V134 HydrophobicContact CD1-CG1 3.67Å; I124-V134 HydrophobicContact CG1-CG1 3.92Å
125T96.6Very high91.9Very high50 Ų5041.1 Ų41.131%0.30725%0.25SC..Hα-helixtrans-64.9-41.1176-58.60000112.4L121 D122 Q123 I127 V134L121-T125 VanDerWaalsContact O-CB 3.24Å; L121-T125 WeakPolarHBondContact O-CB 3.33Å; L121-T125 PolarHBondContact O-N 2.81Å; L121-T125 PolarHBondContact O-OG1 2.9Å; D122-T125 PolarHBondContact O-N 2.83Å; Q123-T125 VanDerWaalsContact C-N 3.25Å; Q123-T125 PolarHBondContact O-N 3.06Å; T125-I127 VanDerWaalsContact C-N 3.33Å; T125-V134 HydrophobicContact CG2-CG2 4.33Å
126A97.1Very high91.7Very high48 Ų4843.5 Ų43.540%0.39727%0.269SS..Hα-helixtrans-69.8-30.117700000113.2F94 L98 D122 Q123F94-A126 HydrophobicContact CE2-CB 4.26Å; F94-A126 HydrophobicContact CZ-CB 3.84Å; L98-A126 HydrophobicContact CD2-CB 3.9Å; L98-A126 WeakPolarHBondContact CD2-O 3.46Å; D122-A126 WeakPolarHBondContact O-CB 3.42Å; D122-A126 PolarHBondContact O-N 3.3Å; Q123-A126 PolarHBondContact O-N 3.25Å
127I98.1Very high91.6Very high0 Ų043.5 Ų43.50%027%0.269CS..Hα-helixtrans-78.2-33.4178.1-65.9160.7000111.5M57 F61 L89 F94 T97 L98 A101 R105 V111 T113 Q123 I124 T125M57-I127 HydrophobicContact SD-CD1 3.95Å; M57-I127 HydrophobicContact SD-CG2 4.35Å; F61-I127 HydrophobicContact CE2-CG2 3.93Å; F61-I127 HydrophobicContact CZ-CG2 3.77Å; L89-I127 HydrophobicContact CD2-CD1 4.09Å; F94-I127 HydrophobicContact CD2-CD1 4.04Å; F94-I127 HydrophobicContact CD2-CG1 4.39Å; F94-I127 HydrophobicContact CE2-CD1 3.99Å; F94-I127 HydrophobicContact CE2-CG1 3.98Å; T97-I127 HydrophobicContact CG2-CD1 3.68Å; T97-I127 HydrophobicContact CG2-CG1 3.91Å; T97-I127 HydrophobicContact CG2-CG2 4.2Å; L98-I127 HydrophobicContact CD2-CG1 3.9Å; A101-I127 HydrophobicContact CB-CG2 4.34Å; R105-I127 PolarHBondContact NH2-O 3.24Å; V111-I127 HydrophobicContact CG1-CG2 4.29Å; V111-I127 WeakPolarHBondContact CG1-O 3.04Å; T113-I127 HydrophobicContact CG2-CB 3.91Å; T113-I127 HydrophobicContact CG2-CG2 3.72Å; Q123-I127 WeakPolarHBondContact O-CD1 2.93Å; Q123-I127 VanDerWaalsContact O-CG1 3.26Å; Q123-I127 WeakPolarHBondContact O-CG1 3.12Å; Q123-I127 PolarHBondContact O-N 2.95Å; I124-I127 PolarHBondContact O-N 3.36Å; T125-I127 VanDerWaalsContact C-N 3.33Å
128A96.2Very high91Very high5 Ų548.5 Ų48.54%0.04128%0.284CS..SBendtrans-67.8161.7177.100000112.8R105 T113 I124 H133 V134R105-A128 PolarHBondContact NH2-O 3.35Å; T113-A128 HydrophobicContact CG2-CB 3.99Å; I124-A128 WeakPolarHBondContact O-CB 3.34Å; I124-A128 PolarHBondContact O-N 3.48Å; A128-H133 HydrophobicContact CB-CB 4.04Å; A128-V134 HydrophobicContact CB-CG2 3.61Å
129D92.4Very high90.1Very high34 Ų3448.8 Ų48.818%0.18229%0.285CS..SBendtrans-72.8-31.4178.9-84.74.9000114.2R105 N110 V111 K186R105-D129 VanDerWaalsContact CD-OD1 3.3Å; R105-D129 WeakPolarHBondContact CD-OD1 3.38Å; R105-D129 WeakPolarHBondContact CG-OD1 3.43Å; R105-D129 IonicContact CZ-OD1 2.63Å; R105-D129 IonicContact NE-OD1 3.88Å; R105-D129 PolarHBondContact NE-OD1 3.17Å; R105-D129 IonicContact NH2-OD1 3.6Å; N110-D129 WeakPolarHBondContact CA-OD2 3.44Å; N110-D129 PolarHBondContact OD1-OD2 3.09Å; V111-D129 WeakPolarHBondContact CB-OD1 3.49Å; V111-D129 VanDerWaalsContact N-CG 3.27Å; V111-D129 PolarHBondContact N-OD1 2.97Å; V111-D129 PolarHBondContact N-OD2 3.27Å; V111-D129 VanDerWaalsContact N-OD2 3.11Å; V111-D129 PolarHBondContact O-N 2.99Å; D129-K186 IonicContact OD2-NZ 3.6Å; D129-K186 PolarHBondContact OD2-NZ 2.88Å
130S89.4Confident88.6Confident44 Ų4448.2 Ų48.231%0.30829%0.289SS..SBendtrans-158.1168.3173.581.50000109.4G132 H133S130-G132 PolarHBondContact O-N 3.05Å; S130-G132 VanDerWaalsContact O-N 3.1Å; S130-G132 PolarHBondContact OG-N 2.7Å; S130-H133 PolarHBondContact N-ND1 3.46Å; S130-H133 WeakPolarHBondContact O-CA 3.29Å; S130-H133 WeakPolarHBondContact O-CB 3.36Å; S130-H133 PolarHBondContact O-N 3.25Å; S130-H133 PolarHBondContact OG-CE1 3.15Å; S130-H133 PolarHBondContact OG-ND1 3.26Å
131P86.3Confident87Confident105 Ų10552.9 Ų52.968%0.68231%0.308SS*.G310 helixtrans-54.8-30.6174.5-26.835.8000113.2H133 V134P131-H133 PolarHBondContact O-N 3.29Å; P131-V134 PolarHBondContact O-N 3.01Å
132G85Confident85.4Confident31 Ų3157.9 Ų57.932%0.3233%0.325SS..G310 helixtrans-68.9-11.1174.400000114.6S130 K154S130-G132 PolarHBondContact O-N 3.05Å; S130-G132 VanDerWaalsContact O-N 3.1Å; S130-G132 PolarHBondContact OG-N 2.7Å; G132-K154 VanDerWaalsContact O-CD 3.32Å; G132-K154 WeakPolarHBondContact O-CD 3.38Å; G132-K154 WeakPolarHBondContact O-CE 3.48Å; G132-K154 PolarHBondContact O-NZ 3.23Å
133H91Very high83.9Confident4 Ų453.1 Ų53.12%0.01930%0.304CS..G310 helixtrans-993.9177.5-64.578.9000112.8V111 Y112 T113 A128 S130 P131 N184V111-H133 WeakPolarHBondContact O-CB 3.34Å; Y112-H133 WeakPolarHBondContact CA-O 3.2Å; Y112-H133 HydrophobicContact CD1-CB 3.79Å; Y112-H133 AromaticContact CD1-CD2 3.52Å; Y112-H133 AromaticContact CD1-CG 3.98Å; Y112-H133 HydrophobicContact CE1-CB 4.24Å; Y112-H133 AromaticContact CE1-CD2 3.17Å; Y112-H133 WeakPolarHBondContact CE1-CD2 3.45Å; Y112-H133 AromaticContact CE1-CG 3.92Å; Y112-H133 AromaticContact CE1-NE2 3.97Å; Y112-H133 AromaticContact CE2-CD2 3.85Å; Y112-H133 HydrophobicContact CG-CB 4.34Å; Y112-H133 AromaticContact CZ-CD2 3.37Å; Y112-H133 AromaticContact CZ-NE2 3.89Å; T113-H133 PolarHBondContact N-O 3.1Å; A128-H133 HydrophobicContact CB-CB 4.04Å; S130-H133 PolarHBondContact N-ND1 3.46Å; S130-H133 WeakPolarHBondContact O-CA 3.29Å; S130-H133 WeakPolarHBondContact O-CB 3.36Å; S130-H133 PolarHBondContact O-N 3.25Å; S130-H133 PolarHBondContact OG-CE1 3.15Å; S130-H133 PolarHBondContact OG-ND1 3.26Å; P131-H133 PolarHBondContact O-N 3.29Å; H133-N184 PolarHBondContact NE2-OD1 3.43Å
134V91.8Very high82.5Confident23 Ų2352.5 Ų52.514%0.13930%0.301CS..EExtended strand (participates in β ladder)trans-96.9132.7179.4-174.30000109.7L121 I124 T125 A128 P131L121-V134 HydrophobicContact CD1-CG1 4.32Å; I124-V134 HydrophobicContact CD1-CG1 3.67Å; I124-V134 HydrophobicContact CG1-CG1 3.92Å; T125-V134 HydrophobicContact CG2-CG2 4.33Å; A128-V134 HydrophobicContact CB-CG2 3.61Å; P131-V134 PolarHBondContact O-N 3.01Å
135F89.9Confident81.3Confident15 Ų1559.9 Ų59.97%0.06633%0.329CS..EExtended strand (participates in β ladder)trans-123.1109.8171-61.5-85000108.2Y112 T113 L114 G115 T147 A150 L151 K154Y112-F135 AromaticContact CD1-CE2 3.81Å; Y112-F135 HydrophobicContact CD1-CE2 3.81Å; T113-F135 PolarHBondContact O-N 2.71Å; L114-F135 CarbonylContact C-O 2.72Å; L114-F135 VanDerWaalsContact CA-O 3.28Å; L114-F135 WeakPolarHBondContact CA-O 3.46Å; L114-F135 HydrophobicContact CD1-CB 3.32Å; L114-F135 HydrophobicContact CD1-CG 4.33Å; G115-F135 PolarHBondContact N-O 3.44Å; F135-T147 HydrophobicContact CB-CG2 4.23Å; F135-T147 HydrophobicContact CD1-CG2 4.26Å; F135-A150 HydrophobicContact CE1-CB 3.81Å; F135-L151 HydrophobicContact CE1-CB 4.48Å; F135-L151 HydrophobicContact CE2-CB 4.32Å; F135-L151 HydrophobicContact CE2-CD1 3.69Å; F135-L151 HydrophobicContact CZ-CB 3.93Å; F135-L151 HydrophobicContact CZ-CD1 4.02Å; F135-K154 HydrophobicContact CE1-CD 4.49Å; F135-K154 HydrophobicContact CZ-CD 3.91Å
136A88.3Confident80.2Confident49 Ų4961.4 Ų61.441%0.40534%0.342SS..EExtended strand (participates in β ladder)trans-105.7118.3-178.200000108.2Y119 L121Y119-A136 HydrophobicContact CE2-CB 3.96Å; Y119-A136 WeakPolarHBondContact OH-CA 3.45Å; Y119-A136 WeakPolarHBondContact OH-CB 3.48Å; L121-A136 HydrophobicContact CD1-CB 4.15Å
137V83.8Confident79.4Confident6 Ų659.7 Ų59.74%0.03633%0.327CS..EExtended strand (participates in β ladder)trans-120.397.5-175.9-1750000110.5L114 G115 A117 Y119 G140 A143 L144 T147L114-V137 HydrophobicContact CD1-CG2 4.02Å; G115-V137 PolarHBondContact O-N 3.1Å; A117-V137 PolarHBondContact N-O 3.38Å; Y119-V137 PolarHBondContact OH-N 3.17Å; V137-G140 VanDerWaalsContact CG1-O 3.3Å; V137-G140 WeakPolarHBondContact CG1-O 3.48Å; V137-A143 HydrophobicContact CG1-CB 3.54Å; V137-L144 HydrophobicContact CB-CD1 4.02Å; V137-L144 HydrophobicContact CG1-CD1 4.19Å; V137-L144 HydrophobicContact CG2-CD1 3.69Å; V137-T147 HydrophobicContact CG2-CG2 3.44Å; V137-T147 VanDerWaalsContact CG2-CG2 3.44Å
138E71.3Confident78.5Confident157 Ų15759.9 Ų59.973%0.73433%0.328SS*.THydrogen-bonded Turntrans-79.2-33.3-177.8-61.9178.8175.200112.5G140E138-G140 VanDerWaalsContact C-N 3.3Å; E138-G140 PolarHBondContact O-N 3.13Å
139N67.4Low77.7Confident142 Ų14263.8 Ų63.876%0.75935%0.347SS*.THydrogen-bonded Turntrans-91.127.6-174.5-67-37.1000114.4A143N139-A143 HydrophobicContact CB-CB 4.07Å
140G60.1Low77.2Confident20 Ų2063.9 Ų63.921%0.20635%0.353CS..  trans66.8-169.2176.700000115.6V137 E138 K142 A143V137-G140 VanDerWaalsContact CG1-O 3.3Å; V137-G140 WeakPolarHBondContact CG1-O 3.48Å; E138-G140 VanDerWaalsContact C-N 3.3Å; E138-G140 PolarHBondContact O-N 3.13Å; G140-K142 PolarHBondContact O-N 3.25Å; G140-A143 PolarHBondContact O-N 3.38Å
141F59.4Low76.8Confident145 Ų14561.8 Ų61.864%0.63634%0.339SS*.THydrogen-bonded Turntrans-60.6-20.9-167.6-71.6-85.6000115.9V116 L144V116-F141 HydrophobicContact CG1-CD2 4.41Å; V116-F141 HydrophobicContact CG1-CE1 4.36Å; V116-F141 HydrophobicContact CG1-CE2 4.19Å; V116-F141 HydrophobicContact CG1-CZ 4.17Å; F141-L144 HydrophobicContact CD1-CD2 3.68Å; F141-L144 HydrophobicContact CE1-CD2 4.12Å; F141-L144 WeakPolarHBondContact O-CB 3.28Å; F141-L144 PolarHBondContact O-N 2.99Å
