A0A077ZLQ3_TRITR Loading...

Thioredoxin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZLQ3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 65 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
1V91.1Very high94.4Very high52 Ų5290 Ų9032%0.31551%0.513SS..  0-52.90-176.40000110.5E3 Q4 Y5 K52 I55 E56 I59V1-E3 VanDerWaalsContact C-N 3.31Å; V1-E3 PolarHBondContact O-N 3.43Å; V1-Q4 WeakPolarHBondContact O-CB 3.38Å; V1-Q4 PolarHBondContact O-N 3.42Å; V1-Y5 HydrophobicContact CG1-CD2 3.88Å; V1-Y5 HydrophobicContact CG1-CE2 4.02Å; V1-Y5 WeakPolarHBondContact O-CD2 3.43Å; V1-Y5 PolarHBondContact O-N 3.09Å; V1-K52 HydrophobicContact CG2-CD 4.32Å; V1-K52 HydrophobicContact CG2-CG 3.58Å; V1-I55 HydrophobicContact CB-CG2 4.32Å; V1-I55 HydrophobicContact CG1-CG2 3.92Å; V1-I55 HydrophobicContact CG2-CG2 4.3Å; V1-E56 HydrophobicContact CG1-CG 4.38Å; V1-I59 HydrophobicContact CG1-CD1 3.53Å
2G91.2Very high94.5Very high27 Ų2789.1 Ų89.128%0.27854%0.538SS..THydrogen-bonded Turntrans-48-49.5176.300000113.8Q4 Y5 A6G2-Q4 VanDerWaalsContact C-N 3.32Å; G2-Q4 PolarHBondContact O-N 3.42Å; G2-Y5 CarbonylContact O-C 3.56Å; G2-Y5 PolarHBondContact O-N 3.17Å; G2-Y5 VanDerWaalsContact O-N 3.13Å; G2-A6 PolarHBondContact O-N 3.49Å; G2-A6 VanDerWaalsContact O-N 3.12Å
3E94.2Very high94.7Very high184 Ų18497.2 Ų97.286%0.8656%0.562SS**G310 helixtrans-58.6-38.2176.1-65.4171.3177.100113.9V1 Y5 A6V1-E3 VanDerWaalsContact C-N 3.31Å; V1-E3 PolarHBondContact O-N 3.43Å; E3-Y5 PolarHBondContact O-N 3.44Å; E3-A6 WeakPolarHBondContact O-CB 3.39Å; E3-A6 PolarHBondContact O-N 3.41Å
4Q94.9Very high94.8Very high105 Ų10597.7 Ų97.749%0.49156%0.56SS.*G310 helixtrans-68.7-24.2-179.9-178.9-177.5-34.100112.3V1 G2 E56V1-Q4 WeakPolarHBondContact O-CB 3.38Å; V1-Q4 PolarHBondContact O-N 3.42Å; G2-Q4 VanDerWaalsContact C-N 3.32Å; G2-Q4 PolarHBondContact O-N 3.42Å; Q4-E56 PolarHBondContact NE2-OE1 3.33Å; Q4-E56 PolarHBondContact OE1-OE1 3.13Å
5Y94.8Very high95Very high30 Ų3095 Ų9512%0.11854%0.543CS..G310 helixtrans-110.517.7179.7-72.2-96.6000112V1 G2 E3 D7 T8 L9 E56 I59V1-Y5 HydrophobicContact CG1-CD2 3.88Å; V1-Y5 HydrophobicContact CG1-CE2 4.02Å; V1-Y5 WeakPolarHBondContact O-CD2 3.43Å; V1-Y5 PolarHBondContact O-N 3.09Å; G2-Y5 CarbonylContact O-C 3.56Å; G2-Y5 PolarHBondContact O-N 3.17Å; G2-Y5 VanDerWaalsContact O-N 3.13Å; E3-Y5 PolarHBondContact O-N 3.44Å; Y5-D7 PolarHBondContact O-N 2.98Å; Y5-D7 VanDerWaalsContact O-N 3.12Å; Y5-T8 WeakPolarHBondContact O-CA 3.37Å; Y5-T8 PolarHBondContact O-N 2.9Å; Y5-L9 HydrophobicContact CD1-CD2 4.49Å; Y5-L9 HydrophobicContact CG-CD2 4.32Å; Y5-L9 PolarHBondContact O-N 3.44Å; Y5-E56 HydrophobicContact CE2-CG 4.2Å; Y5-I59 HydrophobicContact CD1-CG2 3.9Å; Y5-I59 HydrophobicContact CD2-CD1 4.35Å; Y5-I59 HydrophobicContact CE1-CG2 3.74Å; Y5-I59 HydrophobicContact CE2-CD1 4.43Å; Y5-I59 HydrophobicContact CG-CG2 4.45Å
6A94.6Very high95.1Very high65 Ų6594.1 Ų94.154%0.53753%0.529SS..THydrogen-bonded Turntrans-58.5-28.4-175.100000113.3G2 E3 T8G2-A6 PolarHBondContact O-N 3.49Å; G2-A6 VanDerWaalsContact O-N 3.12Å; E3-A6 WeakPolarHBondContact O-CB 3.39Å; E3-A6 PolarHBondContact O-N 3.41Å; A6-T8 VanDerWaalsContact C-N 3.29Å; A6-T8 PolarHBondContact O-N 3.37Å
7D95.4Very high95.1Very high169 Ų16996.5 Ų96.590%0.90454%0.54SS*.THydrogen-bonded Turntrans-78.8-10.4176.1-61.4-39000113.6Y5Y5-D7 PolarHBondContact O-N 2.98Å; Y5-D7 VanDerWaalsContact O-N 3.12Å
8T93.9Very high95.3Very high91 Ų9198.9 Ų98.956%0.55855%0.546SS*.THydrogen-bonded Turntrans-117.1-32.8-174-50.30000112.6Y5 A6 L63Y5-T8 WeakPolarHBondContact O-CA 3.37Å; Y5-T8 PolarHBondContact O-N 2.9Å; A6-T8 VanDerWaalsContact C-N 3.29Å; A6-T8 PolarHBondContact O-N 3.37Å; T8-L63 HydrophobicContact CG2-CD1 3.72Å
9L95.4Very high95.4Very high30 Ų3098.8 Ų98.816%0.15754%0.542CS..  trans-147.1159-177.36485.1000111.6Y5 A11 F36 I59Y5-L9 HydrophobicContact CD1-CD2 4.49Å; Y5-L9 HydrophobicContact CG-CD2 4.32Å; Y5-L9 PolarHBondContact O-N 3.44Å; L9-A11 HydrophobicContact CD1-CB 4.19Å; L9-F36 HydrophobicContact CB-CZ 4.39Å; L9-F36 HydrophobicContact CD2-CE2 4.01Å; L9-F36 HydrophobicContact CD2-CZ 4.06Å; L9-I59 HydrophobicContact CD2-CD1 4.26Å; L9-I59 HydrophobicContact CD2-CG1 4.4Å; L9-I59 HydrophobicContact CD2-CG2 3.84Å
