A0A060X3B1_ONCMY Loading...

Glycoprotein M6Aa

AlphaFold DB (A0A1S3RS50), UniProt , Accession A0A060X3B1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 278 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.2Very low43.2Very low232 Ų232139.3 Ų139.3100%1.14371%0.705SS**  019.20-145.1-174.8-64.200111.4
2E38.2Very low43.8Very low175 Ų175139.6 Ų139.682%0.81870%0.698SS**  trans-114.3-8.1176.3-76.7172.8141.600112.3
3E39.3Very low44.9Very low178 Ų178131.8 Ų131.883%0.83268%0.675SS**SBendtrans-84.1-22.9-179.9-69.7178.8158.500113.5M5E3-M5 VanDerWaalsContact C-N 3.3Å; E3-M5 PolarHBondContact O-N 2.89Å
4D40.8Very low46.1Very low136 Ų136129.1 Ų129.173%0.72767%0.672SS**Hα-helixtrans-78-10.9176.5-83.2-50.5000113.8
5M39.8Very low47.1Very low145 Ų145128 Ų12871%0.71467%0.666SS**Hα-helixtrans-86.5-20.8179.8-105.21785400113.5E3E3-M5 VanDerWaalsContact C-N 3.3Å; E3-M5 PolarHBondContact O-N 2.89Å
6D46.7Very low48.3Very low105 Ų105128.2 Ų128.256%0.56166%0.663SS**Hα-helixtrans-87.5-34.2-177-120.7-41000112.7G8 Q9 T10D6-G8 VanDerWaalsContact C-N 3.33Å; D6-G8 PolarHBondContact O-N 3.04Å; D6-Q9 PolarHBondContact O-N 3.45Å; D6-T10 PolarHBondContact O-N 2.64Å; D6-T10 VanDerWaalsContact O-N 3.12Å; D6-T10 PolarHBondContact O-OG1 3.13Å
7E45.5Very low49.2Very low143 Ų143125.1 Ų125.167%0.66865%0.654SS**Hα-helixtrans-65.6-36.1174.4-73.5-167.615100111.9Q9 T10 Q11E7-Q9 PolarHBondContact O-N 2.94Å; E7-T10 PolarHBondContact O-N 3.02Å; E7-Q11 WeakPolarHBondContact O-CB 3.4Å; E7-Q11 PolarHBondContact O-N 3.11Å
8G42Very low49.9Very low34 Ų34121.9 Ų121.935%0.35164%0.643SS.*Hα-helixtrans-70-24.117700000114.8D6 K12D6-G8 VanDerWaalsContact C-N 3.33Å; D6-G8 PolarHBondContact O-N 3.04Å; G8-K12 WeakPolarHBondContact O-CD 3.29Å; G8-K12 WeakPolarHBondContact O-CG 2.95Å
9Q46.9Very low50.7Low135 Ų135121.1 Ų121.163%0.63164%0.638SS**Hα-helixtrans-84.2-37.5173.2-78-173.8-66.300111.9D6 E7 K12 G13D6-Q9 PolarHBondContact O-N 3.45Å; E7-Q9 PolarHBondContact O-N 2.94Å; Q9-K12 PolarHBondContact O-N 3.16Å; Q9-G13 PolarHBondContact O-N 2.89Å; Q9-G13 VanDerWaalsContact O-N 3.14Å
10T48.9Very low51.4Low97 Ų97123.2 Ų123.260%0.59564%0.642SS**Hα-helixtrans-68.5-38.2178.9-49.20000112D6 E7 G13 C14D6-T10 PolarHBondContact O-N 2.64Å; D6-T10 VanDerWaalsContact O-N 3.12Å; D6-T10 PolarHBondContact O-OG1 3.13Å; E7-T10 PolarHBondContact O-N 3.02Å; T10-G13 PolarHBondContact O-N 2.65Å; T10-C14 PolarHBondContact O-N 2.82Å
11Q46.7Very low52Low152 Ų152121.2 Ų121.271%0.7164%0.637SS**Hα-helixtrans-68.1-34.4175.7-166.8177.74.800112.8E7 L15E7-Q11 WeakPolarHBondContact O-CB 3.4Å; E7-Q11 PolarHBondContact O-N 3.11Å; Q11-L15 PolarHBondContact O-N 3.48Å; Q11-L15 VanDerWaalsContact O-N 3.16Å
12K50.4Low53.1Low143 Ų143114.4 Ų114.462%0.62261%0.605SS**Hα-helixtrans-66.9-39.6173.5-76.9176.6-1781770112G8 Q9 L15 E16G8-K12 WeakPolarHBondContact O-CD 3.29Å; G8-K12 WeakPolarHBondContact O-CG 2.95Å; Q9-K12 PolarHBondContact O-N 3.16Å; K12-L15 PolarHBondContact O-N 2.99Å; K12-E16 WeakPolarHBondContact O-CB 3.49Å; K12-E16 PolarHBondContact O-N 2.89Å
13G58.5Low54.1Low39 Ų39108.9 Ų108.940%0.40260%0.595SS.*Hα-helixtrans-63.3-40.7176.700000113.8Q9 T10 C17Q9-G13 PolarHBondContact O-N 2.89Å; Q9-G13 VanDerWaalsContact O-N 3.14Å; T10-G13 PolarHBondContact O-N 2.65Å; G13-C17 VanDerWaalsContact O-CB 3.29Å; G13-C17 WeakPolarHBondContact O-CB 3.32Å; G13-C17 PolarHBondContact O-N 3.05Å
14C61.9Low55.3Low94 Ų94100.7 Ų100.764%0.63556%0.559SS**Hα-helixtrans-68.2-38.5174.9-1080000112.6T10 C17 C18T10-C14 PolarHBondContact O-N 2.82Å; C14-C17 PolarHBondContact O-N 2.9Å; C14-C18 VanDerWaalsContact O-CB 3.29Å; C14-C18 WeakPolarHBondContact O-CB 3.33Å; C14-C18 PolarHBondContact O-N 3.29Å
15L60.3Low56.8Low112 Ų11296.8 Ų96.859%0.58654%0.537SS*.Hα-helixtrans-68.7-42.3176.9-164.391.6000111.6Q11 K12 C17 C18 I19Q11-L15 PolarHBondContact O-N 3.48Å; Q11-L15 VanDerWaalsContact O-N 3.16Å; K12-L15 PolarHBondContact O-N 2.99Å; L15-C17 VanDerWaalsContact C-N 3.35Å; L15-C18 PolarHBondContact O-N 3.01Å; L15-I19 HydrophobicContact CD2-CD1 3.94Å; L15-I19 HydrophobicContact CG-CD1 3.95Å; L15-I19 WeakPolarHBondContact O-CB 3.3Å; L15-I19 VanDerWaalsContact O-CG1 3.23Å; L15-I19 WeakPolarHBondContact O-CG1 3.46Å; L15-I19 PolarHBondContact O-N 2.99Å
16E66.7Low58.9Low131 Ų13190.5 Ų90.561%0.61251%0.507SS*.Hα-helixtrans-65.6-37174.1-92.9178.4132.800112.3K12 K20K12-E16 WeakPolarHBondContact O-CB 3.49Å; K12-E16 PolarHBondContact O-N 2.89Å; E16-K20 VanDerWaalsContact O-CB 3.3Å; E16-K20 WeakPolarHBondContact O-CB 3.27Å; E16-K20 WeakPolarHBondContact O-CG 3.42Å; E16-K20 PolarHBondContact O-N 2.99Å
17C63.3Low60.7Low76 Ų7690.5 Ų90.551%0.51450%0.5SS..Hα-helixtrans-64.3-42.7172.2-164.50000110.9G13 C14 L15 K20 C21G13-C17 VanDerWaalsContact O-CB 3.29Å; G13-C17 WeakPolarHBondContact O-CB 3.32Å; G13-C17 PolarHBondContact O-N 3.05Å; C14-C17 PolarHBondContact O-N 2.9Å; L15-C17 VanDerWaalsContact C-N 3.35Å; C17-K20 PolarHBondContact O-N 3.03Å; C17-C21 WeakPolarHBondContact O-CB 3.41Å; C17-C21 PolarHBondContact O-N 3.42Å; C17-C21 PolarHBondContact O-SG 3.08Å
18C62.4Low62.7Low67 Ų6787.2 Ų87.245%0.45349%0.491SS..Hα-helixtrans-66.9-40.8177.6-164.50000112.1C14 L15 C21 L22C14-C18 VanDerWaalsContact O-CB 3.29Å; C14-C18 WeakPolarHBondContact O-CB 3.33Å; C14-C18 PolarHBondContact O-N 3.29Å; L15-C18 PolarHBondContact O-N 3.01Å; C18-C21 PolarHBondContact O-N 3.13Å; C18-L22 WeakPolarHBondContact O-CB 3.23Å; C18-L22 WeakPolarHBondContact O-CD1 3.29Å; C18-L22 PolarHBondContact O-N 3.43Å
19I65.3Low64.9Low107 Ų10785.8 Ų85.855%0.54948%0.475SS..Hα-helixtrans-67.3-38.8175.4-69.6166.7000110.9L15 G23L15-I19 HydrophobicContact CD2-CD1 3.94Å; L15-I19 HydrophobicContact CG-CD1 3.95Å; L15-I19 WeakPolarHBondContact O-CB 3.3Å; L15-I19 VanDerWaalsContact O-CG1 3.23Å; L15-I19 WeakPolarHBondContact O-CG1 3.46Å; L15-I19 PolarHBondContact O-N 2.99Å; I19-G23 PolarHBondContact O-N 3.17Å
20K65Low67Low163 Ų16382.1 Ų82.171%0.70946%0.46SS*.Hα-helixtrans-65.4-39.4171.4-83-178.8174.4179.90112.2E16 C17 G24E16-K20 VanDerWaalsContact O-CB 3.3Å; E16-K20 WeakPolarHBondContact O-CB 3.27Å; E16-K20 WeakPolarHBondContact O-CG 3.42Å; E16-K20 PolarHBondContact O-N 2.99Å; C17-K20 PolarHBondContact O-N 3.03Å; K20-G24 PolarHBondContact O-N 2.91Å
21C64.1Low69Low81 Ų8182.3 Ų82.355%0.54746%0.456SS..Hα-helixtrans-68.4-44176.1-74.40000112.2C17 C18 G24C17-C21 WeakPolarHBondContact O-CB 3.41Å; C17-C21 PolarHBondContact O-N 3.42Å; C17-C21 PolarHBondContact O-SG 3.08Å; C18-C21 PolarHBondContact O-N 3.13Å; C21-G24 PolarHBondContact O-N 3.34Å; C21-G24 VanDerWaalsContact O-N 3.17Å
22L61.8Low71.3Confident89 Ų8975 Ų7547%0.46642%0.422SS..Hα-helixtrans-64.8-44.2174.5-99.695000111.3C18 G24 I25 Y27C18-L22 WeakPolarHBondContact O-CB 3.23Å; C18-L22 WeakPolarHBondContact O-CD1 3.29Å; C18-L22 PolarHBondContact O-N 3.43Å; L22-G24 PolarHBondContact O-N 3Å; L22-I25 PolarHBondContact O-N 3.28Å; L22-Y27 VanDerWaalsContact O-CE2 3.27Å; L22-Y27 WeakPolarHBondContact O-CE2 2.79Å; L22-Y27 PolarHBondContact O-OH 2.96Å; L22-Y27 VanDerWaalsContact O-OH 3.05Å
23G60.7Low73.4Confident59 Ų5968.5 Ų68.561%0.60839%0.394SS*.Hα-helixtrans-64.4-16.7174.100000113.7I19I19-G23 PolarHBondContact O-N 3.17Å
24G63.7Low75.2Confident7 Ų771.7 Ų71.77%0.07240%0.401CS..THydrogen-bonded Turntrans-82.6-12.4176.300000115.4K20 C21 L22 S107K20-G24 PolarHBondContact O-N 2.91Å; C21-G24 PolarHBondContact O-N 3.34Å; C21-G24 VanDerWaalsContact O-N 3.17Å; L22-G24 PolarHBondContact O-N 3Å; G24-S107 WeakPolarHBondContact O-CB 3.4Å; G24-S107 PolarHBondContact O-OG 3.21Å
25I72.8Confident76.8Confident54 Ų5469.9 Ų69.928%0.27739%0.385SS..SBendtrans-77.1128.1-177.7-59.5173.9000109.2L22 Y27 L30 F104L22-I25 PolarHBondContact O-N 3.28Å; I25-Y27 HydrophobicContact CB-CD2 4.45Å; I25-Y27 HydrophobicContact CB-CE1 4.33Å; I25-Y27 HydrophobicContact CB-CE2 4.16Å; I25-Y27 HydrophobicContact CG2-CD1 4.26Å; I25-Y27 HydrophobicContact CG2-CE1 4.3Å; I25-Y27 HydrophobicContact CG2-CG 4.49Å; I25-Y27 WeakPolarHBondContact O-CD2 3.23Å; I25-Y27 PolarHBondContact O-N 2.69Å; I25-L30 HydrophobicContact CG2-CD1 4.19Å; I25-F104 HydrophobicContact CG2-CE1 4.49Å
26P83.1Confident78.6Confident12 Ų1264.5 Ų64.58%0.07836%0.357CS..  trans-7473.7172.434.2-36.8000109.4P28 S29 L30 F104P26-P28 VanDerWaalsContact C-N 3.26Å; P26-P28 VanDerWaalsContact O-N 3.15Å; P26-S29 PolarHBondContact O-N 2.97Å; P26-L30 PolarHBondContact O-N 2.03Å; P26-F104 HydrophobicContact CG-CD1 3.92Å; P26-F104 HydrophobicContact CG-CD2 4.15Å; P26-F104 HydrophobicContact CG-CE1 4.07Å; P26-F104 HydrophobicContact CG-CE2 4.28Å; P26-F104 HydrophobicContact CG-CG 3.95Å; P26-F104 HydrophobicContact CG-CZ 4.24Å
27Y84.5Confident80Confident106 Ų10661.3 Ų61.342%0.41634%0.339SS..Hα-helixtrans-48.3-41.1-179.6-66.1-78.2000113.6L22 I25 L30 I31L22-Y27 VanDerWaalsContact O-CE2 3.27Å; L22-Y27 WeakPolarHBondContact O-CE2 2.79Å; L22-Y27 PolarHBondContact O-OH 2.96Å; L22-Y27 VanDerWaalsContact O-OH 3.05Å; I25-Y27 HydrophobicContact CB-CD2 4.45Å; I25-Y27 HydrophobicContact CB-CE1 4.33Å; I25-Y27 HydrophobicContact CB-CE2 4.16Å; I25-Y27 HydrophobicContact CG2-CD1 4.26Å; I25-Y27 HydrophobicContact CG2-CE1 4.3Å; I25-Y27 HydrophobicContact CG2-CG 4.49Å; I25-Y27 WeakPolarHBondContact O-CD2 3.23Å; I25-Y27 PolarHBondContact O-N 2.69Å; Y27-L30 PolarHBondContact O-N 2.77Å; Y27-I31 VanDerWaalsContact O-CG1 3.31Å; Y27-I31 WeakPolarHBondContact O-CG1 3.37Å; Y27-I31 PolarHBondContact O-N 3.19Å
28P87.1Confident81.7Confident74 Ų7459.9 Ų59.948%0.48133%0.333SS..Hα-helixtrans-61.2-44.8175.6-25.537.2000113.5P26 A32 V234P26-P28 VanDerWaalsContact C-N 3.26Å; P26-P28 VanDerWaalsContact O-N 3.15Å; P28-A32 WeakPolarHBondContact O-CB 3.06Å; P28-A32 PolarHBondContact O-N 3.23Å; P28-V234 HydrophobicContact CB-CG2 3.41Å; P28-V234 VanDerWaalsContact CB-CG2 3.41Å
29S88.6Confident83.3Confident3 Ų356.7 Ų56.72%0.02131%0.311CS..Hα-helixtrans-67.4-36.8176.5-62.10000111.7P26 A32 T33 V234P26-S29 PolarHBondContact O-N 2.97Å; S29-A32 PolarHBondContact O-N 3.37Å; S29-T33 PolarHBondContact O-N 3.5Å; S29-T33 PolarHBondContact O-OG1 3.49Å; S29-V234 WeakPolarHBondContact OG-CG1 3.44Å
30L90.6Very high84.9Confident59 Ų5952 Ų5231%0.30929%0.288SS..Hα-helixtrans-64.8-46.8177.8-178.5136.1000111.4I25 P26 Y27 A32 T33 I34I25-L30 HydrophobicContact CG2-CD1 4.19Å; P26-L30 PolarHBondContact O-N 2.03Å; Y27-L30 PolarHBondContact O-N 2.77Å; L30-A32 VanDerWaalsContact C-N 3.32Å; L30-A32 PolarHBondContact O-N 3.23Å; L30-T33 WeakPolarHBondContact O-CB 3.46Å; L30-T33 PolarHBondContact O-N 3.13Å; L30-T33 VanDerWaalsContact O-N 3.15Å; L30-I34 HydrophobicContact CD2-CD1 3.72Å; L30-I34 HydrophobicContact CG-CD1 4.35Å; L30-I34 WeakPolarHBondContact O-CG1 3.2Å; L30-I34 PolarHBondContact O-N 3.01Å
31I92.3Very high86.4Confident100 Ų10047.2 Ų47.251%0.51328%0.279SS..Hα-helixtrans-60.7-44.1175.1-67.3166.4000110.3Y27 T33 I34 L35Y27-I31 VanDerWaalsContact O-CG1 3.31Å; Y27-I31 WeakPolarHBondContact O-CG1 3.37Å; Y27-I31 PolarHBondContact O-N 3.19Å; I31-T33 VanDerWaalsContact C-N 3.29Å; I31-T33 PolarHBondContact O-N 3.49Å; I31-I34 PolarHBondContact O-N 3.41Å; I31-L35 WeakPolarHBondContact O-CB 3.2Å; I31-L35 PolarHBondContact O-N 3.32Å
32A94.3Very high87.9Confident0 Ų047.2 Ų47.20%027%0.273CS..Hα-helixtrans-61.8-36.617600000112.3P28 S29 L30 L36 H230 Y231P28-A32 WeakPolarHBondContact O-CB 3.06Å; P28-A32 PolarHBondContact O-N 3.23Å; S29-A32 PolarHBondContact O-N 3.37Å; L30-A32 VanDerWaalsContact C-N 3.32Å; L30-A32 PolarHBondContact O-N 3.23Å; A32-L36 VanDerWaalsContact O-CB 3.25Å; A32-L36 WeakPolarHBondContact O-CB 3.28Å; A32-L36 PolarHBondContact O-N 3.46Å; A32-H230 HydrophobicContact CB-CB 3.9Å; A32-Y231 HydrophobicContact CB-CD1 4.02Å; A32-Y231 HydrophobicContact CB-CD2 3.83Å; A32-Y231 HydrophobicContact CB-CE1 3.92Å; A32-Y231 HydrophobicContact CB-CE2 3.73Å; A32-Y231 HydrophobicContact CB-CG 4Å
33T94.9Very high89.6Confident6 Ų643.9 Ų43.94%0.03726%0.255CS..Hα-helixtrans-64-48.5175.8-49.30000111.3S29 L30 I31 L35 L36 Y37 M100 Y231S29-T33 PolarHBondContact O-N 3.5Å; S29-T33 PolarHBondContact O-OG1 3.49Å; L30-T33 WeakPolarHBondContact O-CB 3.46Å; L30-T33 PolarHBondContact O-N 3.13Å; L30-T33 VanDerWaalsContact O-N 3.15Å; I31-T33 VanDerWaalsContact C-N 3.29Å; I31-T33 PolarHBondContact O-N 3.49Å; T33-L35 VanDerWaalsContact C-N 3.33Å; T33-L35 PolarHBondContact O-N 3.02Å; T33-L36 PolarHBondContact O-N 3.23Å; T33-Y37 HydrophobicContact CG2-CD2 4.04Å; T33-Y37 HydrophobicContact CG2-CE1 4.3Å; T33-Y37 HydrophobicContact CG2-CE2 3.58Å; T33-Y37 PolarHBondContact O-N 3.22Å; T33-M100 HydrophobicContact CG2-SD 4.24Å; T33-Y231 WeakPolarHBondContact CA-OH 3.27Å; T33-Y231 WeakPolarHBondContact CB-OH 3.21Å; T33-Y231 PolarHBondContact N-OH 3.14Å; T33-Y231 PolarHBondContact OG1-OH 3.05Å
34I95.8Very high91.4Very high105 Ų10541.5 Ų41.554%0.53823%0.229SC..Hα-helixtrans-61.3-45.8179.4-66.8167.5000109.9L30 I31 L36 Y37 A38L30-I34 HydrophobicContact CD2-CD1 3.72Å; L30-I34 HydrophobicContact CG-CD1 4.35Å; L30-I34 WeakPolarHBondContact O-CG1 3.2Å; L30-I34 PolarHBondContact O-N 3.01Å; I31-I34 PolarHBondContact O-N 3.41Å; I34-L36 PolarHBondContact O-N 3.49Å; I34-Y37 PolarHBondContact O-N 3.43Å; I34-A38 VanDerWaalsContact O-CB 3.29Å; I34-A38 WeakPolarHBondContact O-CB 3.25Å; I34-A38 PolarHBondContact O-N 3.48Å
35L96Very high92.9Very high56 Ų5643 Ų4329%0.29324%0.244SC..Hα-helixtrans-64.7-40179-170.664.1000111.9I31 T33 G39 A223 I226 A227I31-L35 WeakPolarHBondContact O-CB 3.2Å; I31-L35 PolarHBondContact O-N 3.32Å; T33-L35 VanDerWaalsContact C-N 3.33Å; T33-L35 PolarHBondContact O-N 3.02Å; L35-G39 PolarHBondContact O-N 3.37Å; L35-A223 HydrophobicContact CD1-CB 4.31Å; L35-I226 HydrophobicContact CD2-CB 4.2Å; L35-I226 HydrophobicContact CD2-CG2 3.73Å; L35-A227 HydrophobicContact CB-CB 4.08Å; L35-A227 HydrophobicContact CD2-CB 4.19Å; L35-A227 HydrophobicContact CG-CB 4.05Å
36L97.3Very high94Very high0 Ų041.4 Ų41.40%024%0.238CC..Hα-helixtrans-60.8-50.3175.117864.2000110.7A32 T33 I34 G39 V40 F92 A227 M228 Y231A32-L36 VanDerWaalsContact O-CB 3.25Å; A32-L36 WeakPolarHBondContact O-CB 3.28Å; A32-L36 PolarHBondContact O-N 3.46Å; T33-L36 PolarHBondContact O-N 3.23Å; I34-L36 PolarHBondContact O-N 3.49Å; L36-G39 PolarHBondContact O-N 3Å; L36-V40 HydrophobicContact CD1-CG2 3.89Å; L36-V40 HydrophobicContact CG-CG2 4.36Å; L36-V40 WeakPolarHBondContact O-CB 3.06Å; L36-V40 VanDerWaalsContact O-CG2 3.22Å; L36-V40 WeakPolarHBondContact O-CG2 3.38Å; L36-V40 PolarHBondContact O-N 2.98Å; L36-F92 HydrophobicContact CD1-CD1 4.33Å; L36-A227 HydrophobicContact CB-CB 3.78Å; L36-A227 HydrophobicContact CD1-CB 4.38Å; L36-M228 HydrophobicContact CD1-CE 3.63Å; L36-M228 HydrophobicContact CD2-CE 4.48Å; L36-Y231 HydrophobicContact CB-CE2 4.19Å; L36-Y231 HydrophobicContact CD2-CE2 3.93Å
37Y97.1Very high94.6Very high63 Ų6341 Ų4125%0.24724%0.236CC..Hα-helixtrans-66.6-41.6-178.8-68.7-11.3000112.3T33 I34 A41 F93 G96 I97T33-Y37 HydrophobicContact CG2-CD2 4.04Å; T33-Y37 HydrophobicContact CG2-CE1 4.3Å; T33-Y37 HydrophobicContact CG2-CE2 3.58Å; T33-Y37 PolarHBondContact O-N 3.22Å; I34-Y37 PolarHBondContact O-N 3.43Å; Y37-A41 WeakPolarHBondContact O-CB 3.49Å; Y37-A41 PolarHBondContact O-N 3.22Å; Y37-F93 HydrophobicContact CE1-CD2 4.32Å; Y37-F93 HydrophobicContact CE2-CD2 4.36Å; Y37-F93 HydrophobicContact CE2-CE2 4.35Å; Y37-F93 PolarHBondContact OH-O 3.38Å; Y37-G96 VanDerWaalsContact OH-C 3.26Å; Y37-I97 WeakPolarHBondContact OH-CG1 3.49Å; Y37-I97 PolarHBondContact OH-N 3.15Å
38A97.6Very high95.1Very high46 Ų4637.6 Ų37.638%0.3822%0.224SC..Hα-helixtrans-60.3-46.7174.100000111.2I34 A41 L42I34-A38 VanDerWaalsContact O-CB 3.29Å; I34-A38 WeakPolarHBondContact O-CB 3.25Å; I34-A38 PolarHBondContact O-N 3.48Å; A38-A41 PolarHBondContact O-N 3.3Å; A38-L42 WeakPolarHBondContact O-CB 3.44Å; A38-L42 VanDerWaalsContact O-CG 3.28Å; A38-L42 WeakPolarHBondContact O-CG 3.37Å; A38-L42 PolarHBondContact O-N 3.38Å
39G97.5Very high95.5Very high0 Ų038.9 Ų38.90%022%0.223CC..Hα-helixtrans-63-49.2179.200000113L35 L36 L42 F43 G220L35-G39 PolarHBondContact O-N 3.37Å; L36-G39 PolarHBondContact O-N 3Å; G39-L42 PolarHBondContact O-N 3.18Å; G39-F43 WeakPolarHBondContact O-CB 3.47Å; G39-F43 PolarHBondContact O-N 2.98Å; G39-G220 CarbonylContact C-O 3.59Å; G39-G220 VanDerWaalsContact CA-O 3.27Å; G39-G220 WeakPolarHBondContact CA-O 3.33Å; G39-G220 CarbonylContact O-C 3.36Å; G39-G220 WeakPolarHBondContact O-CA 3.34Å
40V97.6Very high95.7Very high8 Ų838.8 Ų38.85%0.04822%0.222CC..Hα-helixtrans-64.2-42.8178.3174.90000111.1L36 F43 C44 F92 W141 A224L36-V40 HydrophobicContact CD1-CG2 3.89Å; L36-V40 HydrophobicContact CG-CG2 4.36Å; L36-V40 WeakPolarHBondContact O-CB 3.06Å; L36-V40 VanDerWaalsContact O-CG2 3.22Å; L36-V40 WeakPolarHBondContact O-CG2 3.38Å; L36-V40 PolarHBondContact O-N 2.98Å; V40-F43 PolarHBondContact O-N 3.35Å; V40-C44 VanDerWaalsContact O-CB 3.24Å; V40-C44 WeakPolarHBondContact O-CB 3.17Å; V40-C44 PolarHBondContact O-N 3Å; V40-C44 PolarHBondContact O-SG 3.29Å; V40-F92 HydrophobicContact CG1-CB 4.15Å; V40-F92 HydrophobicContact CG2-CB 3.98Å; V40-F92 HydrophobicContact CG2-CG 4.25Å; V40-W141 HydrophobicContact CG2-CH2 4.07Å; V40-W141 HydrophobicContact CG2-CZ2 3.7Å; V40-A224 HydrophobicContact CG2-CB 4.41Å
41A97.1Very high95.7Very high64 Ų6436.9 Ų36.953%0.52921%0.212SC..Hα-helixtrans-64.7-42.3178.100000112Y37 A38 G45Y37-A41 WeakPolarHBondContact O-CB 3.49Å; Y37-A41 PolarHBondContact O-N 3.22Å; A38-A41 PolarHBondContact O-N 3.3Å; A41-G45 WeakPolarHBondContact O-CA 3.38Å; A41-G45 PolarHBondContact O-N 3.14Å
42L96.8Very high95.7Very high81 Ų8133.4 Ų33.442%0.42420%0.197SC..Hα-helixtrans-63.4-47.8174.5-77172.6000111.5A38 G39 C44 C46A38-L42 WeakPolarHBondContact O-CB 3.44Å; A38-L42 VanDerWaalsContact O-CG 3.28Å; A38-L42 WeakPolarHBondContact O-CG 3.37Å; A38-L42 PolarHBondContact O-N 3.38Å; G39-L42 PolarHBondContact O-N 3.18Å; L42-C44 PolarHBondContact O-N 3.38Å; L42-C46 WeakPolarHBondContact O-CB 3.4Å; L42-C46 PolarHBondContact O-N 2.93Å; L42-C46 PolarHBondContact O-SG 2.78Å; L42-C46 VanDerWaalsContact O-SG 3.4Å
43F97.5Very high95.4Very high18 Ų1834 Ų348%0.07920%0.203CC..Hα-helixtrans-58.6-49.8177.7175.4-102.8000111.7G39 V40 G47 W141 V144 T148 S217 A221G39-F43 WeakPolarHBondContact O-CB 3.47Å; G39-F43 PolarHBondContact O-N 2.98Å; V40-F43 PolarHBondContact O-N 3.35Å; F43-G47 VanDerWaalsContact O-CA 3.26Å; F43-G47 WeakPolarHBondContact O-CA 3.47Å; F43-G47 PolarHBondContact O-N 2.91Å; F43-W141 HydrophobicContact CB-CH2 4.38Å; F43-W141 HydrophobicContact CB-CZ3 4.21Å; F43-W141 AromaticContact CD1-CH2 3.69Å; F43-W141 HydrophobicContact CD1-CH2 3.69Å; F43-W141 AromaticContact CD1-CZ3 3.74Å; F43-W141 HydrophobicContact CD1-CZ3 3.74Å; F43-W141 HydrophobicContact CD2-CZ3 4.37Å; F43-W141 HydrophobicContact CE1-CH2 4.28Å; F43-W141 HydrophobicContact CE1-CZ3 4.21Å; F43-W141 HydrophobicContact CG-CH2 4.13Å; F43-W141 AromaticContact CG-CZ3 3.82Å; F43-W141 HydrophobicContact CG-CZ3 3.82Å; F43-V144 HydrophobicContact CD2-CG1 4.35Å; F43-V144 HydrophobicContact CE1-CG1 4.08Å; F43-V144 HydrophobicContact CE2-CG1 3.53Å; F43-V144 HydrophobicContact CZ-CG1 3.36Å; F43-T148 HydrophobicContact CE2-CG2 4.27Å; F43-T148 WeakPolarHBondContact CE2-OG1 3.47Å; F43-S217 WeakPolarHBondContact CD2-O 3.4Å; F43-S217 WeakPolarHBondContact CD2-OG 3.45Å; F43-S217 PolarHBondContact O-OG 3.29Å; F43-A221 HydrophobicContact CD2-CB 3.8Å; F43-A221 HydrophobicContact CE2-CB 4.3Å; F43-A221 HydrophobicContact CG-CB 4.46Å