142K59.7Low76.5Confident193 Ų19358 Ų5884%0.83931%0.313SS*.THydrogen-bonded Turntrans-69.3-35.3175.4-74.9-176.5-179.81770112G140 L144G140-K142 PolarHBondContact O-N 3.25Å; K142-L144 VanDerWaalsContact C-N 3.26Å
143A65.9Low76Confident29 Ų2958.7 Ų58.724%0.2431%0.314CS..THydrogen-bonded Turntrans-78.2-12.2174.200000112.5V137 N139 G140 R145 S146V137-A143 HydrophobicContact CG1-CB 3.54Å; N139-A143 HydrophobicContact CB-CB 4.07Å; G140-A143 PolarHBondContact O-N 3.38Å; A143-R145 PolarHBondContact O-N 3.46Å; A143-S146 PolarHBondContact O-N 3.09Å; A143-S146 PolarHBondContact O-OG 2.88Å
144L67.3Low75.3Confident1 Ų161.1 Ų61.11%0.00532%0.324CS..Hα-helixtrans-65.5-26.5173.4-144.467.1000111.8W2 M84 L114 V116 V137 F141 K142 S146 T147W2-L144 HydrophobicContact CB-CD2 3.5Å; W2-L144 VanDerWaalsContact CB-CD2 3.5Å; W2-L144 HydrophobicContact CB-CG 4.24Å; W2-L144 HydrophobicContact CD2-CD2 3.98Å; W2-L144 HydrophobicContact CD2-CG 4.2Å; W2-L144 HydrophobicContact CG-CB 4.3Å; W2-L144 HydrophobicContact CG-CD2 3.34Å; W2-L144 HydrophobicContact CG-CG 3.63Å; W2-L144 PolarHBondContact NE1-O 3.1Å; M84-L144 HydrophobicContact CE-CD2 4.25Å; L114-L144 HydrophobicContact CD1-CD1 3.73Å; L114-L144 HydrophobicContact CD2-CD1 3.72Å; L114-L144 HydrophobicContact CD2-CD2 4.39Å; L114-L144 HydrophobicContact CD2-CG 4.14Å; L114-L144 HydrophobicContact CG-CD1 3.85Å; V116-L144 HydrophobicContact CG2-CD1 3.5Å; V116-L144 VanDerWaalsContact CG2-CD1 3.5Å; V116-L144 HydrophobicContact CG2-CD2 4.29Å; V137-L144 HydrophobicContact CB-CD1 4.02Å; V137-L144 HydrophobicContact CG1-CD1 4.19Å; V137-L144 HydrophobicContact CG2-CD1 3.69Å; F141-L144 HydrophobicContact CD1-CD2 3.68Å; F141-L144 HydrophobicContact CE1-CD2 4.12Å; F141-L144 WeakPolarHBondContact O-CB 3.28Å; F141-L144 PolarHBondContact O-N 2.99Å; K142-L144 VanDerWaalsContact C-N 3.26Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 2.96Å; L144-T147 PolarHBondContact O-N 3.45Å; L144-T147 PolarHBondContact O-OG1 3.09Å
145R71.4Confident74.5Confident156 Ų15661.2 Ų61.259%0.58932%0.324SS*.Hα-helixtrans-63.8-38.1176.5-73.5-169.6164.5162-1.1112.9E5 A143 T147 I148E5-R145 IonicContact OE1-CZ 3.26Å; E5-R145 VanDerWaalsContact OE1-CZ 3.26Å; E5-R145 IonicContact OE1-NE 3.52Å; E5-R145 PolarHBondContact OE1-NE 3.42Å; E5-R145 IonicContact OE1-NH2 2.76Å; E5-R145 PolarHBondContact OE1-NH2 3.33Å; E5-R145 WeakPolarHBondContact OE2-CG 3.48Å; E5-R145 IonicContact OE2-NE 2.94Å; E5-R145 PolarHBondContact OE2-NE 3.33Å; E5-R145 VanDerWaalsContact OE2-NE 3.17Å; A143-R145 PolarHBondContact O-N 3.46Å; R145-T147 PolarHBondContact O-N 2.98Å; R145-I148 WeakPolarHBondContact O-CB 3.31Å; R145-I148 PolarHBondContact O-N 3.11Å; R145-I148 VanDerWaalsContact O-N 3.11Å
146S72.5Confident73.7Confident82 Ų8262.7 Ų62.757%0.57334%0.336SS*.Hα-helixtrans-69.7-20.2178.261.70000112.5A143 L144 I148A143-S146 PolarHBondContact O-N 3.09Å; A143-S146 PolarHBondContact O-OG 2.88Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 2.96Å; S146-I148 VanDerWaalsContact C-N 3.31Å
147T80.1Confident73Confident13 Ų1362.5 Ų62.58%0.0833%0.328CS..Hα-helixtrans-75.5-20.3172.972.70000112.6W2 L114 F135 V137 L144 R145 A150 L151W2-T147 PolarHBondContact NE1-OG1 3.45Å; L114-T147 HydrophobicContact CD1-CG2 4.16Å; F135-T147 HydrophobicContact CB-CG2 4.23Å; F135-T147 HydrophobicContact CD1-CG2 4.26Å; V137-T147 HydrophobicContact CG2-CG2 3.44Å; V137-T147 VanDerWaalsContact CG2-CG2 3.44Å; L144-T147 PolarHBondContact O-N 3.45Å; L144-T147 PolarHBondContact O-OG1 3.09Å; R145-T147 PolarHBondContact O-N 2.98Å; T147-A150 PolarHBondContact O-N 3.21Å; T147-L151 WeakPolarHBondContact O-CB 3.44Å; T147-L151 PolarHBondContact O-N 2.99Å
148I80.6Confident72.6Confident4 Ų466.2 Ų66.22%0.02135%0.348CS..Hα-helixtrans-65.4-45.9178.8-60.3178.1000110.5W2 E5 R9 R145 S146 L151 T152W2-I148 HydrophobicContact CG-CD1 4.38Å; W2-I148 HydrophobicContact CG-CG1 4.48Å; W2-I148 HydrophobicContact CZ2-CG1 4.5Å; E5-I148 HydrophobicContact CB-CD1 3.46Å; E5-I148 VanDerWaalsContact CB-CD1 3.46Å; E5-I148 HydrophobicContact CG-CD1 4.49Å; E5-I148 WeakPolarHBondContact OE2-CD1 3.28Å; R9-I148 HydrophobicContact CG-CG2 3.78Å; R145-I148 WeakPolarHBondContact O-CB 3.31Å; R145-I148 PolarHBondContact O-N 3.11Å; R145-I148 VanDerWaalsContact O-N 3.11Å; S146-I148 VanDerWaalsContact C-N 3.31Å; I148-L151 PolarHBondContact O-N 3.02Å; I148-T152 VanDerWaalsContact O-CB 3.28Å; I148-T152 WeakPolarHBondContact O-CB 3.39Å; I148-T152 PolarHBondContact O-N 2.69Å; I148-T152 PolarHBondContact O-OG1 3.33Å
149D79.1Confident73.1Confident86 Ų8659.2 Ų59.246%0.4632%0.316SS..Hα-helixtrans-67-41.9-179.6-67.1-33.6000110.7R9 L151 T152 S153R9-D149 IonicContact CZ-OD1 2.79Å; R9-D149 IonicContact NH1-OD1 3.17Å; R9-D149 IonicContact NH2-OD1 3.7Å; R9-D149 PolarHBondContact NH2-OD1 3.1Å; D149-L151 PolarHBondContact O-N 2.96Å; D149-T152 PolarHBondContact O-N 2.84Å; D149-S153 WeakPolarHBondContact O-CB 3.43Å; D149-S153 PolarHBondContact O-N 2.98Å; D149-S153 PolarHBondContact O-OG 2.68Å
150A80.7Confident73.9Confident36 Ų3655.9 Ų55.930%0.29830%0.3SS..Hα-helixtrans-67.8-33.2176.300000113.3F135 T147 S153 K154F135-A150 HydrophobicContact CE1-CB 3.81Å; T147-A150 PolarHBondContact O-N 3.21Å; A150-S153 PolarHBondContact O-OG 3.41Å; A150-S153 VanDerWaalsContact O-OG 3.1Å; A150-K154 WeakPolarHBondContact O-CB 3.37Å; A150-K154 VanDerWaalsContact O-CG 3.23Å; A150-K154 WeakPolarHBondContact O-CG 3.26Å; A150-K154 PolarHBondContact O-N 2.83Å
151L81.8Confident75.2Confident1 Ų157 Ų571%0.00531%0.305CS..Hα-helixtrans-69.4-49.6171.5178.569.2000109.6W2 T6 I82 Y112 F135 T147 I148 D149 S153 K154 V155W2-L151 HydrophobicContact CH2-CD2 3.82Å; W2-L151 HydrophobicContact CZ2-CD2 3.87Å; T6-L151 HydrophobicContact CG2-CD2 4.03Å; I82-L151 HydrophobicContact CD1-CD1 4.3Å; I82-L151 HydrophobicContact CD1-CD2 3.76Å; I82-L151 HydrophobicContact CG1-CD1 4.32Å; I82-L151 HydrophobicContact CG1-CD2 4.45Å; Y112-L151 HydrophobicContact CD1-CD1 4.07Å; Y112-L151 HydrophobicContact CE1-CD1 4.39Å; Y112-L151 HydrophobicContact CG-CD1 4.24Å; F135-L151 HydrophobicContact CE1-CB 4.48Å; F135-L151 HydrophobicContact CE2-CB 4.32Å; F135-L151 HydrophobicContact CE2-CD1 3.69Å; F135-L151 HydrophobicContact CZ-CB 3.93Å; F135-L151 HydrophobicContact CZ-CD1 4.02Å; T147-L151 WeakPolarHBondContact O-CB 3.44Å; T147-L151 PolarHBondContact O-N 2.99Å; I148-L151 PolarHBondContact O-N 3.02Å; D149-L151 PolarHBondContact O-N 2.96Å; L151-S153 VanDerWaalsContact C-N 3.31Å; L151-S153 PolarHBondContact O-N 3.11Å; L151-K154 CarbonylContact O-C 3.55Å; L151-K154 WeakPolarHBondContact O-CA 3.28Å; L151-K154 PolarHBondContact O-N 2.9Å; L151-V155 HydrophobicContact CD1-CG2 3.59Å; L151-V155 HydrophobicContact CG-CG2 3.92Å; L151-V155 WeakPolarHBondContact O-CB 3.39Å; L151-V155 WeakPolarHBondContact O-CG2 3.35Å; L151-V155 PolarHBondContact O-N 2.77Å
152T78.8Confident76.7Confident25 Ų2550.8 Ų50.815%0.15328%0.279CS..Hα-helixtrans-58.6-44-178.7-55.10000111R9 I148 D149 K154 V155 C156R9-T152 HydrophobicContact CB-CG2 4.26Å; I148-T152 VanDerWaalsContact O-CB 3.28Å; I148-T152 WeakPolarHBondContact O-CB 3.39Å; I148-T152 PolarHBondContact O-N 2.69Å; I148-T152 PolarHBondContact O-OG1 3.33Å; D149-T152 PolarHBondContact O-N 2.84Å; T152-K154 VanDerWaalsContact C-N 3.29Å; T152-K154 PolarHBondContact O-N 2.8Å; T152-V155 PolarHBondContact O-N 3.38Å; T152-C156 VanDerWaalsContact O-CB 3.31Å; T152-C156 WeakPolarHBondContact O-CB 3.36Å; T152-C156 PolarHBondContact O-N 3.5Å
153S75.7Confident78.2Confident46 Ų4646.9 Ų46.932%0.32226%0.264SS..Hα-helixtrans-66.7-29.2175.668.80000113.2D149 A150 L151 N180D149-S153 WeakPolarHBondContact O-CB 3.43Å; D149-S153 PolarHBondContact O-N 2.98Å; D149-S153 PolarHBondContact O-OG 2.68Å; A150-S153 PolarHBondContact O-OG 3.41Å; A150-S153 VanDerWaalsContact O-OG 3.1Å; L151-S153 VanDerWaalsContact C-N 3.31Å; L151-S153 PolarHBondContact O-N 3.11Å; S153-N180 WeakPolarHBondContact O-CB 3.3Å
154K76.3Confident79.3Confident55 Ų5547.7 Ų47.724%0.23927%0.267CS..Hα-helixtrans-79.9-31.6175.2-75.9179.2-170.4170.50112.5Y112 G132 F135 A150 L151 T152 G181 Q183 N184Y112-K154 HydrophobicContact CE1-CB 4.26Å; G132-K154 VanDerWaalsContact O-CD 3.32Å; G132-K154 WeakPolarHBondContact O-CD 3.38Å; G132-K154 WeakPolarHBondContact O-CE 3.48Å; G132-K154 PolarHBondContact O-NZ 3.23Å; F135-K154 HydrophobicContact CE1-CD 4.49Å; F135-K154 HydrophobicContact CZ-CD 3.91Å; A150-K154 WeakPolarHBondContact O-CB 3.37Å; A150-K154 VanDerWaalsContact O-CG 3.23Å; A150-K154 WeakPolarHBondContact O-CG 3.26Å; A150-K154 PolarHBondContact O-N 2.83Å; L151-K154 CarbonylContact O-C 3.55Å; L151-K154 WeakPolarHBondContact O-CA 3.28Å; L151-K154 PolarHBondContact O-N 2.9Å; T152-K154 VanDerWaalsContact C-N 3.29Å; T152-K154 PolarHBondContact O-N 2.8Å; K154-G181 WeakPolarHBondContact O-CA 3.31Å; K154-Q183 VanDerWaalsContact CA-NE2 3.26Å; K154-Q183 VanDerWaalsContact CB-NE2 3.28Å; K154-Q183 PolarHBondContact O-NE2 2.83Å; K154-N184 PolarHBondContact O-ND2 3.37Å
