A0A060Y6C2_ONCMY Loading...

Collectrin-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A060Y6C2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 220 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M53.3Low53.2Low200 Ų200135.5 Ų135.599%0.98568%0.68SS**  0-820-56.9-56.2-100.700111.1V3 W4 I5M1-V3 PolarHBondContact O-N 3.34Å; M1-W4 PolarHBondContact O-N 3.26Å; M1-W4 VanDerWaalsContact O-N 3.12Å; M1-I5 PolarHBondContact O-N 2.86Å
2L49.9Very low52.9Low134 Ų134133.6 Ų133.670%0.70268%0.68SS**Hα-helixtrans-57.2-43.3-171.6-148.580.7000115W4 I5 L6L2-W4 PolarHBondContact O-N 2.91Å; L2-I5 PolarHBondContact O-N 3Å; L2-L6 PolarHBondContact O-N 3.39Å; L2-L6 VanDerWaalsContact O-N 3.15Å
3V55.2Low52.2Low104 Ų104127.5 Ų127.563%0.6367%0.671SS**Hα-helixtrans-61-32-180-179.20000112.7M1 F7M1-V3 PolarHBondContact O-N 3.34Å; V3-F7 HydrophobicContact CG1-CD2 4.45Å; V3-F7 PolarHBondContact O-N 3.16Å; V3-F7 VanDerWaalsContact O-N 3.15Å
4W51.3Low52Low202 Ų202124.4 Ų124.477%0.76567%0.673SS**Hα-helixtrans-76.9-31.8-178.9-148.530.6000111.7M1 L2 F7 L8M1-W4 PolarHBondContact O-N 3.26Å; M1-W4 VanDerWaalsContact O-N 3.12Å; L2-W4 PolarHBondContact O-N 2.91Å; W4-F7 PolarHBondContact O-N 3.24Å; W4-L8 WeakPolarHBondContact O-CG 3.34Å; W4-L8 PolarHBondContact O-N 2.89Å; W4-L8 VanDerWaalsContact O-N 3.1Å
5I58.9Low52Low96 Ų96121.4 Ų121.449%0.49266%0.662SS.*Hα-helixtrans-68.5-40.1173.9-60.1167000110.5M1 L2 L8 L9M1-I5 PolarHBondContact O-N 2.86Å; L2-I5 PolarHBondContact O-N 3Å; I5-L8 PolarHBondContact O-N 3.42Å; I5-L9 HydrophobicContact CG2-CD1 4.17Å; I5-L9 WeakPolarHBondContact O-CG 3.46Å; I5-L9 PolarHBondContact O-N 3.18Å
6L55.6Low51.8Low109 Ų109117.1 Ų117.157%0.57165%0.648SS**Hα-helixtrans-62.3-41.2173.1-83.9155.4000112.5L2 L9 C10L2-L6 PolarHBondContact O-N 3.39Å; L2-L6 VanDerWaalsContact O-N 3.15Å; L6-L9 PolarHBondContact O-N 2.8Å; L6-C10 PolarHBondContact O-N 3.43Å
7F53.8Low51.7Low146 Ų146116.4 Ų116.464%0.6464%0.642SS**Hα-helixtrans-64-38.5174.8-105.4-88.8000113.1V3 W4 Q11V3-F7 HydrophobicContact CG1-CD2 4.45Å; V3-F7 PolarHBondContact O-N 3.16Å; V3-F7 VanDerWaalsContact O-N 3.15Å; W4-F7 PolarHBondContact O-N 3.24Å; F7-Q11 WeakPolarHBondContact O-CG 3.49Å; F7-Q11 PolarHBondContact O-N 3Å
8L53.6Low51.6Low109 Ų109112.3 Ų112.357%0.57163%0.626SS**Hα-helixtrans-68.3-37.9177.4-73.9165.2000112.5W4 I5 C10 Q11W4-L8 WeakPolarHBondContact O-CG 3.34Å; W4-L8 PolarHBondContact O-N 2.89Å; W4-L8 VanDerWaalsContact O-N 3.1Å; I5-L8 PolarHBondContact O-N 3.42Å; L8-C10 PolarHBondContact O-N 3.27Å; L8-Q11 PolarHBondContact O-N 3.39Å
9L55.3Low51.7Low123 Ų123114 Ų11464%0.64463%0.629SS**Hα-helixtrans-66.5-34.7177.3-75163.1000112.8I5 L6I5-L9 HydrophobicContact CG2-CD1 4.17Å; I5-L9 WeakPolarHBondContact O-CG 3.46Å; I5-L9 PolarHBondContact O-N 3.18Å; L6-L9 PolarHBondContact O-N 2.8Å
10C49Very low52.1Low110 Ų110115.5 Ų115.574%0.74364%0.636SS**Hα-helixtrans-71.8-24.4176.7-102.30000114.4L6 L8L6-C10 PolarHBondContact O-N 3.43Å; L8-C10 PolarHBondContact O-N 3.27Å
11Q49.6Very low52.7Low158 Ų158111.7 Ų111.774%0.73862%0.615SS**Hα-helixtrans-80.6-19.7-176.9-73.2-85.8-74.400113.7F7 L8F7-Q11 WeakPolarHBondContact O-CG 3.49Å; F7-Q11 PolarHBondContact O-N 3Å; L8-Q11 PolarHBondContact O-N 3.39Å
12V49.6Very low53.4Low112 Ų112102.7 Ų102.768%0.67957%0.571SS**Hα-helixtrans-102-15-172.6-172.30000113
13G43.8Very low54.3Low54 Ų54103.4 Ų103.456%0.55757%0.571SS**SBendtrans-79.6-15.5-17300000116.9
14A49.6Very low54.7Low85 Ų85106.6 Ų106.670%0.70257%0.572SS**SBendtrans-75-39.1-169.100000117.1
15P51.3Low55.3Low79 Ų79102.3 Ų102.351%0.51356%0.564SS.*SBendtrans-84.4-18-170.931.6-34.5000114.8
16A48.2Very low55.9Low53 Ų5398.2 Ų98.244%0.43854%0.544SS..Hα-helixtrans-68-39.8-171.600000113.3A18 Q19 D20A16-A18 VanDerWaalsContact C-N 3.28Å; A16-A18 PolarHBondContact O-N 2.89Å; A16-Q19 PolarHBondContact O-N 3.32Å; A16-D20 PolarHBondContact O-N 3.44Å
17L51Low56.8Low105 Ų10598 Ų9855%0.5555%0.549SS..Hα-helixtrans-63.9-30.8-174.7-119.2165000113.4T99L17-T99 HydrophobicContact CD2-CG2 4.05Å
18A50.3Low58.3Low43 Ų4393.6 Ų93.636%0.35553%0.532SS..Hα-helixtrans-76.4-22.617600000113.2A16 I78A16-A18 VanDerWaalsContact C-N 3.28Å; A16-A18 PolarHBondContact O-N 2.89Å; A18-I78 HydrophobicContact CB-CG2 4.34Å
19Q52Low59.8Low144 Ų14488.5 Ų88.567%0.67351%0.506SS*.Hα-helixtrans-79.4-38.1-178-69.2179.7-29.300112.1A16 C22A16-Q19 PolarHBondContact O-N 3.32Å; Q19-C22 PolarHBondContact O-N 3.49Å
20D60Low61.5Low144 Ų14483.2 Ų83.277%0.7748%0.478SS*.Hα-helixtrans-69.6-38.2176.9-78.3-20.4000112.8A16 C22A16-D20 PolarHBondContact O-N 3.44Å; D20-C22 PolarHBondContact O-N 3.01Å
21L65.7Low63.5Low36 Ų3680.7 Ų80.719%0.18845%0.454CS..THydrogen-bonded Turntrans-69.3-18.6179.2-71.6170.3000113.6I78 T98 L101L21-I78 HydrophobicContact CD1-CD1 4.3Å; L21-T98 WeakPolarHBondContact CD1-O 3.32Å; L21-L101 HydrophobicContact CD2-CD2 4.24Å; L21-L101 HydrophobicContact CD2-CG 4.34Å
22C67.9Low65.5Low11 Ų1173.2 Ų73.27%0.07442%0.419CS..THydrogen-bonded Turntrans-133.658.5-169.9-146.70000114.5Q19 D20 I78 C80 V91Q19-C22 PolarHBondContact O-N 3.49Å; D20-C22 PolarHBondContact O-N 3.01Å; C22-I78 HydrophobicContact CB-CG2 4.37Å; C22-C80 HydrophobicContact CB-CB 3.74Å; C22-C80 WeakPolarHBondContact CB-SG 3.33Å; C22-C80 WeakPolarHBondContact SG-CB 3.14Å; C22-C80 CovalentContact SG-SG 2Å; C22-C80 PolarHBondContact SG-SG 3.38Å; C22-V91 HydrophobicContact CB-CG2 4.18Å
23Q68.6Low67.6Low148 Ų14873 Ų7369%0.69241%0.406SS*.  trans-68.4156.4167.7-152.6162.817.500111.6D25 A26Q23-D25 PolarHBondContact O-N 2.86Å; Q23-A26 WeakPolarHBondContact O-CB 3.32Å; Q23-A26 PolarHBondContact O-N 2.92Å
24R63.9Low69.9Low172 Ų17270.9 Ų70.965%0.64938%0.382SS*.THydrogen-bonded Turntrans-58.6130.3171-175.5-174.5-77.1160.8-3.7108.6A26R24-A26 VanDerWaalsContact C-N 3.32Å; R24-A26 PolarHBondContact O-N 3.4Å
25D64.3Low71.9Confident112 Ų11268.8 Ų68.860%0.59936%0.362SS*.THydrogen-bonded Turntrans63.228.5-174.2-54.2-70.2000114.9Q23 W89Q23-D25 PolarHBondContact O-N 2.86Å; D25-W89 HydrophobicContact CB-CH2 4.34Å; D25-W89 HydrophobicContact CB-CZ2 4.49Å; D25-W89 WeakPolarHBondContact OD1-CH2 3.45Å; D25-W89 WeakPolarHBondContact OD1-CZ2 3.01Å
26A71.8Confident73.8Confident9 Ų965.8 Ų65.87%0.07434%0.342CS..  trans-49.414017300000112.4Q23 R24 N28 G29Q23-A26 WeakPolarHBondContact O-CB 3.32Å; Q23-A26 PolarHBondContact O-N 2.92Å; R24-A26 VanDerWaalsContact C-N 3.32Å; R24-A26 PolarHBondContact O-N 3.4Å; A26-N28 VanDerWaalsContact C-N 3.26Å; A26-N28 PolarHBondContact O-N 3.4Å; A26-N28 VanDerWaalsContact O-N 3.12Å; A26-G29 PolarHBondContact O-N 2.92Å
27P74.4Confident75.9Confident106 Ų10671.2 Ų71.269%0.68836%0.356SS*.THydrogen-bonded Turntrans-60.8-32.1-16921.6-33.1000113.6K104P27-K104 WeakPolarHBondContact O-CD 3.4Å; P27-K104 WeakPolarHBondContact O-CE 3.35Å; P27-K104 PolarHBondContact O-NZ 3.21Å
28N83.8Confident77.8Confident52 Ų5271.7 Ų71.728%0.27836%0.363SS..THydrogen-bonded Turntrans-101.47.2174.6-68.4-26.6000114.2A26 L101A26-N28 VanDerWaalsContact C-N 3.26Å; A26-N28 PolarHBondContact O-N 3.4Å; A26-N28 VanDerWaalsContact O-N 3.12Å; N28-L101 HydrophobicContact CB-CB 4.2Å; N28-L101 HydrophobicContact CB-CD1 4.03Å
29G86.7Confident79.7Confident2 Ų271.5 Ų71.52%0.02136%0.361CS..  trans-82147.8178.200000114.1A26 F90 K104A26-G29 PolarHBondContact O-N 2.92Å; G29-F90 WeakPolarHBondContact CA-O 3.49Å; G29-K104 WeakPolarHBondContact O-CE 3.35Å; G29-K104 PolarHBondContact O-NZ 3.1Å
30Y89.6Confident81.6Confident12 Ų1266.5 Ų66.55%0.04734%0.339CS..EExtended strand (participates in β ladder)trans-114.6135.8172.1-78-85.1000110.7W89 F90 K104 V107 I134Y30-W89 VanDerWaalsContact C-CE3 3.45Å; Y30-W89 CarbonylContact O-C 3.5Å; Y30-W89 VanDerWaalsContact O-CA 3.27Å; Y30-W89 WeakPolarHBondContact O-CA 3.43Å; Y30-F90 VanDerWaalsContact CB-CE1 3.46Å; Y30-F90 HydrophobicContact CD2-CZ 4.27Å; Y30-F90 HydrophobicContact CG-CE1 4.37Å; Y30-F90 HydrophobicContact CG-CZ 4.21Å; Y30-F90 PolarHBondContact N-O 3.38Å; Y30-F90 PolarHBondContact O-N 3.37Å; Y30-K104 HydrophobicContact CE2-CB 4.21Å; Y30-K104 HydrophobicContact CE2-CD 4.39Å; Y30-K104 HydrophobicContact CE2-CG 3.72Å; Y30-K104 VanDerWaalsContact OH-C 3.29Å; Y30-K104 WeakPolarHBondContact OH-CA 3.4Å; Y30-K104 VanDerWaalsContact OH-CB 3.23Å; Y30-K104 WeakPolarHBondContact OH-CB 3.47Å; Y30-K104 PolarHBondContact OH-O 3.24Å; Y30-V107 HydrophobicContact CD2-CB 4.47Å; Y30-V107 HydrophobicContact CD2-CG1 3.89Å; Y30-V107 HydrophobicContact CE2-CB 3.84Å; Y30-V107 HydrophobicContact CE2-CG1 3.73Å; Y30-I134 HydrophobicContact CD1-CD1 4.03Å; Y30-I134 HydrophobicContact CD1-CG1 4.15Å; Y30-I134 HydrophobicContact CE1-CD1 3.8Å; Y30-I134 HydrophobicContact CE1-CG1 3.71Å
31K91.4Very high83.1Confident58 Ų5861.3 Ų61.325%0.25232%0.319SS..EExtended strand (participates in β ladder)trans-93123.7172.7-175.2166.7-176.8172.20110.1W89 L132K31-W89 HydrophobicContact CB-CD2 3.85Å; K31-W89 HydrophobicContact CB-CE3 3.79Å; K31-W89 HydrophobicContact CB-CH2 3.81Å; K31-W89 HydrophobicContact CB-CZ2 3.87Å; K31-W89 HydrophobicContact CB-CZ3 3.77Å; K31-W89 HydrophobicContact CD-CH2 4.33Å; K31-W89 HydrophobicContact CD-CZ2 3.7Å; K31-W89 HydrophobicContact CG-CD2 4.36Å; K31-W89 HydrophobicContact CG-CZ2 4.24Å; K31-L132 HydrophobicContact CB-CB 4.31Å; K31-L132 HydrophobicContact CB-CD1 3.96Å; K31-L132 HydrophobicContact CB-CG 4.2Å; K31-L132 HydrophobicContact CD-CD1 3.82Å; K31-L132 HydrophobicContact CG-CD1 4Å; K31-L132 HydrophobicContact CG-CG 4.44Å; K31-L132 PolarHBondContact O-N 3.45Å
32V92.5Very high84.4Confident0 Ų068.4 Ų68.40%035%0.352CS..EExtended strand (participates in β ladder)trans-99.9142.2173.2-179.30000108.9I34 F55 S87 F88 F90 L129 E130 F131V32-I34 HydrophobicContact CG1-CD1 4.26Å; V32-I34 HydrophobicContact CG1-CG1 3.88Å; V32-F55 HydrophobicContact CG1-CE2 4.46Å; V32-F55 HydrophobicContact CG2-CZ 3.97Å; V32-S87 VanDerWaalsContact O-CA 3.26Å; V32-S87 WeakPolarHBondContact O-CA 3.48Å; V32-S87 WeakPolarHBondContact O-CB 3.37Å; V32-F88 HydrophobicContact CB-CD2 4.31Å; V32-F88 HydrophobicContact CB-CE2 3.9Å; V32-F88 HydrophobicContact CB-CZ 4.02Å; V32-F88 HydrophobicContact CG1-CE1 4.41Å; V32-F88 HydrophobicContact CG1-CE2 4.34Å; V32-F88 HydrophobicContact CG1-CZ 3.98Å; V32-F88 HydrophobicContact CG2-CE2 4.03Å; V32-F88 HydrophobicContact CG2-CZ 4.46Å; V32-F88 PolarHBondContact N-O 3.38Å; V32-F88 PolarHBondContact O-N 2.94Å; V32-F90 HydrophobicContact CG2-CD1 3.58Å; V32-F90 HydrophobicContact CG2-CE1 3.51Å; V32-L129 HydrophobicContact CG1-CD1 3.71Å; V32-E130 CarbonylContact C-O 3.46Å; V32-E130 WeakPolarHBondContact CA-O 3.4Å; V32-F131 HydrophobicContact CG2-CD1 3.88Å; V32-F131 HydrophobicContact CG2-CE1 3.96Å; V32-F131 HydrophobicContact CG2-CG 4.49Å
33R92.4Very high85.5Confident108 Ų10874.9 Ų74.941%0.40839%0.386SS..EExtended strand (participates in β ladder)trans-127131.7170.1-59.2171.9174.2174-0.4108.9E130R33-E130 HydrophobicContact CB-CB 4.26Å; R33-E130 VanDerWaalsContact CD-OE2 3.29Å; R33-E130 WeakPolarHBondContact CD-OE2 3.44Å; R33-E130 PolarHBondContact N-O 2.95Å; R33-E130 IonicContact NH1-OE2 3.62Å; R33-E130 PolarHBondContact NH1-OE2 3.48Å; R33-E130 PolarHBondContact O-N 3.3Å
34I92.5Very high86.6Confident9 Ų969.1 Ų69.15%0.04636%0.363CS..EExtended strand (participates in β ladder)trans-122.1122.8-177.7-45.3-167.2000109.4V32 L36 W47 V86 F88 L124 T128 L129V32-I34 HydrophobicContact CG1-CD1 4.26Å; V32-I34 HydrophobicContact CG1-CG1 3.88Å; I34-L36 HydrophobicContact CG2-CD2 3.71Å; I34-L36 HydrophobicContact CG2-CG 3.76Å; I34-W47 HydrophobicContact CD1-CD2 4.21Å; I34-W47 HydrophobicContact CD1-CE3 3.91Å; I34-W47 HydrophobicContact CD1-CH2 3.37Å; I34-W47 HydrophobicContact CD1-CZ2 3.68Å; I34-W47 HydrophobicContact CD1-CZ3 3.49Å; I34-W47 VanDerWaalsContact CD1-CZ3 3.49Å; I34-V86 HydrophobicContact CB-CB 4.18Å; I34-V86 HydrophobicContact CB-CG1 3.76Å; I34-V86 HydrophobicContact CD1-CG1 3.94Å; I34-V86 HydrophobicContact CG1-CG1 3.99Å; I34-V86 PolarHBondContact N-O 2.84Å; I34-F88 HydrophobicContact CD1-CE1 3.72Å; I34-F88 HydrophobicContact CD1-CZ 4.17Å; I34-F88 HydrophobicContact CG1-CE1 4.38Å; I34-L124 HydrophobicContact CG2-CD1 3.49Å; I34-L124 VanDerWaalsContact CG2-CD1 3.49Å; I34-T128 WeakPolarHBondContact CA-O 3.39Å; I34-L129 HydrophobicContact CD1-CD1 4Å; I34-L129 HydrophobicContact CG1-CD1 3.79Å
35S91.9Very high88Confident42 Ų4263.9 Ų63.929%0.29434%0.344SS..  trans-108.363-178.4-60.10000110.6K37 T38 A39 T128S35-K37 PolarHBondContact O-N 2.99Å; S35-T38 WeakPolarHBondContact O-CB 3.34Å; S35-T38 PolarHBondContact O-N 3.32Å; S35-T38 VanDerWaalsContact O-N 3.12Å; S35-A39 PolarHBondContact O-N 2.98Å; S35-A39 VanDerWaalsContact O-N 3.09Å; S35-T128 PolarHBondContact N-O 3.06Å