44C96.8Very high95Very high9 Ų934.5 Ų34.56%0.06121%0.206CC..Hα-helixtrans-71.7-46.7-175.7-63.90000112.1V40 L42 H48 I85 A89V40-C44 VanDerWaalsContact O-CB 3.24Å; V40-C44 WeakPolarHBondContact O-CB 3.17Å; V40-C44 PolarHBondContact O-N 3Å; V40-C44 PolarHBondContact O-SG 3.29Å; L42-C44 PolarHBondContact O-N 3.38Å; C44-H48 VanDerWaalsContact O-CB 3.22Å; C44-H48 WeakPolarHBondContact O-CB 3.38Å; C44-H48 PolarHBondContact O-N 2.97Å; C44-I85 HydrophobicContact CB-CG2 3.49Å; C44-I85 VanDerWaalsContact CB-CG2 3.49Å; C44-I85 WeakPolarHBondContact O-CG2 3.33Å; C44-A89 HydrophobicContact CB-CB 4.32Å
45G96Very high94.6Very high39 Ų3930 Ų3040%0.40218%0.184SC..Hα-helixtrans-67.3-55.9-179.500000111.8A41 G47 H48 E49A41-G45 WeakPolarHBondContact O-CA 3.38Å; A41-G45 PolarHBondContact O-N 3.14Å; G45-G47 VanDerWaalsContact C-N 3.32Å; G45-G47 PolarHBondContact O-N 2.99Å; G45-H48 PolarHBondContact O-N 3.08Å; G45-E49 PolarHBondContact O-N 2.81Å; G45-E49 VanDerWaalsContact O-N 3.14Å
46C96.1Very high94.2Very high20 Ų2029.5 Ų29.514%0.13518%0.183CC..Hα-helixtrans-66.8-35.8179.8-57.30000111.6L42 A50 L213 C216L42-C46 WeakPolarHBondContact O-CB 3.4Å; L42-C46 PolarHBondContact O-N 2.93Å; L42-C46 PolarHBondContact O-SG 2.78Å; L42-C46 VanDerWaalsContact O-SG 3.4Å; C46-A50 WeakPolarHBondContact O-CB 3.29Å; C46-A50 PolarHBondContact O-N 2.79Å; C46-L213 HydrophobicContact CB-CB 4.48Å; C46-L213 HydrophobicContact CB-CD2 4.04Å; C46-L213 WeakPolarHBondContact CB-O 3.31Å; C46-C216 HydrophobicContact CB-CB 4.02Å
47G94.7Very high93.6Very high4 Ų429.7 Ų29.74%0.04118%0.184CC..Hα-helixtrans-62.9-43.7174.900000112.6F43 G45 A50 L51F43-G47 VanDerWaalsContact O-CA 3.26Å; F43-G47 WeakPolarHBondContact O-CA 3.47Å; F43-G47 PolarHBondContact O-N 2.91Å; G45-G47 VanDerWaalsContact C-N 3.32Å; G45-G47 PolarHBondContact O-N 2.99Å; G47-A50 PolarHBondContact O-N 3.05Å; G47-L51 WeakPolarHBondContact O-CB 3.35Å; G47-L51 VanDerWaalsContact O-CD1 3.3Å; G47-L51 WeakPolarHBondContact O-CD1 3.41Å; G47-L51 VanDerWaalsContact O-CG 3.26Å; G47-L51 WeakPolarHBondContact O-CG 3.37Å; G47-L51 PolarHBondContact O-N 3.06Å
48H95.3Very high92.9Very high35 Ų3527.1 Ų27.116%0.16218%0.175CC..Hα-helixtrans-61.6-47177.5177.2-89.6000112.3C44 G45 L51 S52 Y86C44-H48 VanDerWaalsContact O-CB 3.22Å; C44-H48 WeakPolarHBondContact O-CB 3.38Å; C44-H48 PolarHBondContact O-N 2.97Å; G45-H48 PolarHBondContact O-N 3.08Å; H48-L51 PolarHBondContact O-N 3.38Å; H48-S52 PolarHBondContact O-N 3.34Å; H48-S52 PolarHBondContact O-OG 3.06Å; H48-Y86 AromaticContact CD2-CZ 3.78Å; H48-Y86 PolarHBondContact CD2-OH 3.37Å; H48-Y86 VanDerWaalsContact CD2-OH 3.23Å; H48-Y86 AromaticContact NE2-CZ 3.93Å; H48-Y86 PolarHBondContact NE2-OH 2.99Å
49E94.9Very high92.2Very high101 Ų10128.5 Ų28.547%0.47217%0.173SC..Hα-helixtrans-67.6-40.5178.3-65.7-50118.900111.5G45 L51 S52 G53 L213G45-E49 PolarHBondContact O-N 2.81Å; G45-E49 VanDerWaalsContact O-N 3.14Å; E49-L51 PolarHBondContact O-N 3.38Å; E49-S52 WeakPolarHBondContact O-CB 3.48Å; E49-S52 PolarHBondContact O-N 3.48Å; E49-G53 PolarHBondContact O-N 3.09Å; E49-L213 HydrophobicContact CB-CD1 3.79Å; E49-L213 HydrophobicContact CB-CD2 4.17Å
50A93.3Very high91.4Very high0 Ų033.1 Ų33.10%020%0.198CC..Hα-helixtrans-60.4-46.5175.800000111.9C46 G47 S52 G53 T54 T210 L213 F214C46-A50 WeakPolarHBondContact O-CB 3.29Å; C46-A50 PolarHBondContact O-N 2.79Å; G47-A50 PolarHBondContact O-N 3.05Å; A50-S52 VanDerWaalsContact C-N 3.29Å; A50-S52 PolarHBondContact O-N 3.06Å; A50-G53 PolarHBondContact O-N 3.24Å; A50-T54 PolarHBondContact O-N 2.95Å; A50-T54 PolarHBondContact O-OG1 2.91Å; A50-T54 VanDerWaalsContact O-OG1 3.08Å; A50-T210 HydrophobicContact CB-CG2 4.48Å; A50-L213 HydrophobicContact CB-CB 3.8Å; A50-F214 HydrophobicContact CB-CD1 3.9Å; A50-F214 HydrophobicContact CB-CD2 3.8Å; A50-F214 HydrophobicContact CB-CE1 3.83Å; A50-F214 HydrophobicContact CB-CE2 3.72Å; A50-F214 HydrophobicContact CB-CG 3.87Å; A50-F214 HydrophobicContact CB-CZ 3.74Å
51L91.8Very high90.6Very high19 Ų1934.5 Ų34.510%0.09920%0.202CC..Hα-helixtrans-61.2-38175.9-77.2158.9000111.8G47 H48 E49 T54 V55 I78 I81 K82 I85G47-L51 WeakPolarHBondContact O-CB 3.35Å; G47-L51 VanDerWaalsContact O-CD1 3.3Å; G47-L51 WeakPolarHBondContact O-CD1 3.41Å; G47-L51 VanDerWaalsContact O-CG 3.26Å; G47-L51 WeakPolarHBondContact O-CG 3.37Å; G47-L51 PolarHBondContact O-N 3.06Å; H48-L51 PolarHBondContact O-N 3.38Å; E49-L51 PolarHBondContact O-N 3.38Å; L51-T54 PolarHBondContact O-N 3.23Å; L51-V55 WeakPolarHBondContact O-CG2 3.25Å; L51-V55 PolarHBondContact O-N 3.39Å; L51-I78 HydrophobicContact CB-CG2 4Å; L51-I78 HydrophobicContact CD2-CB 4.48Å; L51-I78 HydrophobicContact CD2-CG1 4.17Å; L51-I78 HydrophobicContact CD2-CG2 4.01Å; L51-I81 HydrophobicContact CD1-CB 4.29Å; L51-I81 HydrophobicContact CD1-CG2 3.55Å; L51-I81 HydrophobicContact CD2-CG2 4.31Å; L51-K82 HydrophobicContact CB-CG 4.33Å; L51-K82 HydrophobicContact CD1-CG 4.16Å; L51-I85 HydrophobicContact CD1-CD1 3.56Å
52S91.4Very high89.5Confident27 Ų2732.3 Ų32.319%0.18918%0.181CC..Hα-helixtrans-65.7-42.7174.3-58.20000111.8H48 E49 A50 T54 V55 T56 K82H48-S52 PolarHBondContact O-N 3.34Å; H48-S52 PolarHBondContact O-OG 3.06Å; E49-S52 WeakPolarHBondContact O-CB 3.48Å; E49-S52 PolarHBondContact O-N 3.48Å; A50-S52 VanDerWaalsContact C-N 3.29Å; A50-S52 PolarHBondContact O-N 3.06Å; S52-T54 VanDerWaalsContact C-N 3.35Å; S52-T54 PolarHBondContact O-N 3.31Å; S52-V55 WeakPolarHBondContact O-CB 3.06Å; S52-V55 PolarHBondContact O-N 3.04Å; S52-T56 PolarHBondContact O-N 3.17Å; S52-T56 VanDerWaalsContact O-N 3.13Å; S52-T56 PolarHBondContact O-OG1 3Å; S52-K82 VanDerWaalsContact OG-CE 3.27Å; S52-K82 WeakPolarHBondContact OG-CE 3.43Å; S52-K82 PolarHBondContact OG-NZ 2.86Å
53G88.3Confident88.4Confident13 Ų1333.1 Ų33.113%0.13418%0.183CC..Hα-helixtrans-60.6-41.3173.100000112.6E49 A50 V55 T56 I57E49-G53 PolarHBondContact O-N 3.09Å; A50-G53 PolarHBondContact O-N 3.24Å; G53-V55 VanDerWaalsContact C-N 3.32Å; G53-V55 PolarHBondContact O-N 3.18Å; G53-T56 PolarHBondContact O-N 3.47Å; G53-I57 VanDerWaalsContact O-CG1 3.32Å; G53-I57 WeakPolarHBondContact O-CG1 3.33Å; G53-I57 PolarHBondContact O-N 3.25Å
54T87.1Confident87.2Confident16 Ų1632.6 Ų32.610%0.09818%0.181CC..Hα-helixtrans-58.1-42.8174.2-57.40000111.9A50 L51 S52 I57 L58 I78 Y155A50-T54 PolarHBondContact O-N 2.95Å; A50-T54 PolarHBondContact O-OG1 2.91Å; A50-T54 VanDerWaalsContact O-OG1 3.08Å; L51-T54 PolarHBondContact O-N 3.23Å; S52-T54 VanDerWaalsContact C-N 3.35Å; S52-T54 PolarHBondContact O-N 3.31Å; T54-I57 PolarHBondContact O-N 3.44Å; T54-L58 HydrophobicContact CG2-CD1 3.71Å; T54-L58 WeakPolarHBondContact O-CD1 3.45Å; T54-L58 PolarHBondContact O-N 3.29Å; T54-I78 HydrophobicContact CG2-CD1 4.2Å; T54-Y155 WeakPolarHBondContact CA-OH 3.38Å; T54-Y155 WeakPolarHBondContact CB-OH 3.22Å; T54-Y155 PolarHBondContact OG1-OH 3.03Å
55V87Confident85.9Confident10 Ų1036.8 Ų36.86%0.06121%0.206CC..Hα-helixtrans-60.1-48.7175.3171.40000110.9L51 S52 G53 I57 L58 Q59 F75 I78L51-V55 WeakPolarHBondContact O-CG2 3.25Å; L51-V55 PolarHBondContact O-N 3.39Å; S52-V55 WeakPolarHBondContact O-CB 3.06Å; S52-V55 PolarHBondContact O-N 3.04Å; G53-V55 VanDerWaalsContact C-N 3.32Å; G53-V55 PolarHBondContact O-N 3.18Å; V55-I57 VanDerWaalsContact C-N 3.3Å; V55-I57 PolarHBondContact O-N 3.5Å; V55-L58 PolarHBondContact O-N 2.86Å; V55-Q59 HydrophobicContact CG1-CG 4.42Å; V55-Q59 WeakPolarHBondContact O-CG 3.5Å; V55-Q59 PolarHBondContact O-N 3.16Å; V55-F75 HydrophobicContact CG1-CD1 3.96Å; V55-F75 HydrophobicContact CG1-CE1 3.95Å; V55-F75 HydrophobicContact CG2-CD1 4.16Å; V55-I78 HydrophobicContact CG2-CB 4.34Å; V55-I78 HydrophobicContact CG2-CD1 3.74Å; V55-I78 HydrophobicContact CG2-CG2 3.74Å
56T86.6Confident84.5Confident46 Ų4640.5 Ų40.528%0.28221%0.208SC..Hα-helixtrans-58.9-43178.9-54.20000111.5S52 G53 Q59 N60 E206S52-T56 PolarHBondContact O-N 3.17Å; S52-T56 VanDerWaalsContact O-N 3.13Å; S52-T56 PolarHBondContact O-OG1 3Å; G53-T56 PolarHBondContact O-N 3.47Å; T56-Q59 PolarHBondContact O-N 2.66Å; T56-N60 VanDerWaalsContact CG2-ND2 3.25Å; T56-N60 WeakPolarHBondContact CG2-ND2 3.43Å; T56-N60 VanDerWaalsContact O-CB 3.29Å; T56-N60 WeakPolarHBondContact O-CB 3.35Å; T56-N60 PolarHBondContact O-N 3.22Å; T56-E206 WeakPolarHBondContact CG2-OE2 3.41Å
57I85.1Confident82.9Confident5 Ų541 Ų413%0.02622%0.217CC..Hα-helixtrans-64.8-45.6179.4-68163.8000111.4G53 T54 V55 Q59 Y61 F62 Y155 M201 L207 T210G53-I57 VanDerWaalsContact O-CG1 3.32Å; G53-I57 WeakPolarHBondContact O-CG1 3.33Å; G53-I57 PolarHBondContact O-N 3.25Å; T54-I57 PolarHBondContact O-N 3.44Å; V55-I57 VanDerWaalsContact C-N 3.3Å; V55-I57 PolarHBondContact O-N 3.5Å; I57-Q59 VanDerWaalsContact C-N 3.31Å; I57-Q59 PolarHBondContact O-N 2.93Å; I57-Y61 HydrophobicContact CB-CD2 4.42Å; I57-Y61 HydrophobicContact CG2-CD2 4.16Å; I57-Y61 WeakPolarHBondContact O-CB 3.41Å; I57-Y61 PolarHBondContact O-N 3.34Å; I57-F62 HydrophobicContact CG2-CD2 4.35Å; I57-F62 HydrophobicContact CG2-CE2 4.23Å; I57-Y155 HydrophobicContact CD1-CE1 4.04Å; I57-M201 HydrophobicContact CG2-SD 4.4Å; I57-L207 HydrophobicContact CD1-CD1 4.03Å; I57-T210 HydrophobicContact CD1-CG2 4.46Å
58L81.6Confident81.2Confident9 Ų945.7 Ų45.75%0.04725%0.247CC..Hα-helixtrans-61-40.6178.1-97.477.9000111.9T54 V55 F62 E63 V64 V74 F75 I182T54-L58 HydrophobicContact CG2-CD1 3.71Å; T54-L58 WeakPolarHBondContact O-CD1 3.45Å; T54-L58 PolarHBondContact O-N 3.29Å; V55-L58 PolarHBondContact O-N 2.86Å; L58-F62 CarbonylContact O-C 3.4Å; L58-F62 WeakPolarHBondContact O-CB 3.36Å; L58-F62 PolarHBondContact O-N 2.66Å; L58-E63 PolarHBondContact O-N 3.25Å; L58-E63 VanDerWaalsContact O-N 3.13Å; L58-V64 HydrophobicContact CB-CB 4.45Å; L58-V64 HydrophobicContact CB-CG2 4.46Å; L58-V64 HydrophobicContact CD2-CG2 4.46Å; L58-V64 HydrophobicContact CG-CG2 4.42Å; L58-V64 PolarHBondContact O-N 3.33Å; L58-V74 HydrophobicContact CD2-CG1 4.14Å; L58-F75 HydrophobicContact CB-CE1 4.17Å; L58-F75 HydrophobicContact CB-CZ 4.17Å; L58-F75 HydrophobicContact CD2-CE1 4.47Å; L58-F75 HydrophobicContact CD2-CZ 4.41Å; L58-I182 HydrophobicContact CD1-CG2 4.22Å; L58-I182 HydrophobicContact CD2-CG2 3.81Å; L58-I182 HydrophobicContact CG-CG2 4.41Å
59Q82.8Confident79.3Confident75 Ų7550.5 Ų50.535%0.3528%0.278SS..Hα-helixtrans-74.7-43-178.8-67.2-172.4-74.800112.3V55 T56 I57 E63 F75V55-Q59 HydrophobicContact CG1-CG 4.42Å; V55-Q59 WeakPolarHBondContact O-CG 3.5Å; V55-Q59 PolarHBondContact O-N 3.16Å; T56-Q59 PolarHBondContact O-N 2.66Å; I57-Q59 VanDerWaalsContact C-N 3.31Å; I57-Q59 PolarHBondContact O-N 2.93Å; Q59-E63 WeakPolarHBondContact O-CA 3.47Å; Q59-F75 HydrophobicContact CG-CE1 3.74Å; Q59-F75 HydrophobicContact CG-CZ 3.77Å
60N82.7Confident77.3Confident96 Ų9653.8 Ų53.851%0.51330%0.299SS..Hα-helixtrans-83.9-35.5-172-71.4-18.1000113.5T56T56-N60 VanDerWaalsContact CG2-ND2 3.25Å; T56-N60 WeakPolarHBondContact CG2-ND2 3.43Å; T56-N60 VanDerWaalsContact O-CB 3.29Å; T56-N60 WeakPolarHBondContact O-CB 3.35Å; T56-N60 PolarHBondContact O-N 3.22Å
61Y78.9Confident75.6Confident37 Ų3756.3 Ų56.315%0.14532%0.317CS..THydrogen-bonded Turntrans-106.8-40.1-172.6-62.1-79.1000113.1I57 K200 M201 S204I57-Y61 HydrophobicContact CB-CD2 4.42Å; I57-Y61 HydrophobicContact CG2-CD2 4.16Å; I57-Y61 WeakPolarHBondContact O-CB 3.41Å; I57-Y61 PolarHBondContact O-N 3.34Å; Y61-K200 HydrophobicContact CE1-CB 4.13Å; Y61-K200 PolarHBondContact OH-O 3.12Å; Y61-M201 HydrophobicContact CD1-CB 3.53Å; Y61-M201 HydrophobicContact CD1-CG 4.07Å; Y61-M201 HydrophobicContact CD2-CB 4.46Å; Y61-M201 HydrophobicContact CD2-CG 4.13Å; Y61-M201 VanDerWaalsContact CE1-CA 3.45Å; Y61-M201 HydrophobicContact CE1-CB 3.77Å; Y61-M201 HydrophobicContact CE1-CG 4.4Å; Y61-M201 HydrophobicContact CE2-CG 4.48Å; Y61-M201 HydrophobicContact CG-CB 3.91Å; Y61-M201 HydrophobicContact CG-CG 3.9Å; Y61-M201 HydrophobicContact CG-SD 4.35Å; Y61-S204 WeakPolarHBondContact OH-CB 3.38Å
62F75.7Confident74.2Confident18 Ų1863.3 Ų63.38%0.07935%0.353CS..SBendtrans-91.9-3.7176.5-66.7-88.9000112.5I57 L58 V64 L175 P177 K189 V191 M201I57-F62 HydrophobicContact CG2-CD2 4.35Å; I57-F62 HydrophobicContact CG2-CE2 4.23Å; L58-F62 CarbonylContact O-C 3.4Å; L58-F62 WeakPolarHBondContact O-CB 3.36Å; L58-F62 PolarHBondContact O-N 2.66Å; F62-V64 HydrophobicContact CB-CG2 3.74Å; F62-V64 PolarHBondContact O-N 3.23Å; F62-L175 HydrophobicContact CE1-CB 4.33Å; F62-L175 HydrophobicContact CZ-CB 4.34Å; F62-P177 HydrophobicContact CD1-CG 3.8Å; F62-P177 HydrophobicContact CE1-CG 4.17Å; F62-K189 VanDerWaalsContact O-CB 3.3Å; F62-K189 WeakPolarHBondContact O-CB 3.46Å; F62-K189 WeakPolarHBondContact O-CD 3.46Å; F62-V191 HydrophobicContact CD1-CB 4.39Å; F62-V191 HydrophobicContact CD1-CG2 3.54Å; F62-V191 HydrophobicContact CE1-CB 3.87Å; F62-V191 HydrophobicContact CE1-CG2 3.51Å; F62-V191 HydrophobicContact CG-CG2 4.14Å; F62-V191 HydrophobicContact CZ-CB 4.3Å; F62-V191 HydrophobicContact CZ-CG2 4.08Å; F62-M201 HydrophobicContact CE2-SD 3.83Å; F62-M201 HydrophobicContact CZ-SD 4.25Å
63E73Confident73.4Confident99 Ų9962.8 Ų62.846%0.46335%0.348SS..  trans52.124.3-178.7-65.7178.1158.500113.5L58 Q59 V65 K189 K197L58-E63 PolarHBondContact O-N 3.25Å; L58-E63 VanDerWaalsContact O-N 3.13Å; Q59-E63 WeakPolarHBondContact O-CA 3.47Å; E63-V65 PolarHBondContact O-N 3.47Å; E63-V65 VanDerWaalsContact O-N 3.16Å; E63-K189 HydrophobicContact CB-CD 4.17Å; E63-K189 PolarHBondContact O-NZ 3.18Å; E63-K197 IonicContact OE1-NZ 3.66Å; E63-K197 PolarHBondContact OE1-NZ 3.45Å; E63-K197 IonicContact OE2-NZ 3.2Å; E63-K197 PolarHBondContact OE2-NZ 3.4Å
64V72.4Confident72.9Confident6 Ų663 Ų634%0.03635%0.347CS..PPolyproline II helixtrans-67.4119-179.1-170.50000107.8L58 F62 F75 V183L58-V64 HydrophobicContact CB-CB 4.45Å; L58-V64 HydrophobicContact CB-CG2 4.46Å; L58-V64 HydrophobicContact CD2-CG2 4.46Å; L58-V64 HydrophobicContact CG-CG2 4.42Å; L58-V64 PolarHBondContact O-N 3.33Å; F62-V64 HydrophobicContact CB-CG2 3.74Å; F62-V64 PolarHBondContact O-N 3.23Å; V64-F75 HydrophobicContact CB-CE2 4.17Å; V64-F75 HydrophobicContact CB-CZ 4.03Å; V64-F75 HydrophobicContact CG1-CE2 3.72Å; V64-F75 HydrophobicContact CG1-CZ 4.07Å; V64-F75 WeakPolarHBondContact O-CZ 3.3Å; V64-V183 HydrophobicContact CG1-CG2 4.36Å; V64-V183 HydrophobicContact CG2-CG2 4.13Å
65V68.6Low72.6Confident98 Ų9862.3 Ų62.359%0.59434%0.343SS*.PPolyproline II helixtrans-92.3139-179.4-178.30000107.7E63 G67E63-V65 PolarHBondContact O-N 3.47Å; E63-V65 VanDerWaalsContact O-N 3.16Å; V65-G67 PolarHBondContact O-N 3.22Å; V65-G67 VanDerWaalsContact O-N 3.11Å
66R67.5Low72.4Confident116 Ų11664.8 Ų64.844%0.43836%0.358SS..PPolyproline II helixtrans-57.2117.9173.2-80.8-174.1171.486.7-4.3109.5F75R66-F75 HydrophobicContact CB-CD2 4.24Å; R66-F75 HydrophobicContact CG-CB 3.93Å; R66-F75 HydrophobicContact CG-CD1 4.32Å; R66-F75 HydrophobicContact CG-CD2 3.49Å; R66-F75 VanDerWaalsContact CG-CD2 3.49Å; R66-F75 HydrophobicContact CG-CE2 4Å; R66-F75 HydrophobicContact CG-CG 3.65Å
67G62.7Low72.3Confident31 Ų3166.7 Ų66.732%0.3236%0.364SS..PPolyproline II helixtrans-64.9164171.700000112.3V65 D73V65-G67 PolarHBondContact O-N 3.22Å; V65-G67 VanDerWaalsContact O-N 3.11Å; G67-D73 PolarHBondContact N-OD2 3.08Å; G67-D73 VanDerWaalsContact N-OD2 3.13Å
68P59.1Low72.4Confident103 Ų10366.8 Ų66.867%0.66937%0.365SS*.PPolyproline II helixtrans-58.4146.1171.123.2-30.2000111D70 S71P68-D70 PolarHBondContact O-N 2.88Å; P68-S71 PolarHBondContact O-N 3.45Å; P68-S71 PolarHBondContact O-OG 2.95Å
69V55.7Low72.7Confident135 Ų13569.1 Ų69.182%0.81838%0.377SS*.THydrogen-bonded Turntrans-50.6-22-169.9178.50000114.6S71V69-S71 VanDerWaalsContact C-N 3.33Å; V69-S71 PolarHBondContact O-N 3.24Å
70D51.7Low73.1Confident170 Ų17070.4 Ų70.491%0.90939%0.385SS*.THydrogen-bonded Turntrans-81.2-4.8-178.5-65.1-36.2000114.8P68P68-D70 PolarHBondContact O-N 2.88Å
71S57.8Low73.4Confident54 Ų5469.1 Ų69.138%0.37838%0.378SS..SBendtrans-104.9136.6176.859.70000111.7P68 V69 D73P68-S71 PolarHBondContact O-N 3.45Å; P68-S71 PolarHBondContact O-OG 2.95Å; V69-S71 VanDerWaalsContact C-N 3.33Å; V69-S71 PolarHBondContact O-N 3.24Å; S71-D73 PolarHBondContact O-N 2.92Å
72L63.3Low74.1Confident166 Ų16668.8 Ų68.887%0.86938%0.377SS*.  trans-76.669.5-179.4-141.5145.8000109.4
73D73.4Confident74.9Confident16 Ų1676.2 Ų76.29%0.08641%0.406CS..  trans-86.9158.9-176.3-164.713.1000111.3G67 S71 F75 T76 M77G67-D73 PolarHBondContact N-OD2 3.08Å; G67-D73 VanDerWaalsContact N-OD2 3.13Å; S71-D73 PolarHBondContact O-N 2.92Å; D73-F75 VanDerWaalsContact C-N 3.27Å; D73-F75 PolarHBondContact O-N 2.85Å; D73-F75 WeakPolarHBondContact OD2-CD2 3.35Å; D73-T76 WeakPolarHBondContact O-CB 3.49Å; D73-T76 PolarHBondContact O-N 2.04Å; D73-T76 VanDerWaalsContact O-N 3.08Å; D73-M77 PolarHBondContact O-N 2.97Å; D73-M77 VanDerWaalsContact O-N 3.17Å
74V77.3Confident75.9Confident17 Ų1775.3 Ų75.310%0.10341%0.407CS..Hα-helixtrans-68.3-25.9-172.21610000113.4L58 M77 I78 I182L58-V74 HydrophobicContact CD2-CG1 4.14Å; V74-M77 HydrophobicContact CG1-CE 4.28Å; V74-M77 HydrophobicContact CG2-CE 4.08Å; V74-M77 PolarHBondContact O-N 3.22Å; V74-I78 HydrophobicContact CG1-CD1 3.91Å; V74-I78 HydrophobicContact CG1-CG1 4.36Å; V74-I78 VanDerWaalsContact O-CG1 3.29Å; V74-I78 WeakPolarHBondContact O-CG1 3.32Å; V74-I78 PolarHBondContact O-N 2.96Å; V74-I182 VanDerWaalsContact CB-O 3.23Å; V74-I182 WeakPolarHBondContact CB-O 3.26Å; V74-I182 HydrophobicContact CG1-CG2 4.1Å; V74-I182 WeakPolarHBondContact CG2-O 3.32Å
75F81.9Confident77Confident2 Ų275.3 Ų75.31%0.00941%0.407CS..Hα-helixtrans-63.2-42.7170.8-60.2-69.6000112.2V55 L58 Q59 V64 R66 D73 M77 I78 D79V55-F75 HydrophobicContact CG1-CD1 3.96Å; V55-F75 HydrophobicContact CG1-CE1 3.95Å; V55-F75 HydrophobicContact CG2-CD1 4.16Å; L58-F75 HydrophobicContact CB-CE1 4.17Å; L58-F75 HydrophobicContact CB-CZ 4.17Å; L58-F75 HydrophobicContact CD2-CE1 4.47Å; L58-F75 HydrophobicContact CD2-CZ 4.41Å; Q59-F75 HydrophobicContact CG-CE1 3.74Å; Q59-F75 HydrophobicContact CG-CZ 3.77Å; V64-F75 HydrophobicContact CB-CE2 4.17Å; V64-F75 HydrophobicContact CB-CZ 4.03Å; V64-F75 HydrophobicContact CG1-CE2 3.72Å; V64-F75 HydrophobicContact CG1-CZ 4.07Å; V64-F75 WeakPolarHBondContact O-CZ 3.3Å; R66-F75 HydrophobicContact CB-CD2 4.24Å; R66-F75 HydrophobicContact CG-CB 3.93Å; R66-F75 HydrophobicContact CG-CD1 4.32Å; R66-F75 HydrophobicContact CG-CD2 3.49Å; R66-F75 VanDerWaalsContact CG-CD2 3.49Å; R66-F75 HydrophobicContact CG-CE2 4Å; R66-F75 HydrophobicContact CG-CG 3.65Å; D73-F75 VanDerWaalsContact C-N 3.27Å; D73-F75 PolarHBondContact O-N 2.85Å; D73-F75 WeakPolarHBondContact OD2-CD2 3.35Å; F75-M77 VanDerWaalsContact C-N 3.33Å; F75-M77 PolarHBondContact O-N 3.43Å; F75-I78 PolarHBondContact O-N 2.87Å; F75-D79 PolarHBondContact O-N 3.4Å
76T83.5Confident78.2Confident61 Ų6176.7 Ų76.737%0.37440%0.402SS..Hα-helixtrans-64-40.5176.2-51.50000110.9D73 D79 I80D73-T76 WeakPolarHBondContact O-CB 3.49Å; D73-T76 PolarHBondContact O-N 2.04Å; D73-T76 VanDerWaalsContact O-N 3.08Å; T76-D79 PolarHBondContact O-N 3.06Å; T76-I80 HydrophobicContact CG2-CD1 4.23Å; T76-I80 VanDerWaalsContact O-CG1 3.27Å; T76-I80 WeakPolarHBondContact O-CG1 3.04Å; T76-I80 PolarHBondContact O-N 3.21Å