10I96.5Very high95.4Very high170 Ų17098.1 Ų98.187%0.87254%0.542SS*.  trans-98.3127.7169-62.7167.2000107.7
11A96.4Very high95.5Very high67 Ų67101.3 Ų101.355%0.55455%0.553SS**  trans-99128.8174.400000110.3L9L9-A11 HydrophobicContact CD1-CB 4.19Å
12G96.1Very high95.8Very high79 Ų79101.1 Ų101.181%0.81455%0.55SS*.  trans-118.3159.3172.800000111.4
13K96.3Very high96.1Very high195 Ų195100.9 Ų100.985%0.84854%0.542SS*.  trans-124.8135171.7-170-172.880.8173.50108.6
14I96.5Very high96.2Very high104 Ų10499.9 Ų99.953%0.53354%0.537SS..  trans-119.3135.1172.9-62.1-171.1000107.7E19 L22I14-E19 HydrophobicContact CG2-CB 3.89Å; I14-E19 HydrophobicContact CG2-CG 3.84Å; I14-L22 HydrophobicContact CD1-CD2 3.26Å; I14-L22 HydrophobicContact CG2-CD2 4.18Å
15N97.2Very high96.2Very high57 Ų57104.2 Ų104.231%0.30555%0.549SS..  trans-83.6127.1171.1-175.1-20.4000108.7D17 E18 E19N15-D17 VanDerWaalsContact C-N 3.34Å; N15-D17 PolarHBondContact O-N 3.35Å; N15-D17 PolarHBondContact OD1-N 2.72Å; N15-E18 HydrophobicContact CB-CB 4.02Å; N15-E18 HydrophobicContact CB-CG 3.98Å; N15-E18 VanDerWaalsContact ND2-CD 3.3Å; N15-E18 PolarHBondContact ND2-OE1 3.34Å; N15-E18 PolarHBondContact O-N 2.98Å; N15-E19 PolarHBondContact O-N 3.13Å
16Y96.5Very high96.3Very high81 Ų81106 Ų10632%0.31856%0.557SS.*THydrogen-bonded Turntrans-59.4-43-179.3-175.2-84000112.4E18 I23 I28 I31Y16-E18 VanDerWaalsContact C-N 3.34Å; Y16-E18 PolarHBondContact O-N 3.43Å; Y16-I23 HydrophobicContact CD2-CD1 3.69Å; Y16-I23 HydrophobicContact CD2-CG1 3.84Å; Y16-I23 HydrophobicContact CD2-CG2 3.88Å; Y16-I23 HydrophobicContact CE1-CG2 4.24Å; Y16-I23 HydrophobicContact CE2-CB 4.36Å; Y16-I23 HydrophobicContact CE2-CD1 4.25Å; Y16-I23 HydrophobicContact CE2-CG1 4.15Å; Y16-I23 HydrophobicContact CE2-CG2 3.28Å; Y16-I23 HydrophobicContact CG-CD1 4.25Å; Y16-I23 HydrophobicContact CG-CG1 4.13Å; Y16-I23 VanDerWaalsContact CZ-CG2 3.48Å; Y16-I23 WeakPolarHBondContact O-CG1 3.33Å; Y16-I28 HydrophobicContact CD2-CG2 4.31Å; Y16-I28 HydrophobicContact CE2-CB 4.49Å; Y16-I28 HydrophobicContact CE2-CG2 4.12Å; Y16-I28 WeakPolarHBondContact CE2-O 3.5Å; Y16-I28 PolarHBondContact OH-O 3.43Å; Y16-I31 HydrophobicContact CD2-CG2 3.42Å; Y16-I31 VanDerWaalsContact CD2-CG2 3.42Å; Y16-I31 HydrophobicContact CE2-CG2 4.06Å; Y16-I31 HydrophobicContact CG-CG2 3.97Å
17D96.4Very high96.4Very high134 Ų134105.7 Ų105.772%0.71756%0.561SS**THydrogen-bonded Turntrans-77-23.4-174.1-61.4-37.5000112.6N15N15-D17 VanDerWaalsContact C-N 3.34Å; N15-D17 PolarHBondContact O-N 3.35Å; N15-D17 PolarHBondContact OD1-N 2.72Å
18E98.2Very high96.4Very high140 Ų14099 Ų9965%0.65453%0.525SS*.THydrogen-bonded Turntrans-88.3-19.9-176-66.5170.8-163.200112.9N15 Y16 P20N15-E18 HydrophobicContact CB-CB 4.02Å; N15-E18 HydrophobicContact CB-CG 3.98Å; N15-E18 VanDerWaalsContact ND2-CD 3.3Å; N15-E18 PolarHBondContact ND2-OE1 3.34Å; N15-E18 PolarHBondContact O-N 2.98Å; Y16-E18 VanDerWaalsContact C-N 3.34Å; Y16-E18 PolarHBondContact O-N 3.43Å; E18-P20 WeakPolarHBondContact O-CD 3.48Å
19E97Very high96.5Very high98 Ų98100.8 Ų100.846%0.45853%0.531SS..  trans-124.553.5-171.8-65.6-69.2179.900113.2I14 N15 Q21 L22 I23I14-E19 HydrophobicContact CG2-CB 3.89Å; I14-E19 HydrophobicContact CG2-CG 3.84Å; N15-E19 PolarHBondContact O-N 3.13Å; E19-Q21 VanDerWaalsContact C-N 3.29Å; E19-Q21 PolarHBondContact O-N 2.98Å; E19-L22 HydrophobicContact CB-CB 4.05Å; E19-L22 WeakPolarHBondContact O-CB 3.47Å; E19-L22 PolarHBondContact O-N 3Å; E19-I23 WeakPolarHBondContact O-CG1 3.27Å; E19-I23 PolarHBondContact O-N 2.99Å
20P96.3Very high96.6Very high84 Ų84102.2 Ų102.255%0.54554%0.541SS..Hα-helixtrans-59.6-35.8-170.123.9-34.7000113.7E18 L22 I23 E24E18-P20 WeakPolarHBondContact O-CD 3.48Å; P20-L22 VanDerWaalsContact C-N 3.29Å; P20-L22 PolarHBondContact O-N 3.46Å; P20-I23 PolarHBondContact O-N 3.15Å; P20-E24 WeakPolarHBondContact O-CB 3.29Å; P20-E24 PolarHBondContact O-N 3.09Å
21Q97.6Very high96.6Very high166 Ų16699.5 Ų99.578%0.77653%0.527SS*.Hα-helixtrans-65.3-34.5177.2-65.5-178.411.900112.1E19 R25E19-Q21 VanDerWaalsContact C-N 3.29Å; E19-Q21 PolarHBondContact O-N 2.98Å; Q21-R25 VanDerWaalsContact O-CB 3.23Å; Q21-R25 WeakPolarHBondContact O-CB 3.49Å; Q21-R25 PolarHBondContact O-N 3.17Å