36L91.9Very high89.3Confident16 Ų1666.3 Ų66.38%0.08435%0.352CS..Hα-helixtrans-53.6-54.8-174.5-65.9170000112.7I34 T38 A39 L40 A44 Y45 W47 V86 L124I34-L36 HydrophobicContact CG2-CD2 3.71Å; I34-L36 HydrophobicContact CG2-CG 3.76Å; L36-T38 PolarHBondContact O-N 2.94Å; L36-A39 PolarHBondContact O-N 3.43Å; L36-L40 PolarHBondContact O-N 2.75Å; L36-A44 HydrophobicContact CB-CB 4.35Å; L36-Y45 HydrophobicContact CD1-CE2 4.43Å; L36-Y45 HydrophobicContact CD2-CE1 3.93Å; L36-Y45 HydrophobicContact CD2-CE2 3.81Å; L36-Y45 VanDerWaalsContact CD2-CZ 3.47Å; L36-Y45 WeakPolarHBondContact CD2-OH 3.34Å; L36-W47 HydrophobicContact CD1-CB 4.06Å; L36-W47 HydrophobicContact CD1-CE3 4.28Å; L36-V86 HydrophobicContact CD1-CG2 4.31Å; L36-L124 HydrophobicContact CD2-CD1 4.45Å; L36-L124 HydrophobicContact CD2-CD2 4.31Å
37K91.6Very high90.2Very high167 Ų16767 Ų6773%0.72635%0.352SS*.Hα-helixtrans-60.9-29.6178.8-66.4-159.5172.2-148.60113.6S35 G41 A44S35-K37 PolarHBondContact O-N 2.99Å; K37-G41 WeakPolarHBondContact O-CA 3.37Å; K37-G41 PolarHBondContact O-N 2.91Å; K37-A44 HydrophobicContact CG-CB 4.17Å
38T91.2Very high91Very high115 Ų11565.3 Ų65.371%0.70634%0.338SS*.Hα-helixtrans-75.4-26.8176.2-48.90000112.3S35 L36 T128S35-T38 WeakPolarHBondContact O-CB 3.34Å; S35-T38 PolarHBondContact O-N 3.32Å; S35-T38 VanDerWaalsContact O-N 3.12Å; L36-T38 PolarHBondContact O-N 2.94Å; T38-T128 HydrophobicContact CG2-CG2 4.45Å
39A90.5Very high91.3Very high39 Ų3970.9 Ų70.932%0.32236%0.362SS..Hα-helixtrans-87.3-41.8179.400000113.1S35 L36 L124 T128S35-A39 PolarHBondContact O-N 2.98Å; S35-A39 VanDerWaalsContact O-N 3.09Å; L36-A39 PolarHBondContact O-N 3.43Å; A39-L124 HydrophobicContact CB-CD2 3.39Å; A39-T128 HydrophobicContact CB-CG2 3.86Å
40L90.9Very high91.6Very high38 Ų3874.7 Ų74.720%0.19939%0.388CS..Hα-helixtrans-117.3-6.8-166-59.2173.4000113.7L36 E42 D43 A44 Y45 L123L36-L40 PolarHBondContact O-N 2.75Å; L40-E42 PolarHBondContact O-N 3.36Å; L40-D43 PolarHBondContact O-N 2.96Å; L40-D43 VanDerWaalsContact O-N 3.13Å; L40-A44 HydrophobicContact CB-CB 4.05Å; L40-Y45 HydrophobicContact CD1-CD1 3.6Å; L40-Y45 HydrophobicContact CD1-CE1 3.52Å; L40-L123 HydrophobicContact CD2-CB 4.12Å
41G91.6Very high91.8Very high35 Ų3576.1 Ų76.136%0.36140%0.395SS..G310 helixtrans62.4-121.6-179.700000112.3K37 A44K37-G41 WeakPolarHBondContact O-CA 3.37Å; K37-G41 PolarHBondContact O-N 2.91Å; G41-A44 WeakPolarHBondContact O-CB 3.25Å
42E92.6Very high91.8Very high185 Ų18575.4 Ų75.486%0.86439%0.394SS*.G310 helixtrans-78.3-23178-57.1-54.1137.100112.8L40 A44L40-E42 PolarHBondContact O-N 3.36Å; E42-A44 PolarHBondContact O-N 2.94Å
43D91.2Very high91.9Very high147 Ų14781 Ų8179%0.78642%0.418SS*.G310 helixtrans-81.315.3176.3-60.8-44.5000112.5L40 Y45L40-D43 PolarHBondContact O-N 2.96Å; L40-D43 VanDerWaalsContact O-N 3.13Å; D43-Y45 PolarHBondContact O-N 3.3Å
44A92.8Very high92Very high27 Ų2779.9 Ų79.922%0.22342%0.416CS..  trans-72.8111-178.700000111.7L36 K37 L40 G41 E42L36-A44 HydrophobicContact CB-CB 4.35Å; K37-A44 HydrophobicContact CG-CB 4.17Å; L40-A44 HydrophobicContact CB-CB 4.05Å; G41-A44 WeakPolarHBondContact O-CB 3.25Å; E42-A44 PolarHBondContact O-N 2.94Å
45Y92Very high92.2Very high63 Ų6379.5 Ų79.525%0.24741%0.414CS..  trans-64.2158.3174.761.8-93.5000113L36 L40 D43 W47 E51 F122L36-Y45 HydrophobicContact CD1-CE2 4.43Å; L36-Y45 HydrophobicContact CD2-CE1 3.93Å; L36-Y45 HydrophobicContact CD2-CE2 3.81Å; L36-Y45 VanDerWaalsContact CD2-CZ 3.47Å; L36-Y45 WeakPolarHBondContact CD2-OH 3.34Å; L40-Y45 HydrophobicContact CD1-CD1 3.6Å; L40-Y45 HydrophobicContact CD1-CE1 3.52Å; D43-Y45 PolarHBondContact O-N 3.3Å; Y45-W47 HydrophobicContact CE2-CE3 4.07Å; Y45-W47 HydrophobicContact CE2-CZ3 4.32Å; Y45-E51 HydrophobicContact CD2-CG 3.87Å; Y45-E51 HydrophobicContact CE2-CG 3.76Å; Y45-E51 WeakPolarHBondContact CE2-OE2 3.37Å; Y45-F122 WeakPolarHBondContact OH-CD1 3.41Å; Y45-F122 PolarHBondContact OH-O 2.96Å
46E91.8Very high92.3Very high162 Ų16279.6 Ų79.676%0.75741%0.41SS*.  trans-81.2134177.1-64.4-168.2159.800112.1N48E46-N48 PolarHBondContact O-N 3.33Å
47W91.3Very high92.5Very high23 Ų2380.4 Ų80.49%0.08742%0.419CS..  trans-78.185.3175.7-165.7-90000111.7I34 L36 Y45 E51 F55 V86 F88 F122I34-W47 HydrophobicContact CD1-CD2 4.21Å; I34-W47 HydrophobicContact CD1-CE3 3.91Å; I34-W47 HydrophobicContact CD1-CH2 3.37Å; I34-W47 HydrophobicContact CD1-CZ2 3.68Å; I34-W47 HydrophobicContact CD1-CZ3 3.49Å; I34-W47 VanDerWaalsContact CD1-CZ3 3.49Å; L36-W47 HydrophobicContact CD1-CB 4.06Å; L36-W47 HydrophobicContact CD1-CE3 4.28Å; Y45-W47 HydrophobicContact CE2-CE3 4.07Å; Y45-W47 HydrophobicContact CE2-CZ3 4.32Å; W47-E51 HydrophobicContact CD2-CB 3.98Å; W47-E51 HydrophobicContact CE3-CB 3.84Å; W47-E51 HydrophobicContact CE3-CG 4.41Å; W47-E51 HydrophobicContact CH2-CB 4.27Å; W47-E51 HydrophobicContact CZ2-CB 4.4Å; W47-E51 HydrophobicContact CZ3-CB 3.99Å; W47-F55 HydrophobicContact CH2-CB 4.1Å; W47-F55 HydrophobicContact CH2-CD2 4.4Å; W47-F55 HydrophobicContact CZ2-CB 4.12Å; W47-V86 HydrophobicContact CB-CB 4.46Å; W47-V86 HydrophobicContact CB-CG1 3.77Å; W47-V86 HydrophobicContact CB-CG2 3.73Å; W47-V86 HydrophobicContact CD2-CG1 3.54Å; W47-V86 HydrophobicContact CE3-CG1 4.14Å; W47-V86 HydrophobicContact CG-CB 4.44Å; W47-V86 HydrophobicContact CG-CG1 3.32Å; W47-V86 HydrophobicContact CG-CG2 4.21Å; W47-F88 AromaticContact CE2-CE1 3.86Å; W47-F88 HydrophobicContact CH2-CE1 4.5Å; W47-F88 AromaticContact CZ2-CE1 3.59Å; W47-F88 HydrophobicContact CZ2-CE1 3.59Å; W47-F88 AromaticContact CZ2-CZ 3.95Å; W47-F88 HydrophobicContact CZ2-CZ 3.95Å; W47-F88 AromaticContact NE1-CE1 3.93Å; W47-F122 HydrophobicContact CH2-CD1 4.23Å; W47-F122 AromaticContact CH2-CE1 3.84Å; W47-F122 HydrophobicContact CH2-CE1 3.84Å; W47-F122 HydrophobicContact CH2-CZ 4.4Å; W47-F122 AromaticContact CZ3-CD1 3.96Å; W47-F122 HydrophobicContact CZ3-CD1 3.96Å; W47-F122 AromaticContact CZ3-CE1 3.97Å; W47-F122 HydrophobicContact CZ3-CE1 3.97Å
48N91.1Very high92.7Very high72 Ų7273.1 Ų73.139%0.38539%0.389SS..  trans-101.7-173.8-177.566.935.2000112.5E46 S50 E51 M52E46-N48 PolarHBondContact O-N 3.33Å; N48-S50 VanDerWaalsContact C-N 3.3Å; N48-S50 PolarHBondContact O-N 3.5Å; N48-S50 WeakPolarHBondContact OD1-CA 3.35Å; N48-S50 VanDerWaalsContact OD1-CB 3.24Å; N48-S50 WeakPolarHBondContact OD1-CB 3.34Å; N48-S50 PolarHBondContact OD1-N 3.47Å; N48-E51 PolarHBondContact O-N 3.34Å; N48-E51 PolarHBondContact OD1-N 3.47Å; N48-E51 VanDerWaalsContact OD1-N 3.09Å; N48-M52 WeakPolarHBondContact O-CG 3.48Å; N48-M52 PolarHBondContact O-N 2.97Å; N48-M52 VanDerWaalsContact O-N 3.07Å
49Q90.7Very high92.9Very high169 Ų16967.7 Ų67.779%0.7936%0.355SS*.Hα-helixtrans-63.6-31.4179.6-68.6-179.6-11.800113.5M52 F53Q49-M52 PolarHBondContact O-N 3Å; Q49-F53 WeakPolarHBondContact O-CB 3.43Å; Q49-F53 PolarHBondContact O-N 3.39Å
50S92.9Very high93.1Very high82 Ų8266 Ų6657%0.57334%0.342SS*.Hα-helixtrans-67.2-41.6176-51.80000111.2N48 F53 F54N48-S50 VanDerWaalsContact C-N 3.3Å; N48-S50 PolarHBondContact O-N 3.5Å; N48-S50 WeakPolarHBondContact OD1-CA 3.35Å; N48-S50 VanDerWaalsContact OD1-CB 3.24Å; N48-S50 WeakPolarHBondContact OD1-CB 3.34Å; N48-S50 PolarHBondContact OD1-N 3.47Å; S50-F53 PolarHBondContact O-N 3.45Å; S50-F54 VanDerWaalsContact O-CB 3.31Å; S50-F54 WeakPolarHBondContact O-CB 3.35Å; S50-F54 PolarHBondContact O-N 2.96Å
51E92.8Very high93.3Very high41 Ų4167.3 Ų67.319%0.19235%0.346CS..Hα-helixtrans-65.6-38.1174.2-66.1-55133.400112.1Y45 W47 N48 F54 F55Y45-E51 HydrophobicContact CD2-CG 3.87Å; Y45-E51 HydrophobicContact CE2-CG 3.76Å; Y45-E51 WeakPolarHBondContact CE2-OE2 3.37Å; W47-E51 HydrophobicContact CD2-CB 3.98Å; W47-E51 HydrophobicContact CE3-CB 3.84Å; W47-E51 HydrophobicContact CE3-CG 4.41Å; W47-E51 HydrophobicContact CH2-CB 4.27Å; W47-E51 HydrophobicContact CZ2-CB 4.4Å; W47-E51 HydrophobicContact CZ3-CB 3.99Å; N48-E51 PolarHBondContact O-N 3.34Å; N48-E51 PolarHBondContact OD1-N 3.47Å; N48-E51 VanDerWaalsContact OD1-N 3.09Å; E51-F54 PolarHBondContact O-N 3.49Å; E51-F55 WeakPolarHBondContact O-CB 3.38Å; E51-F55 PolarHBondContact O-N 2.9Å
52M91.8Very high93.5Very high44 Ų4465.7 Ų65.722%0.21733%0.329CS..Hα-helixtrans-62.2-46172.7-70.9177.56700112.1N48 Q49 F55 Q56 L79 Q82N48-M52 WeakPolarHBondContact O-CG 3.48Å; N48-M52 PolarHBondContact O-N 2.97Å; N48-M52 VanDerWaalsContact O-N 3.07Å; Q49-M52 PolarHBondContact O-N 3Å; M52-F55 WeakPolarHBondContact O-CB 3.34Å; M52-F55 PolarHBondContact O-N 2.97Å; M52-Q56 WeakPolarHBondContact O-CG 3.42Å; M52-Q56 PolarHBondContact O-N 3.29Å; M52-L79 HydrophobicContact CB-CD1 3.9Å; M52-L79 HydrophobicContact CE-CB 4.31Å; M52-L79 HydrophobicContact CE-CD1 3.97Å; M52-L79 HydrophobicContact CG-CD1 4.32Å; M52-Q82 PolarHBondContact SD-OE1 2.96Å; M52-Q82 VanDerWaalsContact SD-OE1 3.39Å
53F94.4Very high93.6Very high118 Ų11856.9 Ų56.952%0.51829%0.288SS..Hα-helixtrans-63.3-42.1175.3177.6-93.5000111.8Q49 S50 F55 Q56 A57 V74Q49-F53 WeakPolarHBondContact O-CB 3.43Å; Q49-F53 PolarHBondContact O-N 3.39Å; S50-F53 PolarHBondContact O-N 3.45Å; F53-F55 VanDerWaalsContact C-N 3.29Å; F53-F55 PolarHBondContact O-N 3.42Å; F53-Q56 WeakPolarHBondContact O-CB 3.39Å; F53-Q56 PolarHBondContact O-N 3.3Å; F53-A57 WeakPolarHBondContact O-CB 3.37Å; F53-A57 PolarHBondContact O-N 3.26Å; F53-V74 HydrophobicContact CE2-CB 4.31Å; F53-V74 HydrophobicContact CE2-CG1 3.99Å; F53-V74 HydrophobicContact CE2-CG2 4.03Å; F53-V74 HydrophobicContact CZ-CG1 4.19Å
54F95.5Very high93.7Very high84 Ų8454.3 Ų54.337%0.36827%0.267SS..Hα-helixtrans-64.4-34.6176.6-175.3-132.9000111.9S50 E51 A57 T58 A121 F122S50-F54 VanDerWaalsContact O-CB 3.31Å; S50-F54 WeakPolarHBondContact O-CB 3.35Å; S50-F54 PolarHBondContact O-N 2.96Å; E51-F54 PolarHBondContact O-N 3.49Å; F54-A57 PolarHBondContact O-N 3.33Å; F54-T58 VanDerWaalsContact O-CB 3.27Å; F54-T58 WeakPolarHBondContact O-CB 3.47Å; F54-T58 PolarHBondContact O-N 2.94Å; F54-T58 PolarHBondContact O-OG1 3.47Å; F54-A121 HydrophobicContact CE1-CB 4.12Å; F54-A121 WeakPolarHBondContact CE1-O 3.28Å; F54-A121 HydrophobicContact CZ-CB 3.88Å; F54-F122 HydrophobicContact CD1-CD1 4.13Å; F54-F122 AromaticContact CD1-CE1 3.41Å; F54-F122 HydrophobicContact CD1-CE1 3.41Å; F54-F122 VanDerWaalsContact CD1-CE1 3.41Å; F54-F122 AromaticContact CD1-CZ 3.65Å; F54-F122 HydrophobicContact CD1-CZ 3.65Å; F54-F122 HydrophobicContact CE1-CD1 4.31Å; F54-F122 AromaticContact CE1-CE1 3.95Å; F54-F122 HydrophobicContact CE1-CE1 3.95Å; F54-F122 HydrophobicContact CE1-CZ 4.09Å; F54-F122 HydrophobicContact CG-CE1 4.3Å; F54-F122 HydrophobicContact CG-CZ 4.26Å
55F95.1Very high93.8Very high1 Ų159.1 Ų59.10%0.00428%0.279CS..Hα-helixtrans-65.5-45.8170.6-178.6-86000111.9V32 W47 E51 M52 F53 A57 T58 M59 L79 F88 F90 F122 F131V32-F55 HydrophobicContact CG1-CE2 4.46Å; V32-F55 HydrophobicContact CG2-CZ 3.97Å; W47-F55 HydrophobicContact CH2-CB 4.1Å; W47-F55 HydrophobicContact CH2-CD2 4.4Å; W47-F55 HydrophobicContact CZ2-CB 4.12Å; E51-F55 WeakPolarHBondContact O-CB 3.38Å; E51-F55 PolarHBondContact O-N 2.9Å; M52-F55 WeakPolarHBondContact O-CB 3.34Å; M52-F55 PolarHBondContact O-N 2.97Å; F53-F55 VanDerWaalsContact C-N 3.29Å; F53-F55 PolarHBondContact O-N 3.42Å; F55-A57 VanDerWaalsContact C-N 3.32Å; F55-A57 PolarHBondContact O-N 3.46Å; F55-T58 PolarHBondContact O-N 3.08Å; F55-M59 HydrophobicContact CD1-CG 3.95Å; F55-M59 HydrophobicContact CE1-CG 3.43Å; F55-M59 VanDerWaalsContact CE1-CG 3.43Å; F55-M59 HydrophobicContact CE1-SD 4.38Å; F55-M59 HydrophobicContact CE2-CG 4.2Å; F55-M59 HydrophobicContact CE2-SD 4.48Å; F55-M59 HydrophobicContact CZ-CG 3.57Å; F55-M59 HydrophobicContact CZ-SD 3.95Å; F55-M59 WeakPolarHBondContact O-CB 3.46Å; F55-M59 WeakPolarHBondContact O-CG 3.33Å; F55-M59 PolarHBondContact O-N 3.29Å; F55-L79 HydrophobicContact CD1-CD1 4.37Å; F55-L79 HydrophobicContact CD1-CD2 3.81Å; F55-L79 HydrophobicContact CE1-CD2 3.88Å; F55-F88 AromaticContact CD1-CE2 3.87Å; F55-F88 HydrophobicContact CD1-CE2 3.87Å; F55-F88 AromaticContact CD1-CZ 3.92Å; F55-F88 HydrophobicContact CD1-CZ 3.92Å; F55-F88 HydrophobicContact CD2-CZ 4.03Å; F55-F88 AromaticContact CE1-CE2 3.55Å; F55-F88 HydrophobicContact CE1-CE2 3.55Å; F55-F88 AromaticContact CE1-CZ 3.91Å; F55-F88 HydrophobicContact CE1-CZ 3.91Å; F55-F88 HydrophobicContact CE2-CE2 4.35Å; F55-F88 HydrophobicContact CE2-CZ 4.01Å; F55-F88 HydrophobicContact CG-CE2 4.41Å; F55-F88 AromaticContact CG-CZ 3.99Å; F55-F88 HydrophobicContact CG-CZ 3.99Å; F55-F88 AromaticContact CZ-CE2 3.82Å; F55-F88 HydrophobicContact CZ-CE2 3.82Å; F55-F88 AromaticContact CZ-CZ 3.96Å; F55-F88 HydrophobicContact CZ-CZ 3.96Å; F55-F90 HydrophobicContact CE1-CD1 4.28Å; F55-F90 HydrophobicContact CE1-CG 4.4Å; F55-F90 HydrophobicContact CZ-CD1 4.26Å; F55-F90 HydrophobicContact CZ-CE1 4.34Å; F55-F122 HydrophobicContact CB-CE1 4.49Å; F55-F122 HydrophobicContact CB-CZ 3.82Å; F55-F122 HydrophobicContact CD2-CE2 4.11Å; F55-F122 HydrophobicContact CD2-CZ 4.18Å; F55-F131 HydrophobicContact CE2-CE1 4.42Å; F55-F131 HydrophobicContact CE2-CZ 4.15Å; F55-F131 HydrophobicContact CZ-CE1 4.15Å; F55-F131 HydrophobicContact CZ-CZ 4.33Å