77M83.4Confident79.5Confident87 Ų8773 Ų7343%0.42940%0.4SS..Hα-helixtrans-62.4-44.2175.3-174.5-179.866.500111.8D73 V74 F75 D79 I80 I81D73-M77 PolarHBondContact O-N 2.97Å; D73-M77 VanDerWaalsContact O-N 3.17Å; V74-M77 HydrophobicContact CG1-CE 4.28Å; V74-M77 HydrophobicContact CG2-CE 4.08Å; V74-M77 PolarHBondContact O-N 3.22Å; F75-M77 VanDerWaalsContact C-N 3.33Å; F75-M77 PolarHBondContact O-N 3.43Å; M77-D79 VanDerWaalsContact C-N 3.34Å; M77-D79 PolarHBondContact O-N 3.06Å; M77-I80 PolarHBondContact O-N 3.4Å; M77-I81 HydrophobicContact CG-CD1 4.15Å; M77-I81 VanDerWaalsContact O-CG1 3.31Å; M77-I81 WeakPolarHBondContact O-CG1 3.49Å; M77-I81 PolarHBondContact O-N 3.31Å
78I87.3Confident81Confident6 Ų673.2 Ų73.23%0.03139%0.394CS..Hα-helixtrans-60.9-44.1176.8-71.7166.8000110.9L51 T54 V55 V74 F75 I80 I81 K82L51-I78 HydrophobicContact CB-CG2 4Å; L51-I78 HydrophobicContact CD2-CB 4.48Å; L51-I78 HydrophobicContact CD2-CG1 4.17Å; L51-I78 HydrophobicContact CD2-CG2 4.01Å; T54-I78 HydrophobicContact CG2-CD1 4.2Å; V55-I78 HydrophobicContact CG2-CB 4.34Å; V55-I78 HydrophobicContact CG2-CD1 3.74Å; V55-I78 HydrophobicContact CG2-CG2 3.74Å; V74-I78 HydrophobicContact CG1-CD1 3.91Å; V74-I78 HydrophobicContact CG1-CG1 4.36Å; V74-I78 VanDerWaalsContact O-CG1 3.29Å; V74-I78 WeakPolarHBondContact O-CG1 3.32Å; V74-I78 PolarHBondContact O-N 2.96Å; F75-I78 PolarHBondContact O-N 2.87Å; I78-I80 PolarHBondContact O-N 2.81Å; I78-I81 PolarHBondContact O-N 2.69Å; I78-K82 HydrophobicContact CG2-CD 4.38Å; I78-K82 WeakPolarHBondContact O-CG 3.48Å; I78-K82 PolarHBondContact O-N 3.36Å
79D88.2Confident82.7Confident59 Ų5970 Ų7032%0.31638%0.376SS..Hα-helixtrans-63.4-41.8178.3-70.6-24.3000111.4F75 T76 M77 I81 K82 Y83F75-D79 PolarHBondContact O-N 3.4Å; T76-D79 PolarHBondContact O-N 3.06Å; M77-D79 VanDerWaalsContact C-N 3.34Å; M77-D79 PolarHBondContact O-N 3.06Å; D79-I81 VanDerWaalsContact C-N 3.34Å; D79-I81 PolarHBondContact O-N 3.4Å; D79-K82 WeakPolarHBondContact O-CB 3.02Å; D79-K82 PolarHBondContact O-N 3.2Å; D79-Y83 WeakPolarHBondContact O-CD2 3.39Å; D79-Y83 PolarHBondContact O-N 3.42Å
80I90.1Very high84.6Confident101 Ų10167.1 Ų67.152%0.51836%0.362SS..Hα-helixtrans-58.3-46.2173.5-68.6165000110.9T76 M77 I78 K82 Y83 V84T76-I80 HydrophobicContact CG2-CD1 4.23Å; T76-I80 VanDerWaalsContact O-CG1 3.27Å; T76-I80 WeakPolarHBondContact O-CG1 3.04Å; T76-I80 PolarHBondContact O-N 3.21Å; M77-I80 PolarHBondContact O-N 3.4Å; I78-I80 PolarHBondContact O-N 2.81Å; I80-K82 VanDerWaalsContact C-N 3.31Å; I80-K82 PolarHBondContact O-N 2.96Å; I80-Y83 PolarHBondContact O-N 3.42Å; I80-V84 WeakPolarHBondContact O-CG2 3.48Å; I80-V84 PolarHBondContact O-N 3.14Å
81I91Very high86.7Confident69 Ų6961.8 Ų61.835%0.35434%0.341SS..Hα-helixtrans-61.8-40.5179.2-65.9166.4000110.7L51 M77 I78 D79 Y83 V84 I85L51-I81 HydrophobicContact CD1-CB 4.29Å; L51-I81 HydrophobicContact CD1-CG2 3.55Å; L51-I81 HydrophobicContact CD2-CG2 4.31Å; M77-I81 HydrophobicContact CG-CD1 4.15Å; M77-I81 VanDerWaalsContact O-CG1 3.31Å; M77-I81 WeakPolarHBondContact O-CG1 3.49Å; M77-I81 PolarHBondContact O-N 3.31Å; I78-I81 PolarHBondContact O-N 2.69Å; D79-I81 VanDerWaalsContact C-N 3.34Å; D79-I81 PolarHBondContact O-N 3.4Å; I81-Y83 PolarHBondContact O-N 3.45Å; I81-V84 PolarHBondContact O-N 3.37Å; I81-I85 HydrophobicContact CG2-CD1 4.17Å; I81-I85 WeakPolarHBondContact O-CG1 3.44Å; I81-I85 PolarHBondContact O-N 2.91Å
82K92.2Very high88.6Confident31 Ų3160 Ų6014%0.13533%0.326CS..Hα-helixtrans-61.3-43.3175.6-72.2176.7171.5-175.70112.4L51 S52 I78 D79 I80 V84 I85 Y86L51-K82 HydrophobicContact CB-CG 4.33Å; L51-K82 HydrophobicContact CD1-CG 4.16Å; S52-K82 VanDerWaalsContact OG-CE 3.27Å; S52-K82 WeakPolarHBondContact OG-CE 3.43Å; S52-K82 PolarHBondContact OG-NZ 2.86Å; I78-K82 HydrophobicContact CG2-CD 4.38Å; I78-K82 WeakPolarHBondContact O-CG 3.48Å; I78-K82 PolarHBondContact O-N 3.36Å; D79-K82 WeakPolarHBondContact O-CB 3.02Å; D79-K82 PolarHBondContact O-N 3.2Å; I80-K82 VanDerWaalsContact C-N 3.31Å; I80-K82 PolarHBondContact O-N 2.96Å; K82-V84 VanDerWaalsContact C-N 3.32Å; K82-V84 PolarHBondContact O-N 3.31Å; K82-I85 WeakPolarHBondContact O-CB 3.47Å; K82-I85 PolarHBondContact O-N 2.97Å; K82-Y86 WeakPolarHBondContact O-CD2 3.24Å; K82-Y86 PolarHBondContact O-N 3.13Å
83Y93.3Very high90.1Very high173 Ų17357.6 Ų57.668%0.67831%0.309SS*.Hα-helixtrans-62.5-40.2175.1-74.6-65.1000112.3D79 I80 I81 I85 Y86 G87D79-Y83 WeakPolarHBondContact O-CD2 3.39Å; D79-Y83 PolarHBondContact O-N 3.42Å; I80-Y83 PolarHBondContact O-N 3.42Å; I81-Y83 PolarHBondContact O-N 3.45Å; Y83-I85 VanDerWaalsContact C-N 3.32Å; Y83-I85 PolarHBondContact O-N 2.85Å; Y83-Y86 PolarHBondContact O-N 3.32Å; Y83-G87 PolarHBondContact O-N 2.95Å
84V94.3Very high91.2Very high80 Ų8060.9 Ų60.949%0.48533%0.33SS..Hα-helixtrans-61.7-41.1175.1172.10000111I80 I81 K82 Y86 G87 I88I80-V84 WeakPolarHBondContact O-CG2 3.48Å; I80-V84 PolarHBondContact O-N 3.14Å; I81-V84 PolarHBondContact O-N 3.37Å; K82-V84 VanDerWaalsContact C-N 3.32Å; K82-V84 PolarHBondContact O-N 3.31Å; V84-Y86 VanDerWaalsContact C-N 3.34Å; V84-Y86 PolarHBondContact O-N 3.47Å; V84-G87 WeakPolarHBondContact O-CA 3.15Å; V84-G87 PolarHBondContact O-N 2.96Å; V84-G87 VanDerWaalsContact O-N 3.12Å; V84-I88 HydrophobicContact CG1-CD1 3.78Å; V84-I88 HydrophobicContact CG1-CG1 4.23Å; V84-I88 WeakPolarHBondContact O-CG1 3.46Å; V84-I88 PolarHBondContact O-N 3.42Å
85I94.6Very high92Very high7 Ų760.7 Ų60.74%0.03633%0.327CS..Hα-helixtrans-57.7-44.1176.9-75.1170.1000111.8C44 L51 I81 K82 Y83 G87 I88 A89C44-I85 HydrophobicContact CB-CG2 3.49Å; C44-I85 VanDerWaalsContact CB-CG2 3.49Å; C44-I85 WeakPolarHBondContact O-CG2 3.33Å; L51-I85 HydrophobicContact CD1-CD1 3.56Å; I81-I85 HydrophobicContact CG2-CD1 4.17Å; I81-I85 WeakPolarHBondContact O-CG1 3.44Å; I81-I85 PolarHBondContact O-N 2.91Å; K82-I85 WeakPolarHBondContact O-CB 3.47Å; K82-I85 PolarHBondContact O-N 2.97Å; Y83-I85 VanDerWaalsContact C-N 3.32Å; Y83-I85 PolarHBondContact O-N 2.85Å; I85-G87 VanDerWaalsContact C-N 3.32Å; I85-G87 PolarHBondContact O-N 3.28Å; I85-I88 PolarHBondContact O-N 3.09Å; I85-A89 PolarHBondContact O-N 2.89Å
86Y93.6Very high92.6Very high126 Ų12660.6 Ų60.649%0.49433%0.327SS..Hα-helixtrans-64.7-37176.4-60.4-43.3000112.8H48 K82 Y83 V84 S90H48-Y86 AromaticContact CD2-CZ 3.78Å; H48-Y86 PolarHBondContact CD2-OH 3.37Å; H48-Y86 VanDerWaalsContact CD2-OH 3.23Å; H48-Y86 AromaticContact NE2-CZ 3.93Å; H48-Y86 PolarHBondContact NE2-OH 2.99Å; K82-Y86 WeakPolarHBondContact O-CD2 3.24Å; K82-Y86 PolarHBondContact O-N 3.13Å; Y83-Y86 PolarHBondContact O-N 3.32Å; V84-Y86 VanDerWaalsContact C-N 3.34Å; V84-Y86 PolarHBondContact O-N 3.47Å; Y86-S90 PolarHBondContact O-N 3.01Å; Y86-S90 PolarHBondContact O-OG 3.49Å; Y86-S90 VanDerWaalsContact O-OG 3.06Å
87G95.1Very high93.1Very high38 Ų3861.1 Ų61.139%0.39233%0.326SS..Hα-helixtrans-62.8-44.7172.900000112.5Y83 V84 I85 S90 A91Y83-G87 PolarHBondContact O-N 2.95Å; V84-G87 WeakPolarHBondContact O-CA 3.15Å; V84-G87 PolarHBondContact O-N 2.96Å; V84-G87 VanDerWaalsContact O-N 3.12Å; I85-G87 VanDerWaalsContact C-N 3.32Å; I85-G87 PolarHBondContact O-N 3.28Å; G87-S90 PolarHBondContact O-OG 2.67Å; G87-S90 VanDerWaalsContact O-OG 3.06Å; G87-A91 VanDerWaalsContact O-CB 3.26Å; G87-A91 WeakPolarHBondContact O-CB 3.43Å; G87-A91 PolarHBondContact O-N 3.47Å
88I95Very high93.5Very high37 Ų3761 Ų6119%0.1933%0.327CS..Hα-helixtrans-61.6-47.7177-68.6170.9000110.4V84 I85 S90 A91 F92 W141V84-I88 HydrophobicContact CG1-CD1 3.78Å; V84-I88 HydrophobicContact CG1-CG1 4.23Å; V84-I88 WeakPolarHBondContact O-CG1 3.46Å; V84-I88 PolarHBondContact O-N 3.42Å; I85-I88 PolarHBondContact O-N 3.09Å; I88-S90 PolarHBondContact O-N 3.39Å; I88-A91 PolarHBondContact O-N 3.4Å; I88-F92 HydrophobicContact CG2-CD2 3.67Å; I88-F92 HydrophobicContact CG2-CE2 4.05Å; I88-F92 WeakPolarHBondContact O-CB 3.46Å; I88-F92 WeakPolarHBondContact O-CD2 3.2Å; I88-F92 PolarHBondContact O-N 3.16Å; I88-W141 HydrophobicContact CG2-CH2 3.96Å; I88-W141 HydrophobicContact CG2-CZ2 3.79Å
89A95.1Very high93.7Very high36 Ų3660.8 Ų60.830%0.29833%0.326SS..Hα-helixtrans-57.1-48.5-178.600000112.2C44 I85 F93C44-A89 HydrophobicContact CB-CB 4.32Å; I85-A89 PolarHBondContact O-N 2.89Å; A89-F93 WeakPolarHBondContact O-CB 3.14Å; A89-F93 PolarHBondContact O-N 3.39Å; A89-F93 VanDerWaalsContact O-N 3.1Å
90S95.5Very high93.7Very high73 Ų7360.8 Ų60.851%0.5133%0.325SS..Hα-helixtrans-69.3-42.7179.855.30000112.9Y86 G87 I88 F93 V94Y86-S90 PolarHBondContact O-N 3.01Å; Y86-S90 PolarHBondContact O-OG 3.49Å; Y86-S90 VanDerWaalsContact O-OG 3.06Å; G87-S90 PolarHBondContact O-OG 2.67Å; G87-S90 VanDerWaalsContact O-OG 3.06Å; I88-S90 PolarHBondContact O-N 3.39Å; S90-F93 PolarHBondContact O-N 3Å; S90-V94 PolarHBondContact O-N 3.43Å
91A95.6Very high93.6Very high58 Ų5858.8 Ų58.848%0.47932%0.317SS..Hα-helixtrans-63.1-45.7178.900000112.2G87 I88 F93 V94 Y95G87-A91 VanDerWaalsContact O-CB 3.26Å; G87-A91 WeakPolarHBondContact O-CB 3.43Å; G87-A91 PolarHBondContact O-N 3.47Å; I88-A91 PolarHBondContact O-N 3.4Å; A91-F93 VanDerWaalsContact C-N 3.35Å; A91-V94 PolarHBondContact O-N 3.22Å; A91-Y95 WeakPolarHBondContact O-CB 3.49Å; A91-Y95 PolarHBondContact O-N 3.47Å
92F96.2Very high93.3Very high16 Ų1656 Ų567%0.0730%0.303CS..Hα-helixtrans-74.2-24.8-180-82.4-76.5000113.5L36 V40 I88 Y95 G96 F137 W141 M228L36-F92 HydrophobicContact CD1-CD1 4.33Å; V40-F92 HydrophobicContact CG1-CB 4.15Å; V40-F92 HydrophobicContact CG2-CB 3.98Å; V40-F92 HydrophobicContact CG2-CG 4.25Å; I88-F92 HydrophobicContact CG2-CD2 3.67Å; I88-F92 HydrophobicContact CG2-CE2 4.05Å; I88-F92 WeakPolarHBondContact O-CB 3.46Å; I88-F92 WeakPolarHBondContact O-CD2 3.2Å; I88-F92 PolarHBondContact O-N 3.16Å; F92-Y95 HydrophobicContact CD1-CD1 4.06Å; F92-Y95 HydrophobicContact CE1-CD1 4.11Å; F92-G96 PolarHBondContact O-N 2.87Å; F92-F137 HydrophobicContact CE1-CB 4.18Å; F92-F137 HydrophobicContact CE1-CD1 4.35Å; F92-F137 HydrophobicContact CE1-CD2 4.1Å; F92-F137 AromaticContact CE1-CG 3.98Å; F92-F137 HydrophobicContact CE1-CG 3.98Å; F92-F137 HydrophobicContact CZ-CB 4.2Å; F92-F137 AromaticContact CZ-CD1 3.8Å; F92-F137 HydrophobicContact CZ-CD1 3.8Å; F92-F137 HydrophobicContact CZ-CD2 4.35Å; F92-F137 HydrophobicContact CZ-CE1 4.21Å; F92-F137 AromaticContact CZ-CG 3.88Å; F92-F137 HydrophobicContact CZ-CG 3.88Å; F92-W141 AromaticContact CD1-NE1 3.94Å; F92-W141 AromaticContact CD2-CZ2 3.93Å; F92-W141 HydrophobicContact CD2-CZ2 3.93Å; F92-W141 AromaticContact CE1-NE1 3.34Å; F92-W141 VanDerWaalsContact CE1-NE1 3.34Å; F92-W141 AromaticContact CE2-CE2 3.93Å; F92-W141 AromaticContact CE2-CZ2 3.89Å; F92-W141 HydrophobicContact CE2-CZ2 3.89Å; F92-W141 AromaticContact CE2-NE1 3.46Å; F92-W141 HydrophobicContact CG-CZ2 4.39Å; F92-W141 AromaticContact CZ-CD1 3.87Å; F92-W141 AromaticContact CZ-CE2 3.97Å; F92-W141 HydrophobicContact CZ-CZ2 4.37Å; F92-W141 AromaticContact CZ-NE1 3.05Å; F92-M228 HydrophobicContact CD1-CE 3.63Å; F92-M228 HydrophobicContact CE1-CE 3.19Å; F92-M228 HydrophobicContact CZ-CE 4.23Å
93F94.9Very high92.9Very high117 Ų11754.5 Ų54.551%0.51330%0.297SS..Hα-helixtrans-62.4-51.6169.1-178.1-103.1000111Y37 A89 S90 A91 Y95 G96 I97Y37-F93 HydrophobicContact CE1-CD2 4.32Å; Y37-F93 HydrophobicContact CE2-CD2 4.36Å; Y37-F93 HydrophobicContact CE2-CE2 4.35Å; Y37-F93 PolarHBondContact OH-O 3.38Å; A89-F93 WeakPolarHBondContact O-CB 3.14Å; A89-F93 PolarHBondContact O-N 3.39Å; A89-F93 VanDerWaalsContact O-N 3.1Å; S90-F93 PolarHBondContact O-N 3Å; A91-F93 VanDerWaalsContact C-N 3.35Å; F93-Y95 VanDerWaalsContact C-N 3.31Å; F93-Y95 PolarHBondContact O-N 2.92Å; F93-G96 PolarHBondContact O-N 3.49Å; F93-I97 HydrophobicContact CD1-CD1 4.24Å; F93-I97 HydrophobicContact CE1-CD1 3.78Å; F93-I97 HydrophobicContact CZ-CD1 4.09Å; F93-I97 WeakPolarHBondContact O-CG1 3.26Å; F93-I97 PolarHBondContact O-N 3.41Å
94V96.3Very high92.2Very high84 Ų8449.2 Ų49.251%0.50928%0.277SS..Hα-helixtrans-62.6-42.2176.5178.20000110.8S90 A91 G96 I97 L98S90-V94 PolarHBondContact O-N 3.43Å; A91-V94 PolarHBondContact O-N 3.22Å; V94-G96 PolarHBondContact O-N 2.83Å; V94-I97 PolarHBondContact O-N 3.3Å; V94-L98 HydrophobicContact CG1-CD1 4.38Å; V94-L98 WeakPolarHBondContact O-CG 3.38Å; V94-L98 PolarHBondContact O-N 3.06Å; V94-L98 VanDerWaalsContact O-N 3.07Å
95Y95.2Very high91.2Very high13 Ų1350.9 Ų50.95%0.05128%0.278CS..Hα-helixtrans-62.5-41.6179.8-171.4-120.7000113.1A91 F92 F93 I97 L98 L99 F130 L133 T134 F137 M228A91-Y95 WeakPolarHBondContact O-CB 3.49Å; A91-Y95 PolarHBondContact O-N 3.47Å; F92-Y95 HydrophobicContact CD1-CD1 4.06Å; F92-Y95 HydrophobicContact CE1-CD1 4.11Å; F93-Y95 VanDerWaalsContact C-N 3.31Å; F93-Y95 PolarHBondContact O-N 2.92Å; Y95-I97 VanDerWaalsContact C-N 3.31Å; Y95-I97 PolarHBondContact O-N 2.92Å; Y95-L98 PolarHBondContact O-N 3.46Å; Y95-L99 HydrophobicContact CD1-CD1 3.86Å; Y95-L99 HydrophobicContact CD1-CG 4.37Å; Y95-L99 HydrophobicContact CE1-CD1 3.35Å; Y95-L99 HydrophobicContact CE1-CD2 4.49Å; Y95-L99 HydrophobicContact CE1-CG 3.96Å; Y95-L99 HydrophobicContact CE2-CD1 4.41Å; Y95-L99 HydrophobicContact CE2-CD2 4.28Å; Y95-L99 HydrophobicContact CE2-CG 4.12Å; Y95-L99 WeakPolarHBondContact O-CG 3.29Å; Y95-L99 PolarHBondContact O-N 2.93Å; Y95-F130 HydrophobicContact CE2-CD1 4.25Å; Y95-F130 HydrophobicContact CE2-CE1 4.4Å; Y95-L133 HydrophobicContact CD2-CD2 4.1Å; Y95-L133 HydrophobicContact CE2-CD2 3.35Å; Y95-T134 WeakPolarHBondContact OH-CA 3.26Å; Y95-T134 PolarHBondContact OH-N 2.97Å; Y95-T134 PolarHBondContact OH-OG1 3.25Å; Y95-F137 HydrophobicContact CD1-CD2 4.05Å; Y95-F137 HydrophobicContact CD1-CE2 4.15Å; Y95-F137 HydrophobicContact CD2-CE2 4.26Å; Y95-F137 AromaticContact CE1-CD2 3.59Å; Y95-F137 HydrophobicContact CE1-CD2 3.59Å; Y95-F137 AromaticContact CE1-CE2 3.98Å; Y95-F137 HydrophobicContact CE1-CE2 3.98Å; Y95-F137 HydrophobicContact CE2-CD2 4.46Å; Y95-F137 HydrophobicContact CE2-CE2 4.15Å; Y95-F137 HydrophobicContact CG-CE2 4.27Å; Y95-F137 AromaticContact CZ-CD2 3.82Å; Y95-F137 AromaticContact CZ-CE2 3.98Å; Y95-M228 HydrophobicContact CD1-CE 4.35Å; Y95-M228 HydrophobicContact CE1-CE 4.24Å; Y95-M228 HydrophobicContact CE1-SD 4.37Å
96G94.1Very high89.9Confident0 Ų051 Ų510%028%0.279CS..Hα-helixtrans-61.3-38.5175.200000112.6Y37 F92 F93 V94 L99 M100Y37-G96 VanDerWaalsContact OH-C 3.26Å; F92-G96 PolarHBondContact O-N 2.87Å; F93-G96 PolarHBondContact O-N 3.49Å; V94-G96 PolarHBondContact O-N 2.83Å; G96-L99 PolarHBondContact O-N 3.42Å; G96-M100 VanDerWaalsContact O-CB 3.3Å; G96-M100 WeakPolarHBondContact O-CB 3.29Å; G96-M100 PolarHBondContact O-N 3.5Å
97I93.6Very high88.8Confident72 Ų7246 Ų4637%0.36926%0.262SS..Hα-helixtrans-62.3-46.5174.1-63.2175000110.3Y37 F93 V94 Y95 L99 M100 V101Y37-I97 WeakPolarHBondContact OH-CG1 3.49Å; Y37-I97 PolarHBondContact OH-N 3.15Å; F93-I97 HydrophobicContact CD1-CD1 4.24Å; F93-I97 HydrophobicContact CE1-CD1 3.78Å; F93-I97 HydrophobicContact CZ-CD1 4.09Å; F93-I97 WeakPolarHBondContact O-CG1 3.26Å; F93-I97 PolarHBondContact O-N 3.41Å; V94-I97 PolarHBondContact O-N 3.3Å; Y95-I97 VanDerWaalsContact C-N 3.31Å; Y95-I97 PolarHBondContact O-N 2.92Å; I97-L99 VanDerWaalsContact C-N 3.34Å; I97-L99 PolarHBondContact O-N 3.41Å; I97-M100 PolarHBondContact O-N 3.23Å; I97-V101 HydrophobicContact CG2-CG2 4.29Å; I97-V101 WeakPolarHBondContact O-CB 3.4Å; I97-V101 VanDerWaalsContact O-CG2 3.27Å; I97-V101 WeakPolarHBondContact O-CG2 3.37Å; I97-V101 PolarHBondContact O-N 2.95Å
98L92.4Very high86.9Confident85 Ų8546.4 Ų46.445%0.44527%0.267SS..Hα-helixtrans-59.7-44.3179.2-66.6174.5000111.8V94 Y95 V101 E102 F130V94-L98 HydrophobicContact CG1-CD1 4.38Å; V94-L98 WeakPolarHBondContact O-CG 3.38Å; V94-L98 PolarHBondContact O-N 3.06Å; V94-L98 VanDerWaalsContact O-N 3.07Å; Y95-L98 PolarHBondContact O-N 3.46Å; L98-V101 PolarHBondContact O-N 3.18Å; L98-E102 PolarHBondContact O-N 3.39Å; L98-F130 HydrophobicContact CB-CE1 4.1Å; L98-F130 HydrophobicContact CB-CZ 4.35Å
99L91.6Very high84.8Confident1 Ų146.9 Ų46.91%0.00528%0.277CS..Hα-helixtrans-67.7-37.6176.9-71.1-178.8000112.8Y95 G96 I97 E102 G103 F130 Y231 L235Y95-L99 HydrophobicContact CD1-CD1 3.86Å; Y95-L99 HydrophobicContact CD1-CG 4.37Å; Y95-L99 HydrophobicContact CE1-CD1 3.35Å; Y95-L99 HydrophobicContact CE1-CD2 4.49Å; Y95-L99 HydrophobicContact CE1-CG 3.96Å; Y95-L99 HydrophobicContact CE2-CD1 4.41Å; Y95-L99 HydrophobicContact CE2-CD2 4.28Å; Y95-L99 HydrophobicContact CE2-CG 4.12Å; Y95-L99 WeakPolarHBondContact O-CG 3.29Å; Y95-L99 PolarHBondContact O-N 2.93Å; G96-L99 PolarHBondContact O-N 3.42Å; I97-L99 VanDerWaalsContact C-N 3.34Å; I97-L99 PolarHBondContact O-N 3.41Å; L99-E102 PolarHBondContact O-N 2.84Å; L99-G103 PolarHBondContact O-N 3.32Å; L99-F130 HydrophobicContact CD2-CD1 4.01Å; L99-Y231 HydrophobicContact CB-CD1 4.02Å; L99-Y231 HydrophobicContact CB-CE1 3.56Å; L99-Y231 HydrophobicContact CD1-CD1 3.93Å; L99-Y231 HydrophobicContact CD1-CD2 3.79Å; L99-Y231 HydrophobicContact CD1-CE1 4.03Å; L99-Y231 HydrophobicContact CD1-CE2 3.89Å; L99-Y231 HydrophobicContact CD1-CG 3.78Å; L99-Y231 HydrophobicContact CG-CD1 4.48Å; L99-Y231 HydrophobicContact CG-CE1 4.42Å; L99-L235 HydrophobicContact CD2-CD1 4.04Å
100M89Confident82.8Confident60 Ų6047.8 Ų47.830%0.29628%0.276SS..Hα-helixtrans-63.7-45175.5-170.3175.484.300110.7T33 G96 I97 E102 G103 F104T33-M100 HydrophobicContact CG2-SD 4.24Å; G96-M100 VanDerWaalsContact O-CB 3.3Å; G96-M100 WeakPolarHBondContact O-CB 3.29Å; G96-M100 PolarHBondContact O-N 3.5Å; I97-M100 PolarHBondContact O-N 3.23Å; M100-E102 VanDerWaalsContact C-N 3.34Å; M100-E102 PolarHBondContact O-N 3.06Å; M100-G103 WeakPolarHBondContact O-CA 3.35Å; M100-G103 PolarHBondContact O-N 3.4Å; M100-G103 VanDerWaalsContact O-N 3.1Å; M100-F104 HydrophobicContact CE-CE2 4.08Å; M100-F104 HydrophobicContact CG-CD2 4.03Å; M100-F104 HydrophobicContact CG-CE2 3.71Å; M100-F104 VanDerWaalsContact O-CD2 3.23Å; M100-F104 WeakPolarHBondContact O-CD2 3.29Å; M100-F104 PolarHBondContact O-N 3.03Å; M100-F104 HydrophobicContact SD-CE2 4.19Å
101V86.8Confident80.9Confident59 Ų5947.4 Ų47.436%0.35827%0.265SS..Hα-helixtrans-60.4-42.1175.3167.80000111.2I97 L98 G103 F104 F105I97-V101 HydrophobicContact CG2-CG2 4.29Å; I97-V101 WeakPolarHBondContact O-CB 3.4Å; I97-V101 VanDerWaalsContact O-CG2 3.27Å; I97-V101 WeakPolarHBondContact O-CG2 3.37Å; I97-V101 PolarHBondContact O-N 2.95Å; L98-V101 PolarHBondContact O-N 3.18Å; V101-G103 VanDerWaalsContact C-N 3.3Å; V101-G103 PolarHBondContact O-N 3.39Å; V101-F104 PolarHBondContact O-N 3.34Å; V101-F105 HydrophobicContact CG1-CD2 3.56Å; V101-F105 HydrophobicContact CG1-CE2 3.19Å; V101-F105 HydrophobicContact CG1-CZ 4.14Å; V101-F105 WeakPolarHBondContact O-CD2 3.48Å; V101-F105 PolarHBondContact O-N 3.48Å
102E84.4Confident78.8Confident9 Ų952.4 Ų52.44%0.04228%0.284CS..Hα-helixtrans-61.7-38.2173.6-175.5176.7-172.600112.4L98 L99 M100 F105 T106 K118 S127 F130 L235L98-E102 PolarHBondContact O-N 3.39Å; L99-E102 PolarHBondContact O-N 2.84Å; M100-E102 VanDerWaalsContact C-N 3.34Å; M100-E102 PolarHBondContact O-N 3.06Å; E102-F105 PolarHBondContact O-N 3.01Å; E102-T106 PolarHBondContact O-N 3.17Å; E102-T106 PolarHBondContact O-OG1 3.05Å; E102-K118 IonicContact OE1-NZ 3.59Å; E102-S127 WeakPolarHBondContact OE1-CB 3.44Å; E102-S127 PolarHBondContact OE1-OG 3.39Å; E102-F130 WeakPolarHBondContact OE2-CB 3.08Å; E102-F130 VanDerWaalsContact OE2-CD2 3.23Å; E102-F130 WeakPolarHBondContact OE2-CD2 3.33Å; E102-F130 WeakPolarHBondContact OE2-CG 3.14Å; E102-L235 HydrophobicContact CG-CD2 4.1Å; E102-L235 WeakPolarHBondContact OE2-CD2 3.12Å