155V74.7Confident80.3Confident24 Ų2451.7 Ų51.715%0.14530%0.295CS..Hα-helixtrans-88.6-42-172170.10000111.9F10 M80 Y112 L151 T152F10-V155 HydrophobicContact CD1-CG1 4.44Å; F10-V155 HydrophobicContact CE1-CB 3.94Å; F10-V155 HydrophobicContact CE1-CG1 3.36Å; F10-V155 HydrophobicContact CZ-CB 3.82Å; F10-V155 HydrophobicContact CZ-CG1 3.56Å; F10-V155 HydrophobicContact CZ-CG2 4.25Å; M80-V155 HydrophobicContact CE-CB 3.79Å; M80-V155 HydrophobicContact CE-CG1 3.27Å; M80-V155 HydrophobicContact CE-CG2 3.5Å; M80-V155 HydrophobicContact SD-CB 4Å; M80-V155 HydrophobicContact SD-CG1 3.52Å; M80-V155 VanDerWaalsContact SD-CG1 3.52Å; M80-V155 HydrophobicContact SD-CG2 3.28Å; M80-V155 WeakPolarHBondContact SD-CG2 3.2Å; Y112-V155 HydrophobicContact CE1-CG2 4.48Å; Y112-V155 HydrophobicContact CE2-CG2 4.27Å; L151-V155 HydrophobicContact CD1-CG2 3.59Å; L151-V155 HydrophobicContact CG-CG2 3.92Å; L151-V155 WeakPolarHBondContact O-CB 3.39Å; L151-V155 WeakPolarHBondContact O-CG2 3.35Å; L151-V155 PolarHBondContact O-N 2.77Å; T152-V155 PolarHBondContact O-N 3.38Å
156C73.7Confident81Confident46 Ų4646.7 Ų46.731%0.31128%0.284SS..SBendtrans-78.8127.6-178.7-680000110.2T152 N180T152-C156 VanDerWaalsContact O-CB 3.31Å; T152-C156 WeakPolarHBondContact O-CB 3.36Å; T152-C156 PolarHBondContact O-N 3.5Å; C156-N180 CarbonylContact O-C 3.47Å; C156-N180 WeakPolarHBondContact O-CB 3.47Å
157L72.5Confident81.7Confident46 Ų4644.5 Ų44.524%0.24126%0.264CS..  trans-83.2121.3168.2-96.4139.5000110N180 F182 L235 F242L157-N180 WeakPolarHBondContact CA-O 3.47Å; L157-N180 VanDerWaalsContact CD2-O 3.31Å; L157-N180 WeakPolarHBondContact CD2-O 3.24Å; L157-F182 HydrophobicContact CD2-CD1 3.57Å; L157-F182 HydrophobicContact CD2-CE1 3.61Å; L157-L235 HydrophobicContact CD1-CD1 3.07Å; L157-L235 HydrophobicContact CD2-CD1 3.21Å; L157-L235 HydrophobicContact CD2-CG 4.37Å; L157-L235 HydrophobicContact CG-CD1 3.65Å; L157-F242 HydrophobicContact CB-CD1 4.25Å; L157-F242 HydrophobicContact CB-CD2 4.37Å; L157-F242 HydrophobicContact CB-CE1 4.06Å; L157-F242 HydrophobicContact CB-CE2 4.2Å; L157-F242 HydrophobicContact CB-CG 4.41Å; L157-F242 HydrophobicContact CB-CZ 4.03Å; L157-F242 HydrophobicContact CD1-CE2 4.32Å; L157-F242 HydrophobicContact CD1-CZ 4.35Å
158D76.1Confident82Confident83 Ų8345.6 Ų45.644%0.44427%0.272SS..EExtended strand (participates in β ladder)trans-149.8142178.6-167.517.6000109.5G179 N180D158-G179 CarbonylContact O-C 3.48Å; D158-G179 WeakPolarHBondContact O-CA 3.15Å; D158-N180 PolarHBondContact O-N 3.49Å
159V81.6Confident82.2Confident11 Ų1147.3 Ų47.37%0.06728%0.283CS..EExtended strand (participates in β ladder)trans-94113.3172.5178.70000107V162 I177 V233 S244 V246V159-V162 HydrophobicContact CG1-CG1 4.2Å; V159-I177 HydrophobicContact CB-CG2 4.45Å; V159-I177 HydrophobicContact CG1-CG2 3.6Å; V159-I177 HydrophobicContact CG2-CG2 4.05Å; V159-V233 HydrophobicContact CG2-CB 4.45Å; V159-V233 HydrophobicContact CG2-CG2 3.9Å; V159-S244 WeakPolarHBondContact CG1-OG 3.37Å; V159-V246 HydrophobicContact CG1-CG2 4.49Å
160T84.2Confident82.2Confident71 Ų7145.4 Ų45.444%0.43628%0.283SS..EExtended strand (participates in β ladder)trans-90.7-36.7-172.454.70000112.5H178T160-H178 PolarHBondContact N-O 3.25Å; T160-H178 PolarHBondContact OG1-O 2.93Å
161S88.1Confident82Confident44 Ų4450.1 Ų50.131%0.30830%0.299SS..EExtended strand (participates in β ladder)trans-160.8163.5178.356.90000110.6H178S161-H178 PolarHBondContact N-O 2.88Å; S161-H178 PolarHBondContact O-N 3.02Å; S161-H178 WeakPolarHBondContact OG-CB 3.48Å
162V90.1Very high82.3Confident14 Ų1455.9 Ų55.99%0.08534%0.337CS..EExtended strand (participates in β ladder)trans-131.1140.1173.6-64.80000108.9V159 V175 V176 I177 I231 V246 I248V159-V162 HydrophobicContact CG1-CG1 4.2Å; V162-V175 HydrophobicContact CB-CG1 4.38Å; V162-V176 CarbonylContact C-O 3.5Å; V162-V176 VanDerWaalsContact CA-O 3.3Å; V162-V176 WeakPolarHBondContact CA-O 3.23Å; V162-I177 HydrophobicContact CG1-CG1 4.36Å; V162-I177 HydrophobicContact CG1-CG2 4.38Å; V162-I231 HydrophobicContact CB-CD1 4.04Å; V162-I231 HydrophobicContact CG1-CD1 3.63Å; V162-I231 HydrophobicContact CG2-CD1 4.17Å; V162-V246 HydrophobicContact CB-CG2 3.91Å; V162-V246 HydrophobicContact CG1-CG2 3.46Å; V162-V246 VanDerWaalsContact CG1-CG2 3.46Å; V162-V246 HydrophobicContact CG2-CB 3.85Å; V162-V246 HydrophobicContact CG2-CG2 3.41Å; V162-V246 VanDerWaalsContact CG2-CG2 3.41Å; V162-I248 HydrophobicContact CB-CD1 4.41Å; V162-I248 HydrophobicContact CG2-CD1 4.06Å; V162-I248 HydrophobicContact CG2-CG1 3.8Å
163E90.8Very high82.9Confident111 Ų11155.6 Ų55.652%0.51933%0.333SS..EExtended strand (participates in β ladder)trans-126140.2175.1-64.7-173.717500111.1V176E163-V176 HydrophobicContact CB-CB 4.25Å; E163-V176 PolarHBondContact N-O 2.98Å; E163-V176 PolarHBondContact O-N 3.16Å
164P90.2Very high83.7Confident46 Ų4658 Ų5830%0.29934%0.339SS..  cis-81.5166.3-7.330.5-27.4000112.1S166 E167 I248P164-S166 VanDerWaalsContact C-N 3.27Å; P164-S166 PolarHBondContact O-N 2.9Å; P164-E167 VanDerWaalsContact CD-OE1 3.26Å; P164-E167 WeakPolarHBondContact CD-OE1 3.31Å; P164-E167 HydrophobicContact CG-CG 3.62Å; P164-E167 WeakPolarHBondContact CG-OE1 3.34Å; P164-I248 VanDerWaalsContact O-CD1 3.28Å; P164-I248 WeakPolarHBondContact O-CD1 3.43Å; P164-I248 WeakPolarHBondContact O-CG1 3.47Å
165S86.6Confident84.5Confident85 Ų8555.4 Ų55.459%0.59433%0.327SS*.SBendtrans-75.2-16.7177.657.30000113.6I248 T249S165-I248 WeakPolarHBondContact O-CA 3.14Å; S165-T249 PolarHBondContact O-N 3.14Å; S165-T249 VanDerWaalsContact O-N 3.14Å
166S86.4Confident85.5Confident51 Ų5156 Ų5636%0.35733%0.331SS..EExtended strand (participates in β ladder)trans-149143.2178.560.40000111.6P164 T249P164-S166 VanDerWaalsContact C-N 3.27Å; P164-S166 PolarHBondContact O-N 2.9Å; S166-T249 CarbonylContact C-O 3.56Å; S166-T249 WeakPolarHBondContact CA-O 3.37Å; S166-T249 VanDerWaalsContact CB-O 3.28Å; S166-T249 WeakPolarHBondContact CB-O 3.43Å
167E88.6Confident86.3Confident37 Ų3753.8 Ų53.817%0.17332%0.316CS..EExtended strand (participates in β ladder)trans-134.1157.1-174.4-81-70.8-166.400114.7P164 Y173 L222 I248 T249 S250 T251P164-E167 VanDerWaalsContact CD-OE1 3.26Å; P164-E167 WeakPolarHBondContact CD-OE1 3.31Å; P164-E167 HydrophobicContact CG-CG 3.62Å; P164-E167 WeakPolarHBondContact CG-OE1 3.34Å; E167-Y173 HydrophobicContact CB-CD1 4.41Å; E167-Y173 HydrophobicContact CB-CD2 4.23Å; E167-Y173 HydrophobicContact CB-CE1 4.29Å; E167-Y173 HydrophobicContact CB-CE2 4.08Å; E167-Y173 HydrophobicContact CB-CG 4.39Å; E167-Y173 HydrophobicContact CG-CD1 4.39Å; E167-Y173 HydrophobicContact CG-CD2 3.45Å; E167-Y173 VanDerWaalsContact CG-CD2 3.45Å; E167-Y173 HydrophobicContact CG-CE2 3.57Å; E167-Y173 HydrophobicContact CG-CG 3.9Å; E167-Y173 WeakPolarHBondContact OE1-CB 3.45Å; E167-Y173 WeakPolarHBondContact OE1-CD2 3.33Å; E167-L222 HydrophobicContact CB-CD1 3.58Å; E167-I248 HydrophobicContact CB-CG2 4.42Å; E167-I248 HydrophobicContact CG-CG2 4.36Å; E167-T249 PolarHBondContact N-O 3.34Å; E167-S250 CarbonylContact O-C 3.55Å; E167-S250 VanDerWaalsContact O-CA 3.31Å; E167-S250 WeakPolarHBondContact O-CA 3.42Å; E167-T251 PolarHBondContact O-N 3.13Å; E167-T251 PolarHBondContact O-OG1 3.34Å
168C84.9Confident87.2Confident35 Ų3554 Ų5424%0.23632%0.316CS..EExtended strand (participates in β ladder)trans-80.7132.7-175.3-107.80000112.2G170 C253C168-G170 PolarHBondContact O-N 2.89Å; C168-C253 WeakPolarHBondContact CA-SG 3.43Å; C168-C253 HydrophobicContact CB-CB 4.28Å; C168-C253 WeakPolarHBondContact CB-SG 3.42Å; C168-C253 WeakPolarHBondContact SG-CB 3.11Å; C168-C253 CovalentContact SG-SG 2Å; C168-C253 PolarHBondContact SG-SG 3.11Å
169V85.9Confident87.7Confident41 Ų4150.1 Ų50.125%0.24830%0.296CS..THydrogen-bonded Turntrans-66.2133.4175.1175.40000110.5E171 L222 E223 P225 T251V169-E171 PolarHBondContact O-N 3.19Å; V169-L222 WeakPolarHBondContact CG1-O 3.45Å; V169-L222 HydrophobicContact CG2-CB 4.38Å; V169-E223 WeakPolarHBondContact CG1-O 3.33Å; V169-P225 HydrophobicContact CG2-CG 4.05Å; V169-T251 PolarHBondContact N-O 2.78Å
170G77.8Confident87.8Confident46 Ų4651.5 Ų51.547%0.47430%0.303SS..THydrogen-bonded Turntrans89.9-19.4170.600000116.7C168 L222C168-G170 PolarHBondContact O-N 2.89Å; G170-L222 PolarHBondContact N-O 3.47Å
171E77.9Confident87.5Confident135 Ų13548.1 Ų48.163%0.63128%0.282SS*.SBendtrans-94.1142.3178.4-67.8-60.914600111.6V169V169-E171 PolarHBondContact O-N 3.19Å
172P87.1Confident87.3Confident121 Ų12146.1 Ų46.179%0.78627%0.268SS*.  trans-71.3136.117229.7-32.1000110.4
173Y90.9Very high86.8Confident19 Ų1947.1 Ų47.18%0.07527%0.271CS..  trans-140.1172.6179.765.5-79.3000110.4E167 V175 G219 P220 L222 Y229E167-Y173 HydrophobicContact CB-CD1 4.41Å; E167-Y173 HydrophobicContact CB-CD2 4.23Å; E167-Y173 HydrophobicContact CB-CE1 4.29Å; E167-Y173 HydrophobicContact CB-CE2 4.08Å; E167-Y173 HydrophobicContact CB-CG 4.39Å; E167-Y173 HydrophobicContact CG-CD1 4.39Å; E167-Y173 HydrophobicContact CG-CD2 3.45Å; E167-Y173 VanDerWaalsContact CG-CD2 3.45Å; E167-Y173 HydrophobicContact CG-CE2 3.57Å; E167-Y173 HydrophobicContact CG-CG 3.9Å; E167-Y173 WeakPolarHBondContact OE1-CB 3.45Å; E167-Y173 WeakPolarHBondContact OE1-CD2 3.33Å; Y173-V175 HydrophobicContact CD2-CG2 4.06Å; Y173-V175 HydrophobicContact CE2-CG2 3.53Å; Y173-G219 PolarHBondContact O-N 3.26Å; Y173-P220 WeakPolarHBondContact CE1-O 3.42Å; Y173-P220 VanDerWaalsContact OH-CD 3.31Å; Y173-P220 WeakPolarHBondContact OH-CD 3.4Å; Y173-P220 PolarHBondContact OH-O 3.34Å; Y173-L222 HydrophobicContact CE1-CD1 3.87Å; Y173-L222 HydrophobicContact CE1-CG 4.08Å; Y173-Y229 WeakPolarHBondContact CE2-OH 3.32Å; Y173-Y229 PolarHBondContact OH-OH 2.96Å
174H93.2Very high86.3Confident97 Ų9742.5 Ų42.545%0.44925%0.25SS..EExtended strand (participates in β ladder)trans-118.7141.6173-73.674.7000109.3C217H174-C217 CarbonylContact C-O 3.34Å; H174-C217 WeakPolarHBondContact CA-O 3.42Å