56Q95.2Very high93.8Very high43 Ų4357.3 Ų57.320%0.20127%0.273CS..Hα-helixtrans-57.7-45.1173.7-69172.4-57.700111.4M52 F53 M59 A60 V74 I77 L79M52-Q56 WeakPolarHBondContact O-CG 3.42Å; M52-Q56 PolarHBondContact O-N 3.29Å; F53-Q56 WeakPolarHBondContact O-CB 3.39Å; F53-Q56 PolarHBondContact O-N 3.3Å; Q56-M59 PolarHBondContact O-N 2.89Å; Q56-A60 WeakPolarHBondContact O-CB 3.36Å; Q56-A60 PolarHBondContact O-N 3.45Å; Q56-V74 HydrophobicContact CB-CB 4.18Å; Q56-V74 HydrophobicContact CB-CG1 4.14Å; Q56-I77 HydrophobicContact CB-CB 4.17Å; Q56-I77 HydrophobicContact CB-CG2 4.41Å; Q56-I77 HydrophobicContact CG-CB 4.17Å; Q56-I77 HydrophobicContact CG-CG2 4.15Å; Q56-I77 PolarHBondContact NE2-O 3.38Å; Q56-L79 HydrophobicContact CG-CD1 3.73Å; Q56-L79 HydrophobicContact CG-CD2 4.32Å; Q56-L79 HydrophobicContact CG-CG 3.74Å
57A95.7Very high93.8Very high34 Ų3452.5 Ų52.528%0.28125%0.25SC..Hα-helixtrans-64.8-41.4178.900000112.2F53 F54 F55 A60 F61 V74F53-A57 WeakPolarHBondContact O-CB 3.37Å; F53-A57 PolarHBondContact O-N 3.26Å; F54-A57 PolarHBondContact O-N 3.33Å; F55-A57 VanDerWaalsContact C-N 3.32Å; F55-A57 PolarHBondContact O-N 3.46Å; A57-A60 PolarHBondContact O-N 3.44Å; A57-F61 WeakPolarHBondContact O-CB 3.29Å; A57-F61 PolarHBondContact O-N 3.33Å; A57-V74 HydrophobicContact CB-CG1 3.9Å
58T95.9Very high93.6Very high14 Ų1460 Ų609%0.08629%0.286CS..Hα-helixtrans-66.9-37.5177.5-60.60000111.9F54 F55 A62 I118 A121 F122F54-T58 VanDerWaalsContact O-CB 3.27Å; F54-T58 WeakPolarHBondContact O-CB 3.47Å; F54-T58 PolarHBondContact O-N 2.94Å; F54-T58 PolarHBondContact O-OG1 3.47Å; F55-T58 PolarHBondContact O-N 3.08Å; T58-A62 PolarHBondContact O-N 3.02Å; T58-A62 VanDerWaalsContact O-N 3.07Å; T58-I118 HydrophobicContact CG2-CB 4.19Å; T58-I118 HydrophobicContact CG2-CG1 3.9Å; T58-I118 HydrophobicContact CG2-CG2 4.14Å; T58-A121 HydrophobicContact CG2-CB 4.46Å; T58-F122 HydrophobicContact CG2-CE2 4.24Å
59M95.3Very high93.2Very high0 Ų061.6 Ų61.60%029%0.292CS..Hα-helixtrans-69.7-44.5173.2-75.2-58.7-51.800112.3F55 Q56 F61 A62 M63 I77 F90 V111 F131F55-M59 HydrophobicContact CD1-CG 3.95Å; F55-M59 HydrophobicContact CE1-CG 3.43Å; F55-M59 VanDerWaalsContact CE1-CG 3.43Å; F55-M59 HydrophobicContact CE1-SD 4.38Å; F55-M59 HydrophobicContact CE2-CG 4.2Å; F55-M59 HydrophobicContact CE2-SD 4.48Å; F55-M59 HydrophobicContact CZ-CG 3.57Å; F55-M59 HydrophobicContact CZ-SD 3.95Å; F55-M59 WeakPolarHBondContact O-CB 3.46Å; F55-M59 WeakPolarHBondContact O-CG 3.33Å; F55-M59 PolarHBondContact O-N 3.29Å; Q56-M59 PolarHBondContact O-N 2.89Å; M59-F61 VanDerWaalsContact C-N 3.3Å; M59-F61 PolarHBondContact O-N 3.41Å; M59-A62 WeakPolarHBondContact O-CB 3.45Å; M59-A62 PolarHBondContact O-N 3Å; M59-M63 WeakPolarHBondContact O-CG 3.47Å; M59-M63 PolarHBondContact O-N 3.27Å; M59-I77 HydrophobicContact CB-CD1 4.08Å; M59-I77 HydrophobicContact CB-CG1 4.06Å; M59-I77 HydrophobicContact CB-CG2 3.93Å; M59-I77 HydrophobicContact CG-CG2 4.46Å; M59-F90 HydrophobicContact CE-CD2 4.36Å; M59-F90 HydrophobicContact CE-CE2 3.45Å; M59-F90 VanDerWaalsContact CE-CE2 3.45Å; M59-F90 HydrophobicContact CE-CZ 3.61Å; M59-F90 HydrophobicContact SD-CZ 4.35Å; M59-V111 HydrophobicContact CE-CG2 3.58Å; M59-V111 HydrophobicContact SD-CG2 4.1Å; M59-F131 HydrophobicContact SD-CE1 3.97Å; M59-F131 HydrophobicContact SD-CZ 4.25Å
60A95.1Very high92.6Very high4 Ų461.4 Ų61.43%0.03329%0.291CS..Hα-helixtrans-57.8-43.717400000110.9Q56 A57 A62 M63 R64 I77Q56-A60 WeakPolarHBondContact O-CB 3.36Å; Q56-A60 PolarHBondContact O-N 3.45Å; A57-A60 PolarHBondContact O-N 3.44Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 3.3Å; A60-M63 PolarHBondContact O-N 3.13Å; A60-R64 WeakPolarHBondContact O-CG 3.4Å; A60-R64 PolarHBondContact O-N 2.95Å; A60-I77 HydrophobicContact CB-CG1 4.11Å
61F95Very high92.3Very high66 Ų6661.3 Ų61.329%0.28929%0.288SS..Hα-helixtrans-56.9-43.5171.5168.6-91.2000112.7A57 M59 M63 R64 R65 R117A57-F61 WeakPolarHBondContact O-CB 3.29Å; A57-F61 PolarHBondContact O-N 3.33Å; M59-F61 VanDerWaalsContact C-N 3.3Å; M59-F61 PolarHBondContact O-N 3.41Å; F61-M63 VanDerWaalsContact C-N 3.34Å; F61-M63 PolarHBondContact O-N 3.27Å; F61-R64 PolarHBondContact O-N 3.12Å; F61-R65 WeakPolarHBondContact O-CB 3.43Å; F61-R65 PolarHBondContact O-N 2.91Å; F61-R117 HydrophobicContact CE1-CG 4.46Å
62A94.8Very high92.2Very high0 Ų059.9 Ų59.90%028%0.28CS..Hα-helixtrans-62.8-40.4177.300000112T58 M59 A60 R65 H66 I118T58-A62 PolarHBondContact O-N 3.02Å; T58-A62 VanDerWaalsContact O-N 3.07Å; M59-A62 WeakPolarHBondContact O-CB 3.45Å; M59-A62 PolarHBondContact O-N 3Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 3.3Å; A62-R65 PolarHBondContact O-N 3Å; A62-H66 WeakPolarHBondContact O-CB 3.42Å; A62-H66 PolarHBondContact O-N 3.18Å; A62-I118 HydrophobicContact CB-CD1 4.26Å
63M94.9Very high92.2Very high0 Ų061.1 Ų61.10%029%0.288CS..Hα-helixtrans-66.1-45.4175.1-59.8-51.1-67.500111.9M59 A60 F61 R65 H66 F67 Y72 I77 V92 I102 V107 A110M59-M63 WeakPolarHBondContact O-CG 3.47Å; M59-M63 PolarHBondContact O-N 3.27Å; A60-M63 PolarHBondContact O-N 3.13Å; F61-M63 VanDerWaalsContact C-N 3.34Å; F61-M63 PolarHBondContact O-N 3.27Å; M63-R65 VanDerWaalsContact C-N 3.31Å; M63-R65 PolarHBondContact O-N 3.09Å; M63-H66 PolarHBondContact O-N 3.1Å; M63-H66 VanDerWaalsContact O-N 3.12Å; M63-F67 HydrophobicContact CE-CD2 4.25Å; M63-F67 HydrophobicContact CE-CE2 3.66Å; M63-F67 PolarHBondContact O-N 3.24Å; M63-Y72 HydrophobicContact CB-CD1 3.81Å; M63-Y72 HydrophobicContact CB-CD2 4.18Å; M63-Y72 HydrophobicContact CB-CE1 4.15Å; M63-Y72 HydrophobicContact CB-CG 3.82Å; M63-Y72 HydrophobicContact CE-CE1 4.49Å; M63-Y72 HydrophobicContact CG-CD1 4.39Å; M63-I77 HydrophobicContact CG-CD1 4.29Å; M63-V92 HydrophobicContact CE-CG1 3.98Å; M63-V92 HydrophobicContact CG-CG1 4.07Å; M63-V92 HydrophobicContact SD-CG1 4.4Å; M63-V92 HydrophobicContact SD-CG2 4.43Å; M63-I102 HydrophobicContact CE-CG2 3.98Å; M63-V107 HydrophobicContact CE-CG2 4.02Å; M63-V107 HydrophobicContact SD-CG2 4.44Å; M63-A110 HydrophobicContact CE-CB 4.39Å; M63-A110 HydrophobicContact SD-CB 3.56Å; M63-A110 VanDerWaalsContact SD-CB 3.56Å
64R94.5Very high92.1Very high93 Ų9356.4 Ų56.435%0.35127%0.269SS..Hα-helixtrans-54.9-46.9173.2-69.4-173.7-175.1-159.9-2.5111.6A60 F61 H66 Q68 M69 E70 Y72A60-R64 WeakPolarHBondContact O-CG 3.4Å; A60-R64 PolarHBondContact O-N 2.95Å; F61-R64 PolarHBondContact O-N 3.12Å; R64-H66 VanDerWaalsContact C-N 3.29Å; R64-H66 PolarHBondContact O-N 2.96Å; R64-Q68 VanDerWaalsContact O-CA 3.25Å; R64-Q68 WeakPolarHBondContact O-CA 3.4Å; R64-Q68 PolarHBondContact O-N 2.91Å; R64-M69 VanDerWaalsContact CA-O 3.29Å; R64-M69 WeakPolarHBondContact CA-O 3.29Å; R64-M69 WeakPolarHBondContact CB-O 3.47Å; R64-M69 VanDerWaalsContact CG-O 3.31Å; R64-M69 WeakPolarHBondContact CG-O 3.24Å; R64-M69 PolarHBondContact O-N 3.47Å; R64-E70 PolarHBondContact NE-O 3.22Å; R64-E70 PolarHBondContact NH1-O 3.47Å; R64-E70 PolarHBondContact NH2-O 3.06Å; R64-Y72 PolarHBondContact NE-O 3.27Å; R64-Y72 PolarHBondContact NH2-O 3.37Å
65R93.4Very high91.9Very high128 Ų12857.9 Ų57.948%0.48328%0.281SS..Hα-helixtrans-64.8-33.2179.1-172.7176.8-173.7-173.32112.6F61 A62 M63F61-R65 WeakPolarHBondContact O-CB 3.43Å; F61-R65 PolarHBondContact O-N 2.91Å; A62-R65 PolarHBondContact O-N 3Å; M63-R65 VanDerWaalsContact C-N 3.31Å; M63-R65 PolarHBondContact O-N 3.09Å
66H93.2Very high91.7Very high25 Ų2558.3 Ų58.312%0.11628%0.283CS..Hα-helixtrans-72.7-50.8179.4-176.640.6000112.5A62 M63 R64 D106 K109 A110A62-H66 WeakPolarHBondContact O-CB 3.42Å; A62-H66 PolarHBondContact O-N 3.18Å; M63-H66 PolarHBondContact O-N 3.1Å; M63-H66 VanDerWaalsContact O-N 3.12Å; R64-H66 VanDerWaalsContact C-N 3.29Å; R64-H66 PolarHBondContact O-N 2.96Å; H66-D106 PolarHBondContact CD2-O 3.01Å; H66-K109 VanDerWaalsContact CE1-CD 3.43Å; H66-K109 WeakPolarHBondContact CE1-CD 3.4Å; H66-A110 HydrophobicContact CB-CB 3.45Å; H66-A110 VanDerWaalsContact CB-CB 3.45Å
67F90.6Very high91.6Very high61 Ų6156.3 Ų56.327%0.26827%0.274SS..Hα-helixtrans-83.9-10.5-178.3-73.7-69.8000114.1M63 M69 Y72 I102 D106M63-F67 HydrophobicContact CE-CD2 4.25Å; M63-F67 HydrophobicContact CE-CE2 3.66Å; M63-F67 PolarHBondContact O-N 3.24Å; F67-M69 HydrophobicContact CB-CB 4.36Å; F67-M69 HydrophobicContact CB-CG 4.3Å; F67-M69 HydrophobicContact CB-SD 4.2Å; F67-M69 PolarHBondContact O-N 3.19Å; F67-Y72 HydrophobicContact CB-CE2 4.19Å; F67-Y72 AromaticContact CD2-CE2 3.54Å; F67-Y72 HydrophobicContact CD2-CE2 3.54Å; F67-Y72 AromaticContact CD2-CZ 3.69Å; F67-Y72 WeakPolarHBondContact CD2-OH 3.26Å; F67-Y72 HydrophobicContact CE2-CE2 4.26Å; F67-Y72 AromaticContact CE2-CZ 3.92Å; F67-Y72 VanDerWaalsContact CE2-OH 3.26Å; F67-Y72 WeakPolarHBondContact CE2-OH 3.35Å; F67-Y72 HydrophobicContact CG-CE2 4.11Å; F67-I102 HydrophobicContact CE2-CG2 4.34Å; F67-I102 HydrophobicContact CZ-CG2 4.32Å; F67-D106 HydrophobicContact CE2-CB 4.46Å; F67-D106 HydrophobicContact CZ-CB 3.84Å
68Q87.9Confident91.4Very high180 Ų18056.2 Ų56.284%0.84127%0.268SS*.THydrogen-bonded Turntrans58.432.9-173.7-53.9-179.3300112.7R64R64-Q68 VanDerWaalsContact O-CA 3.25Å; R64-Q68 WeakPolarHBondContact O-CA 3.4Å; R64-Q68 PolarHBondContact O-N 2.91Å
69M82.6Confident91.1Very high106 Ų10657 Ų5752%0.52227%0.272SS..  trans-124.5133.9-177.8-67.2171.9-175.500109.8R64 F67 T71R64-M69 VanDerWaalsContact CA-O 3.29Å; R64-M69 WeakPolarHBondContact CA-O 3.29Å; R64-M69 WeakPolarHBondContact CB-O 3.47Å; R64-M69 VanDerWaalsContact CG-O 3.31Å; R64-M69 WeakPolarHBondContact CG-O 3.24Å; R64-M69 PolarHBondContact O-N 3.47Å; F67-M69 HydrophobicContact CB-CB 4.36Å; F67-M69 HydrophobicContact CB-CG 4.3Å; F67-M69 HydrophobicContact CB-SD 4.2Å; F67-M69 PolarHBondContact O-N 3.19Å; M69-T71 VanDerWaalsContact C-N 3.29Å; M69-T71 PolarHBondContact O-N 2.81Å
70E78.2Confident90.6Very high165 Ų16557.7 Ų57.777%0.77128%0.276SS*.THydrogen-bonded Turntrans-83-2.5-178.1-59.2-165.1149.600114.2R64 Y72R64-E70 PolarHBondContact NE-O 3.22Å; R64-E70 PolarHBondContact NH1-O 3.47Å; R64-E70 PolarHBondContact NH2-O 3.06Å; E70-Y72 PolarHBondContact O-N 3.4Å
71T86.4Confident89.6Confident81 Ų8161 Ų6150%0.49730%0.296SS..THydrogen-bonded Turntrans-73-24.7-170.149.10000115M69 N73M69-T71 VanDerWaalsContact C-N 3.29Å; M69-T71 PolarHBondContact O-N 2.81Å; T71-N73 PolarHBondContact O-N 3.06Å
72Y90.1Very high88.7Confident10 Ų1062.5 Ų62.54%0.03930%0.304CS..  trans-65.5122.6179-76.7-88.8000111.9M63 R64 F67 E70 N76 V92 P95 I102M63-Y72 HydrophobicContact CB-CD1 3.81Å; M63-Y72 HydrophobicContact CB-CD2 4.18Å; M63-Y72 HydrophobicContact CB-CE1 4.15Å; M63-Y72 HydrophobicContact CB-CG 3.82Å; M63-Y72 HydrophobicContact CE-CE1 4.49Å; M63-Y72 HydrophobicContact CG-CD1 4.39Å; R64-Y72 PolarHBondContact NE-O 3.27Å; R64-Y72 PolarHBondContact NH2-O 3.37Å; F67-Y72 HydrophobicContact CB-CE2 4.19Å; F67-Y72 AromaticContact CD2-CE2 3.54Å; F67-Y72 HydrophobicContact CD2-CE2 3.54Å; F67-Y72 AromaticContact CD2-CZ 3.69Å; F67-Y72 WeakPolarHBondContact CD2-OH 3.26Å; F67-Y72 HydrophobicContact CE2-CE2 4.26Å; F67-Y72 AromaticContact CE2-CZ 3.92Å; F67-Y72 VanDerWaalsContact CE2-OH 3.26Å; F67-Y72 WeakPolarHBondContact CE2-OH 3.35Å; F67-Y72 HydrophobicContact CG-CE2 4.11Å; E70-Y72 PolarHBondContact O-N 3.4Å; Y72-N76 HydrophobicContact CD1-CB 4.33Å; Y72-V92 HydrophobicContact CD1-CG1 4.47Å; Y72-V92 HydrophobicContact CE1-CG1 4.13Å; Y72-P95 HydrophobicContact CD1-CG 3.72Å; Y72-P95 HydrophobicContact CD2-CG 3.77Å; Y72-P95 HydrophobicContact CE1-CG 3.78Å; Y72-P95 HydrophobicContact CE2-CG 3.82Å; Y72-P95 HydrophobicContact CG-CG 3.71Å; Y72-I102 HydrophobicContact CE1-CG1 4.36Å; Y72-I102 WeakPolarHBondContact OH-CD1 3.39Å
73N92Very high88Confident70 Ų7065 Ų6537%0.37432%0.319SS..  trans-113.3174.9175.7-156.920000112.2T71 D75 N76T71-N73 PolarHBondContact O-N 3.06Å; N73-D75 PolarHBondContact ND2-OD2 2.92Å; N73-D75 PolarHBondContact O-N 2.84Å; N73-N76 PolarHBondContact N-OD1 3.04Å; N73-N76 WeakPolarHBondContact O-CB 3.43Å; N73-N76 PolarHBondContact O-N 3.4Å; N73-N76 VanDerWaalsContact O-N 3.11Å