103G83.5Confident76.6Confident1 Ų158.5 Ų58.51%0.0132%0.316CS..Hα-helixtrans-58.6-47.117300000112L99 M100 V101 T106 S107L99-G103 PolarHBondContact O-N 3.32Å; M100-G103 WeakPolarHBondContact O-CA 3.35Å; M100-G103 PolarHBondContact O-N 3.4Å; M100-G103 VanDerWaalsContact O-N 3.1Å; V101-G103 VanDerWaalsContact C-N 3.3Å; V101-G103 PolarHBondContact O-N 3.39Å; G103-T106 PolarHBondContact O-N 2.75Å; G103-S107 PolarHBondContact O-N 3.33Å
104F79.7Confident74.5Confident62 Ų6261.1 Ų61.127%0.27232%0.324SS..Hα-helixtrans-64-43.9178.5-82.3-72.8000112.2I25 P26 M100 V101 T106 S107 I110I25-F104 HydrophobicContact CG2-CE1 4.49Å; P26-F104 HydrophobicContact CG-CD1 3.92Å; P26-F104 HydrophobicContact CG-CD2 4.15Å; P26-F104 HydrophobicContact CG-CE1 4.07Å; P26-F104 HydrophobicContact CG-CE2 4.28Å; P26-F104 HydrophobicContact CG-CG 3.95Å; P26-F104 HydrophobicContact CG-CZ 4.24Å; M100-F104 HydrophobicContact CE-CE2 4.08Å; M100-F104 HydrophobicContact CG-CD2 4.03Å; M100-F104 HydrophobicContact CG-CE2 3.71Å; M100-F104 VanDerWaalsContact O-CD2 3.23Å; M100-F104 WeakPolarHBondContact O-CD2 3.29Å; M100-F104 PolarHBondContact O-N 3.03Å; M100-F104 HydrophobicContact SD-CE2 4.19Å; V101-F104 PolarHBondContact O-N 3.34Å; F104-T106 PolarHBondContact O-N 3.18Å; F104-T106 VanDerWaalsContact O-N 3.16Å; F104-S107 PolarHBondContact O-N 3.19Å; F104-I110 HydrophobicContact CB-CD1 4.16Å
105F74Confident72.2Confident114 Ų11459.1 Ų59.150%0.532%0.32SS..Hα-helixtrans-63.9-18.7176.6-75-51.3000113.9V101 E102V101-F105 HydrophobicContact CG1-CD2 3.56Å; V101-F105 HydrophobicContact CG1-CE2 3.19Å; V101-F105 HydrophobicContact CG1-CZ 4.14Å; V101-F105 WeakPolarHBondContact O-CD2 3.48Å; V101-F105 PolarHBondContact O-N 3.48Å; E102-F105 PolarHBondContact O-N 3.01Å
106T66.8Low70.2Confident9 Ų963.6 Ų63.66%0.05535%0.345CS..Hα-helixtrans-95.6-23.2176.9-41.80000113.1E102 G103 F104 K118 N238E102-T106 PolarHBondContact O-N 3.17Å; E102-T106 PolarHBondContact O-OG1 3.05Å; G103-T106 PolarHBondContact O-N 2.75Å; F104-T106 PolarHBondContact O-N 3.18Å; F104-T106 VanDerWaalsContact O-N 3.16Å; T106-K118 PolarHBondContact OG1-NZ 3.07Å; T106-N238 HydrophobicContact CG2-CB 3.55Å; T106-N238 VanDerWaalsContact CG2-OD1 3.32Å; T106-N238 WeakPolarHBondContact CG2-OD1 3.27Å
107S69.4Low68.1Low21 Ų2170.3 Ų70.315%0.14738%0.375CS..SBendtrans-66.2143.5177.8-166.50000111.9G24 G103 F104 A109 I110G24-S107 WeakPolarHBondContact O-CB 3.4Å; G24-S107 PolarHBondContact O-OG 3.21Å; G103-S107 PolarHBondContact O-N 3.33Å; F104-S107 PolarHBondContact O-N 3.19Å; S107-A109 VanDerWaalsContact C-N 3.26Å; S107-A109 PolarHBondContact O-N 3.45Å; S107-A109 VanDerWaalsContact O-N 3.14Å; S107-I110 PolarHBondContact O-N 3.39Å
108G55.3Low66.2Low47 Ų4768.8 Ų68.849%0.48537%0.365SS..Hα-helixtrans-61.8-23.7-167.900000115.7I110 K111G108-I110 VanDerWaalsContact C-N 3.34Å; G108-I110 PolarHBondContact O-N 3.25Å; G108-K111 PolarHBondContact O-N 3.38Å
109A51.6Low64.5Low48 Ų4867 Ų6740%0.39736%0.356SS..Hα-helixtrans-73.9-19-175.300000115S107S107-A109 VanDerWaalsContact C-N 3.26Å; S107-A109 PolarHBondContact O-N 3.45Å; S107-A109 VanDerWaalsContact O-N 3.14Å
110I54.1Low63.1Low55 Ų5569.9 Ų69.928%0.28237%0.374SS..Hα-helixtrans-102.5-10.7178.8-57176.7000111.3F104 S107 G108 D112 L113 Y114F104-I110 HydrophobicContact CB-CD1 4.16Å; S107-I110 PolarHBondContact O-N 3.39Å; G108-I110 VanDerWaalsContact C-N 3.34Å; G108-I110 PolarHBondContact O-N 3.25Å; I110-D112 VanDerWaalsContact C-N 3.32Å; I110-D112 PolarHBondContact O-N 3.1Å; I110-L113 PolarHBondContact O-N 2.92Å; I110-Y114 PolarHBondContact O-N 3.5Å
111K53.6Low61.7Low65 Ų6572.5 Ų72.528%0.28339%0.393SS..Hα-helixtrans-60.2-37.5177.2-88.2-178.7178.1142.30113.3G108 L113 G115 Y241G108-K111 PolarHBondContact O-N 3.38Å; K111-L113 PolarHBondContact O-N 3.41Å; K111-G115 WeakPolarHBondContact O-CA 3.29Å; K111-G115 PolarHBondContact O-N 3.43Å; K111-Y241 PolarHBondContact NZ-OH 3.04Å; K111-Y241 VanDerWaalsContact NZ-OH 3.16Å
112D51.7Low60.7Low162 Ų16273.5 Ų73.587%0.86640%0.401SS*.Hα-helixtrans-68.9-18.8-179.6-77.9-11.5000113.2I110I110-D112 VanDerWaalsContact C-N 3.32Å; I110-D112 PolarHBondContact O-N 3.1Å
113L51.4Low60.1Low145 Ų14573.2 Ų73.276%0.75940%0.401SS*.Hα-helixtrans-101.6-26.3-177.1-86.9142.9000114.1I110 K111I110-L113 PolarHBondContact O-N 2.92Å; K111-L113 PolarHBondContact O-N 3.41Å
114Y50.4Low59.6Low171 Ų17177.1 Ų77.167%0.67142%0.416SS*.Hα-helixtrans-129.420-174.9-98.7-93.6000113.5I110 D116 F117I110-Y114 PolarHBondContact O-N 3.5Å; Y114-D116 PolarHBondContact O-N 2.86Å; Y114-F117 PolarHBondContact O-N 3.47Å
115G47.8Very low59.6Low42 Ų4277.5 Ų77.543%0.43343%0.426SS..THydrogen-bonded Turntrans-48.5-12.9-161.100000120K111 I119K111-G115 WeakPolarHBondContact O-CA 3.29Å; K111-G115 PolarHBondContact O-N 3.43Å; G115-I119 WeakPolarHBondContact O-CD1 3.38Å
116D52.1Low60Low108 Ų10875.4 Ų75.458%0.57842%0.422SS*.THydrogen-bonded Turntrans-108.7-18.3-177.2-86.3-40.7000115.4Y114 K118 I119 T120Y114-D116 PolarHBondContact O-N 2.86Å; D116-K118 PolarHBondContact O-N 3.4Å; D116-I119 PolarHBondContact O-N 2.94Å; D116-T120 WeakPolarHBondContact O-CG2 3.2Å; D116-T120 PolarHBondContact O-N 3.46Å
117F51.3Low60.8Low140 Ų14075 Ų7561%0.61442%0.42SS*.THydrogen-bonded Turntrans-68.9-39.6-168.5-170.5-101.6000113.4Y114 I119 T120Y114-F117 PolarHBondContact O-N 3.47Å; F117-I119 VanDerWaalsContact C-N 3.34Å; F117-T120 PolarHBondContact O-N 3.2Å; F117-T120 PolarHBondContact O-OG1 2.9Å
118K53.4Low61.7Low41 Ų4175.9 Ų75.918%0.17843%0.428CS..THydrogen-bonded Turntrans-78-17.5-179-136.5-174.7-172.7-166.80113.4E102 T106 D116 V242E102-K118 IonicContact OE1-NZ 3.59Å; T106-K118 PolarHBondContact OG1-NZ 3.07Å; D116-K118 PolarHBondContact O-N 3.4Å; K118-V242 HydrophobicContact CD-CG2 4.21Å
119I56.4Low63.3Low48 Ų4881.7 Ų81.725%0.24644%0.435CS..THydrogen-bonded Turntrans-82.5-19.2177.8-50172.4000111.2G115 D116 F117 C246G115-I119 WeakPolarHBondContact O-CD1 3.38Å; D116-I119 PolarHBondContact O-N 2.94Å; F117-I119 VanDerWaalsContact C-N 3.34Å; I119-C246 HydrophobicContact CG2-CB 4.06Å
120T62.3Low65.2Low61 Ų6181.4 Ų81.437%0.37443%0.425SS..SBendtrans-61.6150.4169.273.50000112D116 F117 C122 G123 R124D116-T120 WeakPolarHBondContact O-CG2 3.2Å; D116-T120 PolarHBondContact O-N 3.46Å; F117-T120 PolarHBondContact O-N 3.2Å; F117-T120 PolarHBondContact O-OG1 2.9Å; T120-C122 PolarHBondContact O-N 2.88Å; T120-C122 VanDerWaalsContact O-N 3.09Å; T120-G123 PolarHBondContact O-N 3.13Å; T120-G123 VanDerWaalsContact O-N 3.07Å; T120-R124 PolarHBondContact O-N 3.44Å
121T60.6Low67.1Low115 Ų11580.8 Ų80.871%0.70642%0.422SS*.Hα-helixtrans-52.3-33.6177-51.40000112.6R124 C125T121-R124 PolarHBondContact O-N 2.92Å; T121-C125 PolarHBondContact O-N 3.44Å; T121-C125 VanDerWaalsContact O-N 3.14Å; T121-C125 PolarHBondContact O-SG 3.43Å; T121-C125 VanDerWaalsContact O-SG 3.41Å
122C65.3Low69Low79 Ų7982.9 Ų82.953%0.53443%0.434SS..Hα-helixtrans-67.3-43.5178.7-169.70000112.5T120 R124 C125 V126T120-C122 PolarHBondContact O-N 2.88Å; T120-C122 VanDerWaalsContact O-N 3.09Å; C122-R124 VanDerWaalsContact C-N 3.26Å; C122-R124 PolarHBondContact O-N 2.87Å; C122-C125 PolarHBondContact O-N 3.42Å; C122-V126 WeakPolarHBondContact O-CG2 3.25Å; C122-V126 PolarHBondContact O-N 2.89Å
123G70.6Confident71Confident4 Ų478 Ų784%0.04141%0.408CS..Hα-helixtrans-63.1-33178.100000113.1T120 S127T120-G123 PolarHBondContact O-N 3.13Å; T120-G123 VanDerWaalsContact O-N 3.07Å; G123-S127 PolarHBondContact O-N 3.49Å
124R73.6Confident73.1Confident82 Ų8271.1 Ų71.131%0.30937%0.371SS..Hα-helixtrans-70.8-42.3173.7-66.2178.662.2-168.1-5.1112.1T120 T121 C122 V126 S127 A128 W239 V242T120-R124 PolarHBondContact O-N 3.44Å; T121-R124 PolarHBondContact O-N 2.92Å; C122-R124 VanDerWaalsContact C-N 3.26Å; C122-R124 PolarHBondContact O-N 2.87Å; R124-V126 VanDerWaalsContact C-N 3.27Å; R124-V126 PolarHBondContact O-N 2.85Å; R124-S127 PolarHBondContact O-N 3.19Å; R124-A128 WeakPolarHBondContact O-CB 3.48Å; R124-A128 PolarHBondContact O-N 3.38Å; R124-W239 HydrophobicContact CB-CH2 3.95Å; R124-W239 HydrophobicContact CB-CZ3 3.91Å; R124-W239 HydrophobicContact CG-CZ3 4.44Å; R124-W239 WeakPolarHBondContact O-CH2 3.48Å; R124-W239 WeakPolarHBondContact O-CZ3 3.48Å; R124-V242 HydrophobicContact CG-CG1 4.12Å
125C79.6Confident75.3Confident71 Ų7168.9 Ų68.948%0.4836%0.363SS..Hα-helixtrans-59-43.1173.9-69.40000111.2T121 C122 A128 W129T121-C125 PolarHBondContact O-N 3.44Å; T121-C125 VanDerWaalsContact O-N 3.14Å; T121-C125 PolarHBondContact O-SG 3.43Å; T121-C125 VanDerWaalsContact O-SG 3.41Å; C122-C125 PolarHBondContact O-N 3.42Å; C125-A128 PolarHBondContact O-N 3.33Å; C125-W129 WeakPolarHBondContact O-CB 3.39Å; C125-W129 VanDerWaalsContact O-CD1 3.25Å; C125-W129 PolarHBondContact O-N 2.87Å
126V83.1Confident77.7Confident69 Ų6970.9 Ų70.942%0.41836%0.363SS..Hα-helixtrans-63.1-47.1179173.90000112.1C122 R124 A128 W129 F130C122-V126 WeakPolarHBondContact O-CG2 3.25Å; C122-V126 PolarHBondContact O-N 2.89Å; R124-V126 VanDerWaalsContact C-N 3.27Å; R124-V126 PolarHBondContact O-N 2.85Å; V126-A128 PolarHBondContact O-N 3.25Å; V126-W129 WeakPolarHBondContact O-CB 3.26Å; V126-W129 PolarHBondContact O-N 3.03Å; V126-F130 HydrophobicContact CG1-CD2 3.84Å; V126-F130 HydrophobicContact CG1-CE2 3.55Å; V126-F130 VanDerWaalsContact O-CD2 3.26Å; V126-F130 WeakPolarHBondContact O-CD2 3.43Å; V126-F130 PolarHBondContact O-N 2.94Å
127S83.7Confident79.8Confident2 Ų268.6 Ų68.61%0.01435%0.348CS..Hα-helixtrans-67.1-36.5179.6-165.10000112.5E102 G123 R124 W129 F130 I131E102-S127 WeakPolarHBondContact OE1-CB 3.44Å; E102-S127 PolarHBondContact OE1-OG 3.39Å; G123-S127 PolarHBondContact O-N 3.49Å; R124-S127 PolarHBondContact O-N 3.19Å; S127-W129 VanDerWaalsContact C-N 3.32Å; S127-W129 PolarHBondContact O-N 3.48Å; S127-F130 PolarHBondContact O-N 3.23Å; S127-I131 WeakPolarHBondContact O-CG1 3.23Å; S127-I131 PolarHBondContact O-N 2.91Å; S127-I131 VanDerWaalsContact O-N 3.09Å
128A87Confident81.9Confident38 Ų3863.1 Ų63.131%0.31432%0.324SS..Hα-helixtrans-63.4-38.7172.200000112.2R124 C125 V126 I131 M132 W239R124-A128 WeakPolarHBondContact O-CB 3.48Å; R124-A128 PolarHBondContact O-N 3.38Å; C125-A128 PolarHBondContact O-N 3.33Å; V126-A128 PolarHBondContact O-N 3.25Å; A128-I131 PolarHBondContact O-N 2.77Å; A128-M132 PolarHBondContact O-N 3.05Å; A128-W239 HydrophobicContact CB-CH2 3.81Å; A128-W239 HydrophobicContact CB-CZ2 4.49Å; A128-W239 HydrophobicContact CB-CZ3 3.91Å
129W90.1Very high84Confident169 Ų16965.2 Ų65.264%0.6434%0.337SS*.Hα-helixtrans-61.3-44.6174.1-9897.6000112.1C125 V126 S127 I131 M132 L133C125-W129 WeakPolarHBondContact O-CB 3.39Å; C125-W129 VanDerWaalsContact O-CD1 3.25Å; C125-W129 PolarHBondContact O-N 2.87Å; V126-W129 WeakPolarHBondContact O-CB 3.26Å; V126-W129 PolarHBondContact O-N 3.03Å; S127-W129 VanDerWaalsContact C-N 3.32Å; S127-W129 PolarHBondContact O-N 3.48Å; W129-I131 VanDerWaalsContact C-N 3.34Å; W129-I131 PolarHBondContact O-N 3.38Å; W129-M132 PolarHBondContact O-N 2.96Å; W129-L133 VanDerWaalsContact O-CB 3.32Å; W129-L133 WeakPolarHBondContact O-CB 3.36Å; W129-L133 PolarHBondContact O-N 3.46Å
130F91.6Very high85.9Confident42 Ų4265.4 Ų65.418%0.18435%0.346CS..Hα-helixtrans-62.8-38.5175.9-80.4-67.2000112.8Y95 L98 L99 E102 V126 S127 T134Y95-F130 HydrophobicContact CE2-CD1 4.25Å; Y95-F130 HydrophobicContact CE2-CE1 4.4Å; L98-F130 HydrophobicContact CB-CE1 4.1Å; L98-F130 HydrophobicContact CB-CZ 4.35Å; L99-F130 HydrophobicContact CD2-CD1 4.01Å; E102-F130 WeakPolarHBondContact OE2-CB 3.08Å; E102-F130 VanDerWaalsContact OE2-CD2 3.23Å; E102-F130 WeakPolarHBondContact OE2-CD2 3.33Å; E102-F130 WeakPolarHBondContact OE2-CG 3.14Å; V126-F130 HydrophobicContact CG1-CD2 3.84Å; V126-F130 HydrophobicContact CG1-CE2 3.55Å; V126-F130 VanDerWaalsContact O-CD2 3.26Å; V126-F130 WeakPolarHBondContact O-CD2 3.43Å; V126-F130 PolarHBondContact O-N 2.94Å; S127-F130 PolarHBondContact O-N 3.23Å; F130-T134 VanDerWaalsContact O-CB 3.29Å; F130-T134 WeakPolarHBondContact O-CB 3.4Å; F130-T134 PolarHBondContact O-N 2.86Å; F130-T134 PolarHBondContact O-OG1 3.47Å
131I92.4Very high87.6Confident42 Ų4262.9 Ų62.922%0.21533%0.329CS..Hα-helixtrans-61.7-49.7173.8-68.9163.5000110.7S127 A128 W129 L133 T134 Y135 L232 L235 W239S127-I131 WeakPolarHBondContact O-CG1 3.23Å; S127-I131 PolarHBondContact O-N 2.91Å; S127-I131 VanDerWaalsContact O-N 3.09Å; A128-I131 PolarHBondContact O-N 2.77Å; W129-I131 VanDerWaalsContact C-N 3.34Å; W129-I131 PolarHBondContact O-N 3.38Å; I131-L133 PolarHBondContact O-N 3.46Å; I131-T134 PolarHBondContact O-N 3.14Å; I131-Y135 WeakPolarHBondContact O-CB 3.08Å; I131-Y135 PolarHBondContact O-N 3.34Å; I131-L232 HydrophobicContact CG2-CD2 4.32Å; I131-L235 HydrophobicContact CD1-CB 4.43Å; I131-L235 HydrophobicContact CG1-CB 3.72Å; I131-L235 HydrophobicContact CG1-CD1 4.38Å; I131-W239 HydrophobicContact CD1-CB 3.77Å; I131-W239 HydrophobicContact CD1-CD2 4.34Å; I131-W239 HydrophobicContact CD1-CE3 4.48Å; I131-W239 HydrophobicContact CD1-CG 4.06Å
132M93.9Very high89.3Confident110 Ų11061.9 Ų61.954%0.54232%0.32SS..Hα-helixtrans-59.9-46.9179.2-175.6-163.3178.100111.3A128 W129 Y135 I136A128-M132 PolarHBondContact O-N 3.05Å; W129-M132 PolarHBondContact O-N 2.96Å; M132-Y135 WeakPolarHBondContact O-CB 3.33Å; M132-Y135 PolarHBondContact O-N 3.29Å; M132-I136 HydrophobicContact CE-CD1 4.04Å; M132-I136 HydrophobicContact CG-CD1 4.26Å; M132-I136 WeakPolarHBondContact O-CG1 3.22Å; M132-I136 PolarHBondContact O-N 2.86Å
133L94.8Very high90.8Very high59 Ų5959.3 Ų59.331%0.30931%0.306SS..Hα-helixtrans-65.3-44.6-178.7-162.893.3000111.5Y95 W129 I131 Y135 I136 F137Y95-L133 HydrophobicContact CD2-CD2 4.1Å; Y95-L133 HydrophobicContact CE2-CD2 3.35Å; W129-L133 VanDerWaalsContact O-CB 3.32Å; W129-L133 WeakPolarHBondContact O-CB 3.36Å; W129-L133 PolarHBondContact O-N 3.46Å; I131-L133 PolarHBondContact O-N 3.46Å; L133-Y135 PolarHBondContact O-N 2.87Å; L133-I136 PolarHBondContact O-N 3.43Å; L133-F137 HydrophobicContact CD1-CE2 4.49Å; L133-F137 HydrophobicContact CD2-CD2 4.18Å; L133-F137 HydrophobicContact CD2-CE2 3.49Å; L133-F137 VanDerWaalsContact CD2-CE2 3.49Å; L133-F137 HydrophobicContact CD2-CZ 4.25Å; L133-F137 HydrophobicContact CG-CD2 4.12Å; L133-F137 HydrophobicContact CG-CE2 3.68Å; L133-F137 HydrophobicContact CG-CZ 4.28Å; L133-F137 WeakPolarHBondContact O-CD2 3.2Å; L133-F137 PolarHBondContact O-N 3.12Å
134T95.7Very high92Very high0 Ų061 Ų610%032%0.316CS..Hα-helixtrans-60.1-38.4175.9-53.40000111Y95 F130 I131 F137 M138 M228 L232 L235Y95-T134 WeakPolarHBondContact OH-CA 3.26Å; Y95-T134 PolarHBondContact OH-N 2.97Å; Y95-T134 PolarHBondContact OH-OG1 3.25Å; F130-T134 VanDerWaalsContact O-CB 3.29Å; F130-T134 WeakPolarHBondContact O-CB 3.4Å; F130-T134 PolarHBondContact O-N 2.86Å; F130-T134 PolarHBondContact O-OG1 3.47Å; I131-T134 PolarHBondContact O-N 3.14Å; T134-F137 PolarHBondContact O-N 2.99Å; T134-M138 WeakPolarHBondContact O-CB 3.49Å; T134-M138 PolarHBondContact O-N 3.28Å; T134-M228 HydrophobicContact CG2-CB 4.46Å; T134-M228 HydrophobicContact CG2-SD 3.84Å; T134-L232 HydrophobicContact CG2-CD2 3.99Å; T134-L232 HydrophobicContact CG2-CG 3.84Å; T134-L235 WeakPolarHBondContact OG1-CD1 3.38Å
135Y96.3Very high93.1Very high124 Ų12458.8 Ų58.849%0.48631%0.311SS..Hα-helixtrans-65.3-43.3177.1-175.8-100.2000112.3I131 M132 L133 F137 M138 L139 L232I131-Y135 WeakPolarHBondContact O-CB 3.08Å; I131-Y135 PolarHBondContact O-N 3.34Å; M132-Y135 WeakPolarHBondContact O-CB 3.33Å; M132-Y135 PolarHBondContact O-N 3.29Å; L133-Y135 PolarHBondContact O-N 2.87Å; Y135-F137 VanDerWaalsContact C-N 3.34Å; Y135-F137 PolarHBondContact O-N 3Å; Y135-M138 HydrophobicContact CE2-CE 4.46Å; Y135-M138 WeakPolarHBondContact O-CB 3.48Å; Y135-M138 PolarHBondContact O-N 3.11Å; Y135-L139 HydrophobicContact CD1-CD1 4.14Å; Y135-L139 HydrophobicContact CE1-CD1 3.63Å; Y135-L139 HydrophobicContact CE1-CG 4.28Å; Y135-L139 PolarHBondContact O-N 3.35Å; Y135-L139 VanDerWaalsContact O-N 3.08Å; Y135-L232 HydrophobicContact CD2-CD1 4.08Å
136I97.1Very high93.9Very high84 Ų8458 Ų5843%0.43131%0.31SS..Hα-helixtrans-61.3-44.8174.8-68166.5000110.4M132 L133 M138 L139 A140M132-I136 HydrophobicContact CE-CD1 4.04Å; M132-I136 HydrophobicContact CG-CD1 4.26Å; M132-I136 WeakPolarHBondContact O-CG1 3.22Å; M132-I136 PolarHBondContact O-N 2.86Å; L133-I136 PolarHBondContact O-N 3.43Å; I136-M138 VanDerWaalsContact C-N 3.34Å; I136-M138 PolarHBondContact O-N 3.49Å; I136-L139 PolarHBondContact O-N 3.38Å; I136-A140 PolarHBondContact O-N 2.89Å
137F96.3Very high94.3Very high61 Ų6162 Ų6227%0.26832%0.322SS..Hα-helixtrans-66-35.1177.1-70.8-40.9000113.1F92 Y95 L133 T134 Y135 L139 A140 W141 M228F92-F137 HydrophobicContact CE1-CB 4.18Å; F92-F137 HydrophobicContact CE1-CD1 4.35Å; F92-F137 HydrophobicContact CE1-CD2 4.1Å; F92-F137 AromaticContact CE1-CG 3.98Å; F92-F137 HydrophobicContact CE1-CG 3.98Å; F92-F137 HydrophobicContact CZ-CB 4.2Å; F92-F137 AromaticContact CZ-CD1 3.8Å; F92-F137 HydrophobicContact CZ-CD1 3.8Å; F92-F137 HydrophobicContact CZ-CD2 4.35Å; F92-F137 HydrophobicContact CZ-CE1 4.21Å; F92-F137 AromaticContact CZ-CG 3.88Å; F92-F137 HydrophobicContact CZ-CG 3.88Å; Y95-F137 HydrophobicContact CD1-CD2 4.05Å; Y95-F137 HydrophobicContact CD1-CE2 4.15Å; Y95-F137 HydrophobicContact CD2-CE2 4.26Å; Y95-F137 AromaticContact CE1-CD2 3.59Å; Y95-F137 HydrophobicContact CE1-CD2 3.59Å; Y95-F137 AromaticContact CE1-CE2 3.98Å; Y95-F137 HydrophobicContact CE1-CE2 3.98Å; Y95-F137 HydrophobicContact CE2-CD2 4.46Å; Y95-F137 HydrophobicContact CE2-CE2 4.15Å; Y95-F137 HydrophobicContact CG-CE2 4.27Å; Y95-F137 AromaticContact CZ-CD2 3.82Å; Y95-F137 AromaticContact CZ-CE2 3.98Å; L133-F137 HydrophobicContact CD1-CE2 4.49Å; L133-F137 HydrophobicContact CD2-CD2 4.18Å; L133-F137 HydrophobicContact CD2-CE2 3.49Å; L133-F137 VanDerWaalsContact CD2-CE2 3.49Å; L133-F137 HydrophobicContact CD2-CZ 4.25Å; L133-F137 HydrophobicContact CG-CD2 4.12Å; L133-F137 HydrophobicContact CG-CE2 3.68Å; L133-F137 HydrophobicContact CG-CZ 4.28Å; L133-F137 WeakPolarHBondContact O-CD2 3.2Å; L133-F137 PolarHBondContact O-N 3.12Å; T134-F137 PolarHBondContact O-N 2.99Å; Y135-F137 VanDerWaalsContact C-N 3.34Å; Y135-F137 PolarHBondContact O-N 3Å; F137-L139 VanDerWaalsContact C-N 3.32Å; F137-L139 PolarHBondContact O-N 2.76Å; F137-A140 PolarHBondContact O-N 2.61Å; F137-W141 WeakPolarHBondContact O-CB 3.47Å; F137-W141 VanDerWaalsContact O-CD1 3.22Å; F137-W141 PolarHBondContact O-N 3.44Å; F137-M228 HydrophobicContact CB-CE 4.06Å; F137-M228 HydrophobicContact CB-SD 4.45Å
138M96.6Very high94.8Very high24 Ų2462.7 Ų62.712%0.11833%0.326CS..Hα-helixtrans-58.9-45.1172.6-174.5-131.866.800111.1T134 Y135 I136 W141 L142 M228 I229 L232T134-M138 WeakPolarHBondContact O-CB 3.49Å; T134-M138 PolarHBondContact O-N 3.28Å; Y135-M138 HydrophobicContact CE2-CE 4.46Å; Y135-M138 WeakPolarHBondContact O-CB 3.48Å; Y135-M138 PolarHBondContact O-N 3.11Å; I136-M138 VanDerWaalsContact C-N 3.34Å; I136-M138 PolarHBondContact O-N 3.49Å; M138-W141 PolarHBondContact O-N 2.89Å; M138-L142 WeakPolarHBondContact O-CB 3.34Å; M138-L142 PolarHBondContact O-N 3.05Å; M138-M228 HydrophobicContact CB-CB 3.84Å; M138-M228 HydrophobicContact CG-CB 4.07Å; M138-I229 HydrophobicContact CG-CG1 4.15Å; M138-I229 HydrophobicContact SD-CG1 4.19Å; M138-L232 HydrophobicContact CB-CD1 4.28Å; M138-L232 HydrophobicContact CG-CD1 4.4Å; M138-L232 HydrophobicContact SD-CD1 4.16Å