22L96Very high96.5Very high47 Ų47100.3 Ų100.325%0.24653%0.526CS..Hα-helixtrans-74.6-41.3178.6-164.768.1000111.1I14 E19 P20 R25 F26I14-L22 HydrophobicContact CD1-CD2 3.26Å; I14-L22 HydrophobicContact CG2-CD2 4.18Å; E19-L22 HydrophobicContact CB-CB 4.05Å; E19-L22 WeakPolarHBondContact O-CB 3.47Å; E19-L22 PolarHBondContact O-N 3Å; P20-L22 VanDerWaalsContact C-N 3.29Å; P20-L22 PolarHBondContact O-N 3.46Å; L22-R25 PolarHBondContact O-N 3.43Å; L22-F26 HydrophobicContact CD1-CD2 3.84Å; L22-F26 HydrophobicContact CD1-CE2 3.43Å; L22-F26 VanDerWaalsContact CD1-CE2 3.43Å; L22-F26 HydrophobicContact CG-CD2 3.87Å; L22-F26 HydrophobicContact CG-CE2 3.9Å; L22-F26 WeakPolarHBondContact O-CD2 3.35Å; L22-F26 PolarHBondContact O-N 3.47Å
23I97.2Very high96.6Very high23 Ų2398 Ų9812%0.11850%0.497CS..Hα-helixtrans-58.5-47.9174.7-65.1-44.1000110.6Y16 E19 P20 F26 G27 I28Y16-I23 HydrophobicContact CD2-CD1 3.69Å; Y16-I23 HydrophobicContact CD2-CG1 3.84Å; Y16-I23 HydrophobicContact CD2-CG2 3.88Å; Y16-I23 HydrophobicContact CE1-CG2 4.24Å; Y16-I23 HydrophobicContact CE2-CB 4.36Å; Y16-I23 HydrophobicContact CE2-CD1 4.25Å; Y16-I23 HydrophobicContact CE2-CG1 4.15Å; Y16-I23 HydrophobicContact CE2-CG2 3.28Å; Y16-I23 HydrophobicContact CG-CD1 4.25Å; Y16-I23 HydrophobicContact CG-CG1 4.13Å; Y16-I23 VanDerWaalsContact CZ-CG2 3.48Å; Y16-I23 WeakPolarHBondContact O-CG1 3.33Å; E19-I23 WeakPolarHBondContact O-CG1 3.27Å; E19-I23 PolarHBondContact O-N 2.99Å; P20-I23 PolarHBondContact O-N 3.15Å; I23-F26 PolarHBondContact O-N 2.9Å; I23-G27 PolarHBondContact O-N 3.44Å; I23-I28 HydrophobicContact CD1-CB 4.34Å; I23-I28 HydrophobicContact CG2-CB 4.18Å; I23-I28 WeakPolarHBondContact CG2-O 3.07Å; I23-I28 PolarHBondContact O-N 3.18Å
24E97Very high96.7Very high162 Ų16291.8 Ų91.876%0.75747%0.473SS*.Hα-helixtrans-62-47.5175.1-175.2178.9-170.500111.4P20 F26 G27P20-E24 WeakPolarHBondContact O-CB 3.29Å; P20-E24 PolarHBondContact O-N 3.09Å; E24-F26 VanDerWaalsContact C-N 3.27Å; E24-F26 PolarHBondContact O-N 3.29Å; E24-G27 PolarHBondContact O-N 2.99Å
25R96.1Very high96.7Very high197 Ų19789.4 Ų89.474%0.74346%0.46SS*.Hα-helixtrans-56.5-39.1-179.4176.6177.6177.1174.7-0.6113.1Q21 L22Q21-R25 VanDerWaalsContact O-CB 3.23Å; Q21-R25 WeakPolarHBondContact O-CB 3.49Å; Q21-R25 PolarHBondContact O-N 3.17Å; L22-R25 PolarHBondContact O-N 3.43Å
26F96.1Very high96.7Very high66 Ų6687.9 Ų87.929%0.28945%0.451SS..Hα-helixtrans-96.52.4-179.7-69.2-62000113.8L22 I23 E24 I28 M35 F37 V42L22-F26 HydrophobicContact CD1-CD2 3.84Å; L22-F26 HydrophobicContact CD1-CE2 3.43Å; L22-F26 VanDerWaalsContact CD1-CE2 3.43Å; L22-F26 HydrophobicContact CG-CD2 3.87Å; L22-F26 HydrophobicContact CG-CE2 3.9Å; L22-F26 WeakPolarHBondContact O-CD2 3.35Å; L22-F26 PolarHBondContact O-N 3.47Å; I23-F26 PolarHBondContact O-N 2.9Å; E24-F26 VanDerWaalsContact C-N 3.27Å; E24-F26 PolarHBondContact O-N 3.29Å; F26-I28 VanDerWaalsContact C-N 3.33Å; F26-I28 HydrophobicContact CB-CD1 4.12Å; F26-I28 HydrophobicContact CB-CG1 3.89Å; F26-I28 PolarHBondContact O-N 3.47Å; F26-M35 HydrophobicContact CB-CE 4.02Å; F26-M35 HydrophobicContact CB-SD 3.91Å; F26-M35 HydrophobicContact CD1-CE 3.58Å; F26-M35 HydrophobicContact CD1-SD 4.27Å; F26-M35 HydrophobicContact CD2-SD 4.33Å; F26-M35 HydrophobicContact CE1-CE 4.16Å; F26-M35 HydrophobicContact CG-CE 3.86Å; F26-M35 HydrophobicContact CG-SD 3.94Å; F26-F37 AromaticContact CE1-CE1 3.99Å; F26-F37 HydrophobicContact CE1-CE1 3.99Å; F26-F37 HydrophobicContact CE1-CZ 4.13Å; F26-F37 HydrophobicContact CE2-CZ 4.16Å; F26-F37 AromaticContact CZ-CE1 3.71Å; F26-F37 HydrophobicContact CZ-CE1 3.71Å; F26-F37 AromaticContact CZ-CZ 3.76Å; F26-F37 HydrophobicContact CZ-CZ 3.76Å; F26-V42 HydrophobicContact CD1-CG2 4.29Å; F26-V42 HydrophobicContact CE1-CG2 3.85Å
27G96.1Very high96.7Very high59 Ų5988.4 Ų88.461%0.60845%0.454SS*.THydrogen-bonded Turntrans61.239.217800000113.2I23 E24 D29I23-G27 PolarHBondContact O-N 3.44Å; E24-G27 PolarHBondContact O-N 2.99Å; G27-D29 PolarHBondContact O-N 2.88Å