74V92.5Very high86.9Confident20 Ų2071.2 Ų71.212%0.12136%0.362CS..G310 helixtrans-53.4-35.6172-72.50000112.7F53 Q56 A57 N76 I77F53-V74 HydrophobicContact CE2-CB 4.31Å; F53-V74 HydrophobicContact CE2-CG1 3.99Å; F53-V74 HydrophobicContact CE2-CG2 4.03Å; F53-V74 HydrophobicContact CZ-CG1 4.19Å; Q56-V74 HydrophobicContact CB-CB 4.18Å; Q56-V74 HydrophobicContact CB-CG1 4.14Å; A57-V74 HydrophobicContact CB-CG1 3.9Å; V74-N76 PolarHBondContact O-N 3.01Å; V74-I77 PolarHBondContact O-N 3.08Å
75D90.8Very high85.8Confident115 Ų11577.4 Ų77.462%0.61539%0.386SS*.G310 helixtrans-65.1-21.5-179.1-46.1-58.5000113N73 I77N73-D75 PolarHBondContact ND2-OD2 2.92Å; N73-D75 PolarHBondContact O-N 2.84Å; D75-I77 VanDerWaalsContact C-N 3.28Å
76N91.6Very high85.3Confident10 Ų1072.3 Ų72.35%0.05337%0.369CS..G310 helixtrans-81-8175.2-57.7115.5000113.2Y72 N73 V74 V92 T93 S94 P95Y72-N76 HydrophobicContact CD1-CB 4.33Å; N73-N76 PolarHBondContact N-OD1 3.04Å; N73-N76 WeakPolarHBondContact O-CB 3.43Å; N73-N76 PolarHBondContact O-N 3.4Å; N73-N76 VanDerWaalsContact O-N 3.11Å; V74-N76 PolarHBondContact O-N 3.01Å; N76-V92 WeakPolarHBondContact O-CA 3.04Å; N76-T93 WeakPolarHBondContact CA-OG1 3.49Å; N76-T93 PolarHBondContact ND2-OG1 3.45Å; N76-T93 PolarHBondContact O-N 3.39Å; N76-S94 PolarHBondContact ND2-O 3.39Å; N76-P95 WeakPolarHBondContact ND2-CA 3.36Å
77I93.1Very high85.1Confident1 Ų171.9 Ų71.91%0.00537%0.369CS..EExtended strand (participates in β ladder)trans-108.793.4-179.7-47.6-59.6000109Q56 M59 A60 M63 V74 D75 L79 F90 V92Q56-I77 HydrophobicContact CB-CB 4.17Å; Q56-I77 HydrophobicContact CB-CG2 4.41Å; Q56-I77 HydrophobicContact CG-CB 4.17Å; Q56-I77 HydrophobicContact CG-CG2 4.15Å; Q56-I77 PolarHBondContact NE2-O 3.38Å; M59-I77 HydrophobicContact CB-CD1 4.08Å; M59-I77 HydrophobicContact CB-CG1 4.06Å; M59-I77 HydrophobicContact CB-CG2 3.93Å; M59-I77 HydrophobicContact CG-CG2 4.46Å; A60-I77 HydrophobicContact CB-CG1 4.11Å; M63-I77 HydrophobicContact CG-CD1 4.29Å; V74-I77 PolarHBondContact O-N 3.08Å; D75-I77 VanDerWaalsContact C-N 3.28Å; I77-L79 HydrophobicContact CG2-CD2 4.36Å; I77-F90 HydrophobicContact CG2-CD2 4.47Å; I77-V92 HydrophobicContact CD1-CB 4.35Å; I77-V92 HydrophobicContact CD1-CG1 3.88Å; I77-V92 HydrophobicContact CD1-CG2 3.8Å
78I90.8Very high85.1Confident31 Ų3169.1 Ų69.116%0.15936%0.356CS..EExtended strand (participates in β ladder)trans-84.8123.2-178.3-51.7177.3000108.6A18 L21 C22 C80 F90 V91 T93A18-I78 HydrophobicContact CB-CG2 4.34Å; L21-I78 HydrophobicContact CD1-CD1 4.3Å; C22-I78 HydrophobicContact CB-CG2 4.37Å; I78-C80 PolarHBondContact O-SG 3.09Å; I78-C80 VanDerWaalsContact O-SG 3.39Å; I78-F90 WeakPolarHBondContact O-CA 3.33Å; I78-F90 WeakPolarHBondContact O-CB 3.47Å; I78-V91 HydrophobicContact CB-CG2 3.77Å; I78-V91 HydrophobicContact CD1-CG2 4.25Å; I78-V91 HydrophobicContact CG1-CG2 4.34Å; I78-V91 PolarHBondContact N-O 3.22Å; I78-V91 PolarHBondContact O-N 2.92Å; I78-V91 VanDerWaalsContact O-N 3.09Å; I78-T93 HydrophobicContact CD1-CG2 3.72Å; I78-T93 HydrophobicContact CG1-CG2 4.24Å
79L89.9Confident85.3Confident32 Ų3262 Ų6217%0.16832%0.322CS..EExtended strand (participates in β ladder)trans-100138.1175.3-61-172.1000111.4M52 F55 Q56 I77 F88 F90M52-L79 HydrophobicContact CB-CD1 3.9Å; M52-L79 HydrophobicContact CE-CB 4.31Å; M52-L79 HydrophobicContact CE-CD1 3.97Å; M52-L79 HydrophobicContact CG-CD1 4.32Å; F55-L79 HydrophobicContact CD1-CD1 4.37Å; F55-L79 HydrophobicContact CD1-CD2 3.81Å; F55-L79 HydrophobicContact CE1-CD2 3.88Å; Q56-L79 HydrophobicContact CG-CD1 3.73Å; Q56-L79 HydrophobicContact CG-CD2 4.32Å; Q56-L79 HydrophobicContact CG-CG 3.74Å; I77-L79 HydrophobicContact CG2-CD2 4.36Å; L79-F88 HydrophobicContact CD2-CD2 4.02Å; L79-F88 HydrophobicContact CD2-CE2 3.87Å; L79-F90 HydrophobicContact CD2-CB 3.62Å
80C84.7Confident85.7Confident14 Ų1457 Ų5710%0.09530%0.297CS..EExtended strand (participates in β ladder)trans-143.6132.8-161.3-30.20000111.6C22 I78 W89C22-C80 HydrophobicContact CB-CB 3.74Å; C22-C80 WeakPolarHBondContact CB-SG 3.33Å; C22-C80 WeakPolarHBondContact SG-CB 3.14Å; C22-C80 CovalentContact SG-SG 2Å; C22-C80 PolarHBondContact SG-SG 3.38Å; I78-C80 PolarHBondContact O-SG 3.09Å; I78-C80 VanDerWaalsContact O-SG 3.39Å; C80-W89 HydrophobicContact CB-CB 4.17Å; C80-W89 PolarHBondContact N-O 2.88Å; C80-W89 PolarHBondContact O-N 2.87Å
81V75.6Confident86.4Confident73 Ų7349.2 Ų49.244%0.44226%0.261SS..  trans48.876.7172.8-168.20000113.7
82Q76.2Confident86.7Confident97 Ų9745.5 Ų45.545%0.45324%0.238SC..  trans-71.9140.2171.2-176.3179.6-600111.6M52M52-Q82 PolarHBondContact SD-OE1 2.96Å; M52-Q82 VanDerWaalsContact SD-OE1 3.39Å
83T78.6Confident86.8Confident54 Ų5445.1 Ų45.133%0.33124%0.237SC..  trans-108.4162.1169.775.30000111.7R85 V86 S87T83-R85 PolarHBondContact O-N 2.95Å; T83-R85 PolarHBondContact OG1-N 2.9Å; T83-V86 PolarHBondContact O-N 2.89Å; T83-S87 VanDerWaalsContact CG2-OG 3.29Å; T83-S87 WeakPolarHBondContact CG2-OG 3.31Å; T83-S87 PolarHBondContact N-O 3.3Å; T83-S87 PolarHBondContact OG1-N 3.31Å; T83-S87 PolarHBondContact OG1-O 3.29Å; T83-S87 PolarHBondContact OG1-OG 3.29Å
84S72.4Confident86.7Confident129 Ų12942.5 Ų42.590%0.90222%0.224SC*.THydrogen-bonded Turntrans-63.2-17.9176.455.30000114.7V86S84-V86 VanDerWaalsContact C-N 3.3Å
85R72.1Confident86.6Confident223 Ų22343 Ų4384%0.84223%0.228SC*.THydrogen-bonded Turntrans-9423.3173.2-68.1-170.1177.1-172.9-0.5112.8T83 S87T83-R85 PolarHBondContact O-N 2.95Å; T83-R85 PolarHBondContact OG1-N 2.9Å; R85-S87 PolarHBondContact O-N 2.99Å
86V82.8Confident86.4Confident22 Ų2244.6 Ų44.613%0.13324%0.236CC..SBendtrans48.257.4-177.9-163.70000111.7I34 L36 W47 T83 S84I34-V86 HydrophobicContact CB-CB 4.18Å; I34-V86 HydrophobicContact CB-CG1 3.76Å; I34-V86 HydrophobicContact CD1-CG1 3.94Å; I34-V86 HydrophobicContact CG1-CG1 3.99Å; I34-V86 PolarHBondContact N-O 2.84Å; L36-V86 HydrophobicContact CD1-CG2 4.31Å; W47-V86 HydrophobicContact CB-CB 4.46Å; W47-V86 HydrophobicContact CB-CG1 3.77Å; W47-V86 HydrophobicContact CB-CG2 3.73Å; W47-V86 HydrophobicContact CD2-CG1 3.54Å; W47-V86 HydrophobicContact CE3-CG1 4.14Å; W47-V86 HydrophobicContact CG-CB 4.44Å; W47-V86 HydrophobicContact CG-CG1 3.32Å; W47-V86 HydrophobicContact CG-CG2 4.21Å; T83-V86 PolarHBondContact O-N 2.89Å; S84-V86 VanDerWaalsContact C-N 3.3Å
87S89.1Confident86.2Confident16 Ų1647.6 Ų47.611%0.11225%0.252CS..EExtended strand (participates in β ladder)trans-119.4132.4163.579.60000109.5V32 T83 R85V32-S87 VanDerWaalsContact O-CA 3.26Å; V32-S87 WeakPolarHBondContact O-CA 3.48Å; V32-S87 WeakPolarHBondContact O-CB 3.37Å; T83-S87 VanDerWaalsContact CG2-OG 3.29Å; T83-S87 WeakPolarHBondContact CG2-OG 3.31Å; T83-S87 PolarHBondContact N-O 3.3Å; T83-S87 PolarHBondContact OG1-N 3.31Å; T83-S87 PolarHBondContact OG1-O 3.29Å; T83-S87 PolarHBondContact OG1-OG 3.29Å; R85-S87 PolarHBondContact O-N 2.99Å
88F90.9Very high85.7Confident2 Ų251.6 Ų51.61%0.00928%0.277CS..EExtended strand (participates in β ladder)trans-138.9164.7175.554.2-94.4000109.9V32 I34 W47 F55 L79V32-F88 HydrophobicContact CB-CD2 4.31Å; V32-F88 HydrophobicContact CB-CE2 3.9Å; V32-F88 HydrophobicContact CB-CZ 4.02Å; V32-F88 HydrophobicContact CG1-CE1 4.41Å; V32-F88 HydrophobicContact CG1-CE2 4.34Å; V32-F88 HydrophobicContact CG1-CZ 3.98Å; V32-F88 HydrophobicContact CG2-CE2 4.03Å; V32-F88 HydrophobicContact CG2-CZ 4.46Å; V32-F88 PolarHBondContact N-O 3.38Å; V32-F88 PolarHBondContact O-N 2.94Å; I34-F88 HydrophobicContact CD1-CE1 3.72Å; I34-F88 HydrophobicContact CD1-CZ 4.17Å; I34-F88 HydrophobicContact CG1-CE1 4.38Å; W47-F88 AromaticContact CE2-CE1 3.86Å; W47-F88 HydrophobicContact CH2-CE1 4.5Å; W47-F88 AromaticContact CZ2-CE1 3.59Å; W47-F88 HydrophobicContact CZ2-CE1 3.59Å; W47-F88 AromaticContact CZ2-CZ 3.95Å; W47-F88 HydrophobicContact CZ2-CZ 3.95Å; W47-F88 AromaticContact NE1-CE1 3.93Å; F55-F88 AromaticContact CD1-CE2 3.87Å; F55-F88 HydrophobicContact CD1-CE2 3.87Å; F55-F88 AromaticContact CD1-CZ 3.92Å; F55-F88 HydrophobicContact CD1-CZ 3.92Å; F55-F88 HydrophobicContact CD2-CZ 4.03Å; F55-F88 AromaticContact CE1-CE2 3.55Å; F55-F88 HydrophobicContact CE1-CE2 3.55Å; F55-F88 AromaticContact CE1-CZ 3.91Å; F55-F88 HydrophobicContact CE1-CZ 3.91Å; F55-F88 HydrophobicContact CE2-CE2 4.35Å; F55-F88 HydrophobicContact CE2-CZ 4.01Å; F55-F88 HydrophobicContact CG-CE2 4.41Å; F55-F88 AromaticContact CG-CZ 3.99Å; F55-F88 HydrophobicContact CG-CZ 3.99Å; F55-F88 AromaticContact CZ-CE2 3.82Å; F55-F88 HydrophobicContact CZ-CE2 3.82Å; F55-F88 AromaticContact CZ-CZ 3.96Å; F55-F88 HydrophobicContact CZ-CZ 3.96Å; L79-F88 HydrophobicContact CD2-CD2 4.02Å; L79-F88 HydrophobicContact CD2-CE2 3.87Å
89W90.9Very high85.4Confident32 Ų3253.5 Ų53.512%0.12129%0.29CS..EExtended strand (participates in β ladder)trans-98.7151.2168.3-66.986.9000109.5D25 Y30 K31 C80D25-W89 HydrophobicContact CB-CH2 4.34Å; D25-W89 HydrophobicContact CB-CZ2 4.49Å; D25-W89 WeakPolarHBondContact OD1-CH2 3.45Å; D25-W89 WeakPolarHBondContact OD1-CZ2 3.01Å; Y30-W89 VanDerWaalsContact C-CE3 3.45Å; Y30-W89 CarbonylContact O-C 3.5Å; Y30-W89 VanDerWaalsContact O-CA 3.27Å; Y30-W89 WeakPolarHBondContact O-CA 3.43Å; K31-W89 HydrophobicContact CB-CD2 3.85Å; K31-W89 HydrophobicContact CB-CE3 3.79Å; K31-W89 HydrophobicContact CB-CH2 3.81Å; K31-W89 HydrophobicContact CB-CZ2 3.87Å; K31-W89 HydrophobicContact CB-CZ3 3.77Å; K31-W89 HydrophobicContact CD-CH2 4.33Å; K31-W89 HydrophobicContact CD-CZ2 3.7Å; K31-W89 HydrophobicContact CG-CD2 4.36Å; K31-W89 HydrophobicContact CG-CZ2 4.24Å; C80-W89 HydrophobicContact CB-CB 4.17Å; C80-W89 PolarHBondContact N-O 2.88Å; C80-W89 PolarHBondContact O-N 2.87Å
90F92Very high85.3Confident0 Ų057.2 Ų57.20%031%0.308CS..EExtended strand (participates in β ladder)trans-136.5151.9165.377.3-85.1000111.5G29 Y30 V32 F55 M59 I77 I78 L79 V92 V107 F131G29-F90 WeakPolarHBondContact CA-O 3.49Å; Y30-F90 VanDerWaalsContact CB-CE1 3.46Å; Y30-F90 HydrophobicContact CD2-CZ 4.27Å; Y30-F90 HydrophobicContact CG-CE1 4.37Å; Y30-F90 HydrophobicContact CG-CZ 4.21Å; Y30-F90 PolarHBondContact N-O 3.38Å; Y30-F90 PolarHBondContact O-N 3.37Å; V32-F90 HydrophobicContact CG2-CD1 3.58Å; V32-F90 HydrophobicContact CG2-CE1 3.51Å; F55-F90 HydrophobicContact CE1-CD1 4.28Å; F55-F90 HydrophobicContact CE1-CG 4.4Å; F55-F90 HydrophobicContact CZ-CD1 4.26Å; F55-F90 HydrophobicContact CZ-CE1 4.34Å; M59-F90 HydrophobicContact CE-CD2 4.36Å; M59-F90 HydrophobicContact CE-CE2 3.45Å; M59-F90 VanDerWaalsContact CE-CE2 3.45Å; M59-F90 HydrophobicContact CE-CZ 3.61Å; M59-F90 HydrophobicContact SD-CZ 4.35Å; I77-F90 HydrophobicContact CG2-CD2 4.47Å; I78-F90 WeakPolarHBondContact O-CA 3.33Å; I78-F90 WeakPolarHBondContact O-CB 3.47Å; L79-F90 HydrophobicContact CD2-CB 3.62Å; F90-V92 HydrophobicContact CD2-CG2 4.09Å; F90-V92 HydrophobicContact CE2-CG2 3.96Å; F90-V107 HydrophobicContact CE2-CG1 3.91Å; F90-V107 HydrophobicContact CZ-CG1 4.19Å; F90-F131 AromaticContact CE1-CD1 3.86Å; F90-F131 HydrophobicContact CE1-CD1 3.86Å; F90-F131 AromaticContact CE1-CE1 3.85Å; F90-F131 HydrophobicContact CE1-CE1 3.85Å; F90-F131 HydrophobicContact CZ-CD1 4.16Å; F90-F131 HydrophobicContact CZ-CE1 4.06Å
91V92.1Very high85.5Confident1 Ų158.2 Ų58.21%0.00631%0.312CS..EExtended strand (participates in β ladder)trans-125.6156.6167.8-66.70000109C22 I78 L101C22-V91 HydrophobicContact CB-CG2 4.18Å; I78-V91 HydrophobicContact CB-CG2 3.77Å; I78-V91 HydrophobicContact CD1-CG2 4.25Å; I78-V91 HydrophobicContact CG1-CG2 4.34Å; I78-V91 PolarHBondContact N-O 3.22Å; I78-V91 PolarHBondContact O-N 2.92Å; I78-V91 VanDerWaalsContact O-N 3.09Å; V91-L101 HydrophobicContact CB-CD2 4.17Å; V91-L101 HydrophobicContact CG2-CD2 4.17Å
92V92.5Very high86.3Confident4 Ų455.3 Ų55.32%0.02429%0.294CS..EExtended strand (participates in β ladder)trans-117.2131.3175.7-175.90000109.2M63 Y72 N76 I77 F90 L101 I102 V107M63-V92 HydrophobicContact CE-CG1 3.98Å; M63-V92 HydrophobicContact CG-CG1 4.07Å; M63-V92 HydrophobicContact SD-CG1 4.4Å; M63-V92 HydrophobicContact SD-CG2 4.43Å; Y72-V92 HydrophobicContact CD1-CG1 4.47Å; Y72-V92 HydrophobicContact CE1-CG1 4.13Å; N76-V92 WeakPolarHBondContact O-CA 3.04Å; I77-V92 HydrophobicContact CD1-CB 4.35Å; I77-V92 HydrophobicContact CD1-CG1 3.88Å; I77-V92 HydrophobicContact CD1-CG2 3.8Å; F90-V92 HydrophobicContact CD2-CG2 4.09Å; F90-V92 HydrophobicContact CE2-CG2 3.96Å; V92-L101 WeakPolarHBondContact O-CA 3.27Å; V92-I102 HydrophobicContact CB-CB 4.33Å; V92-I102 HydrophobicContact CB-CG1 4.35Å; V92-I102 HydrophobicContact CG1-CB 4.35Å; V92-I102 HydrophobicContact CG1-CG1 3.89Å; V92-I102 PolarHBondContact O-N 3.39Å; V92-V107 HydrophobicContact CB-CG2 4.07Å; V92-V107 HydrophobicContact CG2-CG1 4.17Å; V92-V107 HydrophobicContact CG2-CG2 3.99Å