139L97.3Very high95.1Very high85 Ų8563.3 Ų63.345%0.44533%0.328SS..Hα-helixtrans-65.1-40.7175.9-68.5175.2000111.8Y135 I136 F137 L142 G143Y135-L139 HydrophobicContact CD1-CD1 4.14Å; Y135-L139 HydrophobicContact CE1-CD1 3.63Å; Y135-L139 HydrophobicContact CE1-CG 4.28Å; Y135-L139 PolarHBondContact O-N 3.35Å; Y135-L139 VanDerWaalsContact O-N 3.08Å; I136-L139 PolarHBondContact O-N 3.38Å; F137-L139 VanDerWaalsContact C-N 3.32Å; F137-L139 PolarHBondContact O-N 2.76Å; L139-L142 WeakPolarHBondContact O-CB 3.43Å; L139-L142 PolarHBondContact O-N 2.88Å; L139-G143 PolarHBondContact O-N 2.88Å
140A96.8Very high95.2Very high53 Ų5360 Ų6044%0.43832%0.322SS..Hα-helixtrans-61.5-46.3176.700000111.6I136 F137 L142 G143 V144I136-A140 PolarHBondContact O-N 2.89Å; F137-A140 PolarHBondContact O-N 2.61Å; A140-L142 VanDerWaalsContact C-N 3.31Å; A140-L142 PolarHBondContact O-N 2.9Å; A140-G143 CarbonylContact O-C 3.56Å; A140-G143 WeakPolarHBondContact O-CA 3.45Å; A140-G143 PolarHBondContact O-N 3.2Å; A140-G143 VanDerWaalsContact O-N 3.14Å; A140-V144 WeakPolarHBondContact O-CG2 3.29Å; A140-V144 PolarHBondContact O-N 3.25Å
141W97.3Very high95Very high7 Ų759.6 Ų59.63%0.02732%0.324CS..Hα-helixtrans-65.6-32.7177-84.2107.8000113V40 F43 I88 F92 F137 M138 V144 T145 A221 A224 V225V40-W141 HydrophobicContact CG2-CH2 4.07Å; V40-W141 HydrophobicContact CG2-CZ2 3.7Å; F43-W141 HydrophobicContact CB-CH2 4.38Å; F43-W141 HydrophobicContact CB-CZ3 4.21Å; F43-W141 AromaticContact CD1-CH2 3.69Å; F43-W141 HydrophobicContact CD1-CH2 3.69Å; F43-W141 AromaticContact CD1-CZ3 3.74Å; F43-W141 HydrophobicContact CD1-CZ3 3.74Å; F43-W141 HydrophobicContact CD2-CZ3 4.37Å; F43-W141 HydrophobicContact CE1-CH2 4.28Å; F43-W141 HydrophobicContact CE1-CZ3 4.21Å; F43-W141 HydrophobicContact CG-CH2 4.13Å; F43-W141 AromaticContact CG-CZ3 3.82Å; F43-W141 HydrophobicContact CG-CZ3 3.82Å; I88-W141 HydrophobicContact CG2-CH2 3.96Å; I88-W141 HydrophobicContact CG2-CZ2 3.79Å; F92-W141 AromaticContact CD1-NE1 3.94Å; F92-W141 AromaticContact CD2-CZ2 3.93Å; F92-W141 HydrophobicContact CD2-CZ2 3.93Å; F92-W141 AromaticContact CE1-NE1 3.34Å; F92-W141 VanDerWaalsContact CE1-NE1 3.34Å; F92-W141 AromaticContact CE2-CE2 3.93Å; F92-W141 AromaticContact CE2-CZ2 3.89Å; F92-W141 HydrophobicContact CE2-CZ2 3.89Å; F92-W141 AromaticContact CE2-NE1 3.46Å; F92-W141 HydrophobicContact CG-CZ2 4.39Å; F92-W141 AromaticContact CZ-CD1 3.87Å; F92-W141 AromaticContact CZ-CE2 3.97Å; F92-W141 HydrophobicContact CZ-CZ2 4.37Å; F92-W141 AromaticContact CZ-NE1 3.05Å; F137-W141 WeakPolarHBondContact O-CB 3.47Å; F137-W141 VanDerWaalsContact O-CD1 3.22Å; F137-W141 PolarHBondContact O-N 3.44Å; M138-W141 PolarHBondContact O-N 2.89Å; W141-V144 HydrophobicContact CE3-CB 4.28Å; W141-V144 HydrophobicContact CE3-CG1 4.17Å; W141-V144 HydrophobicContact CZ3-CG1 4.15Å; W141-V144 PolarHBondContact O-N 3.31Å; W141-T145 WeakPolarHBondContact O-CB 3.44Å; W141-T145 PolarHBondContact O-N 3.34Å; W141-T145 PolarHBondContact O-OG1 3.42Å; W141-A221 HydrophobicContact CE3-CB 4.16Å; W141-A221 HydrophobicContact CZ3-CB 4.15Å; W141-A224 HydrophobicContact CD2-CB 3.64Å; W141-A224 HydrophobicContact CE3-CB 3.71Å; W141-A224 HydrophobicContact CG-CB 4.14Å; W141-A224 HydrophobicContact CH2-CB 4.29Å; W141-A224 HydrophobicContact CZ2-CB 4.25Å; W141-A224 HydrophobicContact CZ3-CB 4.03Å; W141-V225 HydrophobicContact CB-CG2 3.65Å
142L97.1Very high95Very high95 Ų9558.6 Ų58.650%0.49732%0.32SS..Hα-helixtrans-63.4-44.7171.3-166.2160.7000110.4M138 L139 A140 T145 A146M138-L142 WeakPolarHBondContact O-CB 3.34Å; M138-L142 PolarHBondContact O-N 3.05Å; L139-L142 WeakPolarHBondContact O-CB 3.43Å; L139-L142 PolarHBondContact O-N 2.88Å; A140-L142 VanDerWaalsContact C-N 3.31Å; A140-L142 PolarHBondContact O-N 2.9Å; L142-T145 WeakPolarHBondContact O-CB 3.45Å; L142-T145 PolarHBondContact O-N 2.95Å; L142-A146 PolarHBondContact O-N 3.43Å
143G96.5Very high94.9Very high24 Ų2459.5 Ų59.525%0.24732%0.321CS..Hα-helixtrans-57.6-49.6171.600000112.4L139 A140 T145 A146 F147L139-G143 PolarHBondContact O-N 2.88Å; A140-G143 CarbonylContact O-C 3.56Å; A140-G143 WeakPolarHBondContact O-CA 3.45Å; A140-G143 PolarHBondContact O-N 3.2Å; A140-G143 VanDerWaalsContact O-N 3.14Å; G143-T145 VanDerWaalsContact C-N 3.29Å; G143-T145 PolarHBondContact O-N 3.26Å; G143-A146 WeakPolarHBondContact O-CB 3.24Å; G143-A146 PolarHBondContact O-N 3.37Å; G143-A146 VanDerWaalsContact O-N 3.12Å; G143-F147 WeakPolarHBondContact O-CD2 3.36Å; G143-F147 PolarHBondContact O-N 2.93Å
144V95.8Very high94.5Very high40 Ų4058.2 Ų58.224%0.24231%0.314CS..Hα-helixtrans-57.3-42.4176.8172.30000111.4F43 A140 W141 A146 F147 T148 A221F43-V144 HydrophobicContact CD2-CG1 4.35Å; F43-V144 HydrophobicContact CE1-CG1 4.08Å; F43-V144 HydrophobicContact CE2-CG1 3.53Å; F43-V144 HydrophobicContact CZ-CG1 3.36Å; A140-V144 WeakPolarHBondContact O-CG2 3.29Å; A140-V144 PolarHBondContact O-N 3.25Å; W141-V144 HydrophobicContact CE3-CB 4.28Å; W141-V144 HydrophobicContact CE3-CG1 4.17Å; W141-V144 HydrophobicContact CZ3-CG1 4.15Å; W141-V144 PolarHBondContact O-N 3.31Å; V144-A146 PolarHBondContact O-N 2.98Å; V144-F147 PolarHBondContact O-N 2.87Å; V144-T148 VanDerWaalsContact O-CB 3.29Å; V144-T148 WeakPolarHBondContact O-CB 3.48Å; V144-T148 PolarHBondContact O-N 3.48Å; V144-T148 PolarHBondContact O-OG1 2.96Å; V144-A221 HydrophobicContact CG1-CB 4.32Å
145T95.8Very high94Very high35 Ų3559.2 Ų59.222%0.21532%0.318CS..Hα-helixtrans-60.9-45.9176.6-56.20000110.8W141 L142 G143 T148 S149 L218W141-T145 WeakPolarHBondContact O-CB 3.44Å; W141-T145 PolarHBondContact O-N 3.34Å; W141-T145 PolarHBondContact O-OG1 3.42Å; L142-T145 WeakPolarHBondContact O-CB 3.45Å; L142-T145 PolarHBondContact O-N 2.95Å; G143-T145 VanDerWaalsContact C-N 3.29Å; G143-T145 PolarHBondContact O-N 3.26Å; T145-T148 PolarHBondContact O-N 2.85Å; T145-S149 PolarHBondContact O-N 3.29Å; T145-S149 VanDerWaalsContact O-N 3.11Å; T145-L218 HydrophobicContact CG2-CD1 3.75Å; T145-L218 VanDerWaalsContact O-CD1 3.24Å; T145-L218 WeakPolarHBondContact O-CD1 3.2Å
146A96Very high93.5Very high56 Ų5658.4 Ų58.446%0.46332%0.317SS..Hα-helixtrans-62.4-46176.900000111.9L142 G143 V144 T148 S149L142-A146 PolarHBondContact O-N 3.43Å; G143-A146 WeakPolarHBondContact O-CB 3.24Å; G143-A146 PolarHBondContact O-N 3.37Å; G143-A146 VanDerWaalsContact O-N 3.12Å; V144-A146 PolarHBondContact O-N 2.98Å; A146-T148 PolarHBondContact O-N 3.33Å; A146-S149 WeakPolarHBondContact O-CB 3.44Å; A146-S149 PolarHBondContact O-N 3.47Å; A146-S149 PolarHBondContact O-OG 3.48Å
147F92.6Very high93Very high151 Ų15156.9 Ų56.966%0.66231%0.31SS*.Hα-helixtrans-65.6-38.1177.7-76.7-67.4000112.9G143 V144 S149 L150 P151G143-F147 WeakPolarHBondContact O-CD2 3.36Å; G143-F147 PolarHBondContact O-N 2.93Å; V144-F147 PolarHBondContact O-N 2.87Å; F147-S149 PolarHBondContact O-N 2.89Å; F147-L150 HydrophobicContact CD1-CD1 4.29Å; F147-L150 WeakPolarHBondContact O-CB 3.25Å; F147-L150 PolarHBondContact O-N 2.89Å; F147-P151 VanDerWaalsContact O-CD 3.29Å; F147-P151 WeakPolarHBondContact O-CD 3.22Å
148T93.2Very high92.3Very high17 Ų1754.9 Ų54.910%0.10430%0.302CS..Hα-helixtrans-69.9-20.9179-51.80000112.1F43 V144 T145 A146 L150 P151 V152 L218F43-T148 HydrophobicContact CE2-CG2 4.27Å; F43-T148 WeakPolarHBondContact CE2-OG1 3.47Å; V144-T148 VanDerWaalsContact O-CB 3.29Å; V144-T148 WeakPolarHBondContact O-CB 3.48Å; V144-T148 PolarHBondContact O-N 3.48Å; V144-T148 PolarHBondContact O-OG1 2.96Å; T145-T148 PolarHBondContact O-N 2.85Å; A146-T148 PolarHBondContact O-N 3.33Å; T148-L150 PolarHBondContact O-N 3.36Å; T148-P151 VanDerWaalsContact O-CD 3.25Å; T148-P151 WeakPolarHBondContact O-CD 3.45Å; T148-P151 VanDerWaalsContact O-CG 3.29Å; T148-P151 WeakPolarHBondContact O-CG 3.43Å; T148-V152 WeakPolarHBondContact O-CG2 3.45Å; T148-L218 HydrophobicContact CG2-CB 4.18Å; T148-L218 HydrophobicContact CG2-CD1 4.42Å
149S93.9Very high91.6Very high51 Ų5156.9 Ų56.936%0.35731%0.308SS..Hα-helixtrans-67.5-23.9173.177.50000113.5T145 A146 F147 V152 F153T145-S149 PolarHBondContact O-N 3.29Å; T145-S149 VanDerWaalsContact O-N 3.11Å; A146-S149 WeakPolarHBondContact O-CB 3.44Å; A146-S149 PolarHBondContact O-N 3.47Å; A146-S149 PolarHBondContact O-OG 3.48Å; F147-S149 PolarHBondContact O-N 2.89Å; S149-V152 PolarHBondContact O-N 3.2Å; S149-F153 WeakPolarHBondContact O-CB 3.46Å; S149-F153 PolarHBondContact O-N 3.03Å
150L91.5Very high90.9Very high99 Ų9955.2 Ų55.252%0.51830%0.302SS..Hα-helixtrans-63.9-55.2179.2-61.8175.3000113F147 T148 V152 F153 I154F147-L150 HydrophobicContact CD1-CD1 4.29Å; F147-L150 WeakPolarHBondContact O-CB 3.25Å; F147-L150 PolarHBondContact O-N 2.89Å; T148-L150 PolarHBondContact O-N 3.36Å; L150-V152 VanDerWaalsContact C-N 3.29Å; L150-V152 PolarHBondContact O-N 3.07Å; L150-F153 PolarHBondContact O-N 3.19Å; L150-I154 WeakPolarHBondContact O-CG1 3.41Å; L150-I154 PolarHBondContact O-N 2.67Å
151P88.9Confident90.1Very high35 Ų3554.5 Ų54.523%0.22729%0.29CS..Hα-helixtrans-62.3-36.617623.6-33.6000111.9F147 T148 F153 I154 Y155 F214F147-P151 VanDerWaalsContact O-CD 3.29Å; F147-P151 WeakPolarHBondContact O-CD 3.22Å; T148-P151 VanDerWaalsContact O-CD 3.25Å; T148-P151 WeakPolarHBondContact O-CD 3.45Å; T148-P151 VanDerWaalsContact O-CG 3.29Å; T148-P151 WeakPolarHBondContact O-CG 3.43Å; P151-F153 VanDerWaalsContact C-N 3.32Å; P151-F153 PolarHBondContact O-N 2.68Å; P151-I154 PolarHBondContact O-N 3.26Å; P151-Y155 WeakPolarHBondContact O-CD2 3.38Å; P151-Y155 PolarHBondContact O-N 3.44Å; P151-F214 HydrophobicContact CB-CD1 3.93Å; P151-F214 HydrophobicContact CB-CE1 3.77Å; P151-F214 HydrophobicContact CB-CE2 4.44Å; P151-F214 HydrophobicContact CB-CG 4.36Å; P151-F214 HydrophobicContact CB-CZ 4.05Å; P151-F214 HydrophobicContact CG-CD1 3.92Å; P151-F214 HydrophobicContact CG-CE1 3.89Å
152V92.1Very high89.4Confident21 Ų2154.9 Ų54.913%0.12729%0.294CS..Hα-helixtrans-58-46.3174.1174.60000111T148 S149 L150 Y155 F156 F214 V215 L218T148-V152 WeakPolarHBondContact O-CG2 3.45Å; S149-V152 PolarHBondContact O-N 3.2Å; L150-V152 VanDerWaalsContact C-N 3.29Å; L150-V152 PolarHBondContact O-N 3.07Å; V152-Y155 PolarHBondContact O-N 2.98Å; V152-F156 WeakPolarHBondContact O-CB 3.27Å; V152-F156 PolarHBondContact O-N 3.41Å; V152-F214 HydrophobicContact CG2-CB 3.83Å; V152-F214 WeakPolarHBondContact CG2-O 3.44Å; V152-V215 HydrophobicContact CG1-CG2 4.03Å; V152-L218 HydrophobicContact CG1-CD2 4.47Å; V152-L218 HydrophobicContact CG2-CB 4.14Å; V152-L218 HydrophobicContact CG2-CD2 4.14Å
153F90.6Very high88.5Confident128 Ų12855.9 Ų55.956%0.56130%0.296SS*.Hα-helixtrans-62.1-43.9177.4179.8-103.6000111.8S149 L150 P151 F156 N157S149-F153 WeakPolarHBondContact O-CB 3.46Å; S149-F153 PolarHBondContact O-N 3.03Å; L150-F153 PolarHBondContact O-N 3.19Å; P151-F153 VanDerWaalsContact C-N 3.32Å; P151-F153 PolarHBondContact O-N 2.68Å; F153-F156 PolarHBondContact O-N 3.38Å; F153-N157 VanDerWaalsContact CE1-ND2 3.26Å; F153-N157 WeakPolarHBondContact CE1-ND2 3.28Å; F153-N157 WeakPolarHBondContact CE2-ND2 3.5Å; F153-N157 WeakPolarHBondContact CZ-ND2 3.25Å; F153-N157 PolarHBondContact O-N 2.96Å; F153-N157 PolarHBondContact O-ND2 3.31Å
154I87Confident87.5Confident33 Ų3358.5 Ų58.517%0.16931%0.305CS..Hα-helixtrans-61.3-51.7178.4-65.7167.7000110.6L150 P151 F156 N157 I158 Y180L150-I154 WeakPolarHBondContact O-CG1 3.41Å; L150-I154 PolarHBondContact O-N 2.67Å; P151-I154 PolarHBondContact O-N 3.26Å; I154-F156 VanDerWaalsContact C-N 3.31Å; I154-F156 PolarHBondContact O-N 3.44Å; I154-N157 PolarHBondContact O-N 3.24Å; I154-I158 HydrophobicContact CG2-CD1 4Å; I154-I158 WeakPolarHBondContact O-CG1 3.33Å; I154-I158 PolarHBondContact O-N 2.96Å; I154-Y180 HydrophobicContact CD1-CD1 4.02Å; I154-Y180 HydrophobicContact CD1-CG 4.46Å; I154-Y180 HydrophobicContact CG1-CD1 3.81Å; I154-Y180 HydrophobicContact CG1-CE1 4.27Å; I154-Y180 HydrophobicContact CG2-CD1 4.08Å; I154-Y180 HydrophobicContact CG2-CE1 4.29Å; I154-Y180 HydrophobicContact CG2-CG 4.34Å
155Y85.5Confident86.2Confident20 Ų2057 Ų578%0.07830%0.296CS..Hα-helixtrans-64.1-35.6179.4-86.1-92.2000112.4T54 I57 P151 V152 N157 I158 W159 L207 T210 F214T54-Y155 WeakPolarHBondContact CA-OH 3.38Å; T54-Y155 WeakPolarHBondContact CB-OH 3.22Å; T54-Y155 PolarHBondContact OG1-OH 3.03Å; I57-Y155 HydrophobicContact CD1-CE1 4.04Å; P151-Y155 WeakPolarHBondContact O-CD2 3.38Å; P151-Y155 PolarHBondContact O-N 3.44Å; V152-Y155 PolarHBondContact O-N 2.98Å; Y155-N157 VanDerWaalsContact C-N 3.34Å; Y155-N157 PolarHBondContact O-N 3.34Å; Y155-I158 PolarHBondContact O-N 3.32Å; Y155-W159 VanDerWaalsContact O-CB 3.29Å; Y155-W159 WeakPolarHBondContact O-CB 3.45Å; Y155-W159 PolarHBondContact O-N 3.45Å; Y155-L207 HydrophobicContact CD1-CD1 3.99Å; Y155-L207 HydrophobicContact CE1-CD1 3.85Å; Y155-T210 HydrophobicContact CD1-CG2 4.39Å; Y155-T210 HydrophobicContact CE1-CG2 3.6Å; Y155-T210 HydrophobicContact CE2-CG2 4.31Å; Y155-T210 WeakPolarHBondContact OH-CG2 3.44Å; Y155-F214 AromaticContact CD2-CD2 3.77Å; Y155-F214 HydrophobicContact CD2-CD2 3.77Å; Y155-F214 AromaticContact CD2-CE2 3.84Å; Y155-F214 HydrophobicContact CD2-CE2 3.84Å; Y155-F214 AromaticContact CE2-CD2 3.78Å; Y155-F214 HydrophobicContact CE2-CD2 3.78Å; Y155-F214 AromaticContact CE2-CE2 3.36Å; Y155-F214 HydrophobicContact CE2-CE2 3.36Å; Y155-F214 HydrophobicContact CE2-CZ 4.31Å; Y155-F214 HydrophobicContact CG-CD2 4.36Å; Y155-F214 AromaticContact CZ-CE2 3.91Å
156F86.8Confident84.5Confident107 Ų10760.3 Ų60.347%0.46932%0.316SS..Hα-helixtrans-61.2-41.4174-179.8-99.3000112.3V152 F153 I154 T160 F211V152-F156 WeakPolarHBondContact O-CB 3.27Å; V152-F156 PolarHBondContact O-N 3.41Å; F153-F156 PolarHBondContact O-N 3.38Å; I154-F156 VanDerWaalsContact C-N 3.31Å; I154-F156 PolarHBondContact O-N 3.44Å; F156-T160 WeakPolarHBondContact O-CB 3.43Å; F156-T160 PolarHBondContact O-N 2.87Å; F156-T160 PolarHBondContact O-OG1 3Å; F156-F211 HydrophobicContact CB-CE2 3.97Å; F156-F211 HydrophobicContact CD2-CE2 4.26Å; F156-F211 HydrophobicContact CD2-CZ 4.1Å
157N85.6Confident82.6Confident52 Ų5264.2 Ų64.228%0.27833%0.328SS..Hα-helixtrans-65.8-44175.8-78.3-81.8000111.3F153 I154 Y155 T160 I161F153-N157 VanDerWaalsContact CE1-ND2 3.26Å; F153-N157 WeakPolarHBondContact CE1-ND2 3.28Å; F153-N157 WeakPolarHBondContact CE2-ND2 3.5Å; F153-N157 WeakPolarHBondContact CZ-ND2 3.25Å; F153-N157 PolarHBondContact O-N 2.96Å; F153-N157 PolarHBondContact O-ND2 3.31Å; I154-N157 PolarHBondContact O-N 3.24Å; Y155-N157 VanDerWaalsContact C-N 3.34Å; Y155-N157 PolarHBondContact O-N 3.34Å; N157-T160 PolarHBondContact O-N 3.29Å; N157-I161 WeakPolarHBondContact O-CD1 3.33Å; N157-I161 VanDerWaalsContact O-CG1 3.25Å; N157-I161 WeakPolarHBondContact O-CG1 3.3Å; N157-I161 PolarHBondContact O-N 3.34Å
158I81.9Confident80.9Confident20 Ų2059.3 Ų59.310%0.10331%0.309CS..Hα-helixtrans-61.8-45.9176.9-62.9169.3000110.6I154 Y155 T160 I161 C162 L175 M201 L207I154-I158 HydrophobicContact CG2-CD1 4Å; I154-I158 WeakPolarHBondContact O-CG1 3.33Å; I154-I158 PolarHBondContact O-N 2.96Å; Y155-I158 PolarHBondContact O-N 3.32Å; I158-T160 PolarHBondContact O-N 3.47Å; I158-I161 WeakPolarHBondContact O-CB 3.27Å; I158-I161 PolarHBondContact O-N 3.28Å; I158-C162 PolarHBondContact O-N 2.89Å; I158-C162 PolarHBondContact O-SG 3.05Å; I158-L175 HydrophobicContact CG1-CD2 4Å; I158-L175 HydrophobicContact CG2-CD1 4.33Å; I158-M201 HydrophobicContact CG2-CE 4.22Å; I158-L207 HydrophobicContact CG2-CD1 4.24Å; I158-L207 HydrophobicContact CG2-CD2 4.15Å
159W82.4Confident79Confident65 Ų6566.3 Ų66.325%0.24634%0.34CS..Hα-helixtrans-58.2-46.4176.1178.3-99.3000112Y155 I161 C162 Q163 D208Y155-W159 VanDerWaalsContact O-CB 3.29Å; Y155-W159 WeakPolarHBondContact O-CB 3.45Å; Y155-W159 PolarHBondContact O-N 3.45Å; W159-I161 VanDerWaalsContact C-N 3.31Å; W159-I161 PolarHBondContact O-N 3Å; W159-C162 WeakPolarHBondContact O-CB 3.34Å; W159-C162 PolarHBondContact O-N 3.21Å; W159-C162 VanDerWaalsContact O-N 3.15Å; W159-Q163 HydrophobicContact CZ2-CG 4.43Å; W159-Q163 VanDerWaalsContact CZ2-NE2 3.3Å; W159-Q163 WeakPolarHBondContact O-CG 3.23Å; W159-Q163 PolarHBondContact O-N 3.26Å; W159-D208 HydrophobicContact CH2-CB 4.27Å; W159-D208 WeakPolarHBondContact CH2-OD1 3.46Å; W159-D208 HydrophobicContact CZ3-CB 3.81Å; W159-D208 VanDerWaalsContact CZ3-OD1 3.23Å; W159-D208 WeakPolarHBondContact CZ3-OD1 3.38Å
160T82.1Confident77.1Confident51 Ų5167.7 Ų67.731%0.31336%0.363SS..Hα-helixtrans-62.7-39.2178.2-58.20000111.6F156 N157 I158 Q163 N164F156-T160 WeakPolarHBondContact O-CB 3.43Å; F156-T160 PolarHBondContact O-N 2.87Å; F156-T160 PolarHBondContact O-OG1 3Å; N157-T160 PolarHBondContact O-N 3.29Å; I158-T160 PolarHBondContact O-N 3.47Å; T160-Q163 PolarHBondContact O-N 2.85Å; T160-N164 WeakPolarHBondContact O-CB 3.37Å; T160-N164 PolarHBondContact O-N 3.35Å
161I80.6Confident75.6Confident37 Ų3767.6 Ų67.619%0.1937%0.366CS..Hα-helixtrans-63.3-42.8174-71.2162.3000110.8N157 I158 W159 Q163 N164 A165 L173 L175 F198N157-I161 WeakPolarHBondContact O-CD1 3.33Å; N157-I161 VanDerWaalsContact O-CG1 3.25Å; N157-I161 WeakPolarHBondContact O-CG1 3.3Å; N157-I161 PolarHBondContact O-N 3.34Å; I158-I161 WeakPolarHBondContact O-CB 3.27Å; I158-I161 PolarHBondContact O-N 3.28Å; W159-I161 VanDerWaalsContact C-N 3.31Å; W159-I161 PolarHBondContact O-N 3Å; I161-Q163 PolarHBondContact O-N 3.08Å; I161-N164 PolarHBondContact O-N 3.45Å; I161-A165 PolarHBondContact O-N 3.22Å; I161-L173 HydrophobicContact CD1-CD2 3.8Å; I161-L173 HydrophobicContact CG1-CD2 3.98Å; I161-L173 HydrophobicContact CG2-CD2 3.97Å; I161-L175 HydrophobicContact CD1-CD2 4.26Å; I161-F198 HydrophobicContact CG2-CE2 4.07Å; I161-F198 HydrophobicContact CG2-CZ 3.84Å
162C81Confident74.5Confident16 Ų1671.7 Ų71.711%0.10839%0.39CS..Hα-helixtrans-61.9-41.5176.6-74.90000112.6I158 W159 A165 C202I158-C162 PolarHBondContact O-N 2.89Å; I158-C162 PolarHBondContact O-SG 3.05Å; W159-C162 WeakPolarHBondContact O-CB 3.34Å; W159-C162 PolarHBondContact O-N 3.21Å; W159-C162 VanDerWaalsContact O-N 3.15Å; C162-A165 WeakPolarHBondContact O-CB 3.26Å; C162-A165 PolarHBondContact O-N 3.47Å; C162-C202 WeakPolarHBondContact CA-SG 3.42Å; C162-C202 HydrophobicContact CB-CB 3.51Å; C162-C202 WeakPolarHBondContact CB-SG 3.29Å; C162-C202 WeakPolarHBondContact SG-CA 3.34Å; C162-C202 WeakPolarHBondContact SG-CB 3.14Å; C162-C202 CovalentContact SG-SG 2.04Å; C162-C202 PolarHBondContact SG-SG 2.88Å
163Q78.4Confident73.5Confident115 Ų11574.1 Ų74.154%0.53740%0.402SS..Hα-helixtrans-68.7-37.1178.1-69.5-67.2-32.900112.6W159 T160 I161 A165W159-Q163 HydrophobicContact CZ2-CG 4.43Å; W159-Q163 VanDerWaalsContact CZ2-NE2 3.3Å; W159-Q163 WeakPolarHBondContact O-CG 3.23Å; W159-Q163 PolarHBondContact O-N 3.26Å; T160-Q163 PolarHBondContact O-N 2.85Å; I161-Q163 PolarHBondContact O-N 3.08Å; Q163-A165 VanDerWaalsContact C-N 3.34Å
164N76.3Confident72.8Confident80 Ų8070.3 Ų70.343%0.42839%0.391SS..THydrogen-bonded Turntrans-90.68.1-179.9-74.3-13.6000113.9T160 I161 T166 I167 L168T160-N164 WeakPolarHBondContact O-CB 3.37Å; T160-N164 PolarHBondContact O-N 3.35Å; I161-N164 PolarHBondContact O-N 3.45Å; N164-T166 PolarHBondContact O-N 3.01Å; N164-I167 PolarHBondContact O-N 3.31Å; N164-L168 PolarHBondContact O-N 2.97Å