28I96.5Very high96.7Very high29 Ų2986.8 Ų86.815%0.14944%0.441CS..  trans-85.9113.6-178.4-51.2-61.8000108.8Y16 I23 F26 T33 M35Y16-I28 HydrophobicContact CD2-CG2 4.31Å; Y16-I28 HydrophobicContact CE2-CB 4.49Å; Y16-I28 HydrophobicContact CE2-CG2 4.12Å; Y16-I28 WeakPolarHBondContact CE2-O 3.5Å; Y16-I28 PolarHBondContact OH-O 3.43Å; I23-I28 HydrophobicContact CD1-CB 4.34Å; I23-I28 HydrophobicContact CG2-CB 4.18Å; I23-I28 WeakPolarHBondContact CG2-O 3.07Å; I23-I28 PolarHBondContact O-N 3.18Å; F26-I28 VanDerWaalsContact C-N 3.33Å; F26-I28 HydrophobicContact CB-CD1 4.12Å; F26-I28 HydrophobicContact CB-CG1 3.89Å; F26-I28 PolarHBondContact O-N 3.47Å; I28-T33 HydrophobicContact CD1-CG2 3.8Å; I28-M35 HydrophobicContact CD1-CG 4.49Å; I28-M35 HydrophobicContact CD1-SD 3.82Å
29D95.9Very high96.5Very high129 Ų12986.1 Ų86.169%0.6945%0.452SS*.  trans-109.4-20.8177.363.11.9000113.2G27G27-D29 PolarHBondContact O-N 2.88Å
30T96.9Very high96.3Very high59 Ų5984.9 Ų84.936%0.36247%0.466SS..SBendtrans-124.4131.8-172.1-55.30000109.8T33 V47 A48T30-T33 PolarHBondContact O-OG1 3.37Å; T30-V47 HydrophobicContact CG2-CG1 3.5Å; T30-V47 VanDerWaalsContact CG2-CG1 3.5Å; T30-A48 HydrophobicContact CG2-CB 4.5Å
31I95.8Very high96.2Very high114 Ų11487.7 Ų87.759%0.58547%0.472SS*.SBendtrans-114.7148.9175.162.3170.9000111.5Y16Y16-I31 HydrophobicContact CD2-CG2 3.42Å; Y16-I31 VanDerWaalsContact CD2-CG2 3.42Å; Y16-I31 HydrophobicContact CE2-CG2 4.06Å; Y16-I31 HydrophobicContact CG-CG2 3.97Å
32P96.1Very high96.1Very high83 Ų8382.8 Ų82.854%0.53945%0.453SS..SBendcis-74.8139.4-831.1-33.3000111.5A48P32-A48 VanDerWaalsContact O-CA 3.28Å; P32-A48 WeakPolarHBondContact O-CA 3.46Å; P32-A48 PolarHBondContact O-N 3.04Å
33T97.7Very high96.2Very high32 Ų3282.7 Ų82.720%0.19645%0.452CS..EExtended strand (participates in β ladder)trans-114.3131166.8-710000109.3I28 T30 M35 V47I28-T33 HydrophobicContact CD1-CG2 3.8Å; T30-T33 PolarHBondContact O-OG1 3.37Å; T33-M35 HydrophobicContact CG2-CG 4.17Å; T33-V47 HydrophobicContact CG2-CG2 4.3Å
34L97.6Very high96.1Very high64 Ų6482.4 Ų82.434%0.33546%0.455SS..EExtended strand (participates in β ladder)trans-100.7132.5171.7-61.1173.2000108.4S45 V46 P49 I55 F58L34-S45 CarbonylContact O-C 3.52Å; L34-S45 VanDerWaalsContact O-CA 3.22Å; L34-S45 WeakPolarHBondContact O-CA 3.22Å; L34-V46 HydrophobicContact CB-CG1 3.78Å; L34-V46 HydrophobicContact CD1-CG1 3.99Å; L34-V46 HydrophobicContact CG-CG1 4.31Å; L34-V46 PolarHBondContact N-O 3.49Å; L34-V46 PolarHBondContact O-N 3.49Å; L34-P49 HydrophobicContact CD1-CG 3.83Å; L34-P49 HydrophobicContact CG-CG 4.34Å; L34-I55 HydrophobicContact CD1-CB 4.35Å; L34-I55 HydrophobicContact CD1-CD1 4.26Å; L34-I55 HydrophobicContact CD1-CG1 3.88Å; L34-I55 HydrophobicContact CD1-CG2 3.73Å; L34-F58 HydrophobicContact CB-CE1 4.25Å
35M96.9Very high96.1Very high54 Ų5478.2 Ų78.227%0.26644%0.443SS..EExtended strand (participates in β ladder)trans-120.3135.6173.8-62.3-17576.400108.9F26 I28 T33 F37 V42F26-M35 HydrophobicContact CB-CE 4.02Å; F26-M35 HydrophobicContact CB-SD 3.91Å; F26-M35 HydrophobicContact CD1-CE 3.58Å; F26-M35 HydrophobicContact CD1-SD 4.27Å; F26-M35 HydrophobicContact CD2-SD 4.33Å; F26-M35 HydrophobicContact CE1-CE 4.16Å; F26-M35 HydrophobicContact CG-CE 3.86Å; F26-M35 HydrophobicContact CG-SD 3.94Å; I28-M35 HydrophobicContact CD1-CG 4.49Å; I28-M35 HydrophobicContact CD1-SD 3.82Å; T33-M35 HydrophobicContact CG2-CG 4.17Å; M35-F37 HydrophobicContact CB-CD2 4.3Å; M35-F37 HydrophobicContact CB-CE2 3.56Å; M35-F37 HydrophobicContact CB-CZ 4.1Å; M35-F37 HydrophobicContact CE-CZ 4.18Å; M35-F37 HydrophobicContact SD-CZ 4.28Å; M35-V42 HydrophobicContact CE-CB 4.28Å; M35-V42 HydrophobicContact CE-CG1 3.71Å; M35-V42 HydrophobicContact CE-CG2 3.53Å
36F97Very high96.2Very high25 Ų2570.5 Ų70.511%0.1142%0.418CS..EExtended strand (participates in β ladder)trans-105.1124.9177.7-151-59.8000109L9 V42 I43 G44 F58 I59 T62 L63L9-F36 HydrophobicContact CB-CZ 4.39Å; L9-F36 HydrophobicContact CD2-CE2 4.01Å; L9-F36 HydrophobicContact CD2-CZ 4.06Å; F36-V42 WeakPolarHBondContact O-CA 3.5Å; F36-I43 HydrophobicContact CB-CG1 4.14Å; F36-I43 HydrophobicContact CD1-CD1 3.75Å; F36-I43 HydrophobicContact CD1-CG1 3.88Å; F36-I43 HydrophobicContact CE1-CD1 4.25Å; F36-I43 HydrophobicContact CG-CD1 4.42Å; F36-I43 HydrophobicContact CG-CG1 4.31Å; F36-I43 WeakPolarHBondContact O-CG1 3.37Å; F36-I43 PolarHBondContact O-N 3.13Å; F36-G44 PolarHBondContact N-O 3.25Å; F36-F58 HydrophobicContact CB-CE1 4.28Å; F36-F58 HydrophobicContact CB-CZ 3.97Å; F36-F58 HydrophobicContact CD2-CE1 4.27Å; F36-I59 HydrophobicContact CE2-CG1 4.35Å; F36-I59 HydrophobicContact CE2-CG2 4.27Å; F36-T62 HydrophobicContact CB-CG2 3.74Å; F36-T62 HydrophobicContact CD1-CG2 4.14Å; F36-T62 HydrophobicContact CD2-CG2 3.89Å; F36-T62 HydrophobicContact CG-CG2 3.65Å; F36-L63 HydrophobicContact CE1-CD2 4.24Å; F36-L63 HydrophobicContact CE2-CD2 4.47Å; F36-L63 HydrophobicContact CE2-CG 4.35Å; F36-L63 HydrophobicContact CZ-CD2 3.68Å; F36-L63 HydrophobicContact CZ-CG 4.04Å