93T91.8Very high87Confident1 Ų153.9 Ų53.91%0.00629%0.293CS..BIsolated β-bridgetrans-101.9161.9176.372.90000111.3N76 I78 T98 M100 L101N76-T93 WeakPolarHBondContact CA-OG1 3.49Å; N76-T93 PolarHBondContact ND2-OG1 3.45Å; N76-T93 PolarHBondContact O-N 3.39Å; I78-T93 HydrophobicContact CD1-CG2 3.72Å; I78-T93 HydrophobicContact CG1-CG2 4.24Å; T93-T98 VanDerWaalsContact CG2-O 3.26Å; T93-T98 WeakPolarHBondContact CG2-O 3.1Å; T93-M100 CarbonylContact C-O 3.54Å; T93-M100 VanDerWaalsContact CA-O 3.27Å; T93-M100 WeakPolarHBondContact CA-O 3.48Å; T93-L101 HydrophobicContact CG2-CD2 4.09Å
94S90.6Very high87.6Confident15 Ų1554.8 Ų54.811%0.10529%0.293CS..  trans-69142.1169.2-176.20000110.9N76 D96 N97 M100N76-S94 PolarHBondContact ND2-O 3.39Å; S94-D96 VanDerWaalsContact C-N 3.26Å; S94-D96 PolarHBondContact O-N 2.94Å; S94-D96 PolarHBondContact OG-N 3.07Å; S94-N97 CarbonylContact O-C 3.29Å; S94-N97 VanDerWaalsContact O-C 3.29Å; S94-N97 PolarHBondContact O-N 3.41Å; S94-M100 PolarHBondContact N-O 2.92Å
95P89.7Confident88.4Confident32 Ų3251.9 Ų51.921%0.20828%0.276CS..SBendtrans-58.9-38171.6-23.635.8000112.7Y72 N76Y72-P95 HydrophobicContact CD1-CG 3.72Å; Y72-P95 HydrophobicContact CD2-CG 3.77Å; Y72-P95 HydrophobicContact CE1-CG 3.78Å; Y72-P95 HydrophobicContact CE2-CG 3.82Å; Y72-P95 HydrophobicContact CG-CG 3.71Å; N76-P95 WeakPolarHBondContact ND2-CA 3.36Å
96D87.8Confident89.4Confident147 Ų14743.5 Ų43.579%0.78625%0.248SC*.SBendtrans-79.7-20.2-177-51.8-51.7000112.9S94S94-D96 VanDerWaalsContact C-N 3.26Å; S94-D96 PolarHBondContact O-N 2.94Å; S94-D96 PolarHBondContact OG-N 3.07Å
97N85.6Confident89.9Confident73 Ų7342.6 Ų42.639%0.3924%0.242SC..  trans-153107.2-179.7-173.8-12.6000111.6S94 T99 M100S94-N97 CarbonylContact O-C 3.29Å; S94-N97 VanDerWaalsContact O-C 3.29Å; S94-N97 PolarHBondContact O-N 3.41Å; N97-T99 PolarHBondContact ND2-OG1 3.39Å; N97-T99 PolarHBondContact O-N 3.29Å; N97-T99 VanDerWaalsContact O-N 3.16Å; N97-T99 PolarHBondContact OD1-N 2.86Å; N97-T99 PolarHBondContact OD1-OG1 2.84Å; N97-M100 HydrophobicContact CB-CB 4.17Å; N97-M100 PolarHBondContact O-N 3.34Å
98T83.8Confident90Very high85 Ų8544.9 Ų44.952%0.52125%0.251SS..THydrogen-bonded Turntrans-65.4-15.6-179.453.90000114.6L21 T93L21-T98 WeakPolarHBondContact CD1-O 3.32Å; T93-T98 VanDerWaalsContact CG2-O 3.26Å; T93-T98 WeakPolarHBondContact CG2-O 3.1Å
99T83.9Confident90.1Very high72 Ų7249.7 Ų49.744%0.44227%0.272SS..THydrogen-bonded Turntrans-86.2-17.5174.567.60000113L17 N97L17-T99 HydrophobicContact CD2-CG2 4.05Å; N97-T99 PolarHBondContact ND2-OG1 3.39Å; N97-T99 PolarHBondContact O-N 3.29Å; N97-T99 VanDerWaalsContact O-N 3.16Å; N97-T99 PolarHBondContact OD1-N 2.86Å; N97-T99 PolarHBondContact OD1-OG1 2.84Å
100M87.9Confident90.2Very high110 Ų11048.1 Ų48.154%0.54227%0.266SS..SBendtrans-89.3114.9-179-176.5175.4177.200110.4T93 S94 N97T93-M100 CarbonylContact C-O 3.54Å; T93-M100 VanDerWaalsContact CA-O 3.27Å; T93-M100 WeakPolarHBondContact CA-O 3.48Å; S94-M100 PolarHBondContact N-O 2.92Å; N97-M100 HydrophobicContact CB-CB 4.17Å; N97-M100 PolarHBondContact O-N 3.34Å
101L89.8Confident90.3Very high34 Ų3448.1 Ų48.118%0.17827%0.266CS..BIsolated β-bridgetrans-80.2137.5175.2-59.6-176.1000111.4L21 N28 V91 V92 T93L21-L101 HydrophobicContact CD2-CD2 4.24Å; L21-L101 HydrophobicContact CD2-CG 4.34Å; N28-L101 HydrophobicContact CB-CB 4.2Å; N28-L101 HydrophobicContact CB-CD1 4.03Å; V91-L101 HydrophobicContact CB-CD2 4.17Å; V91-L101 HydrophobicContact CG2-CD2 4.17Å; V92-L101 WeakPolarHBondContact O-CA 3.27Å; T93-L101 HydrophobicContact CG2-CD2 4.09Å
102I91.3Very high90.3Very high13 Ų1355.1 Ų55.17%0.06729%0.293CS..PPolyproline II helixtrans-71.2139.9174.3-59.3-56.8000110M63 F67 Y72 V92 D106 V107M63-I102 HydrophobicContact CE-CG2 3.98Å; F67-I102 HydrophobicContact CE2-CG2 4.34Å; F67-I102 HydrophobicContact CZ-CG2 4.32Å; Y72-I102 HydrophobicContact CE1-CG1 4.36Å; Y72-I102 WeakPolarHBondContact OH-CD1 3.39Å; V92-I102 HydrophobicContact CB-CB 4.33Å; V92-I102 HydrophobicContact CB-CG1 4.35Å; V92-I102 HydrophobicContact CG1-CB 4.35Å; V92-I102 HydrophobicContact CG1-CG1 3.89Å; V92-I102 PolarHBondContact O-N 3.39Å; I102-D106 HydrophobicContact CG2-CB 4.04Å; I102-V107 HydrophobicContact CB-CG2 4.14Å; I102-V107 HydrophobicContact CG2-CG2 3.86Å
103P91.6Very high90.2Very high66 Ų6659.7 Ų59.743%0.42932%0.315SS..PPolyproline II helixtrans-58.8143.6176.6-24.835000113.1A105 D106 V107P103-A105 VanDerWaalsContact C-N 3.3Å; P103-A105 PolarHBondContact O-N 3.14Å; P103-D106 PolarHBondContact O-N 3.17Å; P103-D106 VanDerWaalsContact O-N 3.15Å; P103-V107 PolarHBondContact O-N 3.24Å
104K90.3Very high90.3Very high74 Ų7459.7 Ų59.732%0.32232%0.315SS..Hα-helixtrans-51.1-45.6177.6-84.9-170.5151.8158.50113.5P27 G29 Y30 D106 V107 E108P27-K104 WeakPolarHBondContact O-CD 3.4Å; P27-K104 WeakPolarHBondContact O-CE 3.35Å; P27-K104 PolarHBondContact O-NZ 3.21Å; G29-K104 WeakPolarHBondContact O-CE 3.35Å; G29-K104 PolarHBondContact O-NZ 3.1Å; Y30-K104 HydrophobicContact CE2-CB 4.21Å; Y30-K104 HydrophobicContact CE2-CD 4.39Å; Y30-K104 HydrophobicContact CE2-CG 3.72Å; Y30-K104 VanDerWaalsContact OH-C 3.29Å; Y30-K104 WeakPolarHBondContact OH-CA 3.4Å; Y30-K104 VanDerWaalsContact OH-CB 3.23Å; Y30-K104 WeakPolarHBondContact OH-CB 3.47Å; Y30-K104 PolarHBondContact OH-O 3.24Å; K104-D106 VanDerWaalsContact C-N 3.25Å; K104-D106 PolarHBondContact O-N 3.5Å; K104-V107 PolarHBondContact O-N 3.38Å; K104-E108 WeakPolarHBondContact O-CB 3.43Å; K104-E108 PolarHBondContact O-N 3.32Å
105A90.6Very high90.3Very high67 Ų6759.2 Ų59.255%0.55431%0.311SS*.Hα-helixtrans-55.9-37.4-178.500000113.6P103 K109P103-A105 VanDerWaalsContact C-N 3.3Å; P103-A105 PolarHBondContact O-N 3.14Å; A105-K109 VanDerWaalsContact O-CB 3.25Å; A105-K109 WeakPolarHBondContact O-CB 3.49Å; A105-K109 PolarHBondContact O-N 2.85Å
106D92.2Very high90.4Very high48 Ų4864 Ų6426%0.25733%0.331SS..Hα-helixtrans-78-39.8-179.2-58.5-46.4000111.5H66 F67 I102 P103 K104 K109 A110H66-D106 PolarHBondContact CD2-O 3.01Å; F67-D106 HydrophobicContact CE2-CB 4.46Å; F67-D106 HydrophobicContact CZ-CB 3.84Å; I102-D106 HydrophobicContact CG2-CB 4.04Å; P103-D106 PolarHBondContact O-N 3.17Å; P103-D106 VanDerWaalsContact O-N 3.15Å; K104-D106 VanDerWaalsContact C-N 3.25Å; K104-D106 PolarHBondContact O-N 3.5Å; D106-K109 PolarHBondContact O-N 2.87Å; D106-A110 VanDerWaalsContact O-CB 3.28Å; D106-A110 WeakPolarHBondContact O-CB 3.27Å; D106-A110 PolarHBondContact O-N 2.9Å
107V92.9Very high90.6Very high2 Ų264 Ų641%0.01232%0.319CS..Hα-helixtrans-62.5-44.5172.9-179.80000110.7Y30 M63 F90 V92 I102 P103 K104 K109 A110 V111Y30-V107 HydrophobicContact CD2-CB 4.47Å; Y30-V107 HydrophobicContact CD2-CG1 3.89Å; Y30-V107 HydrophobicContact CE2-CB 3.84Å; Y30-V107 HydrophobicContact CE2-CG1 3.73Å; M63-V107 HydrophobicContact CE-CG2 4.02Å; M63-V107 HydrophobicContact SD-CG2 4.44Å; F90-V107 HydrophobicContact CE2-CG1 3.91Å; F90-V107 HydrophobicContact CZ-CG1 4.19Å; V92-V107 HydrophobicContact CB-CG2 4.07Å; V92-V107 HydrophobicContact CG2-CG1 4.17Å; V92-V107 HydrophobicContact CG2-CG2 3.99Å; I102-V107 HydrophobicContact CB-CG2 4.14Å; I102-V107 HydrophobicContact CG2-CG2 3.86Å; P103-V107 PolarHBondContact O-N 3.24Å; K104-V107 PolarHBondContact O-N 3.38Å; V107-K109 PolarHBondContact O-N 2.92Å; V107-A110 PolarHBondContact O-N 3.28Å; V107-V111 HydrophobicContact CG1-CG2 4.49Å; V107-V111 WeakPolarHBondContact O-CB 3.33Å; V107-V111 WeakPolarHBondContact O-CG2 2.98Å; V107-V111 PolarHBondContact O-N 3.46Å
108E92.8Very high91.1Very high64 Ų6460.5 Ų60.530%0.29930%0.301SS..Hα-helixtrans-59.5-47174.9170.6169.1178.900111.6K104 A110 V111 R112 I134K104-E108 WeakPolarHBondContact O-CB 3.43Å; K104-E108 PolarHBondContact O-N 3.32Å; E108-A110 PolarHBondContact O-N 3.02Å; E108-V111 PolarHBondContact O-N 3.33Å; E108-R112 VanDerWaalsContact O-CB 3.22Å; E108-R112 WeakPolarHBondContact O-CB 2.93Å; E108-R112 PolarHBondContact O-N 3.05Å; E108-I134 HydrophobicContact CB-CD1 4.16Å; E108-I134 HydrophobicContact CB-CG1 4.16Å; E108-I134 HydrophobicContact CG-CD1 4.32Å; E108-I134 HydrophobicContact CG-CG1 3.94Å; E108-I134 HydrophobicContact CG-CG2 4.17Å
109K92.3Very high91.5Very high103 Ų10356.9 Ų56.945%0.44828%0.278SS..Hα-helixtrans-63.4-41.3178.5-171.9172.2169.9-166.20111.6H66 A105 D106 V107 R112 M113H66-K109 VanDerWaalsContact CE1-CD 3.43Å; H66-K109 WeakPolarHBondContact CE1-CD 3.4Å; A105-K109 VanDerWaalsContact O-CB 3.25Å; A105-K109 WeakPolarHBondContact O-CB 3.49Å; A105-K109 PolarHBondContact O-N 2.85Å; D106-K109 PolarHBondContact O-N 2.87Å; V107-K109 PolarHBondContact O-N 2.92Å; K109-R112 PolarHBondContact O-N 3.17Å; K109-M113 HydrophobicContact CG-SD 4.13Å; K109-M113 WeakPolarHBondContact O-CB 3.38Å; K109-M113 VanDerWaalsContact O-CG 3.23Å; K109-M113 WeakPolarHBondContact O-CG 3.04Å; K109-M113 PolarHBondContact O-N 2.72Å
110A93.3Very high91.9Very high0 Ų057.5 Ų57.50%028%0.279CS..Hα-helixtrans-61.7-48.9175.500000112.7M63 H66 D106 V107 E108 M113 S114M63-A110 HydrophobicContact CE-CB 4.39Å; M63-A110 HydrophobicContact SD-CB 3.56Å; M63-A110 VanDerWaalsContact SD-CB 3.56Å; H66-A110 HydrophobicContact CB-CB 3.45Å; H66-A110 VanDerWaalsContact CB-CB 3.45Å; D106-A110 VanDerWaalsContact O-CB 3.28Å; D106-A110 WeakPolarHBondContact O-CB 3.27Å; D106-A110 PolarHBondContact O-N 2.9Å; V107-A110 PolarHBondContact O-N 3.28Å; E108-A110 PolarHBondContact O-N 3.02Å; A110-M113 PolarHBondContact O-N 2.83Å; A110-S114 WeakPolarHBondContact O-CB 3.48Å; A110-S114 PolarHBondContact O-N 3Å; A110-S114 VanDerWaalsContact O-N 3.1Å; A110-S114 PolarHBondContact O-OG 2.87Å
111V93.9Very high92.3Very high0 Ų054 Ų540%027%0.268CS..Hα-helixtrans-60.8-47.8175.31700000110.2M59 V107 E108 M113 S114 R115 I118 F131 I134M59-V111 HydrophobicContact CE-CG2 3.58Å; M59-V111 HydrophobicContact SD-CG2 4.1Å; V107-V111 HydrophobicContact CG1-CG2 4.49Å; V107-V111 WeakPolarHBondContact O-CB 3.33Å; V107-V111 WeakPolarHBondContact O-CG2 2.98Å; V107-V111 PolarHBondContact O-N 3.46Å; E108-V111 PolarHBondContact O-N 3.33Å; V111-M113 PolarHBondContact O-N 2.75Å; V111-S114 CarbonylContact O-C 3.48Å; V111-S114 PolarHBondContact O-N 3.37Å; V111-S114 VanDerWaalsContact O-N 3.14Å; V111-R115 VanDerWaalsContact O-CA 3.28Å; V111-R115 WeakPolarHBondContact O-CA 3.46Å; V111-R115 WeakPolarHBondContact O-CB 3.21Å; V111-R115 PolarHBondContact O-N 3.35Å; V111-I118 HydrophobicContact CG1-CD1 4.3Å; V111-F131 HydrophobicContact CG1-CD1 4.03Å; V111-F131 HydrophobicContact CG1-CD2 4.21Å; V111-F131 HydrophobicContact CG1-CE1 4.04Å; V111-F131 HydrophobicContact CG1-CE2 4.2Å; V111-F131 HydrophobicContact CG1-CG 4.13Å; V111-F131 HydrophobicContact CG1-CZ 4.13Å; V111-F131 HydrophobicContact CG2-CD1 4.38Å; V111-F131 HydrophobicContact CG2-CE1 4.12Å; V111-I134 HydrophobicContact CB-CD1 3.9Å; V111-I134 HydrophobicContact CG1-CD1 3.86Å; V111-I134 HydrophobicContact CG1-CG2 4.4Å; V111-I134 HydrophobicContact CG2-CD1 4.21Å
112R91.6Very high92.5Very high148 Ų14852.6 Ų52.656%0.55826%0.26SS*.Hα-helixtrans-62.1-41-179.2-165176.667.7155-0112.4E108 K109 S114 T137E108-R112 VanDerWaalsContact O-CB 3.22Å; E108-R112 WeakPolarHBondContact O-CB 2.93Å; E108-R112 PolarHBondContact O-N 3.05Å; K109-R112 PolarHBondContact O-N 3.17Å; R112-S114 VanDerWaalsContact C-N 3.3Å; R112-S114 PolarHBondContact O-N 3.22Å; R112-T137 HydrophobicContact CG-CG2 3.56Å
113M91.4Very high92.6Very high99 Ų9958 Ų5849%0.48829%0.288SS..Hα-helixtrans-67.7-27.8175.8-73.517669.800113.4K109 A110 V111K109-M113 HydrophobicContact CG-SD 4.13Å; K109-M113 WeakPolarHBondContact O-CB 3.38Å; K109-M113 VanDerWaalsContact O-CG 3.23Å; K109-M113 WeakPolarHBondContact O-CG 3.04Å; K109-M113 PolarHBondContact O-N 2.72Å; A110-M113 PolarHBondContact O-N 2.83Å; V111-M113 PolarHBondContact O-N 2.75Å
114S92.8Very high92.7Very high2 Ų255.5 Ų55.51%0.01427%0.271CS..Hα-helixtrans-105.5-0-177.6-58.90000113.9A110 V111 R112 H116 R117 I118A110-S114 WeakPolarHBondContact O-CB 3.48Å; A110-S114 PolarHBondContact O-N 3Å; A110-S114 VanDerWaalsContact O-N 3.1Å; A110-S114 PolarHBondContact O-OG 2.87Å; V111-S114 CarbonylContact O-C 3.48Å; V111-S114 PolarHBondContact O-N 3.37Å; V111-S114 VanDerWaalsContact O-N 3.14Å; R112-S114 VanDerWaalsContact C-N 3.3Å; R112-S114 PolarHBondContact O-N 3.22Å; S114-H116 PolarHBondContact O-N 2.96Å; S114-R117 WeakPolarHBondContact O-CA 3.48Å; S114-R117 PolarHBondContact O-N 3.41Å; S114-I118 WeakPolarHBondContact O-CG1 3.22Å; S114-I118 PolarHBondContact O-N 3.28Å