175V93.6Very high85.9Confident0 Ų041.5 Ų41.50%024%0.242CC..EExtended strand (participates in β ladder)trans-98.2119.3170.8-179.90000108.3V162 Y173 I177 F195 C217 I231 I248V162-V175 HydrophobicContact CB-CG1 4.38Å; Y173-V175 HydrophobicContact CD2-CG2 4.06Å; Y173-V175 HydrophobicContact CE2-CG2 3.53Å; V175-I177 HydrophobicContact CG1-CG1 3.97Å; V175-F195 HydrophobicContact CB-CE1 4.3Å; V175-F195 HydrophobicContact CG2-CE1 4Å; V175-F195 HydrophobicContact CG2-CZ 4.41Å; V175-C217 PolarHBondContact N-O 3.22Å; V175-C217 PolarHBondContact O-N 3.16Å; V175-I231 HydrophobicContact CG1-CD1 3.79Å; V175-I248 HydrophobicContact CB-CD1 4.47Å; V175-I248 HydrophobicContact CG1-CD1 3.77Å; V175-I248 HydrophobicContact CG2-CD1 3.86Å
176V94.5Very high85.4Confident36 Ų3642.8 Ų42.822%0.21824%0.237CC..EExtended strand (participates in β ladder)trans-85.8113.8169-166.80000107.6V162 E163 H178 N216V162-V176 CarbonylContact C-O 3.5Å; V162-V176 VanDerWaalsContact CA-O 3.3Å; V162-V176 WeakPolarHBondContact CA-O 3.23Å; E163-V176 HydrophobicContact CB-CB 4.25Å; E163-V176 PolarHBondContact N-O 2.98Å; E163-V176 PolarHBondContact O-N 3.16Å; V176-H178 WeakPolarHBondContact CG1-NE2 3.4Å; V176-N216 WeakPolarHBondContact CG2-OD1 3.17Å
177I92.1Very high85.2Confident0 Ų045.5 Ų45.50%024%0.242CC..EExtended strand (participates in β ladder)trans-98.7112.7175.1-54.2176.5000107.6V159 V162 V175 F182 C193 S214 M215 C217 I231 V233V159-I177 HydrophobicContact CB-CG2 4.45Å; V159-I177 HydrophobicContact CG1-CG2 3.6Å; V159-I177 HydrophobicContact CG2-CG2 4.05Å; V162-I177 HydrophobicContact CG1-CG1 4.36Å; V162-I177 HydrophobicContact CG1-CG2 4.38Å; V175-I177 HydrophobicContact CG1-CG1 3.97Å; I177-F182 HydrophobicContact CG2-CZ 4.46Å; I177-C193 HydrophobicContact CD1-CB 4.19Å; I177-S214 CarbonylContact O-C 3.5Å; I177-S214 WeakPolarHBondContact O-CA 3.46Å; I177-M215 HydrophobicContact CB-CG 3.85Å; I177-M215 HydrophobicContact CD1-CG 4.31Å; I177-M215 HydrophobicContact CD1-SD 4.48Å; I177-M215 HydrophobicContact CG1-CG 4.43Å; I177-M215 PolarHBondContact N-O 2.93Å; I177-M215 PolarHBondContact O-N 2.95Å; I177-C217 VanDerWaalsContact CD1-SG 3.51Å; I177-I231 HydrophobicContact CD1-CG2 3.7Å; I177-I231 HydrophobicContact CG1-CG2 4.41Å; I177-V233 HydrophobicContact CD1-CG2 3.9Å; I177-V233 HydrophobicContact CG2-CG2 4.13Å
178H90.8Very high85.1Confident51 Ų5150.1 Ų50.124%0.23626%0.259CS..EExtended strand (participates in β ladder)trans-89.4141.8173.2-65.3-83.8000110.4T160 S161 V176 N213T160-H178 PolarHBondContact N-O 3.25Å; T160-H178 PolarHBondContact OG1-O 2.93Å; S161-H178 PolarHBondContact N-O 2.88Å; S161-H178 PolarHBondContact O-N 3.02Å; S161-H178 WeakPolarHBondContact OG-CB 3.48Å; V176-H178 WeakPolarHBondContact CG1-NE2 3.4Å; H178-N213 WeakPolarHBondContact CA-O 3.17Å
179G86.5Confident85.2Confident2 Ų253.9 Ų53.92%0.02128%0.276CS..EExtended strand (participates in β ladder)trans-173.3-175.5-179.100000114.6D158 N213D158-G179 CarbonylContact O-C 3.48Å; D158-G179 WeakPolarHBondContact O-CA 3.15Å; G179-N213 PolarHBondContact N-O 3.32Å; G179-N213 CarbonylContact O-C 3.51Å; G179-N213 VanDerWaalsContact O-CA 3.29Å; G179-N213 WeakPolarHBondContact O-CA 3.34Å; G179-N213 PolarHBondContact O-ND2 2.95Å
180N83.1Confident85.3Confident40 Ų4054.1 Ų54.121%0.21428%0.275CS..EExtended strand (participates in β ladder)trans-112.2147.9-176.6-79.4-36.2000109.9S153 C156 L157 D158 F182S153-N180 WeakPolarHBondContact O-CB 3.3Å; C156-N180 CarbonylContact O-C 3.47Å; C156-N180 WeakPolarHBondContact O-CB 3.47Å; L157-N180 WeakPolarHBondContact CA-O 3.47Å; L157-N180 VanDerWaalsContact CD2-O 3.31Å; L157-N180 WeakPolarHBondContact CD2-O 3.24Å; D158-N180 PolarHBondContact O-N 3.49Å; N180-F182 PolarHBondContact O-N 2.84Å
181G78.8Confident85.9Confident0 Ų052 Ų520%025%0.252CS..SBendtrans80.53.3173.100000117.2K154 Q183 N184K154-G181 WeakPolarHBondContact O-CA 3.31Å; G181-Q183 VanDerWaalsContact C-N 3.26Å; G181-Q183 PolarHBondContact O-N 3.38Å; G181-N184 WeakPolarHBondContact O-CB 3.25Å; G181-N184 PolarHBondContact O-N 3.14Å; G181-N184 VanDerWaalsContact O-N 3.17Å
182F83.9Confident86.6Confident2 Ų246.9 Ų46.91%0.00923%0.229CC..G310 helixtrans-66.4-26.8177.6-56.1-24.1000112.9L157 I177 N180 N184 L185 I210 D211 M215L157-F182 HydrophobicContact CD2-CD1 3.57Å; L157-F182 HydrophobicContact CD2-CE1 3.61Å; I177-F182 HydrophobicContact CG2-CZ 4.46Å; N180-F182 PolarHBondContact O-N 2.84Å; F182-N184 PolarHBondContact O-N 3.01Å; F182-N184 VanDerWaalsContact O-N 3.11Å; F182-L185 HydrophobicContact CB-CD1 4.07Å; F182-L185 VanDerWaalsContact O-CB 3.27Å; F182-L185 WeakPolarHBondContact O-CB 3.27Å; F182-L185 VanDerWaalsContact O-CD1 3.29Å; F182-L185 WeakPolarHBondContact O-CD1 3.49Å; F182-L185 WeakPolarHBondContact O-CG 3.43Å; F182-L185 PolarHBondContact O-N 3.4Å; F182-L185 VanDerWaalsContact O-N 3.14Å; F182-I210 HydrophobicContact CB-CG2 4.34Å; F182-D211 WeakPolarHBondContact CB-O 3.31Å; F182-M215 HydrophobicContact CD1-CE 3.56Å; F182-M215 HydrophobicContact CD2-CE 3.77Å; F182-M215 HydrophobicContact CE1-CE 3.45Å; F182-M215 VanDerWaalsContact CE1-CE 3.45Å; F182-M215 HydrophobicContact CE2-CE 3.65Å; F182-M215 HydrophobicContact CE2-CG 4.36Å; F182-M215 HydrophobicContact CG-CE 3.76Å; F182-M215 HydrophobicContact CZ-CE 3.51Å
183Q79.4Confident87Confident34 Ų3441.1 Ų41.116%0.15919%0.191CC..G310 helixtrans-63.9-15.2174.877.2-70.4-12.500114.1K154 G181 L185 N212K154-Q183 VanDerWaalsContact CA-NE2 3.26Å; K154-Q183 VanDerWaalsContact CB-NE2 3.28Å; K154-Q183 PolarHBondContact O-NE2 2.83Å; G181-Q183 VanDerWaalsContact C-N 3.26Å; G181-Q183 PolarHBondContact O-N 3.38Å; Q183-L185 VanDerWaalsContact C-N 3.29Å; Q183-N212 HydrophobicContact CB-CB 4.01Å; Q183-N212 PolarHBondContact N-O 3.07Å; Q183-N212 PolarHBondContact OE1-O 3.2Å
184N80Confident87.2Confident15 Ų1542.8 Ų42.88%0.0820%0.198CC..G310 helixtrans-85.4-2.1178.9-60.1-17.6000113.1N110 Y112 H133 K154 G181 F182 K186N110-N184 PolarHBondContact ND2-O 2.85Å; N110-N184 PolarHBondContact OD1-O 3.12Å; Y112-N184 PolarHBondContact OH-ND2 2.87Å; Y112-N184 PolarHBondContact OH-OD1 3.09Å; H133-N184 PolarHBondContact NE2-OD1 3.43Å; K154-N184 PolarHBondContact O-ND2 3.37Å; G181-N184 WeakPolarHBondContact O-CB 3.25Å; G181-N184 PolarHBondContact O-N 3.14Å; G181-N184 VanDerWaalsContact O-N 3.17Å; F182-N184 PolarHBondContact O-N 3.01Å; F182-N184 VanDerWaalsContact O-N 3.11Å; N184-K186 PolarHBondContact O-N 3.24Å
185L81.1Confident87.2Confident25 Ų2538.1 Ų38.113%0.13118%0.176CC..  trans-71.4113.1-175.5-68.5170000111.5F182 Q183 V191 I210 L235F182-L185 HydrophobicContact CB-CD1 4.07Å; F182-L185 VanDerWaalsContact O-CB 3.27Å; F182-L185 WeakPolarHBondContact O-CB 3.27Å; F182-L185 VanDerWaalsContact O-CD1 3.29Å; F182-L185 WeakPolarHBondContact O-CD1 3.49Å; F182-L185 WeakPolarHBondContact O-CG 3.43Å; F182-L185 PolarHBondContact O-N 3.4Å; F182-L185 VanDerWaalsContact O-N 3.14Å; Q183-L185 VanDerWaalsContact C-N 3.29Å; L185-V191 HydrophobicContact CD1-CG2 3.93Å; L185-V191 HydrophobicContact CD2-CG2 4.19Å; L185-I210 HydrophobicContact CD1-CD1 4.44Å; L185-I210 HydrophobicContact CD1-CG2 4.01Å; L185-L235 HydrophobicContact CD1-CD2 4.05Å; L185-L235 HydrophobicContact CD2-CB 3.6Å; L185-L235 HydrophobicContact CD2-CD1 3.61Å; L185-L235 HydrophobicContact CD2-CD2 3.62Å; L185-L235 HydrophobicContact CD2-CG 3.77Å; L185-L235 HydrophobicContact CG-CD2 4.43Å
186K76.7Confident87.2Confident112 Ų11239.7 Ų39.749%0.48718%0.184SC..SBendtrans-81.6-28.5174.2-60.7-49.1-160.2-150.20113.3N110 D129 N184N110-K186 WeakPolarHBondContact OD1-CE 3.28Å; N110-K186 PolarHBondContact OD1-NZ 3.39Å; D129-K186 IonicContact OD2-NZ 3.6Å; D129-K186 PolarHBondContact OD2-NZ 2.88Å; N184-K186 PolarHBondContact O-N 3.24Å
187K83.3Confident87Confident107 Ų10739.9 Ų39.947%0.46518%0.182SC..  trans-129.284.6-173.9-64.8-175.8178.2178.60110.2D189 E190K187-D189 PolarHBondContact O-N 2.82Å; K187-E190 HydrophobicContact CB-CB 4.12Å; K187-E190 HydrophobicContact CB-CG 3.91Å; K187-E190 HydrophobicContact CD-CG 4Å; K187-E190 WeakPolarHBondContact CD-OE1 3.49Å; K187-E190 WeakPolarHBondContact CD-OE2 3.49Å; K187-E190 WeakPolarHBondContact CE-OE1 3.5Å; K187-E190 IonicContact NZ-OE1 2.76Å; K187-E190 PolarHBondContact NZ-OE1 3.36Å; K187-E190 IonicContact NZ-OE2 2.77Å; K187-E190 PolarHBondContact O-N 2.87Å; K187-E190 VanDerWaalsContact O-N 3.12Å
188R85.3Confident86.8Confident135 Ų13543.3 Ų43.351%0.50920%0.2SC..G310 helixtrans-62.1-25.7-177.5-69.1-175177.3-148.3-5.7112.6E190 V191 I210R188-E190 VanDerWaalsContact C-N 3.31Å; R188-E190 PolarHBondContact O-N 3Å; R188-V191 WeakPolarHBondContact O-CG2 3.49Å; R188-V191 PolarHBondContact O-N 3.25Å; R188-I210 HydrophobicContact CB-CD1 3.94Å; R188-I210 HydrophobicContact CG-CD1 4.1Å; R188-I210 PolarHBondContact NH1-O 2.99Å
189D86.6Confident86.5Confident114 Ų11450.3 Ų50.361%0.6123%0.233SC*.G310 helixtrans-75.8-14.2177.363.8-57.8000114.5K187K187-D189 PolarHBondContact O-N 2.82Å