37F96.6Very high96.2Very high91 Ų9171 Ų7140%0.39943%0.426SS..EExtended strand (participates in β ladder)trans-110.9138.3179.1-65-97.1000111F26 M35 E41 V42F26-F37 AromaticContact CE1-CE1 3.99Å; F26-F37 HydrophobicContact CE1-CE1 3.99Å; F26-F37 HydrophobicContact CE1-CZ 4.13Å; F26-F37 HydrophobicContact CE2-CZ 4.16Å; F26-F37 AromaticContact CZ-CE1 3.71Å; F26-F37 HydrophobicContact CZ-CE1 3.71Å; F26-F37 AromaticContact CZ-CZ 3.76Å; F26-F37 HydrophobicContact CZ-CZ 3.76Å; M35-F37 HydrophobicContact CB-CD2 4.3Å; M35-F37 HydrophobicContact CB-CE2 3.56Å; M35-F37 HydrophobicContact CB-CZ 4.1Å; M35-F37 HydrophobicContact CE-CZ 4.18Å; M35-F37 HydrophobicContact SD-CZ 4.28Å; F37-E41 CarbonylContact C-O 3.45Å; F37-E41 WeakPolarHBondContact CA-O 3.45Å; F37-V42 HydrophobicContact CD1-CG2 3.89Å; F37-V42 HydrophobicContact CE1-CG2 3.38Å; F37-V42 HydrophobicContact CZ-CG2 3.88Å
38K95.4Very high96.3Very high101 Ų10170.6 Ų70.644%0.43942%0.417SS..EExtended strand (participates in β ladder)trans-138.7126171.2-174.7174.1178.3-178.80107.9G40 E41 I43 Q65K38-G40 PolarHBondContact O-N 3.12Å; K38-G40 VanDerWaalsContact O-N 3.17Å; K38-E41 PolarHBondContact N-O 3.12Å; K38-E41 PolarHBondContact O-N 3.33Å; K38-I43 HydrophobicContact CB-CD1 3.61Å; K38-I43 HydrophobicContact CB-CG1 4.03Å; K38-I43 HydrophobicContact CB-CG2 3.89Å; K38-I43 HydrophobicContact CD-CD1 3.84Å; K38-I43 HydrophobicContact CG-CD1 4.4Å; K38-Q65 PolarHBondContact NZ-OXT 2.86Å; K38-Q65 VanDerWaalsContact NZ-OXT 3.09Å
39S94.2Very high96.3Very high125 Ų12570.4 Ų70.487%0.87442%0.418SS*.THydrogen-bonded Turntrans53.933.6-177.8-55.60000114.9E41S39-E41 VanDerWaalsContact C-N 3.3Å; S39-E41 PolarHBondContact O-N 2.85Å
40G93.9Very high96.2Very high73 Ų7368.1 Ų68.175%0.75343%0.425SS*.THydrogen-bonded Turntrans83.8-1.9-18000000115K38K38-G40 PolarHBondContact O-N 3.12Å; K38-G40 VanDerWaalsContact O-N 3.17Å
41E94.7Very high96.2Very high143 Ų14368.2 Ų68.267%0.66843%0.428SS*.EExtended strand (participates in β ladder)trans-108150.5178.5-63-171.2165.600111.7F37 K38 S39 I43F37-E41 CarbonylContact C-O 3.45Å; F37-E41 WeakPolarHBondContact CA-O 3.45Å; K38-E41 PolarHBondContact N-O 3.12Å; K38-E41 PolarHBondContact O-N 3.33Å; S39-E41 VanDerWaalsContact C-N 3.3Å; S39-E41 PolarHBondContact O-N 2.85Å; E41-I43 PolarHBondContact O-N 3.34Å
42V95.5Very high96.3Very high63 Ų6368 Ų6838%0.38242%0.423SS..EExtended strand (participates in β ladder)trans-79.7117.2173.8-178.80000108.4F26 M35 F36 F37F26-V42 HydrophobicContact CD1-CG2 4.29Å; F26-V42 HydrophobicContact CE1-CG2 3.85Å; M35-V42 HydrophobicContact CE-CB 4.28Å; M35-V42 HydrophobicContact CE-CG1 3.71Å; M35-V42 HydrophobicContact CE-CG2 3.53Å; F36-V42 WeakPolarHBondContact O-CA 3.5Å; F37-V42 HydrophobicContact CD1-CG2 3.89Å; F37-V42 HydrophobicContact CE1-CG2 3.38Å; F37-V42 HydrophobicContact CZ-CG2 3.88Å
43I96.2Very high96.3Very high45 Ų4566.8 Ų66.823%0.23142%0.419CS..EExtended strand (participates in β ladder)trans-106.6-6.4179.559.6160000113.3F36 K38 E41 T62F36-I43 HydrophobicContact CB-CG1 4.14Å; F36-I43 HydrophobicContact CD1-CD1 3.75Å; F36-I43 HydrophobicContact CD1-CG1 3.88Å; F36-I43 HydrophobicContact CE1-CD1 4.25Å; F36-I43 HydrophobicContact CG-CD1 4.42Å; F36-I43 HydrophobicContact CG-CG1 4.31Å; F36-I43 WeakPolarHBondContact O-CG1 3.37Å; F36-I43 PolarHBondContact O-N 3.13Å; K38-I43 HydrophobicContact CB-CD1 3.61Å; K38-I43 HydrophobicContact CB-CG1 4.03Å; K38-I43 HydrophobicContact CB-CG2 3.89Å; K38-I43 HydrophobicContact CD-CD1 3.84Å; K38-I43 HydrophobicContact CG-CD1 4.4Å; E41-I43 PolarHBondContact O-N 3.34Å; I43-T62 HydrophobicContact CB-CG2 4.48Å; I43-T62 HydrophobicContact CD1-CG2 3.52Å; I43-T62 HydrophobicContact CG1-CG2 3.67Å