115R91.4Very high92.7Very high4 Ų454.1 Ų54.12%0.01527%0.271CS..Hα-helixtrans-53.8-47-165.5-168.362.2173.2-97.2-2.5113.5V111 R117 I118 N119 D126 L129 T137V111-R115 VanDerWaalsContact O-CA 3.28Å; V111-R115 WeakPolarHBondContact O-CA 3.46Å; V111-R115 WeakPolarHBondContact O-CB 3.21Å; V111-R115 PolarHBondContact O-N 3.35Å; R115-R117 VanDerWaalsContact C-N 3.32Å; R115-R117 PolarHBondContact O-N 2.87Å; R115-I118 PolarHBondContact O-N 3.27Å; R115-N119 WeakPolarHBondContact O-CB 3.39Å; R115-N119 PolarHBondContact O-N 3.19Å; R115-N119 PolarHBondContact O-OD1 2.87Å; R115-D126 WeakPolarHBondContact CG-OD1 3.28Å; R115-D126 IonicContact CZ-OD1 3.35Å; R115-D126 IonicContact NE-OD1 2.87Å; R115-D126 PolarHBondContact NE-OD1 3.44Å; R115-D126 IonicContact NH2-OD1 3.51Å; R115-L129 PolarHBondContact NH2-O 3.45Å; R115-T137 HydrophobicContact CB-CG2 4.04Å; R115-T137 HydrophobicContact CG-CG2 4.24Å; R115-T137 WeakPolarHBondContact CG-OG1 3.32Å
116H91.2Very high92.6Very high134 Ų13451.3 Ų51.362%0.6225%0.247SC*.Hα-helixtrans-57.3-42.1175.8179.466.3000112.8S114 N120S114-H116 PolarHBondContact O-N 2.96Å; H116-N120 PolarHBondContact CE1-ND2 3.42Å; H116-N120 VanDerWaalsContact CE1-ND2 3.25Å; H116-N120 PolarHBondContact NE2-ND2 2.9Å; H116-N120 WeakPolarHBondContact O-CB 3.45Å; H116-N120 PolarHBondContact O-N 2.77Å; H116-N120 PolarHBondContact O-ND2 3.29Å; H116-N120 PolarHBondContact O-OD1 3.46Å; H116-N120 VanDerWaalsContact O-OD1 3.14Å
117R92.9Very high92.3Very high145 Ų14558 Ų5855%0.54727%0.269SS..Hα-helixtrans-74.8-34.4179.8-174.2164.5173.4168-2.7112.5F61 S114 R115 A121F61-R117 HydrophobicContact CE1-CG 4.46Å; S114-R117 WeakPolarHBondContact O-CA 3.48Å; S114-R117 PolarHBondContact O-N 3.41Å; R115-R117 VanDerWaalsContact C-N 3.32Å; R115-R117 PolarHBondContact O-N 2.87Å; R117-A121 WeakPolarHBondContact O-CB 3.34Å; R117-A121 PolarHBondContact O-N 2.97Å; R117-A121 VanDerWaalsContact O-N 3.1Å
118I94.4Very high92.3Very high1 Ų158.5 Ų58.51%0.00527%0.271CS..Hα-helixtrans-62.2-52.1172.2-60.7165000109.4T58 A62 V111 S114 R115 N120 A121 F122 L129 F131T58-I118 HydrophobicContact CG2-CB 4.19Å; T58-I118 HydrophobicContact CG2-CG1 3.9Å; T58-I118 HydrophobicContact CG2-CG2 4.14Å; A62-I118 HydrophobicContact CB-CD1 4.26Å; V111-I118 HydrophobicContact CG1-CD1 4.3Å; S114-I118 WeakPolarHBondContact O-CG1 3.22Å; S114-I118 PolarHBondContact O-N 3.28Å; R115-I118 PolarHBondContact O-N 3.27Å; I118-N120 PolarHBondContact O-N 2.87Å; I118-A121 WeakPolarHBondContact O-CB 3.38Å; I118-A121 PolarHBondContact O-N 3.47Å; I118-F122 WeakPolarHBondContact O-CD2 3.43Å; I118-F122 PolarHBondContact O-N 3.25Å; I118-L129 HydrophobicContact CG2-CD2 3.81Å; I118-F131 HydrophobicContact CG2-CE2 4.44Å; I118-F131 HydrophobicContact CG2-CZ 4.21Å
119N93.2Very high92.3Very high8 Ų855.5 Ų55.54%0.04326%0.257CS..Hα-helixtrans-55.8-51.5178.6-73.9-0.1000111.9R115 A121 F122 L123 L124 D126R115-N119 WeakPolarHBondContact O-CB 3.39Å; R115-N119 PolarHBondContact O-N 3.19Å; R115-N119 PolarHBondContact O-OD1 2.87Å; N119-A121 VanDerWaalsContact C-N 3.28Å; N119-A121 PolarHBondContact O-N 3.04Å; N119-F122 PolarHBondContact O-N 2.88Å; N119-L123 PolarHBondContact O-N 3.12Å; N119-L124 CarbonylContact C-O 3.58Å; N119-L124 WeakPolarHBondContact CB-O 3.41Å; N119-L124 PolarHBondContact O-N 2.9Å; N119-D126 PolarHBondContact ND2-N 2.75Å; N119-D126 PolarHBondContact ND2-OD1 3.47Å
120N93.1Very high92.2Very high85 Ų8553.9 Ų53.946%0.45525%0.251SS..Hα-helixtrans-62.1-33.3179.6-65.3-1.9000112.9H116 I118 F122 L123H116-N120 PolarHBondContact CE1-ND2 3.42Å; H116-N120 VanDerWaalsContact CE1-ND2 3.25Å; H116-N120 PolarHBondContact NE2-ND2 2.9Å; H116-N120 WeakPolarHBondContact O-CB 3.45Å; H116-N120 PolarHBondContact O-N 2.77Å; H116-N120 PolarHBondContact O-ND2 3.29Å; H116-N120 PolarHBondContact O-OD1 3.46Å; H116-N120 VanDerWaalsContact O-OD1 3.14Å; I118-N120 PolarHBondContact O-N 2.87Å; N120-F122 VanDerWaalsContact C-N 3.27Å; N120-F122 PolarHBondContact O-N 3.5Å; N120-L123 PolarHBondContact O-N 2.86Å
121A94.9Very high92.1Very high38 Ų3854.1 Ų54.131%0.31425%0.252SS..Hα-helixtrans-61.7-36179.300000112.3F54 T58 R117 I118 N119F54-A121 HydrophobicContact CE1-CB 4.12Å; F54-A121 WeakPolarHBondContact CE1-O 3.28Å; F54-A121 HydrophobicContact CZ-CB 3.88Å; T58-A121 HydrophobicContact CG2-CB 4.46Å; R117-A121 WeakPolarHBondContact O-CB 3.34Å; R117-A121 PolarHBondContact O-N 2.97Å; R117-A121 VanDerWaalsContact O-N 3.1Å; I118-A121 WeakPolarHBondContact O-CB 3.38Å; I118-A121 PolarHBondContact O-N 3.47Å; N119-A121 VanDerWaalsContact C-N 3.28Å; N119-A121 PolarHBondContact O-N 3.04Å
122F94.3Very high91.8Very high3 Ų357 Ų571%0.01327%0.268CS..THydrogen-bonded Turntrans-96.72.6178.6-67.1-73.2000113.9Y45 W47 F54 F55 T58 I118 N119 N120 L124 L129Y45-F122 WeakPolarHBondContact OH-CD1 3.41Å; Y45-F122 PolarHBondContact OH-O 2.96Å; W47-F122 HydrophobicContact CH2-CD1 4.23Å; W47-F122 AromaticContact CH2-CE1 3.84Å; W47-F122 HydrophobicContact CH2-CE1 3.84Å; W47-F122 HydrophobicContact CH2-CZ 4.4Å; W47-F122 AromaticContact CZ3-CD1 3.96Å; W47-F122 HydrophobicContact CZ3-CD1 3.96Å; W47-F122 AromaticContact CZ3-CE1 3.97Å; W47-F122 HydrophobicContact CZ3-CE1 3.97Å; F54-F122 HydrophobicContact CD1-CD1 4.13Å; F54-F122 AromaticContact CD1-CE1 3.41Å; F54-F122 HydrophobicContact CD1-CE1 3.41Å; F54-F122 VanDerWaalsContact CD1-CE1 3.41Å; F54-F122 AromaticContact CD1-CZ 3.65Å; F54-F122 HydrophobicContact CD1-CZ 3.65Å; F54-F122 HydrophobicContact CE1-CD1 4.31Å; F54-F122 AromaticContact CE1-CE1 3.95Å; F54-F122 HydrophobicContact CE1-CE1 3.95Å; F54-F122 HydrophobicContact CE1-CZ 4.09Å; F54-F122 HydrophobicContact CG-CE1 4.3Å; F54-F122 HydrophobicContact CG-CZ 4.26Å; F55-F122 HydrophobicContact CB-CE1 4.49Å; F55-F122 HydrophobicContact CB-CZ 3.82Å; F55-F122 HydrophobicContact CD2-CE2 4.11Å; F55-F122 HydrophobicContact CD2-CZ 4.18Å; T58-F122 HydrophobicContact CG2-CE2 4.24Å; I118-F122 WeakPolarHBondContact O-CD2 3.43Å; I118-F122 PolarHBondContact O-N 3.25Å; N119-F122 PolarHBondContact O-N 2.88Å; N120-F122 VanDerWaalsContact C-N 3.27Å; N120-F122 PolarHBondContact O-N 3.5Å; F122-L124 HydrophobicContact CB-CB 4.33Å; F122-L124 HydrophobicContact CB-CD1 3.74Å; F122-L124 HydrophobicContact CB-CG 3.8Å; F122-L124 WeakPolarHBondContact O-CG 3.35Å; F122-L124 PolarHBondContact O-N 3.06Å; F122-L129 HydrophobicContact CD2-CD2 4.44Å
123L93.6Very high91.4Very high127 Ų12753 Ų5367%0.66527%0.272SS*.THydrogen-bonded Turntrans56.233-169.7-52.1176000113L40 N119 N120L40-L123 HydrophobicContact CD2-CB 4.12Å; N119-L123 PolarHBondContact O-N 3.12Å; N120-L123 PolarHBondContact O-N 2.86Å
124L92.8Very high91.1Very high13 Ų1348.6 Ų48.67%0.06825%0.25CS..  trans-108.3169.6-178.8-62.6177.8000112I34 L36 A39 N119 F122 L129I34-L124 HydrophobicContact CG2-CD1 3.49Å; I34-L124 VanDerWaalsContact CG2-CD1 3.49Å; L36-L124 HydrophobicContact CD2-CD1 4.45Å; L36-L124 HydrophobicContact CD2-CD2 4.31Å; A39-L124 HydrophobicContact CB-CD2 3.39Å; N119-L124 CarbonylContact C-O 3.58Å; N119-L124 WeakPolarHBondContact CB-O 3.41Å; N119-L124 PolarHBondContact O-N 2.9Å; F122-L124 HydrophobicContact CB-CB 4.33Å; F122-L124 HydrophobicContact CB-CD1 3.74Å; F122-L124 HydrophobicContact CB-CG 3.8Å; F122-L124 WeakPolarHBondContact O-CG 3.35Å; F122-L124 PolarHBondContact O-N 3.06Å; L124-L129 HydrophobicContact CB-CB 3.93Å; L124-L129 HydrophobicContact CD1-CB 3.87Å; L124-L129 HydrophobicContact CD1-CD1 4.29Å; L124-L129 HydrophobicContact CD1-CD2 4.42Å; L124-L129 HydrophobicContact CD1-CG 4.42Å
125S90.4Very high90.5Very high45 Ų4557.8 Ų57.832%0.31529%0.286SS..  trans-118167175.871.80000110.3R127 T128 L129S125-R127 PolarHBondContact O-N 3.29Å; S125-R127 PolarHBondContact OG-N 2.94Å; S125-T128 PolarHBondContact N-OG1 3.43Å; S125-T128 PolarHBondContact O-N 3.39Å; S125-T128 PolarHBondContact O-OG1 2.83Å; S125-T128 PolarHBondContact OG-N 3.09Å; S125-T128 PolarHBondContact OG-OG1 2.81Å; S125-T128 VanDerWaalsContact OG-OG1 3.08Å; S125-L129 PolarHBondContact O-N 2.79Å
126D88.6Confident89.6Confident8 Ų861.6 Ų61.64%0.04331%0.311CS..THydrogen-bonded Turntrans-58.2-16.6174.7-89.8-8.4000114.5R115 N119 P136 T137 L138R115-D126 WeakPolarHBondContact CG-OD1 3.28Å; R115-D126 IonicContact CZ-OD1 3.35Å; R115-D126 IonicContact NE-OD1 2.87Å; R115-D126 PolarHBondContact NE-OD1 3.44Å; R115-D126 IonicContact NH2-OD1 3.51Å; N119-D126 PolarHBondContact ND2-N 2.75Å; N119-D126 PolarHBondContact ND2-OD1 3.47Å; D126-P136 HydrophobicContact CB-CB 3.69Å; D126-T137 WeakPolarHBondContact OD2-CA 3.36Å; D126-T137 PolarHBondContact OD2-N 3.43Å; D126-T137 PolarHBondContact OD2-OG1 2Å; D126-L138 HydrophobicContact CB-CD1 3.82Å; D126-L138 HydrophobicContact CB-CG 3.92Å; D126-L138 PolarHBondContact OD2-N 3.36Å
127R87.6Confident88.6Confident190 Ų19058.1 Ų58.172%0.71730%0.3SS*.THydrogen-bonded Turntrans-91.3-21.5174.6-63.4-177.8179.9174.40113.7S125S125-R127 PolarHBondContact O-N 3.29Å; S125-R127 PolarHBondContact OG-N 2.94Å
128T91.3Very high87.1Confident12 Ų1256.5 Ų56.57%0.07430%0.301CS..THydrogen-bonded Turntrans-108.6-16.1-176.655.60000112.8I34 S35 T38 A39 S125I34-T128 WeakPolarHBondContact CA-O 3.39Å; S35-T128 PolarHBondContact N-O 3.06Å; T38-T128 HydrophobicContact CG2-CG2 4.45Å; A39-T128 HydrophobicContact CB-CG2 3.86Å; S125-T128 PolarHBondContact N-OG1 3.43Å; S125-T128 PolarHBondContact O-N 3.39Å; S125-T128 PolarHBondContact O-OG1 2.83Å; S125-T128 PolarHBondContact OG-N 3.09Å; S125-T128 PolarHBondContact OG-OG1 2.81Å; S125-T128 VanDerWaalsContact OG-OG1 3.08Å
129L92.4Very high85.3Confident0 Ų060.8 Ų60.80%034%0.337CS..EExtended strand (participates in β ladder)trans-117.792.8164.8-176.459000109.4V32 I34 R115 I118 F122 L124 S125 F131V32-L129 HydrophobicContact CG1-CD1 3.71Å; I34-L129 HydrophobicContact CD1-CD1 4Å; I34-L129 HydrophobicContact CG1-CD1 3.79Å; R115-L129 PolarHBondContact NH2-O 3.45Å; I118-L129 HydrophobicContact CG2-CD2 3.81Å; F122-L129 HydrophobicContact CD2-CD2 4.44Å; L124-L129 HydrophobicContact CB-CB 3.93Å; L124-L129 HydrophobicContact CD1-CB 3.87Å; L124-L129 HydrophobicContact CD1-CD1 4.29Å; L124-L129 HydrophobicContact CD1-CD2 4.42Å; L124-L129 HydrophobicContact CD1-CG 4.42Å; S125-L129 PolarHBondContact O-N 2.79Å; L129-F131 HydrophobicContact CD1-CE2 4.37Å; L129-F131 HydrophobicContact CD2-CE2 3.97Å; L129-F131 HydrophobicContact CG-CD2 4.4Å; L129-F131 HydrophobicContact CG-CE2 3.79Å
130E91.4Very high83.6Confident70 Ų7064.2 Ų64.233%0.32737%0.366SS..EExtended strand (participates in β ladder)trans-94.7129.2179.9-56.5-175.5153.100110.8V32 R33V32-E130 CarbonylContact C-O 3.46Å; V32-E130 WeakPolarHBondContact CA-O 3.4Å; R33-E130 HydrophobicContact CB-CB 4.26Å; R33-E130 VanDerWaalsContact CD-OE2 3.29Å; R33-E130 WeakPolarHBondContact CD-OE2 3.44Å; R33-E130 PolarHBondContact N-O 2.95Å; R33-E130 IonicContact NH1-OE2 3.62Å; R33-E130 PolarHBondContact NH1-OE2 3.48Å; R33-E130 PolarHBondContact O-N 3.3Å
131F91.3Very high82.2Confident4 Ų464.8 Ų64.82%0.01838%0.375CS..EExtended strand (participates in β ladder)trans-105.1108.1166.5-69.3-106.5000107.4V32 F55 M59 F90 V111 I118 L129 G133 I134V32-F131 HydrophobicContact CG2-CD1 3.88Å; V32-F131 HydrophobicContact CG2-CE1 3.96Å; V32-F131 HydrophobicContact CG2-CG 4.49Å; F55-F131 HydrophobicContact CE2-CE1 4.42Å; F55-F131 HydrophobicContact CE2-CZ 4.15Å; F55-F131 HydrophobicContact CZ-CE1 4.15Å; F55-F131 HydrophobicContact CZ-CZ 4.33Å; M59-F131 HydrophobicContact SD-CE1 3.97Å; M59-F131 HydrophobicContact SD-CZ 4.25Å; F90-F131 AromaticContact CE1-CD1 3.86Å; F90-F131 HydrophobicContact CE1-CD1 3.86Å; F90-F131 AromaticContact CE1-CE1 3.85Å; F90-F131 HydrophobicContact CE1-CE1 3.85Å; F90-F131 HydrophobicContact CZ-CD1 4.16Å; F90-F131 HydrophobicContact CZ-CE1 4.06Å; V111-F131 HydrophobicContact CG1-CD1 4.03Å; V111-F131 HydrophobicContact CG1-CD2 4.21Å; V111-F131 HydrophobicContact CG1-CE1 4.04Å; V111-F131 HydrophobicContact CG1-CE2 4.2Å; V111-F131 HydrophobicContact CG1-CG 4.13Å; V111-F131 HydrophobicContact CG1-CZ 4.13Å; V111-F131 HydrophobicContact CG2-CD1 4.38Å; V111-F131 HydrophobicContact CG2-CE1 4.12Å; I118-F131 HydrophobicContact CG2-CE2 4.44Å; I118-F131 HydrophobicContact CG2-CZ 4.21Å; L129-F131 HydrophobicContact CD1-CE2 4.37Å; L129-F131 HydrophobicContact CD2-CE2 3.97Å; L129-F131 HydrophobicContact CG-CD2 4.4Å; L129-F131 HydrophobicContact CG-CE2 3.79Å; F131-G133 PolarHBondContact O-N 3.1Å; F131-I134 HydrophobicContact CB-CB 3.97Å; F131-I134 HydrophobicContact CB-CD1 3.95Å; F131-I134 HydrophobicContact CB-CG1 4.18Å; F131-I134 HydrophobicContact CD1-CD1 4.37Å; F131-I134 HydrophobicContact CG-CD1 4.44Å; F131-I134 PolarHBondContact O-N 3.14Å