190E88.1Confident86.7Confident46 Ų4655.3 Ų55.322%0.21527%0.268CS..G310 helixtrans-90.3-0.3175-68.6-172.7178.500112.9K187 R188 K237K187-E190 HydrophobicContact CB-CB 4.12Å; K187-E190 HydrophobicContact CB-CG 3.91Å; K187-E190 HydrophobicContact CD-CG 4Å; K187-E190 WeakPolarHBondContact CD-OE1 3.49Å; K187-E190 WeakPolarHBondContact CD-OE2 3.49Å; K187-E190 WeakPolarHBondContact CE-OE1 3.5Å; K187-E190 IonicContact NZ-OE1 2.76Å; K187-E190 PolarHBondContact NZ-OE1 3.36Å; K187-E190 IonicContact NZ-OE2 2.77Å; K187-E190 PolarHBondContact O-N 2.87Å; K187-E190 VanDerWaalsContact O-N 3.12Å; R188-E190 VanDerWaalsContact C-N 3.31Å; R188-E190 PolarHBondContact O-N 3Å; E190-K237 HydrophobicContact CB-CB 4.26Å; E190-K237 HydrophobicContact CG-CB 4.28Å; E190-K237 WeakPolarHBondContact O-CA 3.34Å; E190-K237 PolarHBondContact O-N 3.02Å
191V91.1Very high87Confident0 Ų056.3 Ų56.30%028%0.276CS..  trans-78.7135178.5-178.20000110.6L185 R188 P207 I210 M215 V233 S234 L235L185-V191 HydrophobicContact CD1-CG2 3.93Å; L185-V191 HydrophobicContact CD2-CG2 4.19Å; R188-V191 WeakPolarHBondContact O-CG2 3.49Å; R188-V191 PolarHBondContact O-N 3.25Å; V191-P207 HydrophobicContact CB-CG 3.91Å; V191-P207 HydrophobicContact CG1-CG 3.74Å; V191-P207 WeakPolarHBondContact O-CD 3.43Å; V191-I210 HydrophobicContact CB-CD1 4.1Å; V191-I210 HydrophobicContact CG1-CD1 4.34Å; V191-I210 HydrophobicContact CG2-CD1 3.83Å; V191-M215 HydrophobicContact CG1-CE 4.2Å; V191-M215 HydrophobicContact CG1-SD 3.88Å; V191-V233 HydrophobicContact CG1-CG1 4.44Å; V191-S234 CarbonylContact C-O 3.51Å; V191-S234 VanDerWaalsContact CA-O 3.25Å; V191-S234 WeakPolarHBondContact CA-O 3.47Å; V191-L235 HydrophobicContact CB-CD2 4.47Å; V191-L235 HydrophobicContact CG1-CD2 3.94Å; V191-L235 HydrophobicContact CG2-CD2 3.89Å
192I93.4Very high87.7Confident28 Ų2860.2 Ų60.214%0.14430%0.295CS..EExtended strand (participates in β ladder)trans-129.9127.5178.3-57.7175.7000108.1D204 E205 V233 S234 F241I192-D204 HydrophobicContact CG2-CB 3.65Å; I192-E205 WeakPolarHBondContact CA-O 3.37Å; I192-V233 WeakPolarHBondContact O-CA 3.32Å; I192-S234 PolarHBondContact N-O 2.86Å; I192-S234 PolarHBondContact O-N 3.44Å; I192-F241 HydrophobicContact CG2-CE1 4.4Å
193C94.2Very high88.3Confident0 Ų062.7 Ų62.70%031%0.309CS..EExtended strand (participates in β ladder)trans-94.9114.6166.3-37.90000107.3I177 F195 E205 C217I177-C193 HydrophobicContact CD1-CB 4.19Å; C193-F195 HydrophobicContact CB-CE2 4.34Å; C193-F195 HydrophobicContact CB-CZ 4.22Å; C193-E205 PolarHBondContact N-O 3.11Å; C193-E205 PolarHBondContact O-N 3.33Å; C193-C217 HydrophobicContact CB-CB 3.54Å; C193-C217 WeakPolarHBondContact CB-SG 3.18Å; C193-C217 WeakPolarHBondContact SG-CB 3.19Å; C193-C217 CovalentContact SG-SG 2.02Å; C193-C217 PolarHBondContact SG-SG 2.66Å
194R94.9Very high89Confident54 Ų5464.4 Ų64.420%0.20432%0.319CS..EExtended strand (participates in β ladder)trans-104.8123.3-177.9170.1168.9-70178.8-1.5110I196 I202 I203 D204 I231 E232 F241R194-I196 HydrophobicContact CG-CD1 4.13Å; R194-I196 HydrophobicContact CG-CG1 3.71Å; R194-I202 HydrophobicContact CG-CG2 3.63Å; R194-I203 CarbonylContact C-O 3.58Å; R194-I203 WeakPolarHBondContact CA-O 3.14Å; R194-D204 VanDerWaalsContact CB-OD1 3.25Å; R194-D204 WeakPolarHBondContact CB-OD1 3.43Å; R194-D204 VanDerWaalsContact CG-OD1 3.3Å; R194-D204 WeakPolarHBondContact CG-OD1 2.89Å; R194-D204 IonicContact CZ-OD1 3.68Å; R194-D204 IonicContact CZ-OD2 3.14Å; R194-D204 IonicContact NE-OD1 2.69Å; R194-D204 PolarHBondContact NE-OD1 2.82Å; R194-D204 IonicContact NE-OD2 2.75Å; R194-D204 IonicContact NH2-OD1 3.87Å; R194-D204 IonicContact NH2-OD2 3.72Å; R194-D204 PolarHBondContact NH2-OD2 3.32Å; R194-I231 CarbonylContact O-C 3.58Å; R194-I231 WeakPolarHBondContact O-CA 3.49Å; R194-E232 HydrophobicContact CB-CB 4.22Å; R194-E232 WeakPolarHBondContact CB-O 3.28Å; R194-E232 HydrophobicContact CG-CB 4.5Å; R194-E232 PolarHBondContact N-O 2.96Å; R194-E232 PolarHBondContact O-N 2.87Å; R194-F241 HydrophobicContact CB-CD1 4.07Å; R194-F241 HydrophobicContact CB-CE1 3.69Å; R194-F241 HydrophobicContact CG-CE1 4.36Å; R194-F241 VanDerWaalsContact CZ-CE2 3.44Å
195F93.8Very high89.8Confident0 Ų067.2 Ų67.20%033%0.331CS..EExtended strand (participates in β ladder)trans-104.3121.3175.9-52.7-77.5000109.4V175 C193 F197 I202 I203 E205 C217 P218 P220 Y229 I231V175-F195 HydrophobicContact CB-CE1 4.3Å; V175-F195 HydrophobicContact CG2-CE1 4Å; V175-F195 HydrophobicContact CG2-CZ 4.41Å; C193-F195 HydrophobicContact CB-CE2 4.34Å; C193-F195 HydrophobicContact CB-CZ 4.22Å; F195-F197 HydrophobicContact CB-CE2 4.35Å; F195-I202 WeakPolarHBondContact O-CA 3.1Å; F195-I203 HydrophobicContact CB-CB 4.38Å; F195-I203 HydrophobicContact CD2-CB 4.44Å; F195-I203 HydrophobicContact CD2-CG2 4.4Å; F195-I203 PolarHBondContact N-O 2.92Å; F195-I203 PolarHBondContact O-N 3.44Å; F195-E205 HydrophobicContact CD2-CG 4.42Å; F195-E205 HydrophobicContact CE2-CB 3.94Å; F195-E205 HydrophobicContact CE2-CG 3.9Å; F195-C217 HydrophobicContact CZ-CB 4.04Å; F195-P218 WeakPolarHBondContact CE2-O 3.17Å; F195-P218 WeakPolarHBondContact CZ-O 3.31Å; F195-P220 HydrophobicContact CB-CB 4.34Å; F195-P220 HydrophobicContact CB-CG 3.9Å; F195-P220 HydrophobicContact CD1-CG 3.96Å; F195-P220 HydrophobicContact CD2-CB 4.27Å; F195-P220 HydrophobicContact CD2-CG 4.08Å; F195-P220 HydrophobicContact CG-CB 4.29Å; F195-P220 HydrophobicContact CG-CG 3.71Å; F195-Y229 HydrophobicContact CB-CD2 4.19Å; F195-Y229 AromaticContact CD1-CD2 3.87Å; F195-Y229 HydrophobicContact CD1-CD2 3.87Å; F195-Y229 AromaticContact CD1-CE2 3.52Å; F195-Y229 HydrophobicContact CD1-CE2 3.52Å; F195-Y229 HydrophobicContact CE1-CE2 4.13Å; F195-Y229 HydrophobicContact CG-CE2 4.44Å; F195-I231 HydrophobicContact CD1-CG1 3.84Å; F195-I231 HydrophobicContact CE1-CD1 4.39Å; F195-I231 HydrophobicContact CE1-CG1 4.08Å
196I92.9Very high90.4Very high33 Ų3372.6 Ų72.617%0.16935%0.354CS..EExtended strand (participates in β ladder)trans-117.3106.7-174.7-51.4179.2000108.7R194 I202 Y229 S230 E232R194-I196 HydrophobicContact CG-CD1 4.13Å; R194-I196 HydrophobicContact CG-CG1 3.71Å; I196-I202 HydrophobicContact CG2-CG1 4.4Å; I196-Y229 VanDerWaalsContact O-CA 3.32Å; I196-Y229 WeakPolarHBondContact O-CA 3.28Å; I196-Y229 WeakPolarHBondContact O-CB 3.33Å; I196-S230 PolarHBondContact N-O 3.11Å; I196-S230 PolarHBondContact O-N 2.75Å; I196-E232 VanDerWaalsContact CD1-CD 3.44Å; I196-E232 HydrophobicContact CD1-CG 3.62Å
197F90.8Very high91.3Very high39 Ų3968.4 Ų68.417%0.17134%0.338CS..EExtended strand (participates in β ladder)trans-85.6-38.2174.3-69.3-100000111.1F195 T201 I203 P220 L222 E227 Y229F195-F197 HydrophobicContact CB-CE2 4.35Å; F197-T201 HydrophobicContact CB-CG2 4.02Å; F197-T201 HydrophobicContact CD2-CG2 4.05Å; F197-T201 HydrophobicContact CG-CG2 4.22Å; F197-T201 PolarHBondContact N-O 2.79Å; F197-I203 HydrophobicContact CE2-CD1 4.06Å; F197-P220 HydrophobicContact CE2-CB 3.89Å; F197-P220 HydrophobicContact CE2-CG 3.92Å; F197-P220 HydrophobicContact CZ-CB 3.95Å; F197-P220 HydrophobicContact CZ-CG 3.78Å; F197-L222 HydrophobicContact CE1-CD2 3.87Å; F197-L222 HydrophobicContact CZ-CD2 3.97Å; F197-E227 HydrophobicContact CE1-CB 4.5Å; F197-Y229 HydrophobicContact CD1-CD1 4.33Å; F197-Y229 HydrophobicContact CD1-CG 4.49Å; F197-Y229 AromaticContact CE1-CD1 3.62Å; F197-Y229 HydrophobicContact CE1-CD1 3.62Å; F197-Y229 HydrophobicContact CE1-CG 4.12Å; F197-Y229 HydrophobicContact CE2-CD1 4.37Å; F197-Y229 HydrophobicContact CE2-CG 4.28Å; F197-Y229 AromaticContact CZ-CD1 3.64Å; F197-Y229 HydrophobicContact CZ-CD1 3.64Å; F197-Y229 HydrophobicContact CZ-CE1 4.32Å; F197-Y229 AromaticContact CZ-CG 4Å; F197-Y229 HydrophobicContact CZ-CG 4Å
198N88.3Confident91.8Very high72 Ų7267.4 Ų67.439%0.38534%0.341SS..EExtended strand (participates in β ladder)trans-164.3-178.2175.959.864.9000109.4S200 T201N198-S200 PolarHBondContact O-N 3.27Å; N198-S200 VanDerWaalsContact O-N 3.11Å; N198-S200 WeakPolarHBondContact OD1-CA 3.28Å; N198-S200 PolarHBondContact OD1-N 3.32Å; N198-S200 PolarHBondContact OD1-OG 2.89Å; N198-T201 PolarHBondContact ND2-OG1 3.1Å; N198-T201 PolarHBondContact O-N 3.21Å; N198-T201 PolarHBondContact OD1-N 3.46Å; N198-T201 PolarHBondContact OD1-OG1 3.06Å
199E85.4Confident92.2Very high199 Ų19963 Ų6393%0.9333%0.33SS*.THydrogen-bonded Turntrans-59.4-22.7-178.5-61.9-174.3172.500114.6
200S88.9Confident92.5Very high107 Ų10758.1 Ų58.175%0.74831%0.305SS*.THydrogen-bonded Turntrans-106.6-15.1-177.860.40000114.7N198N198-S200 PolarHBondContact O-N 3.27Å; N198-S200 VanDerWaalsContact O-N 3.11Å; N198-S200 WeakPolarHBondContact OD1-CA 3.28Å; N198-S200 PolarHBondContact OD1-N 3.32Å; N198-S200 PolarHBondContact OD1-OG 2.89Å
201T90.9Very high92.6Very high61 Ų6160 Ų6037%0.37432%0.316SS..EExtended strand (participates in β ladder)trans-118.593.9-175.7-52.20000109.6F197 N198F197-T201 HydrophobicContact CB-CG2 4.02Å; F197-T201 HydrophobicContact CD2-CG2 4.05Å; F197-T201 HydrophobicContact CG-CG2 4.22Å; F197-T201 PolarHBondContact N-O 2.79Å; N198-T201 PolarHBondContact ND2-OG1 3.1Å; N198-T201 PolarHBondContact O-N 3.21Å; N198-T201 PolarHBondContact OD1-N 3.46Å; N198-T201 PolarHBondContact OD1-OG1 3.06Å
202I93.8Very high92.2Very high81 Ų8164.7 Ų64.742%0.41534%0.341SS..EExtended strand (participates in β ladder)trans-124130.4179.4-57.8176.6000108.6R194 F195 I196R194-I202 HydrophobicContact CG-CG2 3.63Å; F195-I202 WeakPolarHBondContact O-CA 3.1Å; I196-I202 HydrophobicContact CG2-CG1 4.4Å