44G96.3Very high96.3Very high17 Ų1767 Ų6718%0.17543%0.425CS..EExtended strand (participates in β ladder)trans-174.4153.9175.700000111.7F36F36-G44 PolarHBondContact N-O 3.25Å
45S97.1Very high96.3Very high74 Ų7465.9 Ų65.952%0.51742%0.418SS..EExtended strand (participates in β ladder)trans-142150.817062.90000110.6L34L34-S45 CarbonylContact O-C 3.52Å; L34-S45 VanDerWaalsContact O-CA 3.22Å; L34-S45 WeakPolarHBondContact O-CA 3.22Å
46V97.2Very high96.3Very high34 Ų3464.7 Ų64.721%0.20641%0.412CS..EExtended strand (participates in β ladder)trans-136.6127.5169.961.50000109.3L34 P49 F58L34-V46 HydrophobicContact CB-CG1 3.78Å; L34-V46 HydrophobicContact CD1-CG1 3.99Å; L34-V46 HydrophobicContact CG-CG1 4.31Å; L34-V46 PolarHBondContact N-O 3.49Å; L34-V46 PolarHBondContact O-N 3.49Å; V46-P49 HydrophobicContact CG1-CB 4.38Å; V46-P49 HydrophobicContact CG1-CG 4.31Å; V46-P49 HydrophobicContact CG2-CB 4.15Å; V46-F58 HydrophobicContact CB-CB 4.47Å; V46-F58 HydrophobicContact CB-CD1 4.36Å; V46-F58 HydrophobicContact CB-CD2 3.87Å; V46-F58 HydrophobicContact CB-CE2 4.17Å; V46-F58 HydrophobicContact CB-CG 3.96Å; V46-F58 HydrophobicContact CG1-CB 4.07Å; V46-F58 HydrophobicContact CG1-CD1 3.48Å; V46-F58 VanDerWaalsContact CG1-CD1 3.48Å; V46-F58 HydrophobicContact CG1-CD2 3.91Å; V46-F58 HydrophobicContact CG1-CE1 3.82Å; V46-F58 HydrophobicContact CG1-CE2 4.22Å; V46-F58 HydrophobicContact CG1-CG 3.53Å; V46-F58 HydrophobicContact CG1-CZ 4.17Å
47V97.6Very high96.3Very high76 Ų7666.1 Ų66.146%0.46142%0.423SS..EExtended strand (participates in β ladder)trans-95.4132.8179.9-179.60000109.2T30 T33T30-V47 HydrophobicContact CG2-CG1 3.5Å; T30-V47 VanDerWaalsContact CG2-CG1 3.5Å; T33-V47 HydrophobicContact CG2-CG2 4.3Å
48A97.1Very high96.3Very high52 Ų5262.9 Ų62.943%0.4341%0.409SS..SBendtrans43.455.6176.800000114.2T30 P32 G50T30-A48 HydrophobicContact CG2-CB 4.5Å; P32-A48 VanDerWaalsContact O-CA 3.28Å; P32-A48 WeakPolarHBondContact O-CA 3.46Å; P32-A48 PolarHBondContact O-N 3.04Å; A48-G50 PolarHBondContact O-N 2.92Å; A48-G50 VanDerWaalsContact O-N 3.13Å
49P96.3Very high96.4Very high25 Ų2558.7 Ų58.716%0.16239%0.391CS..  trans-59121179.425.4-34.6000110.8L34 V46 S51 A54 I55L34-P49 HydrophobicContact CD1-CG 3.83Å; L34-P49 HydrophobicContact CG-CG 4.34Å; V46-P49 HydrophobicContact CG1-CB 4.38Å; V46-P49 HydrophobicContact CG1-CG 4.31Å; V46-P49 HydrophobicContact CG2-CB 4.15Å; P49-S51 VanDerWaalsContact C-N 3.3Å; P49-S51 PolarHBondContact O-N 2.81Å; P49-A54 HydrophobicContact CB-CB 4.36Å; P49-I55 HydrophobicContact CB-CG1 3.77Å; P49-I55 HydrophobicContact CG-CD1 4.31Å; P49-I55 HydrophobicContact CG-CG1 3.8Å
50G95Very high96.4Very high81 Ų8158.3 Ų58.384%0.83537%0.371SS*.  trans-76.8-5.6-169.500000116.1A48A48-G50 PolarHBondContact O-N 2.92Å; A48-G50 VanDerWaalsContact O-N 3.13Å
51S97.1Very high96.5Very high60 Ų6060.8 Ų60.842%0.4236%0.363SS..SBendtrans-159.3163.9179.570.20000112.9P49 A53 A54 I55P49-S51 VanDerWaalsContact C-N 3.3Å; P49-S51 PolarHBondContact O-N 2.81Å; S51-A53 PolarHBondContact O-N 3.49Å; S51-A53 PolarHBondContact OG-N 2.9Å; S51-A54 WeakPolarHBondContact O-CB 3.49Å; S51-A54 PolarHBondContact O-N 3.19Å; S51-A54 PolarHBondContact OG-N 3.27Å; S51-A54 VanDerWaalsContact OG-N 3.09Å; S51-I55 WeakPolarHBondContact O-CG1 3.19Å; S51-I55 PolarHBondContact O-N 2.89Å
52K96.3Very high96.6Very high110 Ų11054.2 Ų54.248%0.47833%0.332SS..Hα-helixtrans-54.3-43.4170-170.7-169.7178-154.40111.4V1 A54 I55 E56V1-K52 HydrophobicContact CG2-CD 4.32Å; V1-K52 HydrophobicContact CG2-CG 3.58Å; K52-A54 VanDerWaalsContact C-N 3.32Å; K52-A54 PolarHBondContact O-N 3.19Å; K52-I55 WeakPolarHBondContact O-CB 3.49Å; K52-I55 PolarHBondContact O-N 2.96Å; K52-E56 WeakPolarHBondContact CE-OE1 3.4Å; K52-E56 IonicContact NZ-OE1 3.18Å; K52-E56 PolarHBondContact NZ-OE1 2.76Å; K52-E56 WeakPolarHBondContact O-CG 3.28Å; K52-E56 PolarHBondContact O-N 3.25Å
53A97.1Very high96.5Very high57 Ų5754.6 Ų54.647%0.47133%0.332SS..Hα-helixtrans-62.2-39.5179.700000111.9S51 I55 E56 T57S51-A53 PolarHBondContact O-N 3.49Å; S51-A53 PolarHBondContact OG-N 2.9Å; A53-I55 VanDerWaalsContact C-N 3.34Å; A53-I55 PolarHBondContact O-N 3.17Å; A53-E56 PolarHBondContact O-N 3.46Å; A53-T57 WeakPolarHBondContact O-CB 3.47Å; A53-T57 PolarHBondContact O-N 3.34Å; A53-T57 PolarHBondContact O-OG1 3.44Å