132L88.1Confident80.8Confident62 Ų6269.9 Ų69.933%0.32540%0.401SS..THydrogen-bonded Turntrans-64.5127.4-175.9-62.1-169.1000111K31K31-L132 HydrophobicContact CB-CB 4.31Å; K31-L132 HydrophobicContact CB-CD1 3.96Å; K31-L132 HydrophobicContact CB-CG 4.2Å; K31-L132 HydrophobicContact CD-CD1 3.82Å; K31-L132 HydrophobicContact CG-CD1 4Å; K31-L132 HydrophobicContact CG-CG 4.44Å; K31-L132 PolarHBondContact O-N 3.45Å
133G82.6Confident79.6Confident62 Ų6276 Ų7664%0.63944%0.435SS*.THydrogen-bonded Turntrans93.8-15.2-174.100000114.5F131F131-G133 PolarHBondContact O-N 3.1Å
134I84.9Confident78.6Confident8 Ų874.1 Ų74.14%0.04143%0.429CS..SBendtrans-107106.2177.7-52.6179000109.1Y30 E108 V111 F131Y30-I134 HydrophobicContact CD1-CD1 4.03Å; Y30-I134 HydrophobicContact CD1-CG1 4.15Å; Y30-I134 HydrophobicContact CE1-CD1 3.8Å; Y30-I134 HydrophobicContact CE1-CG1 3.71Å; E108-I134 HydrophobicContact CB-CD1 4.16Å; E108-I134 HydrophobicContact CB-CG1 4.16Å; E108-I134 HydrophobicContact CG-CD1 4.32Å; E108-I134 HydrophobicContact CG-CG1 3.94Å; E108-I134 HydrophobicContact CG-CG2 4.17Å; V111-I134 HydrophobicContact CB-CD1 3.9Å; V111-I134 HydrophobicContact CG1-CD1 3.86Å; V111-I134 HydrophobicContact CG1-CG2 4.4Å; V111-I134 HydrophobicContact CG2-CD1 4.21Å; F131-I134 HydrophobicContact CB-CB 3.97Å; F131-I134 HydrophobicContact CB-CD1 3.95Å; F131-I134 HydrophobicContact CB-CG1 4.18Å; F131-I134 HydrophobicContact CD1-CD1 4.37Å; F131-I134 HydrophobicContact CG-CD1 4.44Å; F131-I134 PolarHBondContact O-N 3.14Å
135Y79.5Confident78Confident194 Ų19481.6 Ų81.676%0.76147%0.47SS*.  trans-57.8144.6178.7-71.4-81000112.2
136P74.1Confident77.6Confident84 Ų8483 Ų8355%0.54548%0.476SS..  trans-63.5150.5178.628.8-36.4000111.5D126D126-P136 HydrophobicContact CB-CB 3.69Å
137T68.7Low77.6Confident62 Ų6285.4 Ų85.438%0.3849%0.493SS..  trans-98.4-10.7-176.8530000114.1R112 R115 D126 A139R112-T137 HydrophobicContact CG-CG2 3.56Å; R115-T137 HydrophobicContact CB-CG2 4.04Å; R115-T137 HydrophobicContact CG-CG2 4.24Å; R115-T137 WeakPolarHBondContact CG-OG1 3.32Å; D126-T137 WeakPolarHBondContact OD2-CA 3.36Å; D126-T137 PolarHBondContact OD2-N 3.43Å; D126-T137 PolarHBondContact OD2-OG1 2Å; T137-A139 PolarHBondContact O-N 2.83Å
138L61.8Low77.6Confident111 Ų11180.5 Ų80.558%0.58149%0.485SS*.PPolyproline II helixtrans-54.4121.2174.2-72.8176.3000110.9D126D126-L138 HydrophobicContact CB-CD1 3.82Å; D126-L138 HydrophobicContact CB-CG 3.92Å; D126-L138 PolarHBondContact OD2-N 3.36Å
139A57.8Low77.7Confident90 Ų9088.1 Ų88.174%0.74451%0.513SS*.PPolyproline II helixtrans-54.6150.415900000109.3T137T137-A139 PolarHBondContact O-N 2.83Å
140A57.4Low77.6Confident81 Ų8192.3 Ų92.367%0.66954%0.535SS*.PPolyproline II helixtrans-53.6144.4173.100000109.8V142A140-V142 PolarHBondContact O-N 3.43Å
141P63.2Low77.6Confident97 Ų9793.8 Ų93.863%0.6354%0.544SS*.PPolyproline II helixtrans-48.8129.6177-27.534.9000110.4N143P141-N143 PolarHBondContact O-N 3.07Å
142V65.3Low77.8Confident144 Ų14498 Ų9887%0.87357%0.57SS**  trans-68.797.6-177.2-153.70000107.6A140A140-V142 PolarHBondContact O-N 3.43Å
143N68.3Low78.1Confident133 Ų133100.8 Ų100.871%0.71158%0.58SS**  trans-67.3130.5171.6-69.6-46.6000107.3P141 D145P141-N143 PolarHBondContact O-N 3.07Å; N143-D145 PolarHBondContact O-N 2.91Å
144P73.3Confident78.8Confident86 Ų8699.9 Ų99.956%0.55857%0.57SS**  trans-63136.1175.427-33.9000109.6T146 P148P144-T146 PolarHBondContact O-N 3.26Å; P144-P148 HydrophobicContact CG-CG 4.48Å
145D79.3Confident79.3Confident170 Ų170104.4 Ų104.491%0.90960%0.598SS**SBendtrans-59.3-19.3-177.6-62.8-49000113.3N143N143-D145 PolarHBondContact O-N 2.91Å
146T82.2Confident80.2Confident75 Ų7599 Ų9946%0.4659%0.585SS.*SBendtrans-118.7131.5170.953.70000111P144P144-T146 PolarHBondContact O-N 3.26Å
147P88.8Confident81.2Confident59 Ų5998.7 Ų98.738%0.38358%0.578SS.*  trans-61.6132.6174.5-25.835.6000112W149 L150P147-W149 VanDerWaalsContact CB-CD1 3.43Å; P147-W149 HydrophobicContact CB-CG 4.31Å; P147-W149 PolarHBondContact O-N 2.83Å; P147-W149 VanDerWaalsContact O-N 3.08Å; P147-L150 WeakPolarHBondContact O-CB 3.43Å; P147-L150 PolarHBondContact O-N 3.02Å
148P88.8Confident82.6Confident87 Ų8797.6 Ų97.657%0.56558%0.579SS**Hα-helixtrans-56.4-30.7-176.7-29.635.9000115P144 L150 I151 V152P144-P148 HydrophobicContact CG-CG 4.48Å; P148-L150 PolarHBondContact O-N 3.25Å; P148-I151 PolarHBondContact O-N 2.84Å; P148-V152 PolarHBondContact O-N 3.19Å
149W91.8Very high84.2Confident172 Ų17295.4 Ų95.465%0.65258%0.577SS**Hα-helixtrans-63.2-27.9177.669.5-99000113.1P147 V152 F153P147-W149 VanDerWaalsContact CB-CD1 3.43Å; P147-W149 HydrophobicContact CB-CG 4.31Å; P147-W149 PolarHBondContact O-N 2.83Å; P147-W149 VanDerWaalsContact O-N 3.08Å; W149-V152 PolarHBondContact O-N 2.9Å; W149-F153 WeakPolarHBondContact O-CB 3.16Å; W149-F153 PolarHBondContact O-N 2.85Å
150L91.9Very high86.1Confident87 Ų8794.9 Ų94.946%0.45557%0.565SS.*Hα-helixtrans-73.1-34.2-178.9-163.1151.2000110.9P147 P148 G154P147-L150 WeakPolarHBondContact O-CB 3.43Å; P147-L150 PolarHBondContact O-N 3.02Å; P148-L150 PolarHBondContact O-N 3.25Å; L150-G154 PolarHBondContact O-N 3.42Å
151I91.2Very high87.9Confident101 Ų10194 Ų9452%0.51855%0.553SS.*Hα-helixtrans-64.2-48.7171.4-56.1174.1000109.9P148 F153 G154 V155P148-I151 PolarHBondContact O-N 2.84Å; I151-F153 PolarHBondContact O-N 3.5Å; I151-G154 PolarHBondContact O-N 2.92Å; I151-V155 WeakPolarHBondContact O-CG2 3.35Å; I151-V155 PolarHBondContact O-N 3.21Å; I151-V155 VanDerWaalsContact O-N 3.1Å
152V94.9Very high89.4Confident94 Ų9492.2 Ų92.257%0.5755%0.546SS*.Hα-helixtrans-59.9-45.5177.8178.30000111.1P148 W149 G154 V155 V156P148-V152 PolarHBondContact O-N 3.19Å; W149-V152 PolarHBondContact O-N 2.9Å; V152-G154 PolarHBondContact O-N 2.89Å; V152-V155 PolarHBondContact O-N 3.48Å; V152-V156 HydrophobicContact CG1-CG2 4.44Å; V152-V156 WeakPolarHBondContact O-CG2 3.23Å; V152-V156 PolarHBondContact O-N 3.35Å
153F95.4Very high90.8Very high120 Ų12087 Ų8753%0.52652%0.521SS..Hα-helixtrans-58.4-46.2176.3177-99.7000112.2W149 I151 V155 V156 I157W149-F153 WeakPolarHBondContact O-CB 3.16Å; W149-F153 PolarHBondContact O-N 2.85Å; I151-F153 PolarHBondContact O-N 3.5Å; F153-V155 PolarHBondContact O-N 3.34Å; F153-V156 PolarHBondContact O-N 3.01Å; F153-I157 HydrophobicContact CD1-CG1 4.35Å; F153-I157 HydrophobicContact CD2-CG1 4.15Å; F153-I157 HydrophobicContact CE1-CG1 3.95Å; F153-I157 HydrophobicContact CE2-CD1 4.02Å; F153-I157 HydrophobicContact CE2-CG1 3.73Å; F153-I157 HydrophobicContact CG-CG1 4.45Å; F153-I157 HydrophobicContact CZ-CD1 4.1Å; F153-I157 HydrophobicContact CZ-CG1 3.62Å; F153-I157 WeakPolarHBondContact O-CG1 3.39Å; F153-I157 PolarHBondContact O-N 3.43Å
154G95.4Very high92Very high43 Ų4385 Ų8544%0.44351%0.51SS..Hα-helixtrans-59.4-43.2177.800000113.2L150 I151 V152 G158L150-G154 PolarHBondContact O-N 3.42Å; I151-G154 PolarHBondContact O-N 2.92Å; V152-G154 PolarHBondContact O-N 2.89Å; G154-G158 PolarHBondContact O-N 3.07Å
155V96.7Very high93Very high103 Ų10386 Ų8662%0.62451%0.509SS*.Hα-helixtrans-65.1-44.4176.8174.70000111.6I151 V152 F153 G158 A159I151-V155 WeakPolarHBondContact O-CG2 3.35Å; I151-V155 PolarHBondContact O-N 3.21Å; I151-V155 VanDerWaalsContact O-N 3.1Å; V152-V155 PolarHBondContact O-N 3.48Å; F153-V155 PolarHBondContact O-N 3.34Å; V155-G158 PolarHBondContact O-N 3.41Å; V155-A159 WeakPolarHBondContact O-CB 3.42Å; V155-A159 PolarHBondContact O-N 3.32Å
156V97.3Very high93.6Very high80 Ų8080.5 Ų80.549%0.48549%0.487SS..Hα-helixtrans-63.4-48.8179.6171.30000111.3V152 F153 G158 A159 V160V152-V156 HydrophobicContact CG1-CG2 4.44Å; V152-V156 WeakPolarHBondContact O-CG2 3.23Å; V152-V156 PolarHBondContact O-N 3.35Å; F153-V156 PolarHBondContact O-N 3.01Å; V156-G158 VanDerWaalsContact C-N 3.34Å; V156-G158 PolarHBondContact O-N 3.2Å; V156-A159 PolarHBondContact O-N 3.1Å; V156-V160 WeakPolarHBondContact O-CG2 3.26Å; V156-V160 PolarHBondContact O-N 3.48Å
157I96.6Very high93.9Very high77 Ų7783 Ų8340%0.39550%0.497SS..Hα-helixtrans-63.6-40.5177.5-64.9-62.9000111.1F153 A159 V160 C161F153-I157 HydrophobicContact CD1-CG1 4.35Å; F153-I157 HydrophobicContact CD2-CG1 4.15Å; F153-I157 HydrophobicContact CE1-CG1 3.95Å; F153-I157 HydrophobicContact CE2-CD1 4.02Å; F153-I157 HydrophobicContact CE2-CG1 3.73Å; F153-I157 HydrophobicContact CG-CG1 4.45Å; F153-I157 HydrophobicContact CZ-CD1 4.1Å; F153-I157 HydrophobicContact CZ-CG1 3.62Å; F153-I157 WeakPolarHBondContact O-CG1 3.39Å; F153-I157 PolarHBondContact O-N 3.43Å; I157-A159 PolarHBondContact O-N 3.27Å; I157-V160 PolarHBondContact O-N 3.37Å; I157-C161 WeakPolarHBondContact O-CB 3.46Å; I157-C161 PolarHBondContact O-N 3.49Å; I157-C161 PolarHBondContact O-SG 3.11Å; I157-C161 VanDerWaalsContact O-SG 3.33Å
158G96.6Very high94Very high40 Ų4085.3 Ų85.341%0.41251%0.506SS..Hα-helixtrans-57.9-46.8175.200000112.8G154 V155 V156 C161 A162G154-G158 PolarHBondContact O-N 3.07Å; V155-G158 PolarHBondContact O-N 3.41Å; V156-G158 VanDerWaalsContact C-N 3.34Å; V156-G158 PolarHBondContact O-N 3.2Å; G158-C161 PolarHBondContact O-N 3.21Å; G158-A162 WeakPolarHBondContact O-CB 3.4Å; G158-A162 PolarHBondContact O-N 2.99Å
159A96.4Very high93.9Very high65 Ų6584.8 Ų84.854%0.53750%0.501SS..Hα-helixtrans-64.7-42.1177.300000112.6V155 V156 I157 A162 G163V155-A159 WeakPolarHBondContact O-CB 3.42Å; V155-A159 PolarHBondContact O-N 3.32Å; V156-A159 PolarHBondContact O-N 3.1Å; I157-A159 PolarHBondContact O-N 3.27Å; A159-A162 PolarHBondContact O-N 2.97Å; A159-G163 PolarHBondContact O-N 3.15Å
160V96.9Very high93.4Very high79 Ų7979.3 Ų79.348%0.47949%0.489SS..Hα-helixtrans-63.1-47.2176.7170.30000111.1V156 I157 A162 G163 I164V156-V160 WeakPolarHBondContact O-CG2 3.26Å; V156-V160 PolarHBondContact O-N 3.48Å; I157-V160 PolarHBondContact O-N 3.37Å; V160-A162 PolarHBondContact O-N 3.39Å; V160-G163 PolarHBondContact O-N 3.46Å; V160-I164 HydrophobicContact CG1-CD1 3.85Å; V160-I164 WeakPolarHBondContact O-CG1 3.28Å; V160-I164 PolarHBondContact O-N 3.04Å
161C95.5Very high92.8Very high62 Ų6278.7 Ų78.742%0.41949%0.491SS..Hα-helixtrans-61.6-44.2177.1-72.50000112.1I157 G158 G163 I164 I165I157-C161 WeakPolarHBondContact O-CB 3.46Å; I157-C161 PolarHBondContact O-N 3.49Å; I157-C161 PolarHBondContact O-SG 3.11Å; I157-C161 VanDerWaalsContact O-SG 3.33Å; G158-C161 PolarHBondContact O-N 3.21Å; C161-G163 VanDerWaalsContact C-N 3.33Å; C161-G163 PolarHBondContact O-N 3.21Å; C161-I164 PolarHBondContact O-N 3.31Å; C161-I165 VanDerWaalsContact O-CG1 3.28Å; C161-I165 WeakPolarHBondContact O-CG1 3.47Å; C161-I165 PolarHBondContact O-N 3.27Å
162A94.9Very high92.1Very high59 Ų5979.4 Ų79.449%0.48850%0.495SS..Hα-helixtrans-60.9-41.8175.500000112G158 A159 V160 I165 A166G158-A162 WeakPolarHBondContact O-CB 3.4Å; G158-A162 PolarHBondContact O-N 2.99Å; A159-A162 PolarHBondContact O-N 2.97Å; V160-A162 PolarHBondContact O-N 3.39Å; A162-I165 PolarHBondContact O-N 3.28Å; A162-A166 WeakPolarHBondContact O-CB 3.38Å; A162-A166 PolarHBondContact O-N 3.42Å
163G94.9Very high91.1Very high34 Ų3479.5 Ų79.535%0.35149%0.493SS..Hα-helixtrans-61.1-46174.500000113A159 V160 C161 A166 L167A159-G163 PolarHBondContact O-N 3.15Å; V160-G163 PolarHBondContact O-N 3.46Å; C161-G163 VanDerWaalsContact C-N 3.33Å; C161-G163 PolarHBondContact O-N 3.21Å; G163-A166 PolarHBondContact O-N 3.15Å; G163-L167 VanDerWaalsContact O-CG 3.32Å; G163-L167 WeakPolarHBondContact O-CG 3.4Å; G163-L167 PolarHBondContact O-N 2.86Å
164I94.2Very high90.1Very high92 Ų9279.6 Ų79.647%0.47250%0.495SS..Hα-helixtrans-61.3-46.2176.8-67.3164.6000110.8V160 C161 A166 L167 L168V160-I164 HydrophobicContact CG1-CD1 3.85Å; V160-I164 WeakPolarHBondContact O-CG1 3.28Å; V160-I164 PolarHBondContact O-N 3.04Å; C161-I164 PolarHBondContact O-N 3.31Å; I164-A166 PolarHBondContact O-N 3.46Å; I164-L167 PolarHBondContact O-N 2.92Å; I164-L168 HydrophobicContact CG2-CD1 4.05Å; I164-L168 HydrophobicContact CG2-CG 4.47Å; I164-L168 WeakPolarHBondContact O-CG 3.37Å; I164-L168 PolarHBondContact O-N 3.12Å