203I94.7Very high92Very high55 Ų5567.5 Ų67.528%0.28236%0.356SS..EExtended strand (participates in β ladder)trans-122124.3178.6-59.2175000108.4R194 F195 F197 E205 P220R194-I203 CarbonylContact C-O 3.58Å; R194-I203 WeakPolarHBondContact CA-O 3.14Å; F195-I203 HydrophobicContact CB-CB 4.38Å; F195-I203 HydrophobicContact CD2-CB 4.44Å; F195-I203 HydrophobicContact CD2-CG2 4.4Å; F195-I203 PolarHBondContact N-O 2.92Å; F195-I203 PolarHBondContact O-N 3.44Å; F197-I203 HydrophobicContact CE2-CD1 4.06Å; I203-E205 HydrophobicContact CG2-CG 4.28Å; I203-P220 HydrophobicContact CD1-CB 3.73Å
204D95.6Very high91.8Very high69 Ų6968.7 Ų68.737%0.36937%0.365SS..EExtended strand (participates in β ladder)trans-108.2119.6178.6-77.9-5.3000109.4I192 R194I192-D204 HydrophobicContact CG2-CB 3.65Å; R194-D204 VanDerWaalsContact CB-OD1 3.25Å; R194-D204 WeakPolarHBondContact CB-OD1 3.43Å; R194-D204 VanDerWaalsContact CG-OD1 3.3Å; R194-D204 WeakPolarHBondContact CG-OD1 2.89Å; R194-D204 IonicContact CZ-OD1 3.68Å; R194-D204 IonicContact CZ-OD2 3.14Å; R194-D204 IonicContact NE-OD1 2.69Å; R194-D204 PolarHBondContact NE-OD1 2.82Å; R194-D204 IonicContact NE-OD2 2.75Å; R194-D204 IonicContact NH2-OD1 3.87Å; R194-D204 IonicContact NH2-OD2 3.72Å; R194-D204 PolarHBondContact NH2-OD2 3.32Å
205E95.5Very high91.8Very high75 Ų7566.1 Ų66.135%0.3536%0.355SS..EExtended strand (participates in β ladder)trans-117.6159.1176.9-71.9-63.6162.900111.7I192 C193 F195 I203I192-E205 WeakPolarHBondContact CA-O 3.37Å; C193-E205 PolarHBondContact N-O 3.11Å; C193-E205 PolarHBondContact O-N 3.33Å; F195-E205 HydrophobicContact CD2-CG 4.42Å; F195-E205 HydrophobicContact CE2-CB 3.94Å; F195-E205 HydrophobicContact CE2-CG 3.9Å; I203-E205 HydrophobicContact CG2-CG 4.28Å
206K94.9Very high91.8Very high137 Ų13768.1 Ų68.160%0.59637%0.366SS*.  trans-96139.8170.7-71.5-173.8176.4-172.30110.2P218K206-P218 WeakPolarHBondContact O-CD 3.1Å
207P94.7Very high91.9Very high24 Ų2466.5 Ų66.516%0.15636%0.357CS..  trans-63.8139.7175.727.6-34.4000110.9V191 I210 M215 N216V191-P207 HydrophobicContact CB-CG 3.91Å; V191-P207 HydrophobicContact CG1-CG 3.74Å; V191-P207 WeakPolarHBondContact O-CD 3.43Å; P207-I210 HydrophobicContact CB-CD1 4.34Å; P207-I210 HydrophobicContact CB-CG1 3.87Å; P207-I210 HydrophobicContact CG-CD1 3.62Å; P207-I210 HydrophobicContact CG-CG1 3.72Å; P207-M215 HydrophobicContact CB-CB 4.32Å; P207-N216 CarbonylContact C-O 3.46Å; P207-N216 WeakPolarHBondContact CA-O 3.11Å; P207-N216 VanDerWaalsContact CB-O 3.29Å; P207-N216 WeakPolarHBondContact CB-O 3.44Å
208T94.9Very high92.2Very high87 Ų8766.3 Ų66.353%0.53436%0.36SS..SBendtrans-78.2-33.7173.2500000111.6N216 P218T208-N216 PolarHBondContact N-O 3.16Å; T208-N216 WeakPolarHBondContact OG1-CB 3.3Å; T208-N216 PolarHBondContact OG1-O 3.47Å; T208-P218 HydrophobicContact CG2-CG 3.81Å
209S93.5Very high92.4Very high41 Ų4163.7 Ų63.729%0.28735%0.35SS..EExtended strand (participates in β ladder)trans-143150172.173.50000111.5M215 N216S209-M215 CarbonylContact O-C 3.52Å; S209-M215 VanDerWaalsContact O-CA 3.29Å; S209-M215 WeakPolarHBondContact O-CA 3.48Å; S209-M215 WeakPolarHBondContact O-CB 3.27Å; S209-N216 PolarHBondContact O-N 2.9Å; S209-N216 PolarHBondContact OG-ND2 2.85Å
210I91.4Very high92.7Very high13 Ų1354.4 Ų54.47%0.06731%0.307CS..EExtended strand (participates in β ladder)trans-133.6120.6175-55174000108.3F182 L185 R188 V191 P207 M215F182-I210 HydrophobicContact CB-CG2 4.34Å; L185-I210 HydrophobicContact CD1-CD1 4.44Å; L185-I210 HydrophobicContact CD1-CG2 4.01Å; R188-I210 HydrophobicContact CB-CD1 3.94Å; R188-I210 HydrophobicContact CG-CD1 4.1Å; R188-I210 PolarHBondContact NH1-O 2.99Å; V191-I210 HydrophobicContact CB-CD1 4.1Å; V191-I210 HydrophobicContact CG1-CD1 4.34Å; V191-I210 HydrophobicContact CG2-CD1 3.83Å; P207-I210 HydrophobicContact CB-CD1 4.34Å; P207-I210 HydrophobicContact CB-CG1 3.87Å; P207-I210 HydrophobicContact CG-CD1 3.62Å; P207-I210 HydrophobicContact CG-CG1 3.72Å; I210-M215 HydrophobicContact CB-CB 4.46Å; I210-M215 HydrophobicContact CG1-CB 4.1Å; I210-M215 HydrophobicContact CG2-CB 4.45Å
211D90Very high92.6Very high86 Ų8656.7 Ų56.746%0.4630%0.303SS..  trans-106.9-178.2172.6-61.5-55000110.2F182 N213 S214F182-D211 WeakPolarHBondContact CB-O 3.31Å; D211-N213 VanDerWaalsContact C-N 3.29Å; D211-N213 PolarHBondContact O-N 2.81Å; D211-S214 CarbonylContact C-O 3.56Å; D211-S214 WeakPolarHBondContact CA-O 3.26Å; D211-S214 PolarHBondContact N-O 3.4Å
212N84.4Confident92.4Very high97 Ų9753.9 Ų53.952%0.51929%0.286SS..SBendtrans-65-33-176.6-70-16.7000113.3Q183Q183-N212 HydrophobicContact CB-CB 4.01Å; Q183-N212 PolarHBondContact N-O 3.07Å; Q183-N212 PolarHBondContact OE1-O 3.2Å
213N87.7Confident91.9Very high87 Ų8756.6 Ų56.647%0.46530%0.297SS..SBendtrans-131.27.1-172.6-68.690.5000113.3H178 G179 D211H178-N213 WeakPolarHBondContact CA-O 3.17Å; G179-N213 PolarHBondContact N-O 3.32Å; G179-N213 CarbonylContact O-C 3.51Å; G179-N213 VanDerWaalsContact O-CA 3.29Å; G179-N213 WeakPolarHBondContact O-CA 3.34Å; G179-N213 PolarHBondContact O-ND2 2.95Å; D211-N213 VanDerWaalsContact C-N 3.29Å; D211-N213 PolarHBondContact O-N 2.81Å
214S91.8Very high91.5Very high25 Ų2560.1 Ų60.118%0.17531%0.31CS..EExtended strand (participates in β ladder)trans-150.6155.8178.351.20000111.2I177 D211I177-S214 CarbonylContact O-C 3.5Å; I177-S214 WeakPolarHBondContact O-CA 3.46Å; D211-S214 CarbonylContact C-O 3.56Å; D211-S214 WeakPolarHBondContact CA-O 3.26Å; D211-S214 PolarHBondContact N-O 3.4Å
215M93.1Very high91Very high0 Ų060.3 Ų60.30%032%0.315CS..EExtended strand (participates in β ladder)trans-137.814516563.1-178.676.800110.1I177 F182 V191 P207 S209 I210 V233 L235I177-M215 HydrophobicContact CB-CG 3.85Å; I177-M215 HydrophobicContact CD1-CG 4.31Å; I177-M215 HydrophobicContact CD1-SD 4.48Å; I177-M215 HydrophobicContact CG1-CG 4.43Å; I177-M215 PolarHBondContact N-O 2.93Å; I177-M215 PolarHBondContact O-N 2.95Å; F182-M215 HydrophobicContact CD1-CE 3.56Å; F182-M215 HydrophobicContact CD2-CE 3.77Å; F182-M215 HydrophobicContact CE1-CE 3.45Å; F182-M215 VanDerWaalsContact CE1-CE 3.45Å; F182-M215 HydrophobicContact CE2-CE 3.65Å; F182-M215 HydrophobicContact CE2-CG 4.36Å; F182-M215 HydrophobicContact CG-CE 3.76Å; F182-M215 HydrophobicContact CZ-CE 3.51Å; V191-M215 HydrophobicContact CG1-CE 4.2Å; V191-M215 HydrophobicContact CG1-SD 3.88Å; P207-M215 HydrophobicContact CB-CB 4.32Å; S209-M215 CarbonylContact O-C 3.52Å; S209-M215 VanDerWaalsContact O-CA 3.29Å; S209-M215 WeakPolarHBondContact O-CA 3.48Å; S209-M215 WeakPolarHBondContact O-CB 3.27Å; I210-M215 HydrophobicContact CB-CB 4.46Å; I210-M215 HydrophobicContact CG1-CB 4.1Å; I210-M215 HydrophobicContact CG2-CB 4.45Å; M215-V233 HydrophobicContact CE-CG1 3.91Å; M215-V233 HydrophobicContact SD-CG1 4.11Å; M215-V233 HydrophobicContact SD-CG2 4.49Å; M215-L235 HydrophobicContact CE-CD2 4.43Å
216N95.3Very high90.5Very high42 Ų4259.6 Ų59.623%0.22533%0.328CS..EExtended strand (participates in β ladder)trans-97.6128.4172.3-86.3-57000109.5V176 P207 T208 S209V176-N216 WeakPolarHBondContact CG2-OD1 3.17Å; P207-N216 CarbonylContact C-O 3.46Å; P207-N216 WeakPolarHBondContact CA-O 3.11Å; P207-N216 VanDerWaalsContact CB-O 3.29Å; P207-N216 WeakPolarHBondContact CB-O 3.44Å; T208-N216 PolarHBondContact N-O 3.16Å; T208-N216 WeakPolarHBondContact OG1-CB 3.3Å; T208-N216 PolarHBondContact OG1-O 3.47Å; S209-N216 PolarHBondContact O-N 2.9Å; S209-N216 PolarHBondContact OG-ND2 2.85Å
217C95.1Very high90.2Very high0 Ų055.6 Ų55.60%031%0.311CS..EExtended strand (participates in β ladder)trans-120.3140.6174.2-48.70000109.4H174 V175 I177 C193 F195 G219H174-C217 CarbonylContact C-O 3.34Å; H174-C217 WeakPolarHBondContact CA-O 3.42Å; V175-C217 PolarHBondContact N-O 3.22Å; V175-C217 PolarHBondContact O-N 3.16Å; I177-C217 VanDerWaalsContact CD1-SG 3.51Å; C193-C217 HydrophobicContact CB-CB 3.54Å; C193-C217 WeakPolarHBondContact CB-SG 3.18Å; C193-C217 WeakPolarHBondContact SG-CB 3.19Å; C193-C217 CovalentContact SG-SG 2.02Å; C193-C217 PolarHBondContact SG-SG 2.66Å; F195-C217 HydrophobicContact CZ-CB 4.04Å; C217-G219 PolarHBondContact O-N 2.97Å
218P95.4Very high89.9Confident35 Ų3559.8 Ų59.823%0.22733%0.329CS..EExtended strand (participates in β ladder)trans-56.7127.8167.4-20.532.8000109.4F195 K206 T208F195-P218 WeakPolarHBondContact CE2-O 3.17Å; F195-P218 WeakPolarHBondContact CZ-O 3.31Å; K206-P218 WeakPolarHBondContact O-CD 3.1Å; T208-P218 HydrophobicContact CG2-CG 3.81Å
219G92.5Very high89.8Confident17 Ų1755.7 Ų55.718%0.17530%0.304CS..PPolyproline II helixtrans-71.9146179.200000111.8Y173 C217Y173-G219 PolarHBondContact O-N 3.26Å; C217-G219 PolarHBondContact O-N 2.97Å
220P91.8Very high89.7Confident3 Ų355.3 Ų55.32%0.01930%0.301CS..PPolyproline II helixtrans-67.2145.7173.730.3-36.2000110.1Y173 F195 F197 I203 L222 Y229Y173-P220 WeakPolarHBondContact CE1-O 3.42Å; Y173-P220 VanDerWaalsContact OH-CD 3.31Å; Y173-P220 WeakPolarHBondContact OH-CD 3.4Å; Y173-P220 PolarHBondContact OH-O 3.34Å; F195-P220 HydrophobicContact CB-CB 4.34Å; F195-P220 HydrophobicContact CB-CG 3.9Å; F195-P220 HydrophobicContact CD1-CG 3.96Å; F195-P220 HydrophobicContact CD2-CB 4.27Å; F195-P220 HydrophobicContact CD2-CG 4.08Å; F195-P220 HydrophobicContact CG-CB 4.29Å; F195-P220 HydrophobicContact CG-CG 3.71Å; F197-P220 HydrophobicContact CE2-CB 3.89Å; F197-P220 HydrophobicContact CE2-CG 3.92Å; F197-P220 HydrophobicContact CZ-CB 3.95Å; F197-P220 HydrophobicContact CZ-CG 3.78Å; I203-P220 HydrophobicContact CD1-CB 3.73Å; P220-L222 PolarHBondContact O-N 3.32Å; P220-Y229 HydrophobicContact CG-CD1 4.47Å; P220-Y229 HydrophobicContact CG-CE1 4.08Å; P220-Y229 HydrophobicContact CG-CE2 4.22Å