54A97.3Very high96.3Very high37 Ų3756.7 Ų56.731%0.30636%0.356SS..Hα-helixtrans-62.3-41175.400000111.9P49 S51 K52 T57 F58P49-A54 HydrophobicContact CB-CB 4.36Å; S51-A54 WeakPolarHBondContact O-CB 3.49Å; S51-A54 PolarHBondContact O-N 3.19Å; S51-A54 PolarHBondContact OG-N 3.27Å; S51-A54 VanDerWaalsContact OG-N 3.09Å; K52-A54 VanDerWaalsContact C-N 3.32Å; K52-A54 PolarHBondContact O-N 3.19Å; A54-T57 PolarHBondContact O-N 2.92Å; A54-F58 WeakPolarHBondContact O-CB 3.43Å; A54-F58 PolarHBondContact O-N 3.24Å
55I97.3Very high95.7Very high40 Ų4063.4 Ų63.421%0.20538%0.383CS..Hα-helixtrans-63.3-45.9175.3-58.7172000110.7V1 L34 P49 S51 K52 A53 T57 F58 I59V1-I55 HydrophobicContact CB-CG2 4.32Å; V1-I55 HydrophobicContact CG1-CG2 3.92Å; V1-I55 HydrophobicContact CG2-CG2 4.3Å; L34-I55 HydrophobicContact CD1-CB 4.35Å; L34-I55 HydrophobicContact CD1-CD1 4.26Å; L34-I55 HydrophobicContact CD1-CG1 3.88Å; L34-I55 HydrophobicContact CD1-CG2 3.73Å; P49-I55 HydrophobicContact CB-CG1 3.77Å; P49-I55 HydrophobicContact CG-CD1 4.31Å; P49-I55 HydrophobicContact CG-CG1 3.8Å; S51-I55 WeakPolarHBondContact O-CG1 3.19Å; S51-I55 PolarHBondContact O-N 2.89Å; K52-I55 WeakPolarHBondContact O-CB 3.49Å; K52-I55 PolarHBondContact O-N 2.96Å; A53-I55 VanDerWaalsContact C-N 3.34Å; A53-I55 PolarHBondContact O-N 3.17Å; I55-T57 VanDerWaalsContact C-N 3.34Å; I55-T57 PolarHBondContact O-N 3.49Å; I55-F58 PolarHBondContact O-N 3.48Å; I55-I59 HydrophobicContact CG2-CD1 3.99Å; I55-I59 WeakPolarHBondContact O-CG1 3.38Å; I55-I59 PolarHBondContact O-N 3.04Å
56E96.7Very high95.6Very high29 Ų2962.9 Ų62.914%0.13638%0.376CS..Hα-helixtrans-65.1-37.5179.5-67.5-178.6179.300112.5V1 Q4 Y5 K52 A53 I59 R60V1-E56 HydrophobicContact CG1-CG 4.38Å; Q4-E56 PolarHBondContact NE2-OE1 3.33Å; Q4-E56 PolarHBondContact OE1-OE1 3.13Å; Y5-E56 HydrophobicContact CE2-CG 4.2Å; K52-E56 WeakPolarHBondContact CE-OE1 3.4Å; K52-E56 IonicContact NZ-OE1 3.18Å; K52-E56 PolarHBondContact NZ-OE1 2.76Å; K52-E56 WeakPolarHBondContact O-CG 3.28Å; K52-E56 PolarHBondContact O-N 3.25Å; A53-E56 PolarHBondContact O-N 3.46Å; E56-I59 PolarHBondContact O-N 3.03Å; E56-R60 VanDerWaalsContact CB-NH2 3.32Å; E56-R60 WeakPolarHBondContact O-CG 3.35Å; E56-R60 PolarHBondContact O-N 2.67Å; E56-R60 PolarHBondContact O-NE 2.98Å; E56-R60 IonicContact OE2-NH1 3.41Å; E56-R60 PolarHBondContact OE2-NH1 3.3Å; E56-R60 IonicContact OE2-NH2 3.75Å
57T97Very high95.6Very high56 Ų5664.4 Ų64.434%0.34439%0.385SS..Hα-helixtrans-63.5-48.2174-670000110.9A53 A54 I55 I59 R60 E61A53-T57 WeakPolarHBondContact O-CB 3.47Å; A53-T57 PolarHBondContact O-N 3.34Å; A53-T57 PolarHBondContact O-OG1 3.44Å; A54-T57 PolarHBondContact O-N 2.92Å; I55-T57 VanDerWaalsContact C-N 3.34Å; I55-T57 PolarHBondContact O-N 3.49Å; T57-I59 VanDerWaalsContact C-N 3.31Å; T57-I59 PolarHBondContact O-N 3.07Å; T57-R60 PolarHBondContact O-N 3.01Å; T57-R60 VanDerWaalsContact O-N 3.13Å; T57-R60 PolarHBondContact OG1-NH2 3.3Å; T57-E61 HydrophobicContact CG2-CG 4.23Å; T57-E61 WeakPolarHBondContact CG2-OE1 3.42Å; T57-E61 WeakPolarHBondContact O-CG 3.19Å; T57-E61 PolarHBondContact O-N 2.93Å
58F97.3Very high95.4Very high22 Ų2263.8 Ų63.810%0.09638%0.381CS..Hα-helixtrans-54.9-45.7175167.2-110.2000112.2L34 F36 V46 A54 I55 T62L34-F58 HydrophobicContact CB-CE1 4.25Å; F36-F58 HydrophobicContact CB-CE1 4.28Å; F36-F58 HydrophobicContact CB-CZ 3.97Å; F36-F58 HydrophobicContact CD2-CE1 4.27Å; V46-F58 HydrophobicContact CB-CB 4.47Å; V46-F58 HydrophobicContact CB-CD1 4.36Å; V46-F58 HydrophobicContact CB-CD2 3.87Å; V46-F58 HydrophobicContact CB-CE2 4.17Å; V46-F58 HydrophobicContact CB-CG 3.96Å; V46-F58 HydrophobicContact CG1-CB 4.07Å; V46-F58 HydrophobicContact CG1-CD1 3.48Å; V46-F58 VanDerWaalsContact CG1-CD1 3.48Å; V46-F58 HydrophobicContact CG1-CD2 3.91Å; V46-F58 HydrophobicContact CG1-CE1 3.82Å; V46-F58 HydrophobicContact CG1-CE2 4.22Å; V46-F58 HydrophobicContact CG1-CG 3.53Å; V46-F58 HydrophobicContact CG1-CZ 4.17Å; A54-F58 WeakPolarHBondContact O-CB 3.43Å; A54-F58 PolarHBondContact O-N 3.24Å; I55-F58 PolarHBondContact O-N 3.48Å; F58-T62 WeakPolarHBondContact CE2-OG1 3.39Å; F58-T62 VanDerWaalsContact O-CB 3.27Å; F58-T62 WeakPolarHBondContact O-CB 3.42Å; F58-T62 PolarHBondContact O-N 3.4Å; F58-T62 PolarHBondContact O-OG1 3.18Å