165A68.8Low72.2Confident8 Ų869.2 Ų69.27%0.06639%0.385CS..THydrogen-bonded Turntrans-60.5-28.2-17500000113.7I161 C162 Q163 I167 L168 F198I161-A165 PolarHBondContact O-N 3.22Å; C162-A165 WeakPolarHBondContact O-CB 3.26Å; C162-A165 PolarHBondContact O-N 3.47Å; Q163-A165 VanDerWaalsContact C-N 3.34Å; A165-I167 VanDerWaalsContact C-N 3.34Å; A165-L168 PolarHBondContact O-N 3.41Å; A165-F198 HydrophobicContact CB-CE1 3.97Å; A165-F198 HydrophobicContact CB-CZ 4.44Å
166T59.4Low71.6Confident104 Ų10469.1 Ų69.164%0.63839%0.386SS*.THydrogen-bonded Turntrans-70.4-26.1176.145.50000113.4N164N164-T166 PolarHBondContact O-N 3.01Å
167I57Low70.8Confident139 Ų13964.5 Ų64.571%0.71337%0.367SS*.THydrogen-bonded Turntrans-83.1-22.8176.2-56.6179000110.7N164 A165 E169N164-I167 PolarHBondContact O-N 3.31Å; A165-I167 VanDerWaalsContact C-N 3.34Å; I167-E169 PolarHBondContact O-N 3.43Å
168L55.9Low69.9Low48 Ų4866 Ų6625%0.25137%0.369SS..THydrogen-bonded Turntrans-81.88.7178.1-108.381.2000114N164 A165 G170 V171 L173 T193N164-L168 PolarHBondContact O-N 2.97Å; A165-L168 PolarHBondContact O-N 3.41Å; L168-G170 PolarHBondContact O-N 3.01Å; L168-V171 HydrophobicContact CG-CB 4.33Å; L168-V171 PolarHBondContact O-N 3.1Å; L168-L173 HydrophobicContact CD2-CB 3.71Å; L168-L173 HydrophobicContact CD2-CD2 4.17Å; L168-T193 HydrophobicContact CB-CG2 4.36Å
169E52.9Low69.2Low164 Ų16472 Ų7277%0.76640%0.396SS*.THydrogen-bonded Turntrans-58.982.4171.5-78.1-173.816300110.6I167I167-E169 PolarHBondContact O-N 3.43Å
170G54.3Low68.5Low80 Ų8073.1 Ų73.183%0.82540%0.401SS*.THydrogen-bonded Turntrans143-14.2-176.400000115.3L168L168-G170 PolarHBondContact O-N 3.01Å
171V60.8Low67.7Low97 Ų9773.7 Ų73.759%0.58842%0.417SS*.  trans-120.2117.1178.5-1770000110L168 L173L168-V171 HydrophobicContact CG-CB 4.33Å; L168-V171 PolarHBondContact O-N 3.1Å; V171-L173 PolarHBondContact O-N 3.47Å
172T64.2Low67.1Low121 Ų12173.9 Ų73.974%0.74242%0.418SS*.  trans-79.988.317852.30000110.7
173L72.1Confident66.1Low71 Ų7173.7 Ų73.737%0.37242%0.416SS..  trans-85128170-172.369.6000109.8I161 L168 V171 C192 T193I161-L173 HydrophobicContact CD1-CD2 3.8Å; I161-L173 HydrophobicContact CG1-CD2 3.98Å; I161-L173 HydrophobicContact CG2-CD2 3.97Å; L168-L173 HydrophobicContact CD2-CB 3.71Å; L168-L173 HydrophobicContact CD2-CD2 4.17Å; V171-L173 PolarHBondContact O-N 3.47Å; L173-C192 CarbonylContact O-C 3.41Å; L173-C192 WeakPolarHBondContact O-CA 3.46Å; L173-T193 PolarHBondContact O-N 3.05Å; L173-T193 PolarHBondContact O-OG1 2.7Å; L173-T193 VanDerWaalsContact O-OG1 3.04Å
174C75.3Confident65.3Low49 Ų4972 Ų7233%0.33142%0.415SS..EExtended strand (participates in β ladder)trans-114.3121.8178.1-59.90000110.5D176 C192C174-D176 PolarHBondContact O-N 2.76Å; C174-C192 HydrophobicContact CB-CB 4.03Å; C174-C192 WeakPolarHBondContact CB-SG 3.4Å; C174-C192 WeakPolarHBondContact SG-CB 3.43Å; C174-C192 CovalentContact SG-SG 2.03Å; C174-C192 PolarHBondContact SG-SG 3.49Å
175L75.1Confident64.4Low9 Ų975.1 Ų75.15%0.04743%0.43CS..EExtended strand (participates in β ladder)trans-74.2110169.4-72.6161.9000108.1F62 I158 I161 T190 V191 F198 M201F62-L175 HydrophobicContact CE1-CB 4.33Å; F62-L175 HydrophobicContact CZ-CB 4.34Å; I158-L175 HydrophobicContact CG1-CD2 4Å; I158-L175 HydrophobicContact CG2-CD1 4.33Å; I161-L175 HydrophobicContact CD1-CD2 4.26Å; L175-T190 WeakPolarHBondContact O-CA 3.32Å; L175-V191 PolarHBondContact N-O 3.05Å; L175-V191 PolarHBondContact O-N 3.34Å; L175-F198 HydrophobicContact CD1-CD2 4.15Å; L175-F198 HydrophobicContact CD1-CE2 3.88Å; L175-M201 HydrophobicContact CD1-CE 3.77Å
176D71.9Confident63.6Low19 Ų1978.4 Ų78.410%0.10247%0.465CS..  trans-107.5110.8173.5-169.6-20.2000109.6C174 R178 Q179 T190C174-D176 PolarHBondContact O-N 2.76Å; D176-R178 PolarHBondContact O-N 3Å; D176-R178 WeakPolarHBondContact OD1-CB 3.12Å; D176-R178 VanDerWaalsContact OD1-CG 3.23Å; D176-R178 WeakPolarHBondContact OD1-CG 3.49Å; D176-R178 IonicContact OD1-CZ 3.46Å; D176-R178 PolarHBondContact OD1-N 3.46Å; D176-R178 IonicContact OD1-NE 3.57Å; D176-R178 PolarHBondContact OD1-NE 2.95Å; D176-R178 IonicContact OD2-CZ 3.02Å; D176-R178 VanDerWaalsContact OD2-CZ 3.24Å; D176-R178 IonicContact OD2-NE 3.95Å; D176-R178 PolarHBondContact OD2-NE 2.97Å; D176-R178 IonicContact OD2-NH2 2.65Å; D176-R178 PolarHBondContact OD2-NH2 3.36Å; D176-Q179 HydrophobicContact CB-CG 4.1Å; D176-Q179 WeakPolarHBondContact O-CB 3.15Å; D176-Q179 PolarHBondContact O-N 3.29Å; D176-T190 HydrophobicContact CB-CG2 3.64Å; D176-T190 VanDerWaalsContact CG-CG2 3.46Å; D176-T190 WeakPolarHBondContact OD2-CG2 3.29Å
177P69.9Low63.5Low9 Ų977.9 Ų77.96%0.05846%0.455CS..G310 helixtrans-62.1-16.5-179.724.7-31.7000113F62 Q179 Y180 I182 V183 K189F62-P177 HydrophobicContact CD1-CG 3.8Å; F62-P177 HydrophobicContact CE1-CG 4.17Å; P177-Q179 VanDerWaalsContact C-N 3.33Å; P177-Q179 PolarHBondContact O-N 3.49Å; P177-Y180 PolarHBondContact O-N 3.32Å; P177-I182 HydrophobicContact CB-CB 4.17Å; P177-I182 HydrophobicContact CB-CG2 4.36Å; P177-I182 WeakPolarHBondContact O-CB 3.39Å; P177-I182 PolarHBondContact O-N 2.84Å; P177-V183 HydrophobicContact CB-CG2 4.01Å; P177-V183 HydrophobicContact CG-CG2 4.04Å; P177-K189 VanDerWaalsContact CD-O 3.29Å; P177-K189 WeakPolarHBondContact CD-O 3.47Å
178R67.4Low63.3Low85 Ų8573.7 Ų73.732%0.32145%0.447SS..G310 helixtrans-66.9-32.3174.1-60178.2-67.6-1792.3112.8D176 Y180 G181 V183 I185D176-R178 PolarHBondContact O-N 3Å; D176-R178 WeakPolarHBondContact OD1-CB 3.12Å; D176-R178 VanDerWaalsContact OD1-CG 3.23Å; D176-R178 WeakPolarHBondContact OD1-CG 3.49Å; D176-R178 IonicContact OD1-CZ 3.46Å; D176-R178 PolarHBondContact OD1-N 3.46Å; D176-R178 IonicContact OD1-NE 3.57Å; D176-R178 PolarHBondContact OD1-NE 2.95Å; D176-R178 IonicContact OD2-CZ 3.02Å; D176-R178 VanDerWaalsContact OD2-CZ 3.24Å; D176-R178 IonicContact OD2-NE 3.95Å; D176-R178 PolarHBondContact OD2-NE 2.97Å; D176-R178 IonicContact OD2-NH2 2.65Å; D176-R178 PolarHBondContact OD2-NH2 3.36Å; R178-Y180 PolarHBondContact O-N 2.98Å; R178-G181 PolarHBondContact O-N 3.32Å; R178-G181 VanDerWaalsContact O-N 3.09Å; R178-V183 HydrophobicContact CG-CB 4.43Å; R178-I185 PolarHBondContact NH1-O 3.07Å
179Q66.9Low63.8Low145 Ų14574.4 Ų74.468%0.67845%0.448SS*.G310 helixtrans-65.1-24.1179.1-66.7177.6-57.800112.3D176 P177D176-Q179 HydrophobicContact CB-CG 4.1Å; D176-Q179 WeakPolarHBondContact O-CB 3.15Å; D176-Q179 PolarHBondContact O-N 3.29Å; P177-Q179 VanDerWaalsContact C-N 3.33Å; P177-Q179 PolarHBondContact O-N 3.49Å
180Y68.9Low64.7Low89 Ų8969.6 Ų69.635%0.34943%0.43SS..G310 helixtrans-98.34.1179-58.2-76.2000112.7I154 P177 R178 I182I154-Y180 HydrophobicContact CD1-CD1 4.02Å; I154-Y180 HydrophobicContact CD1-CG 4.46Å; I154-Y180 HydrophobicContact CG1-CD1 3.81Å; I154-Y180 HydrophobicContact CG1-CE1 4.27Å; I154-Y180 HydrophobicContact CG2-CD1 4.08Å; I154-Y180 HydrophobicContact CG2-CE1 4.29Å; I154-Y180 HydrophobicContact CG2-CG 4.34Å; P177-Y180 PolarHBondContact O-N 3.32Å; R178-Y180 PolarHBondContact O-N 2.98Å; Y180-I182 PolarHBondContact O-N 2.87Å
181G64.8Low65.6Low62 Ų6266.1 Ų66.164%0.63939%0.393SS*.THydrogen-bonded Turntrans7017.4-177.600000114.2R178R178-G181 PolarHBondContact O-N 3.32Å; R178-G181 VanDerWaalsContact O-N 3.09Å
182I66.9Low66.5Low41 Ų4163.3 Ų63.321%0.2138%0.376CS..SBendtrans-85.1-16.6-175.3-60.7172.4000111.6L58 V74 P177 Y180L58-I182 HydrophobicContact CD1-CG2 4.22Å; L58-I182 HydrophobicContact CD2-CG2 3.81Å; L58-I182 HydrophobicContact CG-CG2 4.41Å; V74-I182 VanDerWaalsContact CB-O 3.23Å; V74-I182 WeakPolarHBondContact CB-O 3.26Å; V74-I182 HydrophobicContact CG1-CG2 4.1Å; V74-I182 WeakPolarHBondContact CG2-O 3.32Å; P177-I182 HydrophobicContact CB-CB 4.17Å; P177-I182 HydrophobicContact CB-CG2 4.36Å; P177-I182 WeakPolarHBondContact O-CB 3.39Å; P177-I182 PolarHBondContact O-N 2.84Å; Y180-I182 PolarHBondContact O-N 2.87Å
183V61.7Low66.7Low12 Ų1258.4 Ų58.47%0.07335%0.346CS..SBendtrans-144.1140.5178.8-177.90000109.6V64 P177 R178 E187V64-V183 HydrophobicContact CG1-CG2 4.36Å; V64-V183 HydrophobicContact CG2-CG2 4.13Å; P177-V183 HydrophobicContact CB-CG2 4.01Å; P177-V183 HydrophobicContact CG-CG2 4.04Å; R178-V183 HydrophobicContact CG-CB 4.43Å; V183-E187 HydrophobicContact CG1-CB 4.39Å
184P61.8Low66.5Low79 Ų7957.6 Ų57.651%0.51336%0.355SS..  trans-59.5150.1172.321.5-31.3000112.5G186P184-G186 PolarHBondContact O-N 2.72Å
185I56.4Low66.6Low146 Ų14657.2 Ų57.275%0.74935%0.353SS*.THydrogen-bonded Turntrans-59.4-17.3-165.3-58.5172.7000114.1R178R178-I185 PolarHBondContact NH1-O 3.07Å
186G52.5Low66.7Low78 Ų7862.8 Ų62.880%0.80438%0.383SS*.THydrogen-bonded Turntrans-78.3-19.8-172.400000117.3P184P184-G186 PolarHBondContact O-N 2.72Å
187E56Low66.9Low92 Ų9266 Ų6643%0.4340%0.396SS..  trans-110.492.7178.6-69.3-164.9-173.700110.8V183 K189V183-E187 HydrophobicContact CG1-CB 4.39Å; E187-K189 VanDerWaalsContact C-N 3.29Å; E187-K189 PolarHBondContact O-N 3.21Å
188G54.7Low67.5Low52 Ų5265.6 Ų65.654%0.53639%0.393SS..  trans-73.278.3177.400000112
189K65.4Low68Low63 Ų6366.5 Ų66.527%0.27440%0.398SS..  trans-10583.2173.2-58-159.6-176.4-1640109.8F62 E63 P177 E187F62-K189 VanDerWaalsContact O-CB 3.3Å; F62-K189 WeakPolarHBondContact O-CB 3.46Å; F62-K189 WeakPolarHBondContact O-CD 3.46Å; E63-K189 HydrophobicContact CB-CD 4.17Å; E63-K189 PolarHBondContact O-NZ 3.18Å; P177-K189 VanDerWaalsContact CD-O 3.29Å; P177-K189 WeakPolarHBondContact CD-O 3.47Å; E187-K189 VanDerWaalsContact C-N 3.29Å; E187-K189 PolarHBondContact O-N 3.21Å
190T72.3Confident68.8Low63 Ų6366.2 Ų66.239%0.38739%0.394SS..  trans-94.5140.6178.158.60000110.8L175 D176L175-T190 WeakPolarHBondContact O-CA 3.32Å; D176-T190 HydrophobicContact CB-CG2 3.64Å; D176-T190 VanDerWaalsContact CG-CG2 3.46Å; D176-T190 WeakPolarHBondContact OD2-CG2 3.29Å
191V73.6Confident69.5Low7 Ų762 Ų624%0.04238%0.378CS..EExtended strand (participates in β ladder)trans-110.8111.3175.8176.50000108.4F62 L175 F198F62-V191 HydrophobicContact CD1-CB 4.39Å; F62-V191 HydrophobicContact CD1-CG2 3.54Å; F62-V191 HydrophobicContact CE1-CB 3.87Å; F62-V191 HydrophobicContact CE1-CG2 3.51Å; F62-V191 HydrophobicContact CG-CG2 4.14Å; F62-V191 HydrophobicContact CZ-CB 4.3Å; F62-V191 HydrophobicContact CZ-CG2 4.08Å; L175-V191 PolarHBondContact N-O 3.05Å; L175-V191 PolarHBondContact O-N 3.34Å; V191-F198 HydrophobicContact CG1-CB 3.77Å; V191-F198 HydrophobicContact CG1-CD2 4.17Å; V191-F198 HydrophobicContact CG1-CG 4.49Å
192C77.8Confident70.3Confident37 Ų3760.3 Ų60.325%0.2536%0.355CS..EExtended strand (participates in β ladder)trans-98.7145.2-175.5-54.50000113.3L173 C174 G194 S195 F198L173-C192 CarbonylContact O-C 3.41Å; L173-C192 WeakPolarHBondContact O-CA 3.46Å; C174-C192 HydrophobicContact CB-CB 4.03Å; C174-C192 WeakPolarHBondContact CB-SG 3.4Å; C174-C192 WeakPolarHBondContact SG-CB 3.43Å; C174-C192 CovalentContact SG-SG 2.03Å; C174-C192 PolarHBondContact SG-SG 3.49Å; C192-G194 PolarHBondContact O-N 3.41Å; C192-S195 WeakPolarHBondContact O-CB 3.42Å; C192-S195 PolarHBondContact O-N 2.71Å; C192-S195 VanDerWaalsContact O-N 3.08Å; C192-S195 PolarHBondContact O-OG 2.88Å; C192-F198 WeakPolarHBondContact O-CB 3.47Å
193T70.4Confident71.2Confident18 Ų1866.6 Ų66.611%0.1138%0.384CS..THydrogen-bonded Turntrans-54.8126.6168-51.70000109.1L168 L173 F198L168-T193 HydrophobicContact CB-CG2 4.36Å; L173-T193 PolarHBondContact O-N 3.05Å; L173-T193 PolarHBondContact O-OG1 2.7Å; L173-T193 VanDerWaalsContact O-OG1 3.04Å; T193-F198 HydrophobicContact CG2-CD1 4.48Å; T193-F198 HydrophobicContact CG2-CE1 4.02Å; T193-F198 HydrophobicContact CG2-CZ 4.41Å
194G66.7Low72.2Confident54 Ų5466.8 Ų66.856%0.55739%0.386SS*.THydrogen-bonded Turntrans102.1-9.6-172.500000115.1C192C192-G194 PolarHBondContact O-N 3.41Å
195S76.6Confident73.3Confident41 Ų4168.3 Ų68.329%0.28739%0.39SS..SBendtrans-85.5144.1171.467.80000112C192 K197 F198 Y199C192-S195 WeakPolarHBondContact O-CB 3.42Å; C192-S195 PolarHBondContact O-N 2.71Å; C192-S195 VanDerWaalsContact O-N 3.08Å; C192-S195 PolarHBondContact O-OG 2.88Å; S195-K197 PolarHBondContact O-N 3.49Å; S195-K197 VanDerWaalsContact O-N 3.14Å; S195-F198 WeakPolarHBondContact O-CB 3.42Å; S195-F198 PolarHBondContact O-N 3.27Å; S195-F198 WeakPolarHBondContact OG-CB 3.21Å; S195-F198 PolarHBondContact OG-N 2.9Å; S195-Y199 WeakPolarHBondContact O-CD2 3.23Å; S195-Y199 PolarHBondContact O-N 3.46Å
196D78.1Confident74.7Confident127 Ų12765.2 Ų65.268%0.67937%0.372SS*.Hα-helixtrans-56-32.8175.8-68.2-24.4000112.4K200D196-K200 WeakPolarHBondContact O-CB 3.44Å; D196-K200 VanDerWaalsContact O-CG 3.28Å; D196-K200 WeakPolarHBondContact O-CG 3.39Å; D196-K200 PolarHBondContact O-N 3.3Å
197K76.8Confident76.2Confident85 Ų8561.7 Ų61.737%0.3734%0.335SS..Hα-helixtrans-66-39177.2-70.6-179.2175.3176.60112E63 S195 M201E63-K197 IonicContact OE1-NZ 3.66Å; E63-K197 PolarHBondContact OE1-NZ 3.45Å; E63-K197 IonicContact OE2-NZ 3.2Å; E63-K197 PolarHBondContact OE2-NZ 3.4Å; S195-K197 PolarHBondContact O-N 3.49Å; S195-K197 VanDerWaalsContact O-N 3.14Å; K197-M201 WeakPolarHBondContact O-CB 3.47Å; K197-M201 PolarHBondContact O-N 3.23Å
198F81.1Confident77.7Confident1 Ų159.4 Ų59.40%0.00433%0.325CS..Hα-helixtrans-64.6-48.1177.1176.5-94.3000111.3I161 A165 L175 V191 C192 T193 S195 K200 M201 C202I161-F198 HydrophobicContact CG2-CE2 4.07Å; I161-F198 HydrophobicContact CG2-CZ 3.84Å; A165-F198 HydrophobicContact CB-CE1 3.97Å; A165-F198 HydrophobicContact CB-CZ 4.44Å; L175-F198 HydrophobicContact CD1-CD2 4.15Å; L175-F198 HydrophobicContact CD1-CE2 3.88Å; V191-F198 HydrophobicContact CG1-CB 3.77Å; V191-F198 HydrophobicContact CG1-CD2 4.17Å; V191-F198 HydrophobicContact CG1-CG 4.49Å; C192-F198 WeakPolarHBondContact O-CB 3.47Å; T193-F198 HydrophobicContact CG2-CD1 4.48Å; T193-F198 HydrophobicContact CG2-CE1 4.02Å; T193-F198 HydrophobicContact CG2-CZ 4.41Å; S195-F198 WeakPolarHBondContact O-CB 3.42Å; S195-F198 PolarHBondContact O-N 3.27Å; S195-F198 WeakPolarHBondContact OG-CB 3.21Å; S195-F198 PolarHBondContact OG-N 2.9Å; F198-K200 PolarHBondContact O-N 2.99Å; F198-M201 HydrophobicContact CD2-CE 4.41Å; F198-M201 PolarHBondContact O-N 3.17Å; F198-C202 PolarHBondContact O-N 3.39Å; F198-C202 PolarHBondContact O-SG 2.83Å; F198-C202 VanDerWaalsContact O-SG 3.4Å
199Y78.9Confident79.4Confident105 Ų10561.4 Ų61.441%0.41232%0.322SS..Hα-helixtrans-63-44.4177.9-71.9-73.2000112S195 M201 C202 E203S195-Y199 WeakPolarHBondContact O-CD2 3.23Å; S195-Y199 PolarHBondContact O-N 3.46Å; Y199-M201 VanDerWaalsContact C-N 3.28Å; Y199-M201 PolarHBondContact O-N 3.21Å; Y199-C202 PolarHBondContact O-N 3.47Å; Y199-E203 WeakPolarHBondContact O-CB 3.26Å; Y199-E203 PolarHBondContact O-N 2.97Å
200K83.5Confident80.6Confident139 Ų13958.6 Ų58.660%0.60431%0.31SS*.Hα-helixtrans-62.9-31.7175.8-74.9178179.9177.80113.4Y61 D196 F198 S204Y61-K200 HydrophobicContact CE1-CB 4.13Å; Y61-K200 PolarHBondContact OH-O 3.12Å; D196-K200 WeakPolarHBondContact O-CB 3.44Å; D196-K200 VanDerWaalsContact O-CG 3.28Å; D196-K200 WeakPolarHBondContact O-CG 3.39Å; D196-K200 PolarHBondContact O-N 3.3Å; F198-K200 PolarHBondContact O-N 2.99Å; K200-S204 WeakPolarHBondContact O-CB 3.45Å; K200-S204 PolarHBondContact O-N 3.27Å
201M83.3Confident81.4Confident1 Ų156.9 Ų56.91%0.00530%0.297CS..Hα-helixtrans-71.9-44174.9-172.7-176.668.400110.9I57 Y61 F62 I158 L175 K197 F198 Y199 S204I57-M201 HydrophobicContact CG2-SD 4.4Å; Y61-M201 HydrophobicContact CD1-CB 3.53Å; Y61-M201 HydrophobicContact CD1-CG 4.07Å; Y61-M201 HydrophobicContact CD2-CB 4.46Å; Y61-M201 HydrophobicContact CD2-CG 4.13Å; Y61-M201 VanDerWaalsContact CE1-CA 3.45Å; Y61-M201 HydrophobicContact CE1-CB 3.77Å; Y61-M201 HydrophobicContact CE1-CG 4.4Å; Y61-M201 HydrophobicContact CE2-CG 4.48Å; Y61-M201 HydrophobicContact CG-CB 3.91Å; Y61-M201 HydrophobicContact CG-CG 3.9Å; Y61-M201 HydrophobicContact CG-SD 4.35Å; F62-M201 HydrophobicContact CE2-SD 3.83Å; F62-M201 HydrophobicContact CZ-SD 4.25Å; I158-M201 HydrophobicContact CG2-CE 4.22Å; L175-M201 HydrophobicContact CD1-CE 3.77Å; K197-M201 WeakPolarHBondContact O-CB 3.47Å; K197-M201 PolarHBondContact O-N 3.23Å; F198-M201 HydrophobicContact CD2-CE 4.41Å; F198-M201 PolarHBondContact O-N 3.17Å; Y199-M201 VanDerWaalsContact C-N 3.28Å; Y199-M201 PolarHBondContact O-N 3.21Å; M201-S204 WeakPolarHBondContact O-CB 3.41Å; M201-S204 PolarHBondContact O-N 3.02Å; M201-S204 VanDerWaalsContact O-N 3.16Å; M201-S204 PolarHBondContact O-OG 3.14Å
202C82.3Confident82.4Confident25 Ų2560.9 Ų60.917%0.16932%0.316CS..Hα-helixtrans-68.2-31.6179.5-71.60000113.6C162 F198 Y199 S204C162-C202 WeakPolarHBondContact CA-SG 3.42Å; C162-C202 HydrophobicContact CB-CB 3.51Å; C162-C202 WeakPolarHBondContact CB-SG 3.29Å; C162-C202 WeakPolarHBondContact SG-CA 3.34Å; C162-C202 WeakPolarHBondContact SG-CB 3.14Å; C162-C202 CovalentContact SG-SG 2.04Å; C162-C202 PolarHBondContact SG-SG 2.88Å; F198-C202 PolarHBondContact O-N 3.39Å; F198-C202 PolarHBondContact O-SG 2.83Å; F198-C202 VanDerWaalsContact O-SG 3.4Å; Y199-C202 PolarHBondContact O-N 3.47Å; C202-S204 VanDerWaalsContact C-N 3.31Å
203E84.8Confident83.2Confident174 Ų17460.7 Ų60.781%0.81331%0.312SS*.THydrogen-bonded Turntrans-83.9-8.4173.9-163.1176.9-17500112.3Y199 N205Y199-E203 WeakPolarHBondContact O-CB 3.26Å; Y199-E203 PolarHBondContact O-N 2.97Å; E203-N205 PolarHBondContact O-N 3.48Å
204S84.3Confident84.3Confident15 Ų1560.5 Ų60.511%0.10531%0.31CS..  trans-70.8132.9-176.376.20000112.2Y61 K200 M201 C202 E206 L207Y61-S204 WeakPolarHBondContact OH-CB 3.38Å; K200-S204 WeakPolarHBondContact O-CB 3.45Å; K200-S204 PolarHBondContact O-N 3.27Å; M201-S204 WeakPolarHBondContact O-CB 3.41Å; M201-S204 PolarHBondContact O-N 3.02Å; M201-S204 VanDerWaalsContact O-N 3.16Å; M201-S204 PolarHBondContact O-OG 3.14Å; C202-S204 VanDerWaalsContact C-N 3.31Å; S204-E206 PolarHBondContact O-N 3.4Å; S204-L207 PolarHBondContact O-N 2.98Å; S204-L207 WeakPolarHBondContact OG-CB 3.17Å; S204-L207 PolarHBondContact OG-N 3.09Å
205N84.6Confident85.7Confident112 Ų11260.8 Ų60.860%0.59930%0.3SS*.Hα-helixtrans-65.5-20.8169.1-168.457.3000111.9E203 M209E203-N205 PolarHBondContact O-N 3.48Å; N205-M209 WeakPolarHBondContact O-CB 3.4Å; N205-M209 PolarHBondContact O-N 3.16Å
206E84.3Confident86.7Confident80 Ų8061.5 Ų61.537%0.37431%0.305SS..Hα-helixtrans-66.3-43.8177.9-63.6-172.817200112T56 S204 T210T56-E206 WeakPolarHBondContact CG2-OE2 3.41Å; S204-E206 PolarHBondContact O-N 3.4Å; E206-T210 VanDerWaalsContact O-CB 3.25Å; E206-T210 WeakPolarHBondContact O-CB 3.16Å; E206-T210 PolarHBondContact O-N 3.09Å; E206-T210 PolarHBondContact O-OG1 3.23Å
207L85Confident87.6Confident4 Ų455.6 Ų55.62%0.02127%0.273CS..Hα-helixtrans-65.9-47.2177.8-174.776.4000111.3I57 Y155 I158 S204 T210 F211I57-L207 HydrophobicContact CD1-CD1 4.03Å; Y155-L207 HydrophobicContact CD1-CD1 3.99Å; Y155-L207 HydrophobicContact CE1-CD1 3.85Å; I158-L207 HydrophobicContact CG2-CD1 4.24Å; I158-L207 HydrophobicContact CG2-CD2 4.15Å; S204-L207 PolarHBondContact O-N 2.98Å; S204-L207 WeakPolarHBondContact OG-CB 3.17Å; S204-L207 PolarHBondContact OG-N 3.09Å; L207-T210 PolarHBondContact O-N 3.46Å; L207-F211 PolarHBondContact O-N 2.8Å
208D87.5Confident88.5Confident44 Ų4453.7 Ų53.724%0.23527%0.267CS..Hα-helixtrans-61.9-48179.5-176.663.4000111.9W159 T210 F211 H212W159-D208 HydrophobicContact CH2-CB 4.27Å; W159-D208 WeakPolarHBondContact CH2-OD1 3.46Å; W159-D208 HydrophobicContact CZ3-CB 3.81Å; W159-D208 VanDerWaalsContact CZ3-OD1 3.23Å; W159-D208 WeakPolarHBondContact CZ3-OD1 3.38Å; D208-T210 PolarHBondContact O-N 3.15Å; D208-F211 PolarHBondContact O-N 3.22Å; D208-H212 PolarHBondContact O-N 3.45Å; D208-H212 VanDerWaalsContact O-N 3.13Å; D208-H212 PolarHBondContact O-ND1 3.18Å; D208-H212 IonicContact OD1-CE1 3.24Å; D208-H212 PolarHBondContact OD1-CE1 2.76Å; D208-H212 IonicContact OD1-ND1 2.96Å; D208-H212 PolarHBondContact OD1-ND1 2.8Å; D208-H212 IonicContact OD2-CE1 3Å; D208-H212 IonicContact OD2-ND1 2.69Å