221K87.8Confident89.7Confident156 Ų15654.7 Ų54.768%0.67830%0.297SS*.PPolyproline II helixtrans-63.2122175.2-172.5-178.8-179.6-173.90110
222L86.9Confident89.7Confident2 Ų252.2 Ų52.21%0.0128%0.283CS..PPolyproline II helixtrans-90.1130.7175.7-57.9168.7000109.1E167 V169 G170 Y173 F197 P220 Y229E167-L222 HydrophobicContact CB-CD1 3.58Å; V169-L222 WeakPolarHBondContact CG1-O 3.45Å; V169-L222 HydrophobicContact CG2-CB 4.38Å; G170-L222 PolarHBondContact N-O 3.47Å; Y173-L222 HydrophobicContact CE1-CD1 3.87Å; Y173-L222 HydrophobicContact CE1-CG 4.08Å; F197-L222 HydrophobicContact CE1-CD2 3.87Å; F197-L222 HydrophobicContact CZ-CD2 3.97Å; P220-L222 PolarHBondContact O-N 3.32Å; L222-Y229 HydrophobicContact CD2-CD1 3.91Å; L222-Y229 HydrophobicContact CD2-CE1 3.57Å
223E83.6Confident89.9Confident137 Ų13747.7 Ų47.764%0.6426%0.259SS*.  trans-103.5-34-175-66.3-164.1164.400112.5V169 E227V169-E223 WeakPolarHBondContact CG1-O 3.33Å; E223-E227 PolarHBondContact N-OE2 2.91Å
224K85.3Confident89.9Confident130 Ų13043.5 Ų43.557%0.56524%0.237SC*.SBendtrans-134.5139.4-174.3-62.3171.6-171163.10111E227 S250K224-E227 HydrophobicContact CB-CG 4.01Å; K224-E227 PolarHBondContact N-OE2 3.25Å; K224-E227 VanDerWaalsContact O-CG 3.31Å; K224-E227 WeakPolarHBondContact O-CG 3.46Å; K224-E227 PolarHBondContact O-N 3.35Å; K224-S250 PolarHBondContact O-OG 2.95Å
225P86.3Confident89.5Confident73 Ų7343.4 Ų43.447%0.47423%0.234SC..THydrogen-bonded Turntrans-60.7143171.1-21.232.3000111.5V169 E227V169-P225 HydrophobicContact CG2-CG 4.05Å; P225-E227 VanDerWaalsContact C-N 3.33Å
226G84.7Confident88.7Confident59 Ų5945 Ų4561%0.60824%0.242SC*.THydrogen-bonded Turntrans84-0.3-179.200000114.9S250G226-S250 PolarHBondContact N-O 3.47Å; G226-S250 PolarHBondContact N-OG 3.17Å
227E87.1Confident88.2Confident53 Ų5350.5 Ų50.525%0.24827%0.265CS..  trans-64.2133.5164.1-68.6178142.800110.1F197 E223 K224 P225 S250F197-E227 HydrophobicContact CE1-CB 4.5Å; E223-E227 PolarHBondContact N-OE2 2.91Å; K224-E227 HydrophobicContact CB-CG 4.01Å; K224-E227 PolarHBondContact N-OE2 3.25Å; K224-E227 VanDerWaalsContact O-CG 3.31Å; K224-E227 WeakPolarHBondContact O-CG 3.46Å; K224-E227 PolarHBondContact O-N 3.35Å; P225-E227 VanDerWaalsContact C-N 3.33Å; E227-S250 WeakPolarHBondContact CA-OG 3.38Å; E227-S250 WeakPolarHBondContact CB-OG 3.38Å; E227-S250 PolarHBondContact N-OG 3.48Å; E227-S250 PolarHBondContact O-N 3.18Å; E227-S250 PolarHBondContact O-OG 3.35Å
228E90.4Very high87.6Confident112 Ų11251.9 Ų51.952%0.52328%0.279SS..EExtended strand (participates in β ladder)trans-120.6138.3176-174.8179.8-171.100108.8S247 I248E228-S247 WeakPolarHBondContact OE1-CB 3.47Å; E228-S247 PolarHBondContact OE1-OG 2.98Å; E228-I248 WeakPolarHBondContact CA-O 3.28Å
229Y91.2Very high86.8Confident2 Ų257.5 Ų57.51%0.00830%0.299CS..EExtended strand (participates in β ladder)trans-133.9149.117363.3-92.3000111.1Y173 F195 I196 F197 P220 L222 I231 S247 I248Y173-Y229 WeakPolarHBondContact CE2-OH 3.32Å; Y173-Y229 PolarHBondContact OH-OH 2.96Å; F195-Y229 HydrophobicContact CB-CD2 4.19Å; F195-Y229 AromaticContact CD1-CD2 3.87Å; F195-Y229 HydrophobicContact CD1-CD2 3.87Å; F195-Y229 AromaticContact CD1-CE2 3.52Å; F195-Y229 HydrophobicContact CD1-CE2 3.52Å; F195-Y229 HydrophobicContact CE1-CE2 4.13Å; F195-Y229 HydrophobicContact CG-CE2 4.44Å; I196-Y229 VanDerWaalsContact O-CA 3.32Å; I196-Y229 WeakPolarHBondContact O-CA 3.28Å; I196-Y229 WeakPolarHBondContact O-CB 3.33Å; F197-Y229 HydrophobicContact CD1-CD1 4.33Å; F197-Y229 HydrophobicContact CD1-CG 4.49Å; F197-Y229 AromaticContact CE1-CD1 3.62Å; F197-Y229 HydrophobicContact CE1-CD1 3.62Å; F197-Y229 HydrophobicContact CE1-CG 4.12Å; F197-Y229 HydrophobicContact CE2-CD1 4.37Å; F197-Y229 HydrophobicContact CE2-CG 4.28Å; F197-Y229 AromaticContact CZ-CD1 3.64Å; F197-Y229 HydrophobicContact CZ-CD1 3.64Å; F197-Y229 HydrophobicContact CZ-CE1 4.32Å; F197-Y229 AromaticContact CZ-CG 4Å; F197-Y229 HydrophobicContact CZ-CG 4Å; P220-Y229 HydrophobicContact CG-CD1 4.47Å; P220-Y229 HydrophobicContact CG-CE1 4.08Å; P220-Y229 HydrophobicContact CG-CE2 4.22Å; L222-Y229 HydrophobicContact CD2-CD1 3.91Å; L222-Y229 HydrophobicContact CD2-CE1 3.57Å; Y229-I231 HydrophobicContact CD2-CG1 4.1Å; Y229-I231 HydrophobicContact CE2-CD1 4.07Å; Y229-I231 HydrophobicContact CE2-CG1 3.95Å; Y229-S247 VanDerWaalsContact O-CA 3.26Å; Y229-S247 WeakPolarHBondContact O-CA 3.48Å; Y229-S247 WeakPolarHBondContact O-CB 3.19Å; Y229-I248 HydrophobicContact CE1-CB 3.88Å; Y229-I248 HydrophobicContact CE1-CG2 3.98Å; Y229-I248 HydrophobicContact CE2-CB 3.93Å; Y229-I248 HydrophobicContact CE2-CD1 4.07Å; Y229-I248 HydrophobicContact CE2-CG1 4.27Å; Y229-I248 PolarHBondContact N-O 3.17Å; Y229-I248 PolarHBondContact O-N 3.11Å; Y229-I248 VanDerWaalsContact O-N 3.11Å; Y229-I248 WeakPolarHBondContact OH-CD1 3.47Å
230S91.4Very high86.1Confident32 Ų3260 Ų6022%0.22431%0.311CS..EExtended strand (participates in β ladder)trans-98.7157.7171.862.20000110.6I196I196-S230 PolarHBondContact N-O 3.11Å; I196-S230 PolarHBondContact O-N 2.75Å
231I91.1Very high85.6Confident0 Ų062.1 Ų62.10%032%0.32CS..EExtended strand (participates in β ladder)trans-115.6136.4-177.7-63.6157.6000109.5V162 V175 I177 R194 F195 Y229 S244 I248V162-I231 HydrophobicContact CB-CD1 4.04Å; V162-I231 HydrophobicContact CG1-CD1 3.63Å; V162-I231 HydrophobicContact CG2-CD1 4.17Å; V175-I231 HydrophobicContact CG1-CD1 3.79Å; I177-I231 HydrophobicContact CD1-CG2 3.7Å; I177-I231 HydrophobicContact CG1-CG2 4.41Å; R194-I231 CarbonylContact O-C 3.58Å; R194-I231 WeakPolarHBondContact O-CA 3.49Å; F195-I231 HydrophobicContact CD1-CG1 3.84Å; F195-I231 HydrophobicContact CE1-CD1 4.39Å; F195-I231 HydrophobicContact CE1-CG1 4.08Å; Y229-I231 HydrophobicContact CD2-CG1 4.1Å; Y229-I231 HydrophobicContact CE2-CD1 4.07Å; Y229-I231 HydrophobicContact CE2-CG1 3.95Å; I231-S244 WeakPolarHBondContact O-CB 3.37Å; I231-S244 PolarHBondContact O-N 3.25Å; I231-I248 HydrophobicContact CD1-CD1 3.85Å; I231-I248 HydrophobicContact CD1-CG1 4.28Å
232E91.2Very high85.2Confident35 Ų3558.2 Ų58.216%0.16430%0.303CS..EExtended strand (participates in β ladder)trans-124.5147.9166.4-53.4-167.6148.200110.1R194 I196 F241 F242 K243R194-E232 HydrophobicContact CB-CB 4.22Å; R194-E232 WeakPolarHBondContact CB-O 3.28Å; R194-E232 HydrophobicContact CG-CB 4.5Å; R194-E232 PolarHBondContact N-O 2.96Å; R194-E232 PolarHBondContact O-N 2.87Å; I196-E232 VanDerWaalsContact CD1-CD 3.44Å; I196-E232 HydrophobicContact CD1-CG 3.62Å; E232-F241 HydrophobicContact CB-CB 4.08Å; E232-F241 HydrophobicContact CB-CD1 3.85Å; E232-F241 HydrophobicContact CB-CG 4.38Å; E232-F241 WeakPolarHBondContact OE2-CB 3.47Å; E232-F242 WeakPolarHBondContact CA-O 3.3Å; E232-K243 HydrophobicContact CG-CB 4.46Å; E232-K243 HydrophobicContact CG-CG 4.43Å
233V89.3Confident84.7Confident1 Ų164.6 Ų64.61%0.00633%0.331CS..EExtended strand (participates in β ladder)trans-116.2129177.3178.60000109.5V159 I177 V191 I192 M215 L235 F241 F242V159-V233 HydrophobicContact CG2-CB 4.45Å; V159-V233 HydrophobicContact CG2-CG2 3.9Å; I177-V233 HydrophobicContact CD1-CG2 3.9Å; I177-V233 HydrophobicContact CG2-CG2 4.13Å; V191-V233 HydrophobicContact CG1-CG1 4.44Å; I192-V233 WeakPolarHBondContact O-CA 3.32Å; M215-V233 HydrophobicContact CE-CG1 3.91Å; M215-V233 HydrophobicContact SD-CG1 4.11Å; M215-V233 HydrophobicContact SD-CG2 4.49Å; V233-L235 HydrophobicContact CG1-CD2 3.57Å; V233-L235 HydrophobicContact CG1-CG 4.33Å; V233-F241 WeakPolarHBondContact O-CA 3.23Å; V233-F242 PolarHBondContact N-O 3.26Å; V233-F242 WeakPolarHBondContact O-CD2 3.45Å; V233-F242 PolarHBondContact O-N 3.04Å
234S87Confident84.1Confident0 Ų058.2 Ų58.20%030%0.302CS..EExtended strand (participates in β ladder)trans-110.8143.8166.4-174.70000110.4V191 I192 N236 G238 T240 F241V191-S234 CarbonylContact C-O 3.51Å; V191-S234 VanDerWaalsContact CA-O 3.25Å; V191-S234 WeakPolarHBondContact CA-O 3.47Å; I192-S234 PolarHBondContact N-O 2.86Å; I192-S234 PolarHBondContact O-N 3.44Å; S234-N236 PolarHBondContact OG-OD1 2.96Å; S234-G238 VanDerWaalsContact OG-CA 3.23Å; S234-G238 WeakPolarHBondContact OG-CA 3.43Å; S234-G238 PolarHBondContact OG-N 3.26Å; S234-T240 WeakPolarHBondContact CA-O 3.01Å; S234-T240 WeakPolarHBondContact CB-O 3.03Å; S234-T240 PolarHBondContact OG-O 3Å; S234-F241 VanDerWaalsContact CB-CE1 3.4Å
235L82.3Confident83.5Confident22 Ų2259.6 Ų59.612%0.11532%0.315CS..SBendtrans-120.84.3-177.9-54.1177000112.9L157 L185 V191 M215 V233 F242L157-L235 HydrophobicContact CD1-CD1 3.07Å; L157-L235 HydrophobicContact CD2-CD1 3.21Å; L157-L235 HydrophobicContact CD2-CG 4.37Å; L157-L235 HydrophobicContact CG-CD1 3.65Å; L185-L235 HydrophobicContact CD1-CD2 4.05Å; L185-L235 HydrophobicContact CD2-CB 3.6Å; L185-L235 HydrophobicContact CD2-CD1 3.61Å; L185-L235 HydrophobicContact CD2-CD2 3.62Å; L185-L235 HydrophobicContact CD2-CG 3.77Å; L185-L235 HydrophobicContact CG-CD2 4.43Å; V191-L235 HydrophobicContact CB-CD2 4.47Å; V191-L235 HydrophobicContact CG1-CD2 3.94Å; V191-L235 HydrophobicContact CG2-CD2 3.89Å; M215-L235 HydrophobicContact CE-CD2 4.43Å; V233-L235 HydrophobicContact CG1-CD2 3.57Å; V233-L235 HydrophobicContact CG1-CG 4.33Å; L235-F242 HydrophobicContact CD1-CD2 4.49Å; L235-F242 HydrophobicContact CD1-CE2 4.05Å; L235-F242 HydrophobicContact CG-CE2 4.34Å