59I96.3Very high95.3Very high13 Ų1364.5 Ų64.57%0.06738%0.378CS..Hα-helixtrans-60.3-48.1176.9-70.5167000110.8V1 Y5 L9 F36 I55 E56 T57 T62 L63V1-I59 HydrophobicContact CG1-CD1 3.53Å; Y5-I59 HydrophobicContact CD1-CG2 3.9Å; Y5-I59 HydrophobicContact CD2-CD1 4.35Å; Y5-I59 HydrophobicContact CE1-CG2 3.74Å; Y5-I59 HydrophobicContact CE2-CD1 4.43Å; Y5-I59 HydrophobicContact CG-CG2 4.45Å; L9-I59 HydrophobicContact CD2-CD1 4.26Å; L9-I59 HydrophobicContact CD2-CG1 4.4Å; L9-I59 HydrophobicContact CD2-CG2 3.84Å; F36-I59 HydrophobicContact CE2-CG1 4.35Å; F36-I59 HydrophobicContact CE2-CG2 4.27Å; I55-I59 HydrophobicContact CG2-CD1 3.99Å; I55-I59 WeakPolarHBondContact O-CG1 3.38Å; I55-I59 PolarHBondContact O-N 3.04Å; E56-I59 PolarHBondContact O-N 3.03Å; T57-I59 VanDerWaalsContact C-N 3.31Å; T57-I59 PolarHBondContact O-N 3.07Å; I59-T62 PolarHBondContact O-N 2.95Å; I59-L63 HydrophobicContact CG2-CD1 3.79Å; I59-L63 HydrophobicContact CG2-CG 4.42Å; I59-L63 WeakPolarHBondContact O-CB 3.36Å; I59-L63 VanDerWaalsContact O-CG 3.29Å; I59-L63 WeakPolarHBondContact O-CG 3.23Å; I59-L63 PolarHBondContact O-N 3.43Å
60R95.7Very high95.3Very high118 Ų11866.9 Ų66.945%0.44539%0.391SS..Hα-helixtrans-62.8-46.5-178.8-76.3-178.6-72.5-108.5-1112.4E56 T57 T62 L63 A64E56-R60 VanDerWaalsContact CB-NH2 3.32Å; E56-R60 WeakPolarHBondContact O-CG 3.35Å; E56-R60 PolarHBondContact O-N 2.67Å; E56-R60 PolarHBondContact O-NE 2.98Å; E56-R60 IonicContact OE2-NH1 3.41Å; E56-R60 PolarHBondContact OE2-NH1 3.3Å; E56-R60 IonicContact OE2-NH2 3.75Å; T57-R60 PolarHBondContact O-N 3.01Å; T57-R60 VanDerWaalsContact O-N 3.13Å; T57-R60 PolarHBondContact OG1-NH2 3.3Å; R60-T62 VanDerWaalsContact C-N 3.34Å; R60-L63 PolarHBondContact O-N 3.46Å; R60-A64 PolarHBondContact O-N 3.42Å
61E96.3Very high95.3Very high125 Ų12566 Ų6658%0.58436%0.362SS*.Hα-helixtrans-66-37.7179.7-70.8175.4171.500111.8T57 A64T57-E61 HydrophobicContact CG2-CG 4.23Å; T57-E61 WeakPolarHBondContact CG2-OE1 3.42Å; T57-E61 WeakPolarHBondContact O-CG 3.19Å; T57-E61 PolarHBondContact O-N 2.93Å; E61-A64 PolarHBondContact O-N 3.05Å
62T96Very high95.2Very high4 Ų466.4 Ų66.43%0.02536%0.358CS..Hα-helixtrans-71.5-37.1178.6-53.70000112F36 I43 F58 I59 R60 A64 Q65F36-T62 HydrophobicContact CB-CG2 3.74Å; F36-T62 HydrophobicContact CD1-CG2 4.14Å; F36-T62 HydrophobicContact CD2-CG2 3.89Å; F36-T62 HydrophobicContact CG-CG2 3.65Å; I43-T62 HydrophobicContact CB-CG2 4.48Å; I43-T62 HydrophobicContact CD1-CG2 3.52Å; I43-T62 HydrophobicContact CG1-CG2 3.67Å; F58-T62 WeakPolarHBondContact CE2-OG1 3.39Å; F58-T62 VanDerWaalsContact O-CB 3.27Å; F58-T62 WeakPolarHBondContact O-CB 3.42Å; F58-T62 PolarHBondContact O-N 3.4Å; F58-T62 PolarHBondContact O-OG1 3.18Å; I59-T62 PolarHBondContact O-N 2.95Å; R60-T62 VanDerWaalsContact C-N 3.34Å; T62-A64 VanDerWaalsContact C-N 3.27Å; T62-A64 PolarHBondContact O-N 3.42Å; T62-Q65 PolarHBondContact O-N 3.48Å
63L92.8Very high95.1Very high71 Ų7163.1 Ų63.137%0.37235%0.348SS..Hα-helixtrans-71.4-20.7176-74.8175.2000113.8T8 F36 I59 R60 Q65T8-L63 HydrophobicContact CG2-CD1 3.72Å; F36-L63 HydrophobicContact CE1-CD2 4.24Å; F36-L63 HydrophobicContact CE2-CD2 4.47Å; F36-L63 HydrophobicContact CE2-CG 4.35Å; F36-L63 HydrophobicContact CZ-CD2 3.68Å; F36-L63 HydrophobicContact CZ-CG 4.04Å; I59-L63 HydrophobicContact CG2-CD1 3.79Å; I59-L63 HydrophobicContact CG2-CG 4.42Å; I59-L63 WeakPolarHBondContact O-CB 3.36Å; I59-L63 VanDerWaalsContact O-CG 3.29Å; I59-L63 WeakPolarHBondContact O-CG 3.23Å; I59-L63 PolarHBondContact O-N 3.43Å; R60-L63 PolarHBondContact O-N 3.46Å; L63-Q65 PolarHBondContact O-N 3.01Å
64A92.7Very high94.9Very high89 Ų8963.6 Ų63.674%0.73634%0.338SS*.THydrogen-bonded Turntrans-78.7-2.217800000113.7R60 E61 T62R60-A64 PolarHBondContact O-N 3.42Å; E61-A64 PolarHBondContact O-N 3.05Å; T62-A64 VanDerWaalsContact C-N 3.27Å; T62-A64 PolarHBondContact O-N 3.42Å
65Q83.7Confident94.7Very high159 Ų15966 Ų6674%0.74334%0.341SS*.  trans-920175.4-59.2176.950.100112K38 T62 L63K38-Q65 PolarHBondContact NZ-OXT 2.86Å; K38-Q65 VanDerWaalsContact NZ-OXT 3.09Å; T62-Q65 PolarHBondContact O-N 3.48Å; L63-Q65 PolarHBondContact O-N 3.01Å

Retrieved 65 of 65 residues in 14.2 ms (Link to these results)

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