209M89.8Confident89.3Confident95 Ų9556.6 Ų56.647%0.46829%0.291SS..Hα-helixtrans-61.3-44.7177.2-173.866.970.700111.2N205 F211 H212 L213N205-M209 WeakPolarHBondContact O-CB 3.4Å; N205-M209 PolarHBondContact O-N 3.16Å; M209-F211 VanDerWaalsContact C-N 3.33Å; M209-F211 PolarHBondContact O-N 2.98Å; M209-H212 PolarHBondContact O-N 2.92Å; M209-L213 HydrophobicContact CG-CD1 3.82Å; M209-L213 HydrophobicContact CG-CG 4.36Å; M209-L213 WeakPolarHBondContact O-CB 3.05Å; M209-L213 WeakPolarHBondContact O-CD1 3.36Å; M209-L213 WeakPolarHBondContact O-CG 3.45Å; M209-L213 PolarHBondContact O-N 2.94Å
210T90.4Very high90.2Very high4 Ų451.6 Ų51.63%0.02527%0.271CS..Hα-helixtrans-62-40.5179.6-59.20000111.8A50 I57 Y155 E206 L207 D208 L213 F214A50-T210 HydrophobicContact CB-CG2 4.48Å; I57-T210 HydrophobicContact CD1-CG2 4.46Å; Y155-T210 HydrophobicContact CD1-CG2 4.39Å; Y155-T210 HydrophobicContact CE1-CG2 3.6Å; Y155-T210 HydrophobicContact CE2-CG2 4.31Å; Y155-T210 WeakPolarHBondContact OH-CG2 3.44Å; E206-T210 VanDerWaalsContact O-CB 3.25Å; E206-T210 WeakPolarHBondContact O-CB 3.16Å; E206-T210 PolarHBondContact O-N 3.09Å; E206-T210 PolarHBondContact O-OG1 3.23Å; L207-T210 PolarHBondContact O-N 3.46Å; D208-T210 PolarHBondContact O-N 3.15Å; T210-L213 PolarHBondContact O-N 3.31Å; T210-F214 HydrophobicContact CG2-CD2 3.82Å; T210-F214 HydrophobicContact CG2-CE2 3.63Å; T210-F214 VanDerWaalsContact O-CD2 3.29Å; T210-F214 WeakPolarHBondContact O-CD2 3.31Å; T210-F214 PolarHBondContact O-N 3.4Å
211F90.1Very high90.9Very high27 Ų2745 Ų4512%0.11824%0.243CC..Hα-helixtrans-60.4-50.6175.3169.2-110.5000111.9F156 L207 D208 M209 L213 F214 V215F156-F211 HydrophobicContact CB-CE2 3.97Å; F156-F211 HydrophobicContact CD2-CE2 4.26Å; F156-F211 HydrophobicContact CD2-CZ 4.1Å; L207-F211 PolarHBondContact O-N 2.8Å; D208-F211 PolarHBondContact O-N 3.22Å; M209-F211 VanDerWaalsContact C-N 3.33Å; M209-F211 PolarHBondContact O-N 2.98Å; F211-L213 VanDerWaalsContact C-N 3.3Å; F211-L213 PolarHBondContact O-N 3.17Å; F211-F214 PolarHBondContact O-N 3.18Å; F211-V215 HydrophobicContact CD2-CG2 4.33Å; F211-V215 HydrophobicContact CE1-CG2 4.33Å; F211-V215 HydrophobicContact CE2-CG2 3.88Å; F211-V215 HydrophobicContact CZ-CG2 3.88Å; F211-V215 WeakPolarHBondContact O-CG2 3.42Å; F211-V215 PolarHBondContact O-N 3.03Å
212H93.5Very high91.6Very high91 Ų9145.9 Ų45.942%0.42125%0.253SS..Hα-helixtrans-61.9-38.7178.3-72.890.3000112D208 M209 F214 V215 C216D208-H212 PolarHBondContact O-N 3.45Å; D208-H212 VanDerWaalsContact O-N 3.13Å; D208-H212 PolarHBondContact O-ND1 3.18Å; D208-H212 IonicContact OD1-CE1 3.24Å; D208-H212 PolarHBondContact OD1-CE1 2.76Å; D208-H212 IonicContact OD1-ND1 2.96Å; D208-H212 PolarHBondContact OD1-ND1 2.8Å; D208-H212 IonicContact OD2-CE1 3Å; D208-H212 IonicContact OD2-ND1 2.69Å; M209-H212 PolarHBondContact O-N 2.92Å; H212-F214 PolarHBondContact O-N 3.05Å; H212-V215 PolarHBondContact O-N 3.44Å; H212-C216 WeakPolarHBondContact O-CB 3.4Å; H212-C216 PolarHBondContact O-N 3.35Å; H212-C216 PolarHBondContact O-SG 3.46Å
213L94.8Very high92.3Very high33 Ų3345.7 Ų45.717%0.17325%0.252CS..Hα-helixtrans-62.9-40.8175.6-71.9164.8000112.1C46 E49 A50 M209 T210 F211 C216 S217C46-L213 HydrophobicContact CB-CB 4.48Å; C46-L213 HydrophobicContact CB-CD2 4.04Å; C46-L213 WeakPolarHBondContact CB-O 3.31Å; E49-L213 HydrophobicContact CB-CD1 3.79Å; E49-L213 HydrophobicContact CB-CD2 4.17Å; A50-L213 HydrophobicContact CB-CB 3.8Å; M209-L213 HydrophobicContact CG-CD1 3.82Å; M209-L213 HydrophobicContact CG-CG 4.36Å; M209-L213 WeakPolarHBondContact O-CB 3.05Å; M209-L213 WeakPolarHBondContact O-CD1 3.36Å; M209-L213 WeakPolarHBondContact O-CG 3.45Å; M209-L213 PolarHBondContact O-N 2.94Å; T210-L213 PolarHBondContact O-N 3.31Å; F211-L213 VanDerWaalsContact C-N 3.3Å; F211-L213 PolarHBondContact O-N 3.17Å; L213-C216 PolarHBondContact O-N 2.78Å; L213-S217 WeakPolarHBondContact O-CB 3.39Å; L213-S217 PolarHBondContact O-N 3.46Å
214F94.6Very high92.9Very high14 Ų1437.4 Ų37.46%0.06121%0.214CC..Hα-helixtrans-64.9-39.8173.7-85.5-61.6000112.5A50 P151 V152 Y155 T210 F211 H212 S217 L218A50-F214 HydrophobicContact CB-CD1 3.9Å; A50-F214 HydrophobicContact CB-CD2 3.8Å; A50-F214 HydrophobicContact CB-CE1 3.83Å; A50-F214 HydrophobicContact CB-CE2 3.72Å; A50-F214 HydrophobicContact CB-CG 3.87Å; A50-F214 HydrophobicContact CB-CZ 3.74Å; P151-F214 HydrophobicContact CB-CD1 3.93Å; P151-F214 HydrophobicContact CB-CE1 3.77Å; P151-F214 HydrophobicContact CB-CE2 4.44Å; P151-F214 HydrophobicContact CB-CG 4.36Å; P151-F214 HydrophobicContact CB-CZ 4.05Å; P151-F214 HydrophobicContact CG-CD1 3.92Å; P151-F214 HydrophobicContact CG-CE1 3.89Å; V152-F214 HydrophobicContact CG2-CB 3.83Å; V152-F214 WeakPolarHBondContact CG2-O 3.44Å; Y155-F214 AromaticContact CD2-CD2 3.77Å; Y155-F214 HydrophobicContact CD2-CD2 3.77Å; Y155-F214 AromaticContact CD2-CE2 3.84Å; Y155-F214 HydrophobicContact CD2-CE2 3.84Å; Y155-F214 AromaticContact CE2-CD2 3.78Å; Y155-F214 HydrophobicContact CE2-CD2 3.78Å; Y155-F214 AromaticContact CE2-CE2 3.36Å; Y155-F214 HydrophobicContact CE2-CE2 3.36Å; Y155-F214 HydrophobicContact CE2-CZ 4.31Å; Y155-F214 HydrophobicContact CG-CD2 4.36Å; Y155-F214 AromaticContact CZ-CE2 3.91Å; T210-F214 HydrophobicContact CG2-CD2 3.82Å; T210-F214 HydrophobicContact CG2-CE2 3.63Å; T210-F214 VanDerWaalsContact O-CD2 3.29Å; T210-F214 WeakPolarHBondContact O-CD2 3.31Å; T210-F214 PolarHBondContact O-N 3.4Å; F211-F214 PolarHBondContact O-N 3.18Å; H212-F214 PolarHBondContact O-N 3.05Å; F214-S217 PolarHBondContact O-N 2.91Å; F214-L218 PolarHBondContact O-N 3.38Å
215V95.8Very high93.5Very high59 Ų5937.6 Ų37.636%0.35822%0.215SC..Hα-helixtrans-63.5-45.8175.1173.90000111.1V152 F211 H212 S217 L218 A219V152-V215 HydrophobicContact CG1-CG2 4.03Å; F211-V215 HydrophobicContact CD2-CG2 4.33Å; F211-V215 HydrophobicContact CE1-CG2 4.33Å; F211-V215 HydrophobicContact CE2-CG2 3.88Å; F211-V215 HydrophobicContact CZ-CG2 3.88Å; F211-V215 WeakPolarHBondContact O-CG2 3.42Å; F211-V215 PolarHBondContact O-N 3.03Å; H212-V215 PolarHBondContact O-N 3.44Å; V215-S217 VanDerWaalsContact C-N 3.31Å; V215-S217 PolarHBondContact O-N 3.2Å; V215-L218 PolarHBondContact O-N 3.35Å; V215-A219 PolarHBondContact O-N 3.41Å
216C96.7Very high94.1Very high57 Ų5736.4 Ų36.439%0.38521%0.207SC..Hα-helixtrans-61.5-39.1175.1-71.30000112.1C46 H212 L213 A219 G220C46-C216 HydrophobicContact CB-CB 4.02Å; H212-C216 WeakPolarHBondContact O-CB 3.4Å; H212-C216 PolarHBondContact O-N 3.35Å; H212-C216 PolarHBondContact O-SG 3.46Å; L213-C216 PolarHBondContact O-N 2.78Å; C216-A219 PolarHBondContact O-N 3.39Å; C216-G220 PolarHBondContact O-N 3.32Å
217S96.8Very high94.7Very high3 Ų332.6 Ų32.62%0.02119%0.189CC..Hα-helixtrans-63.6-45175.8-176.60000111.4F43 L213 F214 V215 A219 G220 A221F43-S217 WeakPolarHBondContact CD2-O 3.4Å; F43-S217 WeakPolarHBondContact CD2-OG 3.45Å; F43-S217 PolarHBondContact O-OG 3.29Å; L213-S217 WeakPolarHBondContact O-CB 3.39Å; L213-S217 PolarHBondContact O-N 3.46Å; F214-S217 PolarHBondContact O-N 2.91Å; V215-S217 VanDerWaalsContact C-N 3.31Å; V215-S217 PolarHBondContact O-N 3.2Å; S217-A219 VanDerWaalsContact C-N 3.35Å; S217-A219 PolarHBondContact O-N 3.02Å; S217-G220 WeakPolarHBondContact O-CA 3.28Å; S217-G220 PolarHBondContact O-N 3.38Å; S217-G220 VanDerWaalsContact O-N 3.13Å; S217-A221 PolarHBondContact O-N 3.3Å
218L97.4Very high95.2Very high44 Ų4432.4 Ų32.423%0.2319%0.188CC..Hα-helixtrans-59.8-43.7174.7179.664.3000112T145 T148 V152 F214 V215 G220 A221 G222T145-L218 HydrophobicContact CG2-CD1 3.75Å; T145-L218 VanDerWaalsContact O-CD1 3.24Å; T145-L218 WeakPolarHBondContact O-CD1 3.2Å; T148-L218 HydrophobicContact CG2-CB 4.18Å; T148-L218 HydrophobicContact CG2-CD1 4.42Å; V152-L218 HydrophobicContact CG1-CD2 4.47Å; V152-L218 HydrophobicContact CG2-CB 4.14Å; V152-L218 HydrophobicContact CG2-CD2 4.14Å; F214-L218 PolarHBondContact O-N 3.38Å; V215-L218 PolarHBondContact O-N 3.35Å; L218-G220 VanDerWaalsContact C-N 3.32Å; L218-G220 PolarHBondContact O-N 2.91Å; L218-A221 PolarHBondContact O-N 2.95Å; L218-G222 PolarHBondContact O-N 3.23Å
219A97.8Very high95.6Very high62 Ų6233.7 Ų33.751%0.51219%0.194SC..Hα-helixtrans-62.3-39.617500000111.8V215 C216 S217 G222 A223V215-A219 PolarHBondContact O-N 3.41Å; C216-A219 PolarHBondContact O-N 3.39Å; S217-A219 VanDerWaalsContact C-N 3.35Å; S217-A219 PolarHBondContact O-N 3.02Å; A219-G222 PolarHBondContact O-N 2.83Å; A219-A223 WeakPolarHBondContact O-CB 3.27Å; A219-A223 PolarHBondContact O-N 3.46Å
220G97.5Very high95.9Very high0 Ų032.6 Ų32.60%019%0.188CC..Hα-helixtrans-61.2-45.2174.100000113G39 C216 S217 L218 G222 A223 A224G39-G220 CarbonylContact C-O 3.59Å; G39-G220 VanDerWaalsContact CA-O 3.27Å; G39-G220 WeakPolarHBondContact CA-O 3.33Å; G39-G220 CarbonylContact O-C 3.36Å; G39-G220 WeakPolarHBondContact O-CA 3.34Å; C216-G220 PolarHBondContact O-N 3.32Å; S217-G220 WeakPolarHBondContact O-CA 3.28Å; S217-G220 PolarHBondContact O-N 3.38Å; S217-G220 VanDerWaalsContact O-N 3.13Å; L218-G220 VanDerWaalsContact C-N 3.32Å; L218-G220 PolarHBondContact O-N 2.91Å; G220-G222 VanDerWaalsContact C-N 3.35Å; G220-G222 PolarHBondContact O-N 2.75Å; G220-A223 PolarHBondContact O-N 2.9Å; G220-A224 PolarHBondContact O-N 3.06Å
221A97.6Very high96Very high0 Ų032.5 Ų32.50%019%0.187CC..Hα-helixtrans-61.4-43174.600000111.7F43 W141 V144 S217 L218 A224 V225F43-A221 HydrophobicContact CD2-CB 3.8Å; F43-A221 HydrophobicContact CE2-CB 4.3Å; F43-A221 HydrophobicContact CG-CB 4.46Å; W141-A221 HydrophobicContact CE3-CB 4.16Å; W141-A221 HydrophobicContact CZ3-CB 4.15Å; V144-A221 HydrophobicContact CG1-CB 4.32Å; S217-A221 PolarHBondContact O-N 3.3Å; L218-A221 PolarHBondContact O-N 2.95Å; A221-A224 WeakPolarHBondContact O-CB 3.38Å; A221-A224 PolarHBondContact O-N 3.17Å; A221-V225 PolarHBondContact O-N 3.05Å
222G97.2Very high96.2Very high21 Ų2132.6 Ų32.622%0.21619%0.189CC..Hα-helixtrans-61.9-42.2174.100000113L218 A219 G220 A224 V225 I226L218-G222 PolarHBondContact O-N 3.23Å; A219-G222 PolarHBondContact O-N 2.83Å; G220-G222 VanDerWaalsContact C-N 3.35Å; G220-G222 PolarHBondContact O-N 2.75Å; G222-A224 VanDerWaalsContact C-N 3.32Å; G222-A224 PolarHBondContact O-N 3.28Å; G222-V225 WeakPolarHBondContact O-CB 3.2Å; G222-V225 PolarHBondContact O-N 3.44Å; G222-I226 WeakPolarHBondContact O-CG1 3.02Å; G222-I226 PolarHBondContact O-N 3.45Å
223A97.6Very high96.1Very high20 Ų2033 Ų3317%0.16519%0.192CC..Hα-helixtrans-62.2-38.8174.900000112L35 A219 G220 I226 A227L35-A223 HydrophobicContact CD1-CB 4.31Å; A219-A223 WeakPolarHBondContact O-CB 3.27Å; A219-A223 PolarHBondContact O-N 3.46Å; G220-A223 PolarHBondContact O-N 2.9Å; A223-I226 PolarHBondContact O-N 3.39Å; A223-A227 WeakPolarHBondContact O-CB 3.21Å; A223-A227 PolarHBondContact O-N 2.81Å
224A97.3Very high95.9Very high0 Ų032.6 Ų32.60%019%0.191CC..Hα-helixtrans-62.9-40.517400000112V40 W141 G220 A221 G222 A227 M228V40-A224 HydrophobicContact CG2-CB 4.41Å; W141-A224 HydrophobicContact CD2-CB 3.64Å; W141-A224 HydrophobicContact CE3-CB 3.71Å; W141-A224 HydrophobicContact CG-CB 4.14Å; W141-A224 HydrophobicContact CH2-CB 4.29Å; W141-A224 HydrophobicContact CZ2-CB 4.25Å; W141-A224 HydrophobicContact CZ3-CB 4.03Å; G220-A224 PolarHBondContact O-N 3.06Å; A221-A224 WeakPolarHBondContact O-CB 3.38Å; A221-A224 PolarHBondContact O-N 3.17Å; G222-A224 VanDerWaalsContact C-N 3.32Å; G222-A224 PolarHBondContact O-N 3.28Å; A224-A227 PolarHBondContact O-N 3.19Å; A224-M228 WeakPolarHBondContact O-CG 3.46Å; A224-M228 PolarHBondContact O-N 3.37Å
225V98Very high95.6Very high20 Ų2032 Ų3212%0.12119%0.189CC..Hα-helixtrans-59.1-48.5172.6175.20000110.9W141 A221 G222 A227 M228 I229W141-V225 HydrophobicContact CB-CG2 3.65Å; A221-V225 PolarHBondContact O-N 3.05Å; G222-V225 WeakPolarHBondContact O-CB 3.2Å; G222-V225 PolarHBondContact O-N 3.44Å; V225-A227 VanDerWaalsContact C-N 3.29Å; V225-A227 PolarHBondContact O-N 3.16Å; V225-M228 PolarHBondContact O-N 3.44Å; V225-I229 HydrophobicContact CG1-CD1 3.96Å; V225-I229 WeakPolarHBondContact O-CG1 3.34Å; V225-I229 PolarHBondContact O-N 3.04Å
226I96.9Very high95.3Very high86 Ų8632.1 Ų32.144%0.44119%0.192SC..Hα-helixtrans-61-41.4179.3-64.4167.9000110.6L35 G222 A223 I229 H230L35-I226 HydrophobicContact CD2-CB 4.2Å; L35-I226 HydrophobicContact CD2-CG2 3.73Å; G222-I226 WeakPolarHBondContact O-CG1 3.02Å; G222-I226 PolarHBondContact O-N 3.45Å; A223-I226 PolarHBondContact O-N 3.39Å; I226-I229 PolarHBondContact O-N 3.49Å; I226-H230 PolarHBondContact O-N 3.14Å; I226-H230 PolarHBondContact O-ND1 2.63Å
227A96.8Very high94.8Very high0 Ų032.2 Ų32.20%020%0.196CC..Hα-helixtrans-61.8-42.6176.100000112L35 L36 A223 A224 V225 I229 H230 Y231L35-A227 HydrophobicContact CB-CB 4.08Å; L35-A227 HydrophobicContact CD2-CB 4.19Å; L35-A227 HydrophobicContact CG-CB 4.05Å; L36-A227 HydrophobicContact CB-CB 3.78Å; L36-A227 HydrophobicContact CD1-CB 4.38Å; A223-A227 WeakPolarHBondContact O-CB 3.21Å; A223-A227 PolarHBondContact O-N 2.81Å; A224-A227 PolarHBondContact O-N 3.19Å; V225-A227 VanDerWaalsContact C-N 3.29Å; V225-A227 PolarHBondContact O-N 3.16Å; A227-I229 VanDerWaalsContact C-N 3.35Å; A227-I229 PolarHBondContact O-N 3.48Å; A227-H230 WeakPolarHBondContact O-CB 3.21Å; A227-H230 PolarHBondContact O-N 2.98Å; A227-Y231 VanDerWaalsContact O-CD2 3.26Å; A227-Y231 WeakPolarHBondContact O-CD2 3.32Å; A227-Y231 PolarHBondContact O-N 3.4Å
228M95.6Very high94.1Very high0 Ų033.4 Ų33.40%020%0.203CC..Hα-helixtrans-63.4-39.6175.7-68-59179.700112.5L36 F92 Y95 T134 F137 M138 A224 V225 H230 Y231 L232L36-M228 HydrophobicContact CD1-CE 3.63Å; L36-M228 HydrophobicContact CD2-CE 4.48Å; F92-M228 HydrophobicContact CD1-CE 3.63Å; F92-M228 HydrophobicContact CE1-CE 3.19Å; F92-M228 HydrophobicContact CZ-CE 4.23Å; Y95-M228 HydrophobicContact CD1-CE 4.35Å; Y95-M228 HydrophobicContact CE1-CE 4.24Å; Y95-M228 HydrophobicContact CE1-SD 4.37Å; T134-M228 HydrophobicContact CG2-CB 4.46Å; T134-M228 HydrophobicContact CG2-SD 3.84Å; F137-M228 HydrophobicContact CB-CE 4.06Å; F137-M228 HydrophobicContact CB-SD 4.45Å; M138-M228 HydrophobicContact CB-CB 3.84Å; M138-M228 HydrophobicContact CG-CB 4.07Å; A224-M228 WeakPolarHBondContact O-CG 3.46Å; A224-M228 PolarHBondContact O-N 3.37Å; V225-M228 PolarHBondContact O-N 3.44Å; M228-H230 VanDerWaalsContact C-N 3.33Å; M228-Y231 PolarHBondContact O-N 3.14Å; M228-L232 WeakPolarHBondContact O-CG 3.32Å; M228-L232 PolarHBondContact O-N 3.02Å
229I96.1Very high93.5Very high71 Ų7134.5 Ų34.536%0.36420%0.204SC..Hα-helixtrans-62.4-43.4174.4-65.6166.9000110.2M138 V225 I226 A227 Y231 L232 M233M138-I229 HydrophobicContact CG-CG1 4.15Å; M138-I229 HydrophobicContact SD-CG1 4.19Å; V225-I229 HydrophobicContact CG1-CD1 3.96Å; V225-I229 WeakPolarHBondContact O-CG1 3.34Å; V225-I229 PolarHBondContact O-N 3.04Å; I226-I229 PolarHBondContact O-N 3.49Å; A227-I229 VanDerWaalsContact C-N 3.35Å; A227-I229 PolarHBondContact O-N 3.48Å; I229-Y231 VanDerWaalsContact C-N 3.34Å; I229-Y231 PolarHBondContact O-N 3.4Å; I229-L232 PolarHBondContact O-N 3.35Å; I229-M233 HydrophobicContact CG2-CE 4.19Å; I229-M233 WeakPolarHBondContact O-CG 3.46Å; I229-M233 PolarHBondContact O-N 2.96Å
230H94.7Very high92.8Very high73 Ų7333.8 Ų33.834%0.33820%0.198SC..Hα-helixtrans-59.7-44.3174.5-78.474.5000111.9A32 I226 A227 M228 L232 M233 V234A32-H230 HydrophobicContact CB-CB 3.9Å; I226-H230 PolarHBondContact O-N 3.14Å; I226-H230 PolarHBondContact O-ND1 2.63Å; A227-H230 WeakPolarHBondContact O-CB 3.21Å; A227-H230 PolarHBondContact O-N 2.98Å; M228-H230 VanDerWaalsContact C-N 3.33Å; H230-L232 PolarHBondContact O-N 3.27Å; H230-M233 HydrophobicContact CB-CE 4.33Å; H230-M233 PolarHBondContact O-N 3.23Å; H230-V234 WeakPolarHBondContact O-CG2 3.37Å; H230-V234 PolarHBondContact O-N 3.34Å
231Y93.5Very high91.8Very high2 Ų239.7 Ų39.71%0.00822%0.221CC..Hα-helixtrans-61-44.4174.2-83-63000112.7A32 T33 L36 L99 A227 M228 I229 M233 V234 L235A32-Y231 HydrophobicContact CB-CD1 4.02Å; A32-Y231 HydrophobicContact CB-CD2 3.83Å; A32-Y231 HydrophobicContact CB-CE1 3.92Å; A32-Y231 HydrophobicContact CB-CE2 3.73Å; A32-Y231 HydrophobicContact CB-CG 4Å; T33-Y231 WeakPolarHBondContact CA-OH 3.27Å; T33-Y231 WeakPolarHBondContact CB-OH 3.21Å; T33-Y231 PolarHBondContact N-OH 3.14Å; T33-Y231 PolarHBondContact OG1-OH 3.05Å; L36-Y231 HydrophobicContact CB-CE2 4.19Å; L36-Y231 HydrophobicContact CD2-CE2 3.93Å; L99-Y231 HydrophobicContact CB-CD1 4.02Å; L99-Y231 HydrophobicContact CB-CE1 3.56Å; L99-Y231 HydrophobicContact CD1-CD1 3.93Å; L99-Y231 HydrophobicContact CD1-CD2 3.79Å; L99-Y231 HydrophobicContact CD1-CE1 4.03Å; L99-Y231 HydrophobicContact CD1-CE2 3.89Å; L99-Y231 HydrophobicContact CD1-CG 3.78Å; L99-Y231 HydrophobicContact CG-CD1 4.48Å; L99-Y231 HydrophobicContact CG-CE1 4.42Å; A227-Y231 VanDerWaalsContact O-CD2 3.26Å; A227-Y231 WeakPolarHBondContact O-CD2 3.32Å; A227-Y231 PolarHBondContact O-N 3.4Å; M228-Y231 PolarHBondContact O-N 3.14Å; I229-Y231 VanDerWaalsContact C-N 3.34Å; I229-Y231 PolarHBondContact O-N 3.4Å; Y231-M233 VanDerWaalsContact C-N 3.31Å; Y231-M233 PolarHBondContact O-N 3.06Å; Y231-V234 PolarHBondContact O-N 2.89Å; Y231-L235 VanDerWaalsContact O-CB 3.27Å; Y231-L235 WeakPolarHBondContact O-CB 3.44Å; Y231-L235 WeakPolarHBondContact O-CG 3.43Å; Y231-L235 PolarHBondContact O-N 3.48Å
232L93.7Very high90.7Very high28 Ų2840.3 Ų40.315%0.14722%0.224CC..Hα-helixtrans-60.6-39.9176.7-74.5169.9000112.3I131 T134 Y135 M138 M228 I229 H230 S236I131-L232 HydrophobicContact CG2-CD2 4.32Å; T134-L232 HydrophobicContact CG2-CD2 3.99Å; T134-L232 HydrophobicContact CG2-CG 3.84Å; Y135-L232 HydrophobicContact CD2-CD1 4.08Å; M138-L232 HydrophobicContact CB-CD1 4.28Å; M138-L232 HydrophobicContact CG-CD1 4.4Å; M138-L232 HydrophobicContact SD-CD1 4.16Å; M228-L232 WeakPolarHBondContact O-CG 3.32Å; M228-L232 PolarHBondContact O-N 3.02Å; I229-L232 PolarHBondContact O-N 3.35Å; H230-L232 PolarHBondContact O-N 3.27Å; L232-S236 WeakPolarHBondContact O-CB 3.38Å; L232-S236 PolarHBondContact O-N 2.89Å; L232-S236 PolarHBondContact O-OG 2.8Å
233M92.2Very high89.8Confident100 Ų10043.3 Ų43.349%0.49323%0.231SC..Hα-helixtrans-61.6-47.2174.7-70.6-172.4-67.600111.3I229 H230 Y231 S236 A237I229-M233 HydrophobicContact CG2-CE 4.19Å; I229-M233 WeakPolarHBondContact O-CG 3.46Å; I229-M233 PolarHBondContact O-N 2.96Å; H230-M233 HydrophobicContact CB-CE 4.33Å; H230-M233 PolarHBondContact O-N 3.23Å; Y231-M233 VanDerWaalsContact C-N 3.31Å; Y231-M233 PolarHBondContact O-N 3.06Å; M233-S236 PolarHBondContact O-OG 3.29Å; M233-A237 WeakPolarHBondContact O-CB 3.29Å; M233-A237 PolarHBondContact O-N 3.49Å
234V89.7Confident88.8Confident24 Ų2446.3 Ų46.315%0.14525%0.245CC..Hα-helixtrans-69-44.4-179179.10000111.5P28 S29 H230 Y231 S236 A237 N238P28-V234 HydrophobicContact CB-CG2 3.41Å; P28-V234 VanDerWaalsContact CB-CG2 3.41Å; S29-V234 WeakPolarHBondContact OG-CG1 3.44Å; H230-V234 WeakPolarHBondContact O-CG2 3.37Å; H230-V234 PolarHBondContact O-N 3.34Å; Y231-V234 PolarHBondContact O-N 2.89Å; V234-S236 VanDerWaalsContact C-N 3.35Å; V234-S236 PolarHBondContact O-N 3.48Å; V234-A237 PolarHBondContact O-N 2.99Å; V234-N238 WeakPolarHBondContact O-CB 3.43Å; V234-N238 PolarHBondContact O-N 3.36Å; V234-N238 PolarHBondContact O-ND2 3.39Å; V234-N238 PolarHBondContact O-OD1 2.95Å