236N77.3Confident83Confident34 Ų3458.3 Ų58.318%0.18231%0.306CS..SBendtrans-138.440.7-171.660.75.9000110.4S234 G238 K239 T240S234-N236 PolarHBondContact OG-OD1 2.96Å; N236-G238 VanDerWaalsContact C-N 3.32Å; N236-G238 PolarHBondContact O-N 2.97Å; N236-K239 WeakPolarHBondContact O-CG 3.41Å; N236-K239 PolarHBondContact O-N 3.04Å; N236-K239 PolarHBondContact OD1-N 3.13Å; N236-K239 VanDerWaalsContact OD1-N 3.16Å; N236-T240 PolarHBondContact ND2-OG1 3.43Å; N236-T240 PolarHBondContact OD1-N 3.34Å; N236-T240 PolarHBondContact OD1-O 3.3Å; N236-T240 PolarHBondContact OD1-OG1 3.4Å
237K85.4Confident83Confident158 Ų15857.6 Ų57.669%0.68729%0.292SS*.THydrogen-bonded Turntrans5942.4176.1-158.5-179.5-178.8176.40112.4E190 K239E190-K237 HydrophobicContact CB-CB 4.26Å; E190-K237 HydrophobicContact CG-CB 4.28Å; E190-K237 WeakPolarHBondContact O-CA 3.34Å; E190-K237 PolarHBondContact O-N 3.02Å; K237-K239 PolarHBondContact O-N 3.47Å
238G81.5Confident82.9Confident29 Ų2955.1 Ų55.130%0.29928%0.28SS..THydrogen-bonded Turntrans79.911.817400000115.6S234 N236 F241S234-G238 VanDerWaalsContact OG-CA 3.23Å; S234-G238 WeakPolarHBondContact OG-CA 3.43Å; S234-G238 PolarHBondContact OG-N 3.26Å; N236-G238 VanDerWaalsContact C-N 3.32Å; N236-G238 PolarHBondContact O-N 2.97Å; G238-F241 VanDerWaalsContact CA-CE2 3.48Å; G238-F241 VanDerWaalsContact O-CE2 3.31Å; G238-F241 WeakPolarHBondContact O-CE2 3.27Å
239K78.6Confident82.9Confident152 Ų15252.4 Ų52.466%0.66127%0.271SS*.SBendtrans-72.7-38176.8-67.7179.5179.7-172.50112.2N236 K237N236-K239 WeakPolarHBondContact O-CG 3.41Å; N236-K239 PolarHBondContact O-N 3.04Å; N236-K239 PolarHBondContact OD1-N 3.13Å; N236-K239 VanDerWaalsContact OD1-N 3.16Å; K237-K239 PolarHBondContact O-N 3.47Å
240T77.4Confident82.6Confident69 Ų6952.4 Ų52.442%0.42327%0.271SS..SBendtrans-136.5144.8174.259.80000109.8S234 N236S234-T240 WeakPolarHBondContact CA-O 3.01Å; S234-T240 WeakPolarHBondContact CB-O 3.03Å; S234-T240 PolarHBondContact OG-O 3Å; N236-T240 PolarHBondContact ND2-OG1 3.43Å; N236-T240 PolarHBondContact OD1-N 3.34Å; N236-T240 PolarHBondContact OD1-O 3.3Å; N236-T240 PolarHBondContact OD1-OG1 3.4Å
241F81.6Confident82.4Confident48 Ų4853.5 Ų53.521%0.21128%0.277CS..EExtended strand (participates in β ladder)trans-119.6137.6176.8-75.2-91.5000109.9I192 R194 E232 V233 S234 G238I192-F241 HydrophobicContact CG2-CE1 4.4Å; R194-F241 HydrophobicContact CB-CD1 4.07Å; R194-F241 HydrophobicContact CB-CE1 3.69Å; R194-F241 HydrophobicContact CG-CE1 4.36Å; R194-F241 VanDerWaalsContact CZ-CE2 3.44Å; E232-F241 HydrophobicContact CB-CB 4.08Å; E232-F241 HydrophobicContact CB-CD1 3.85Å; E232-F241 HydrophobicContact CB-CG 4.38Å; E232-F241 WeakPolarHBondContact OE2-CB 3.47Å; V233-F241 WeakPolarHBondContact O-CA 3.23Å; S234-F241 VanDerWaalsContact CB-CE1 3.4Å; G238-F241 VanDerWaalsContact CA-CE2 3.48Å; G238-F241 VanDerWaalsContact O-CE2 3.31Å; G238-F241 WeakPolarHBondContact O-CE2 3.27Å
242F80Confident82Confident74 Ų7458.9 Ų58.933%0.32531%0.31SS..EExtended strand (participates in β ladder)trans-98112.5171.4-59.6-81.7000107.3L157 E232 V233 L235L157-F242 HydrophobicContact CB-CD1 4.25Å; L157-F242 HydrophobicContact CB-CD2 4.37Å; L157-F242 HydrophobicContact CB-CE1 4.06Å; L157-F242 HydrophobicContact CB-CE2 4.2Å; L157-F242 HydrophobicContact CB-CG 4.41Å; L157-F242 HydrophobicContact CB-CZ 4.03Å; L157-F242 HydrophobicContact CD1-CE2 4.32Å; L157-F242 HydrophobicContact CD1-CZ 4.35Å; E232-F242 WeakPolarHBondContact CA-O 3.3Å; V233-F242 PolarHBondContact N-O 3.26Å; V233-F242 WeakPolarHBondContact O-CD2 3.45Å; V233-F242 PolarHBondContact O-N 3.04Å; L235-F242 HydrophobicContact CD1-CD2 4.49Å; L235-F242 HydrophobicContact CD1-CE2 4.05Å; L235-F242 HydrophobicContact CG-CE2 4.34Å
243K75.1Confident81.2Confident136 Ų13659.4 Ų59.459%0.59132%0.317SS*.EExtended strand (participates in β ladder)trans-73.4133.3-178.5-174.5173.2-177.71790110.1E232E232-K243 HydrophobicContact CG-CB 4.46Å; E232-K243 HydrophobicContact CG-CG 4.43Å
244S71.2Confident80.3Confident3 Ų365 Ų652%0.02135%0.354CS..EExtended strand (participates in β ladder)trans-88.8142.1169.1-164.90000111V159 I231 V246V159-S244 WeakPolarHBondContact CG1-OG 3.37Å; I231-S244 WeakPolarHBondContact O-CB 3.37Å; I231-S244 PolarHBondContact O-N 3.25Å; S244-V246 WeakPolarHBondContact OG-CG2 3.47Å; S244-V246 PolarHBondContact OG-N 3.39Å
245N73.9Confident79.2Confident160 Ų16070.3 Ų70.386%0.85639%0.391SS*.EExtended strand (participates in β ladder)trans-87.19.5170.8-71-25.9000112.4
246V75.3Confident78.1Confident46 Ų4677.9 Ų77.928%0.27943%0.43SS..EExtended strand (participates in β ladder)trans-110.2149.1177.5-65.40000111.6V159 V162 S244V159-V246 HydrophobicContact CG1-CG2 4.49Å; V162-V246 HydrophobicContact CB-CG2 3.91Å; V162-V246 HydrophobicContact CG1-CG2 3.46Å; V162-V246 VanDerWaalsContact CG1-CG2 3.46Å; V162-V246 HydrophobicContact CG2-CB 3.85Å; V162-V246 HydrophobicContact CG2-CG2 3.41Å; V162-V246 VanDerWaalsContact CG2-CG2 3.41Å; S244-V246 WeakPolarHBondContact OG-CG2 3.47Å; S244-V246 PolarHBondContact OG-N 3.39Å
247S84.5Confident76.2Confident44 Ų4489.3 Ų89.331%0.30848%0.478SS..EExtended strand (participates in β ladder)trans-130.5158.1179.654.80000110.4E228 Y229E228-S247 WeakPolarHBondContact OE1-CB 3.47Å; E228-S247 PolarHBondContact OE1-OG 2.98Å; Y229-S247 VanDerWaalsContact O-CA 3.26Å; Y229-S247 WeakPolarHBondContact O-CA 3.48Å; Y229-S247 WeakPolarHBondContact O-CB 3.19Å
248I86.1Confident75.8Confident0 Ų085.9 Ų85.90%047%0.468CS..EExtended strand (participates in β ladder)trans-117.4138.4174.9-61.6179.7000107.9V162 P164 S165 E167 V175 E228 Y229 I231V162-I248 HydrophobicContact CB-CD1 4.41Å; V162-I248 HydrophobicContact CG2-CD1 4.06Å; V162-I248 HydrophobicContact CG2-CG1 3.8Å; P164-I248 VanDerWaalsContact O-CD1 3.28Å; P164-I248 WeakPolarHBondContact O-CD1 3.43Å; P164-I248 WeakPolarHBondContact O-CG1 3.47Å; S165-I248 WeakPolarHBondContact O-CA 3.14Å; E167-I248 HydrophobicContact CB-CG2 4.42Å; E167-I248 HydrophobicContact CG-CG2 4.36Å; V175-I248 HydrophobicContact CB-CD1 4.47Å; V175-I248 HydrophobicContact CG1-CD1 3.77Å; V175-I248 HydrophobicContact CG2-CD1 3.86Å; E228-I248 WeakPolarHBondContact CA-O 3.28Å; Y229-I248 HydrophobicContact CE1-CB 3.88Å; Y229-I248 HydrophobicContact CE1-CG2 3.98Å; Y229-I248 HydrophobicContact CE2-CB 3.93Å; Y229-I248 HydrophobicContact CE2-CD1 4.07Å; Y229-I248 HydrophobicContact CE2-CG1 4.27Å; Y229-I248 PolarHBondContact N-O 3.17Å; Y229-I248 PolarHBondContact O-N 3.11Å; Y229-I248 VanDerWaalsContact O-N 3.11Å; Y229-I248 WeakPolarHBondContact OH-CD1 3.47Å; I231-I248 HydrophobicContact CD1-CD1 3.85Å; I231-I248 HydrophobicContact CD1-CG1 4.28Å
249T88.5Confident75.5Confident55 Ų5588.9 Ų88.934%0.33748%0.477SS..EExtended strand (participates in β ladder)trans-112.3131.4179.9-48.60000111.3S165 S166 E167S165-T249 PolarHBondContact O-N 3.14Å; S165-T249 VanDerWaalsContact O-N 3.14Å; S166-T249 CarbonylContact C-O 3.56Å; S166-T249 WeakPolarHBondContact CA-O 3.37Å; S166-T249 VanDerWaalsContact CB-O 3.28Å; S166-T249 WeakPolarHBondContact CB-O 3.43Å; E167-T249 PolarHBondContact N-O 3.34Å
250S86.6Confident75.3Confident2 Ų285.4 Ų85.41%0.01447%0.467CS..EExtended strand (participates in β ladder)trans-74.3140.7173.260.40000112.1E167 K224 G226 E227E167-S250 CarbonylContact O-C 3.55Å; E167-S250 VanDerWaalsContact O-CA 3.31Å; E167-S250 WeakPolarHBondContact O-CA 3.42Å; K224-S250 PolarHBondContact O-OG 2.95Å; G226-S250 PolarHBondContact N-O 3.47Å; G226-S250 PolarHBondContact N-OG 3.17Å; E227-S250 WeakPolarHBondContact CA-OG 3.38Å; E227-S250 WeakPolarHBondContact CB-OG 3.38Å; E227-S250 PolarHBondContact N-OG 3.48Å; E227-S250 PolarHBondContact O-N 3.18Å; E227-S250 PolarHBondContact O-OG 3.35Å
251T85.9Confident75.2Confident55 Ų5586.4 Ų86.434%0.33747%0.469SS..EExtended strand (participates in β ladder)trans-131.7158.7-176.259.90000111.8E167 V169E167-T251 PolarHBondContact O-N 3.13Å; E167-T251 PolarHBondContact O-OG1 3.34Å; V169-T251 PolarHBondContact N-O 2.78Å
252T83.1Confident74.8Confident113 Ų11388.8 Ų88.869%0.69349%0.485SS*.PPolyproline II helixtrans-79123.2174.4-41.30000109.7
253C75Confident74.4Confident47 Ų4789.7 Ų89.732%0.31850%0.496SS..PPolyproline II helixtrans-79.4143.9-179.6-480000111.8C168 S255C168-C253 WeakPolarHBondContact CA-SG 3.43Å; C168-C253 HydrophobicContact CB-CB 4.28Å; C168-C253 WeakPolarHBondContact CB-SG 3.42Å; C168-C253 WeakPolarHBondContact SG-CB 3.11Å; C168-C253 CovalentContact SG-SG 2Å; C168-C253 PolarHBondContact SG-SG 3.11Å; C253-S255 PolarHBondContact O-N 3.01Å
254P69.3Low74.4Confident119 Ų11986.4 Ų86.477%0.77349%0.489SS*.PPolyproline II helixtrans-64124.8162-9.524.1000108.6L256P254-L256 PolarHBondContact O-N 2.94Å
255S64.6Low74.6Confident111 Ų11192.8 Ų92.878%0.77653%0.525SS*.PPolyproline II helixtrans-61120170.941.30000109.4C253 K257C253-S255 PolarHBondContact O-N 3.01Å; S255-K257 PolarHBondContact O-N 2.76Å; S255-K257 VanDerWaalsContact O-N 3.11Å
256L58.2Low74.7Confident181 Ų18187.3 Ų87.395%0.94850%0.498SS*.  trans-56.3114.7169.5-79.4154.8000107.7P254P254-L256 PolarHBondContact O-N 2.94Å
257K39.3Very low74.6Confident274 Ų27491 Ų91100%1.19152%0.518SS*.  trans-72.30173.6-87.6-174.5175.9178.60111.2S255S255-K257 PolarHBondContact O-N 2.76Å; S255-K257 VanDerWaalsContact O-N 3.11Å

Retrieved 257 of 257 residues in 149.3 ms (Link to these results)

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