165I94.1Very high88.9Confident108 Ų10883.8 Ų83.855%0.55450%0.5SS*.Hα-helixtrans-61.4-45.4178.3-67.4164.4000110.6C161 A162 L167 L168 V169C161-I165 VanDerWaalsContact O-CG1 3.28Å; C161-I165 WeakPolarHBondContact O-CG1 3.47Å; C161-I165 PolarHBondContact O-N 3.27Å; A162-I165 PolarHBondContact O-N 3.28Å; I165-L167 VanDerWaalsContact C-N 3.35Å; I165-L167 PolarHBondContact O-N 3.33Å; I165-L168 PolarHBondContact O-N 2.74Å; I165-V169 HydrophobicContact CG2-CG2 4.38Å; I165-V169 WeakPolarHBondContact O-CG2 3.25Å; I165-V169 PolarHBondContact O-N 2.87Å
166A90.9Very high87.4Confident53 Ų5387.2 Ų87.244%0.43850%0.502SS..Hα-helixtrans-60.6-41.6177.600000112.4A162 G163 I164 S170A162-A166 WeakPolarHBondContact O-CB 3.38Å; A162-A166 PolarHBondContact O-N 3.42Å; G163-A166 PolarHBondContact O-N 3.15Å; I164-A166 PolarHBondContact O-N 3.46Å; A166-S170 VanDerWaalsContact O-CB 3.25Å; A166-S170 WeakPolarHBondContact O-CB 3.49Å; A166-S170 PolarHBondContact O-N 2.83Å; A166-S170 PolarHBondContact O-OG 3.25Å
167L89.6Confident85.8Confident128 Ų12892.6 Ų92.667%0.6751%0.514SS*.Hα-helixtrans-64.6-43.3176.2-72.3171.9000112.2G163 I164 I165 S170 S171G163-L167 VanDerWaalsContact O-CG 3.32Å; G163-L167 WeakPolarHBondContact O-CG 3.4Å; G163-L167 PolarHBondContact O-N 2.86Å; I164-L167 PolarHBondContact O-N 2.92Å; I165-L167 VanDerWaalsContact C-N 3.35Å; I165-L167 PolarHBondContact O-N 3.33Å; L167-S170 PolarHBondContact O-N 2.84Å; L167-S171 WeakPolarHBondContact O-CB 3.31Å; L167-S171 PolarHBondContact O-N 3.48Å
168L89.8Confident84.2Confident108 Ų10896.1 Ų96.157%0.56553%0.526SS*.Hα-helixtrans-64.4-46177.5-69.8173.9000111.9I164 I165 S171 L172I164-L168 HydrophobicContact CG2-CD1 4.05Å; I164-L168 HydrophobicContact CG2-CG 4.47Å; I164-L168 WeakPolarHBondContact O-CG 3.37Å; I164-L168 PolarHBondContact O-N 3.12Å; I165-L168 PolarHBondContact O-N 2.74Å; L168-S171 PolarHBondContact O-N 3.42Å; L168-L172 WeakPolarHBondContact O-CG 3.46Å; L168-L172 PolarHBondContact O-N 3.01Å
169V87.4Confident82.4Confident76 Ų7698.3 Ų98.346%0.46153%0.526SS..Hα-helixtrans-62.8-43.2176.7172.20000110.9I165 S171 L172 L173I165-V169 HydrophobicContact CG2-CG2 4.38Å; I165-V169 WeakPolarHBondContact O-CG2 3.25Å; I165-V169 PolarHBondContact O-N 2.87Å; V169-S171 PolarHBondContact O-N 3.44Å; V169-L172 PolarHBondContact O-N 3.21Å; V169-L173 HydrophobicContact CG1-CD1 3.85Å; V169-L173 HydrophobicContact CG1-CG 4.44Å; V169-L173 WeakPolarHBondContact O-CB 3.23Å; V169-L173 WeakPolarHBondContact O-CG 3.38Å; V169-L173 PolarHBondContact O-N 3.19Å
170S81.6Confident80.5Confident57 Ų57102.2 Ų102.240%0.39953%0.531SS..Hα-helixtrans-62.6-41.9176.4-60.90000112.1A166 L167 L173 Q174A166-S170 VanDerWaalsContact O-CB 3.25Å; A166-S170 WeakPolarHBondContact O-CB 3.49Å; A166-S170 PolarHBondContact O-N 2.83Å; A166-S170 PolarHBondContact O-OG 3.25Å; L167-S170 PolarHBondContact O-N 2.84Å; S170-L173 PolarHBondContact O-N 3.39Å; S170-Q174 WeakPolarHBondContact O-CB 3.38Å; S170-Q174 WeakPolarHBondContact O-CG 3.43Å; S170-Q174 PolarHBondContact O-N 3.22Å
171S78.7Confident78.4Confident73 Ų73100.5 Ų100.551%0.5153%0.529SS..Hα-helixtrans-63.1-43.2177-1760000112.2L167 L168 V169 Q174 K175L167-S171 WeakPolarHBondContact O-CB 3.31Å; L167-S171 PolarHBondContact O-N 3.48Å; L168-S171 PolarHBondContact O-N 3.42Å; V169-S171 PolarHBondContact O-N 3.44Å; S171-Q174 PolarHBondContact O-N 2.93Å; S171-K175 PolarHBondContact O-N 3.38Å
172L77.3Confident76.2Confident116 Ų116105.1 Ų105.161%0.60755%0.546SS*.Hα-helixtrans-66.8-41.1176.1-69.5173.2000112.3L168 V169 K175 R176L168-L172 WeakPolarHBondContact O-CG 3.46Å; L168-L172 PolarHBondContact O-N 3.01Å; V169-L172 PolarHBondContact O-N 3.21Å; L172-K175 PolarHBondContact O-N 3.16Å; L172-R176 WeakPolarHBondContact O-CB 3.35Å; L172-R176 WeakPolarHBondContact O-CG 3.41Å; L172-R176 PolarHBondContact O-N 3.46Å
173L73.9Confident73.8Confident97 Ų97107.7 Ų107.751%0.50856%0.556SS.*Hα-helixtrans-65.2-39.7174.8-74.4169.7000112.1V169 S170 R176 R177V169-L173 HydrophobicContact CG1-CD1 3.85Å; V169-L173 HydrophobicContact CG1-CG 4.44Å; V169-L173 WeakPolarHBondContact O-CB 3.23Å; V169-L173 WeakPolarHBondContact O-CG 3.38Å; V169-L173 PolarHBondContact O-N 3.19Å; S170-L173 PolarHBondContact O-N 3.39Å; L173-R176 PolarHBondContact O-N 3.15Å; L173-R177 WeakPolarHBondContact O-CB 3.27Å; L173-R177 WeakPolarHBondContact O-CG 3.43Å; L173-R177 PolarHBondContact O-N 2.85Å
174Q74.1Confident71.4Confident122 Ų122113.8 Ų113.857%0.5758%0.575SS**Hα-helixtrans-64.6-42.2173.8-77.1-177.86.700111.8S170 S171 R177 K178S170-Q174 WeakPolarHBondContact O-CB 3.38Å; S170-Q174 WeakPolarHBondContact O-CG 3.43Å; S170-Q174 PolarHBondContact O-N 3.22Å; S171-Q174 PolarHBondContact O-N 2.93Å; Q174-R177 PolarHBondContact O-N 3.31Å; Q174-K178 WeakPolarHBondContact O-CG 3.5Å; Q174-K178 PolarHBondContact O-N 2.97Å
175K70Confident69.1Low130 Ų130117 Ų11757%0.56559%0.594SS**Hα-helixtrans-62-45.4175.4-166.6-176.8-178.6-161.90111.4S171 L172 R177 K178 E179S171-K175 PolarHBondContact O-N 3.38Å; L172-K175 PolarHBondContact O-N 3.16Å; K175-R177 VanDerWaalsContact C-N 3.31Å; K175-R177 PolarHBondContact O-N 3.05Å; K175-K178 PolarHBondContact O-N 3.25Å; K175-K178 VanDerWaalsContact O-N 3.16Å; K175-E179 WeakPolarHBondContact CE-OE1 3.4Å; K175-E179 IonicContact NZ-OE1 3.29Å; K175-E179 WeakPolarHBondContact O-CG 3.26Å; K175-E179 PolarHBondContact O-N 3.46Å
176R64Low66.7Low175 Ų175114.7 Ų114.766%0.6660%0.596SS**Hα-helixtrans-62.7-33175.1-73.1-73.3-177.8159.9-2.4113.3L172 L173 K180L172-R176 WeakPolarHBondContact O-CB 3.35Å; L172-R176 WeakPolarHBondContact O-CG 3.41Å; L172-R176 PolarHBondContact O-N 3.46Å; L173-R176 PolarHBondContact O-N 3.15Å; R176-K180 WeakPolarHBondContact O-CG 3.47Å; R176-K180 PolarHBondContact O-N 3.43Å
177R65.3Low63.9Low194 Ų194120.4 Ų120.473%0.73261%0.614SS**Hα-helixtrans-71.2-38.5172.4-75.8178.2-178.6-174.70.5112.3L173 Q174 K175 K180 G181L173-R177 WeakPolarHBondContact O-CB 3.27Å; L173-R177 WeakPolarHBondContact O-CG 3.43Å; L173-R177 PolarHBondContact O-N 2.85Å; Q174-R177 PolarHBondContact O-N 3.31Å; K175-R177 VanDerWaalsContact C-N 3.31Å; K175-R177 PolarHBondContact O-N 3.05Å; R177-K180 PolarHBondContact O-N 3.37Å; R177-G181 PolarHBondContact O-N 3.12Å
178K61.8Low61.3Low150 Ų150121 Ų12165%0.65262%0.618SS**Hα-helixtrans-67.5-41.1174-72.9-176.1176.8-172.20112.5Q174 K175 K180 G181 M182Q174-K178 WeakPolarHBondContact O-CG 3.5Å; Q174-K178 PolarHBondContact O-N 2.97Å; K175-K178 PolarHBondContact O-N 3.25Å; K175-K178 VanDerWaalsContact O-N 3.16Å; K178-K180 VanDerWaalsContact C-N 3.3Å; K178-K180 PolarHBondContact O-N 3.34Å; K178-G181 PolarHBondContact O-N 3.41Å; K178-M182 WeakPolarHBondContact O-CB 3.29Å; K178-M182 WeakPolarHBondContact O-CG 3.25Å; K178-M182 PolarHBondContact O-N 3Å
179E58.6Low59.3Low86 Ų86124.7 Ų124.740%0.40263%0.632SS.*Hα-helixtrans-61.1-37.8174.2-74.6167.5-179.700111.7K175 T183K175-E179 WeakPolarHBondContact CE-OE1 3.4Å; K175-E179 IonicContact NZ-OE1 3.29Å; K175-E179 WeakPolarHBondContact O-CG 3.26Å; K175-E179 PolarHBondContact O-N 3.46Å; E179-T183 PolarHBondContact O-OG1 2.67Å
180K56.3Low57.1Low147 Ų147130.1 Ų130.164%0.63965%0.653SS**Hα-helixtrans-72.4-44.3174.1-74-173.9172.2-156.60113.6R176 R177 K178 M182 T183 E184R176-K180 WeakPolarHBondContact O-CG 3.47Å; R176-K180 PolarHBondContact O-N 3.43Å; R177-K180 PolarHBondContact O-N 3.37Å; K178-K180 VanDerWaalsContact C-N 3.3Å; K178-K180 PolarHBondContact O-N 3.34Å; K180-M182 PolarHBondContact O-N 2.84Å; K180-T183 PolarHBondContact O-N 3.41Å; K180-T183 PolarHBondContact O-OG1 3.47Å; K180-E184 PolarHBondContact O-N 3.34Å
181G54.3Low54.8Low43 Ų43135.6 Ų135.644%0.44368%0.677SS.*Hα-helixtrans-66.8-16.2176.700000114.4R177 K178R177-G181 PolarHBondContact O-N 3.12Å; K178-G181 PolarHBondContact O-N 3.41Å
182M47.9Very low52.7Low159 Ų159139 Ų13978%0.78369%0.687SS**THydrogen-bonded Turntrans-91-3.6171.1-71.8176.667.200113.9K178 K180K178-M182 WeakPolarHBondContact O-CB 3.29Å; K178-M182 WeakPolarHBondContact O-CG 3.25Å; K178-M182 PolarHBondContact O-N 3Å; K180-M182 PolarHBondContact O-N 2.84Å
183T44.6Very low50.4Low113 Ų113141.3 Ų141.369%0.69370%0.695SS**SBendtrans-104.2-2.7169.938.50000113.6E179 K180E179-T183 PolarHBondContact O-OG1 2.67Å; K180-T183 PolarHBondContact O-N 3.41Å; K180-T183 PolarHBondContact O-OG1 3.47Å
184E46.1Very low48.3Very low162 Ų162142.1 Ų142.176%0.75770%0.703SS**SBendtrans-106.114.9178-71.7175.9149.400112.7K180K180-E184 PolarHBondContact O-N 3.34Å
185D44.1Very low46.2Very low160 Ų160145.1 Ų145.186%0.85671%0.714SS**SBendtrans-103.133.3175.8-159.426.4000111.8
186G43.7Very low44.3Very low59 Ų59142.6 Ų142.661%0.60873%0.725SS**SBendtrans177.945.8-170.500000116.8
187Q33.5Very low42.9Very low173 Ų173139.2 Ų139.281%0.80872%0.724SS**SBendtrans-170.1124.2140-105.6159.6-5.900112.6
188D34.4Very low41.5Very low142 Ų142137.7 Ų137.776%0.75973%0.725SS**  trans67.2105.4144-49-20.1000119.2
189E47.4Very low40Very low185 Ų185138.5 Ų138.586%0.86474%0.737SS**  trans-55.6161.4143.5-59.2-176.3175.200110.1
190E41.5Very low38.8Very low190 Ų190137.5 Ų137.589%0.88875%0.749SS**  trans7883.8-177.3-50.4-173.9-169.800116.2
191D33.6Very low37.7Very low171 Ų171138.8 Ų138.891%0.91476%0.761SS**  -146.5151.1110-137.7-19000113.5
192M34.1Very low36.7Very low144 Ų144143.6 Ų143.671%0.70978%0.777SS**  trans-112.1158.9-164.3166.2-179.951.500111.2
193Q29Very low36.3Very low166 Ų166143.2 Ų143.278%0.77678%0.777SS**  trans67.9153.4167.5-93.4176.565.900114.5
194V30.6Very low35.9Very low113 Ų113145.4 Ų145.469%0.68579%0.785SS**  cis-143.1138.75.2-171.60000105.1
195K30.6Very low35.5Very low185 Ų185140.6 Ų140.680%0.80478%0.779SS**  cis-154.2162.59.2-129.8163.7-172.7170.90109.5V197K195-V197 HydrophobicContact CD-CG2 4.37Å; K195-V197 HydrophobicContact CG-CG2 4.42Å
196G29.1Very low35.2Very low77 Ų77139.7 Ų139.779%0.79478%0.779SS**  trans-152.2106.6160.700000108.9
197V34.5Very low35.3Very low105 Ų105147.8 Ų147.864%0.63679%0.793SS**  trans-84.4124.5-169.1171.20000110.6K195K195-V197 HydrophobicContact CD-CG2 4.37Å; K195-V197 HydrophobicContact CG-CG2 4.42Å
198E35Very low36.1Very low161 Ų161146.6 Ų146.675%0.75279%0.792SS**  trans50.3113.5153.9-64160.6-175.100118.9
199N31.6Very low36.9Very low168 Ų168151.7 Ų151.790%0.89880%0.801SS**  -173.3125.9106.1-96.1-50.4000113.5
200G32.1Very low36.3Very low64 Ų64146.1 Ų146.166%0.6679%0.792SS**  trans89.2107.4137.200000121
201I33.4Very low36.2Very low175 Ų175146.6 Ų146.690%0.89779%0.792SS**  trans55.691.2136.742.9174.1000121.6
202N34.3Very low36.9Very low143 Ų143143.7 Ų143.777%0.76578%0.781SS**  39.7119.6121.8-113.913.3000122.4
203L38.5Very low37.4Very low151 Ų151144 Ų14479%0.79179%0.785SS**  trans49.7116130.4-64.3172.2000121.5
204D36.3Very low38.2Very low160 Ų160143.5 Ų143.586%0.85679%0.788SS**  151.1150.3107.6-169.320.5000111.2
205G38.5Very low39.2Very low61 Ų61145.9 Ų145.963%0.62980%0.797SS**  trans154.143.1176.700000120.5
206T38.8Very low39.8Very low140 Ų140146.5 Ų146.586%0.85979%0.794SS**  trans30153.3149.7450000125.1
207Y43.8Very low40.3Very low229 Ų229151 Ų15190%0.89879%0.792SS**  trans-83.2169.6-164.7-107.3-104.2000118.7
208N50.8Low40.9Very low149 Ų149152.4 Ų152.480%0.79780%0.801SS**  trans-56.9153.7-177-67.3-57.4000118.5
209R50.8Low41.1Very low249 Ų249154.2 Ų154.294%0.9481%0.806SS**  trans-132.8135.1148.1-64.3175.2176152.4-1.3105.8
210G35.5Very low41.2Very low67 Ų67158 Ų15869%0.69183%0.826SS**  cis113.3118.222.200000108.7
211F39.8Very low41.7Very low200 Ų200162.8 Ų162.888%0.87783%0.834SS**  trans118.6125.9-175.7-89.7-111.8000112.1
212T47.9Very low42.1Very low111 Ų111162.1 Ų162.168%0.68183%0.83SS**  cis-160.8141.6-6.41.40000109.6
213D44.5Very low42.5Very low150 Ų150163.2 Ų163.280%0.80283%0.834SS**  trans-74.6148.6157.3-67.4-53.2000110.1
214D46.8Very low42.8Very low156 Ų156163.9 Ų163.983%0.83484%0.837SS**  trans-148.369.1160.9-126.9-17.8000109.8R216D214-R216 PolarHBondContact O-N 3.45Å
215D50.9Low43.2Very low163 Ų163164.1 Ų164.187%0.87284%0.836SS**  trans-69.6111.9168.6-104.5-29.2000109.7
216R42.2Very low43.5Very low198 Ų198171 Ų17175%0.74785%0.849SS**  trans-142.5104.5169.7-119.1-172.6168.4-163.7-6.7115.8D214D214-R216 PolarHBondContact O-N 3.45Å
217F40.1Very low43.8Very low170 Ų170173.2 Ų173.275%0.74685%0.849SS**  trans77103.7154.4-57-54000120.1
218T47.8Very low43.8Very low135 Ų135168.9 Ų168.983%0.82885%0.845SS**  trans-74.5129.7141.741.20000111.4
219K38.2Very low43.2Very low200 Ų200170.6 Ų170.687%0.8785%0.849SS**  trans179.3115.4137.6-109.3179.6177.3178.70112.7
220L34.4Very low42.6Very low248 Ų248163.5 Ų163.5100%1.29884%0.841SS**  -162.30109.4-101.2166.2000109.2

Retrieved 220 of 220 residues in 409.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).