235L89.2Confident87.7Confident3 Ų347.9 Ų47.92%0.01626%0.258CS..Hα-helixtrans-63.2-39.1177.7-68.8174.4000112.1L99 E102 I131 T134 Y231 N238 W239L99-L235 HydrophobicContact CD2-CD1 4.04Å; E102-L235 HydrophobicContact CG-CD2 4.1Å; E102-L235 WeakPolarHBondContact OE2-CD2 3.12Å; I131-L235 HydrophobicContact CD1-CB 4.43Å; I131-L235 HydrophobicContact CG1-CB 3.72Å; I131-L235 HydrophobicContact CG1-CD1 4.38Å; T134-L235 WeakPolarHBondContact OG1-CD1 3.38Å; Y231-L235 VanDerWaalsContact O-CB 3.27Å; Y231-L235 WeakPolarHBondContact O-CB 3.44Å; Y231-L235 WeakPolarHBondContact O-CG 3.43Å; Y231-L235 PolarHBondContact O-N 3.48Å; L235-N238 WeakPolarHBondContact O-CB 3.33Å; L235-N238 PolarHBondContact O-N 2.78Å; L235-W239 WeakPolarHBondContact O-CB 3.24Å; L235-W239 PolarHBondContact O-N 3.01Å
236S89.3Confident86.4Confident60 Ų6048.4 Ų48.442%0.4226%0.262SS..Hα-helixtrans-69.7-40.1177.358.80000112.7L232 M233 V234 N238 W239 A240L232-S236 WeakPolarHBondContact O-CB 3.38Å; L232-S236 PolarHBondContact O-N 2.89Å; L232-S236 PolarHBondContact O-OG 2.8Å; M233-S236 PolarHBondContact O-OG 3.29Å; V234-S236 VanDerWaalsContact C-N 3.35Å; V234-S236 PolarHBondContact O-N 3.48Å; S236-N238 VanDerWaalsContact C-N 3.33Å; S236-W239 PolarHBondContact O-N 3.18Å; S236-A240 PolarHBondContact O-N 3.19Å
237A86.2Confident85.5Confident59 Ų5951.6 Ų51.649%0.48827%0.268SS..Hα-helixtrans-61.4-44.5172.200000111.3M233 V234 W239 A240 Y241M233-A237 WeakPolarHBondContact O-CB 3.29Å; M233-A237 PolarHBondContact O-N 3.49Å; V234-A237 PolarHBondContact O-N 2.99Å; A237-W239 VanDerWaalsContact C-N 3.35Å; A237-W239 PolarHBondContact O-N 2.84Å; A237-A240 PolarHBondContact O-N 3.48Å; A237-Y241 WeakPolarHBondContact O-CB 3.34Å; A237-Y241 PolarHBondContact O-N 3.28Å
238N82.3Confident84.6Confident28 Ų2857 Ų5715%0.1530%0.295CS..Hα-helixtrans-60.1-43175.4-77.2-7.2000112.1T106 V234 L235 S236 Y241 V242T106-N238 HydrophobicContact CG2-CB 3.55Å; T106-N238 VanDerWaalsContact CG2-OD1 3.32Å; T106-N238 WeakPolarHBondContact CG2-OD1 3.27Å; V234-N238 WeakPolarHBondContact O-CB 3.43Å; V234-N238 PolarHBondContact O-N 3.36Å; V234-N238 PolarHBondContact O-ND2 3.39Å; V234-N238 PolarHBondContact O-OD1 2.95Å; L235-N238 WeakPolarHBondContact O-CB 3.33Å; L235-N238 PolarHBondContact O-N 2.78Å; S236-N238 VanDerWaalsContact C-N 3.33Å; N238-Y241 PolarHBondContact O-N 3.25Å; N238-V242 VanDerWaalsContact O-CG2 3.28Å; N238-V242 WeakPolarHBondContact O-CG2 3.49Å; N238-V242 PolarHBondContact O-N 2.82Å
239W83.8Confident83.7Confident68 Ų6860 Ų6026%0.25831%0.309SS..Hα-helixtrans-63.9-46.3176.3176-101000112.9R124 A128 I131 L235 S236 A237 Y241 V242 K243R124-W239 HydrophobicContact CB-CH2 3.95Å; R124-W239 HydrophobicContact CB-CZ3 3.91Å; R124-W239 HydrophobicContact CG-CZ3 4.44Å; R124-W239 WeakPolarHBondContact O-CH2 3.48Å; R124-W239 WeakPolarHBondContact O-CZ3 3.48Å; A128-W239 HydrophobicContact CB-CH2 3.81Å; A128-W239 HydrophobicContact CB-CZ2 4.49Å; A128-W239 HydrophobicContact CB-CZ3 3.91Å; I131-W239 HydrophobicContact CD1-CB 3.77Å; I131-W239 HydrophobicContact CD1-CD2 4.34Å; I131-W239 HydrophobicContact CD1-CE3 4.48Å; I131-W239 HydrophobicContact CD1-CG 4.06Å; L235-W239 WeakPolarHBondContact O-CB 3.24Å; L235-W239 PolarHBondContact O-N 3.01Å; S236-W239 PolarHBondContact O-N 3.18Å; A237-W239 VanDerWaalsContact C-N 3.35Å; A237-W239 PolarHBondContact O-N 2.84Å; W239-Y241 VanDerWaalsContact C-N 3.32Å; W239-Y241 PolarHBondContact O-N 3.05Å; W239-V242 PolarHBondContact O-N 3.04Å; W239-K243 WeakPolarHBondContact O-CB 3.38Å; W239-K243 PolarHBondContact O-N 2.88Å
240A83.3Confident83Confident46 Ų4663.7 Ų63.738%0.3832%0.323SS..Hα-helixtrans-59.1-46.6177.200000110.6S236 A237 V242 K243 D244S236-A240 PolarHBondContact O-N 3.19Å; A237-A240 PolarHBondContact O-N 3.48Å; A240-V242 PolarHBondContact O-N 2.91Å; A240-K243 WeakPolarHBondContact O-CB 3.38Å; A240-K243 PolarHBondContact O-N 3.4Å; A240-D244 PolarHBondContact O-N 2.86Å
241Y76.9Confident82.3Confident125 Ų12567.4 Ų67.449%0.4933%0.334SS..Hα-helixtrans-59.3-48.9176.2-179.2-82.2000112.5K111 A237 N238 W239 K243 D244 A245K111-Y241 PolarHBondContact NZ-OH 3.04Å; K111-Y241 VanDerWaalsContact NZ-OH 3.16Å; A237-Y241 WeakPolarHBondContact O-CB 3.34Å; A237-Y241 PolarHBondContact O-N 3.28Å; N238-Y241 PolarHBondContact O-N 3.25Å; W239-Y241 VanDerWaalsContact C-N 3.32Å; W239-Y241 PolarHBondContact O-N 3.05Å; Y241-K243 VanDerWaalsContact C-N 3.27Å; Y241-K243 PolarHBondContact O-N 3.44Å; Y241-D244 PolarHBondContact O-N 3.23Å; Y241-D244 VanDerWaalsContact O-N 3.14Å; Y241-A245 HydrophobicContact CE1-CB 4.22Å; Y241-A245 PolarHBondContact O-N 3.25Å
242V74.4Confident81.8Confident12 Ų1273.1 Ų73.17%0.07336%0.361CS..Hα-helixtrans-61.3-38.6179.7169.30000111.1K118 R124 N238 W239 A240 D244 C246K118-V242 HydrophobicContact CD-CG2 4.21Å; R124-V242 HydrophobicContact CG-CG1 4.12Å; N238-V242 VanDerWaalsContact O-CG2 3.28Å; N238-V242 WeakPolarHBondContact O-CG2 3.49Å; N238-V242 PolarHBondContact O-N 2.82Å; W239-V242 PolarHBondContact O-N 3.04Å; A240-V242 PolarHBondContact O-N 2.91Å; V242-D244 VanDerWaalsContact C-N 3.34Å; V242-C246 WeakPolarHBondContact O-CB 3.45Å; V242-C246 PolarHBondContact O-N 2.95Å
243K78.6Confident81.3Confident84 Ų8475.7 Ų75.737%0.36538%0.375SS..Hα-helixtrans-62.6-41.4175.8-178-176.5177.3-1760111.7W239 A240 Y241 R247W239-K243 WeakPolarHBondContact O-CB 3.38Å; W239-K243 PolarHBondContact O-N 2.88Å; A240-K243 WeakPolarHBondContact O-CB 3.38Å; A240-K243 PolarHBondContact O-N 3.4Å; Y241-K243 VanDerWaalsContact C-N 3.27Å; Y241-K243 PolarHBondContact O-N 3.44Å; K243-R247 WeakPolarHBondContact O-CG 3.43Å; K243-R247 PolarHBondContact O-N 2.98Å
244D76.3Confident81.1Confident84 Ų8474 Ų7445%0.44937%0.371SS..Hα-helixtrans-73.6-40.2-179.9-69.4-25.2000112.1A240 Y241 V242 C246 R247 M248A240-D244 PolarHBondContact O-N 2.86Å; Y241-D244 PolarHBondContact O-N 3.23Å; Y241-D244 VanDerWaalsContact O-N 3.14Å; V242-D244 VanDerWaalsContact C-N 3.34Å; D244-C246 VanDerWaalsContact C-N 3.33Å; D244-C246 PolarHBondContact O-N 3.39Å; D244-R247 WeakPolarHBondContact O-CB 3.43Å; D244-R247 PolarHBondContact O-N 3.06Å; D244-R247 VanDerWaalsContact O-N 3.14Å; D244-R247 IonicContact OD1-NH1 3.72Å; D244-M248 PolarHBondContact O-N 3.08Å; D244-M248 VanDerWaalsContact O-N 3.08Å
245A73.9Confident81.2Confident32 Ų3277.6 Ų77.626%0.26438%0.384SS..Hα-helixtrans-58.8-42.9173.100000112.1Y241 R247 M248 Q249Y241-A245 HydrophobicContact CE1-CB 4.22Å; Y241-A245 PolarHBondContact O-N 3.25Å; A245-R247 VanDerWaalsContact C-N 3.32Å; A245-R247 PolarHBondContact O-N 3.2Å; A245-M248 PolarHBondContact O-N 2.99Å; A245-Q249 PolarHBondContact O-N 3.08Å
246C71Confident81.2Confident31 Ų3180 Ų8021%0.20940%0.402CS..Hα-helixtrans-62.2-37.3175.8179.50000112.7I119 V242 D244 M248 Q249 K250I119-C246 HydrophobicContact CG2-CB 4.06Å; V242-C246 WeakPolarHBondContact O-CB 3.45Å; V242-C246 PolarHBondContact O-N 2.95Å; D244-C246 VanDerWaalsContact C-N 3.33Å; D244-C246 PolarHBondContact O-N 3.39Å; C246-M248 VanDerWaalsContact C-N 3.34Å; C246-Q249 PolarHBondContact O-N 3.49Å; C246-K250 PolarHBondContact O-N 3.32Å
247R77.5Confident81.3Confident153 Ų15384 Ų8458%0.57741%0.411SS*.Hα-helixtrans-64.6-40.7175.3-75.2170.8167.1-177.8-10.1111.5K243 D244 A245 K250 Y251K243-R247 WeakPolarHBondContact O-CG 3.43Å; K243-R247 PolarHBondContact O-N 2.98Å; D244-R247 WeakPolarHBondContact O-CB 3.43Å; D244-R247 PolarHBondContact O-N 3.06Å; D244-R247 VanDerWaalsContact O-N 3.14Å; D244-R247 IonicContact OD1-NH1 3.72Å; A245-R247 VanDerWaalsContact C-N 3.32Å; A245-R247 PolarHBondContact O-N 3.2Å; R247-K250 PolarHBondContact O-N 3.05Å; R247-Y251 PolarHBondContact O-N 3.23Å; R247-Y251 VanDerWaalsContact O-N 3.09Å
248M78.2Confident81.6Confident113 Ų11387 Ų8756%0.55742%0.415SS*.Hα-helixtrans-64.9-45.8176.3-68.1-58-64.500111.7D244 A245 C246 K250 Y251 E252D244-M248 PolarHBondContact O-N 3.08Å; D244-M248 VanDerWaalsContact O-N 3.08Å; A245-M248 PolarHBondContact O-N 2.99Å; C246-M248 VanDerWaalsContact C-N 3.34Å; M248-K250 VanDerWaalsContact C-N 3.34Å; M248-K250 PolarHBondContact O-N 2.85Å; M248-Y251 WeakPolarHBondContact O-CA 3.45Å; M248-Y251 WeakPolarHBondContact O-CB 3.29Å; M248-Y251 PolarHBondContact O-N 2.71Å; M248-E252 PolarHBondContact O-N 3.14Å
249Q77.3Confident82.1Confident63 Ų6390.5 Ų90.529%0.29443%0.431SS..Hα-helixtrans-60.6-42.4176.9-172.1173.12.100112A245 C246 Y251 E252 D253A245-Q249 PolarHBondContact O-N 3.08Å; C246-Q249 PolarHBondContact O-N 3.49Å; Q249-Y251 VanDerWaalsContact C-N 3.26Å; Q249-Y251 PolarHBondContact O-N 3.09Å; Q249-E252 PolarHBondContact O-N 3.33Å; Q249-D253 WeakPolarHBondContact O-CB 3.39Å; Q249-D253 PolarHBondContact O-N 3.35Å
250K80.6Confident82.4Confident150 Ų15093.5 Ų93.565%0.65245%0.447SS*.Hα-helixtrans-62.3-34.6175.4-171.4176.4-178.6-178.30112.4C246 R247 M248 T254C246-K250 PolarHBondContact O-N 3.32Å; R247-K250 PolarHBondContact O-N 3.05Å; M248-K250 VanDerWaalsContact C-N 3.34Å; M248-K250 PolarHBondContact O-N 2.85Å; K250-T254 WeakPolarHBondContact O-CB 3.41Å; K250-T254 PolarHBondContact O-N 2.96Å; K250-T254 VanDerWaalsContact O-N 3.08Å; K250-T254 PolarHBondContact O-OG1 3.43Å
251Y79.4Confident82.8Confident150 Ų15097.5 Ų97.559%0.58846%0.458SS*.Hα-helixtrans-67.7-45.5175.4177.9-95.8000111.2R247 M248 Q249 T254 K255R247-Y251 PolarHBondContact O-N 3.23Å; R247-Y251 VanDerWaalsContact O-N 3.09Å; M248-Y251 WeakPolarHBondContact O-CA 3.45Å; M248-Y251 WeakPolarHBondContact O-CB 3.29Å; M248-Y251 PolarHBondContact O-N 2.71Å; Q249-Y251 VanDerWaalsContact C-N 3.26Å; Q249-Y251 PolarHBondContact O-N 3.09Å; Y251-T254 PolarHBondContact O-N 3.36Å; Y251-K255 WeakPolarHBondContact O-CB 3.34Å; Y251-K255 PolarHBondContact O-N 2.96Å
252E83.4Confident83.5Confident123 Ų12397.4 Ų97.458%0.57547%0.466SS*.Hα-helixtrans-64-40176.1-69.1-174.1161.200112.8M248 Q249 T254 K255 S256M248-E252 PolarHBondContact O-N 3.14Å; Q249-E252 PolarHBondContact O-N 3.33Å; E252-T254 VanDerWaalsContact C-N 3.31Å; E252-T254 PolarHBondContact O-N 3.16Å; E252-K255 PolarHBondContact O-N 2.89Å; E252-S256 WeakPolarHBondContact O-CB 3.49Å; E252-S256 PolarHBondContact O-N 2.87Å; E252-S256 PolarHBondContact O-OG 2.97Å
253D84.8Confident84.3Confident81 Ų81103.4 Ų103.443%0.43349%0.493SS..Hα-helixtrans-63.6-36.2173.6-77.1-14.5000112.3Q249 S256 K257Q249-D253 WeakPolarHBondContact O-CB 3.39Å; Q249-D253 PolarHBondContact O-N 3.35Å; D253-S256 WeakPolarHBondContact CA-OG 3.37Å; D253-S256 PolarHBondContact O-OG 3.28Å; D253-S256 VanDerWaalsContact O-OG 3.04Å; D253-K257 WeakPolarHBondContact O-CD 3.3Å; D253-K257 VanDerWaalsContact O-CG 3.24Å; D253-K257 WeakPolarHBondContact O-CG 3.46Å; D253-K257 PolarHBondContact O-N 3.01Å
254T86.9Confident84.8Confident65 Ų65104 Ų10440%0.39950%0.5SS..Hα-helixtrans-72.3-45.9177.5-540000110K250 Y251 E252 S256 K257 E258K250-T254 WeakPolarHBondContact O-CB 3.41Å; K250-T254 PolarHBondContact O-N 2.96Å; K250-T254 VanDerWaalsContact O-N 3.08Å; K250-T254 PolarHBondContact O-OG1 3.43Å; Y251-T254 PolarHBondContact O-N 3.36Å; E252-T254 VanDerWaalsContact C-N 3.31Å; E252-T254 PolarHBondContact O-N 3.16Å; T254-S256 PolarHBondContact O-N 3.29Å; T254-K257 PolarHBondContact O-N 3.47Å; T254-E258 WeakPolarHBondContact O-CG 3.23Å; T254-E258 PolarHBondContact O-N 3.25Å
255K91.6Very high85.5Confident100 Ų100105.2 Ų105.244%0.43551%0.505SS..Hα-helixtrans-59.1-46.1177.3-177.5-174.2170.7-166.30111.9Y251 E252 K257 E258 E259Y251-K255 WeakPolarHBondContact O-CB 3.34Å; Y251-K255 PolarHBondContact O-N 2.96Å; E252-K255 PolarHBondContact O-N 2.89Å; K255-K257 VanDerWaalsContact C-N 3.35Å; K255-K257 PolarHBondContact O-N 2.9Å; K255-E258 PolarHBondContact O-N 3.47Å; K255-E259 WeakPolarHBondContact CE-OE1 3.45Å; K255-E259 IonicContact NZ-OE1 3.75Å; K255-E259 WeakPolarHBondContact O-CG 3.46Å; K255-E259 PolarHBondContact O-N 3.46Å
256S88.9Confident86.2Confident54 Ų54110 Ų11038%0.37852%0.522SS..Hα-helixtrans-64.4-37.6178.854.30000112.5E252 D253 T254 Q260E252-S256 WeakPolarHBondContact O-CB 3.49Å; E252-S256 PolarHBondContact O-N 2.87Å; E252-S256 PolarHBondContact O-OG 2.97Å; D253-S256 WeakPolarHBondContact CA-OG 3.37Å; D253-S256 PolarHBondContact O-OG 3.28Å; D253-S256 VanDerWaalsContact O-OG 3.04Å; T254-S256 PolarHBondContact O-N 3.29Å; S256-Q260 WeakPolarHBondContact O-CB 3.4Å; S256-Q260 PolarHBondContact O-N 3.24Å
257K91.8Very high86.9Confident142 Ų142110.8 Ų110.862%0.61753%0.528SS*.Hα-helixtrans-62.8-45.1171.7-74.5172.5-177176.30112.1D253 T254 K255 Q260 E261D253-K257 WeakPolarHBondContact O-CD 3.3Å; D253-K257 VanDerWaalsContact O-CG 3.24Å; D253-K257 WeakPolarHBondContact O-CG 3.46Å; D253-K257 PolarHBondContact O-N 3.01Å; T254-K257 PolarHBondContact O-N 3.47Å; K255-K257 VanDerWaalsContact C-N 3.35Å; K255-K257 PolarHBondContact O-N 2.9Å; K257-Q260 PolarHBondContact O-N 2.82Å; K257-E261 WeakPolarHBondContact O-CG 3.48Å; K257-E261 PolarHBondContact O-N 2.9Å
258E92.4Very high87.3Confident124 Ų124107.3 Ų107.358%0.57952%0.524SS*.Hα-helixtrans-63.2-42.8177-71.6179172.200112.2T254 K255 Q260 E261 L262T254-E258 WeakPolarHBondContact O-CG 3.23Å; T254-E258 PolarHBondContact O-N 3.25Å; K255-E258 PolarHBondContact O-N 3.47Å; E258-Q260 VanDerWaalsContact C-N 3.32Å; E258-Q260 PolarHBondContact O-N 3.01Å; E258-E261 PolarHBondContact O-N 3.02Å; E258-L262 WeakPolarHBondContact O-CB 3.29Å; E258-L262 PolarHBondContact O-N 3.45Å
259E92.1Very high87.4Confident100 Ų100109.2 Ų109.247%0.46752%0.524SS..Hα-helixtrans-62.4-39.6175.1-75.2179172.500111.6K255 L262 H263K255-E259 WeakPolarHBondContact CE-OE1 3.45Å; K255-E259 IonicContact NZ-OE1 3.75Å; K255-E259 WeakPolarHBondContact O-CG 3.46Å; K255-E259 PolarHBondContact O-N 3.46Å; E259-L262 PolarHBondContact O-N 3.25Å; E259-H263 PolarHBondContact O-CD2 3.23Å; E259-H263 VanDerWaalsContact O-CD2 3.28Å; E259-H263 PolarHBondContact O-N 2.87Å
260Q91.4Very high87.5Confident131 Ų131108.8 Ų108.861%0.61253%0.528SS*.Hα-helixtrans-68.6-43.3177.9-172.2141.9-0.100112.5S256 K257 E258 L262 H263 D264S256-Q260 WeakPolarHBondContact O-CB 3.4Å; S256-Q260 PolarHBondContact O-N 3.24Å; K257-Q260 PolarHBondContact O-N 2.82Å; E258-Q260 VanDerWaalsContact C-N 3.32Å; E258-Q260 PolarHBondContact O-N 3.01Å; Q260-L262 VanDerWaalsContact C-N 3.32Å; Q260-L262 PolarHBondContact O-N 3.43Å; Q260-H263 PolarHBondContact O-N 3.38Å; Q260-D264 PolarHBondContact O-N 3.45Å
261E91.9Very high87.5Confident130 Ų130107.7 Ų107.761%0.60752%0.524SS*.Hα-helixtrans-61-40.5174.4-73.2-17517100111.9K257 E258 D264 I265K257-E261 WeakPolarHBondContact O-CG 3.48Å; K257-E261 PolarHBondContact O-N 2.9Å; E258-E261 PolarHBondContact O-N 3.02Å; E261-D264 PolarHBondContact O-N 3.12Å; E261-I265 VanDerWaalsContact O-CG1 3.29Å; E261-I265 WeakPolarHBondContact O-CG1 3.33Å; E261-I265 PolarHBondContact O-N 3.45Å
262L91.6Very high87.4Confident123 Ų123107 Ų10764%0.64453%0.526SS*.Hα-helixtrans-63.6-43.4176-171.774.2000111.8E258 E259 Q260 D264 I265 H266E258-L262 WeakPolarHBondContact O-CB 3.29Å; E258-L262 PolarHBondContact O-N 3.45Å; E259-L262 PolarHBondContact O-N 3.25Å; Q260-L262 VanDerWaalsContact C-N 3.32Å; Q260-L262 PolarHBondContact O-N 3.43Å; L262-D264 VanDerWaalsContact C-N 3.33Å; L262-I265 PolarHBondContact O-N 3.38Å; L262-H266 PolarHBondContact O-N 3.2Å
263H90Very high86.8Confident138 Ų138108.9 Ų108.964%0.63953%0.528SS*.Hα-helixtrans-60.5-42.7175.6-94.6-69.2000112E259 Q260 H266 S267E259-H263 PolarHBondContact O-CD2 3.23Å; E259-H263 VanDerWaalsContact O-CD2 3.28Å; E259-H263 PolarHBondContact O-N 2.87Å; Q260-H263 PolarHBondContact O-N 3.38Å; H263-H266 PolarHBondContact O-N 2.94Å; H263-S267 WeakPolarHBondContact O-CB 3.4Å; H263-S267 PolarHBondContact O-N 2.91Å
264D90.6Very high86.2Confident97 Ų97111.2 Ų111.252%0.51954%0.54SS..Hα-helixtrans-64.4-46178.1-77-21.1000111.5Q260 E261 L262 H266 S267 T268Q260-D264 PolarHBondContact O-N 3.45Å; E261-D264 PolarHBondContact O-N 3.12Å; L262-D264 VanDerWaalsContact C-N 3.33Å; D264-H266 VanDerWaalsContact C-N 3.32Å; D264-H266 PolarHBondContact O-N 3.45Å; D264-S267 WeakPolarHBondContact O-CB 3.37Å; D264-S267 PolarHBondContact O-N 2.8Å; D264-S267 VanDerWaalsContact O-N 3.13Å; D264-T268 PolarHBondContact O-N 3.33Å; D264-T268 PolarHBondContact O-OG1 2.98Å
265I91.3Very high85.5Confident110 Ų110113.8 Ų113.856%0.56455%0.551SS**Hα-helixtrans-58.6-42.9176.3-68165.2000111.5E261 L262 S267 T268 R269E261-I265 VanDerWaalsContact O-CG1 3.29Å; E261-I265 WeakPolarHBondContact O-CG1 3.33Å; E261-I265 PolarHBondContact O-N 3.45Å; L262-I265 PolarHBondContact O-N 3.38Å; I265-S267 VanDerWaalsContact C-N 3.32Å; I265-T268 WeakPolarHBondContact CA-OG1 3.38Å; I265-T268 PolarHBondContact O-OG1 3.03Å; I265-R269 WeakPolarHBondContact O-CB 3.39Å; I265-R269 PolarHBondContact O-N 3.39Å
266H88.7Confident84.4Confident133 Ų133112.7 Ų112.762%0.61656%0.561SS**Hα-helixtrans-67.1-35.9178.2-167.6-110.9000111.9L262 H263 D264 S270L262-H266 PolarHBondContact O-N 3.2Å; H263-H266 PolarHBondContact O-N 2.94Å; D264-H266 VanDerWaalsContact C-N 3.32Å; D264-H266 PolarHBondContact O-N 3.45Å; H266-S270 WeakPolarHBondContact O-CB 3.37Å; H266-S270 PolarHBondContact O-N 3.13Å; H266-S270 PolarHBondContact O-OG 3.44Å
267S85.6Confident83Confident47 Ų47120.3 Ų120.333%0.32958%0.583SS.*Hα-helixtrans-67.4-43.1175.4-172.80000112.7H263 D264 I265 S270 K271H263-S267 WeakPolarHBondContact O-CB 3.4Å; H263-S267 PolarHBondContact O-N 2.91Å; D264-S267 WeakPolarHBondContact O-CB 3.37Å; D264-S267 PolarHBondContact O-N 2.8Å; D264-S267 VanDerWaalsContact O-N 3.13Å; I265-S267 VanDerWaalsContact C-N 3.32Å; S267-S270 WeakPolarHBondContact CA-OG 3.04Å; S267-S270 PolarHBondContact O-OG 3.01Å; S267-K271 WeakPolarHBondContact O-CG 3.35Å; S267-K271 PolarHBondContact O-N 3.33Å; S267-K271 VanDerWaalsContact O-N 3.13Å
268T84.6Confident81.2Confident80 Ų80122 Ų12249%0.49161%0.605SS.*Hα-helixtrans-65.2-46.6174.217.40000111.4D264 I265 S270 K271 E272D264-T268 PolarHBondContact O-N 3.33Å; D264-T268 PolarHBondContact O-OG1 2.98Å; I265-T268 WeakPolarHBondContact CA-OG1 3.38Å; I265-T268 PolarHBondContact O-OG1 3.03Å; T268-S270 VanDerWaalsContact C-N 3.3Å; T268-S270 PolarHBondContact O-N 3.13Å; T268-K271 PolarHBondContact O-N 3.01Å; T268-E272 PolarHBondContact O-N 3.4Å
269R81.3Confident80.6Confident152 Ų152121.9 Ų121.957%0.57461%0.606SS**Hα-helixtrans-62-37-179.9-166.2-179.3-168.5-172.64.5112.8I265 R273I265-R269 WeakPolarHBondContact O-CB 3.39Å; I265-R269 PolarHBondContact O-N 3.39Å; R269-R273 WeakPolarHBondContact O-CG 3.47Å; R269-R273 PolarHBondContact O-N 3.39Å; R269-R273 VanDerWaalsContact O-N 3.13Å
270S79.2Confident80Confident54 Ų54123.1 Ų123.138%0.37861%0.613SS.*Hα-helixtrans-69.9-39.2176.649.80000112.4H266 S267 T268 R273 L274H266-S270 WeakPolarHBondContact O-CB 3.37Å; H266-S270 PolarHBondContact O-N 3.13Å; H266-S270 PolarHBondContact O-OG 3.44Å; S267-S270 WeakPolarHBondContact CA-OG 3.04Å; S267-S270 PolarHBondContact O-OG 3.01Å; T268-S270 VanDerWaalsContact C-N 3.3Å; T268-S270 PolarHBondContact O-N 3.13Å; S270-R273 PolarHBondContact O-N 2.93Å; S270-L274 PolarHBondContact O-N 3.16Å
271K79.3Confident79.4Confident128 Ų128122.6 Ų122.656%0.55761%0.614SS**Hα-helixtrans-64.1-43.7173.1-74.5173.7-179.4169.80112.9S267 T268 R273 L274 N275S267-K271 WeakPolarHBondContact O-CG 3.35Å; S267-K271 PolarHBondContact O-N 3.33Å; S267-K271 VanDerWaalsContact O-N 3.13Å; T268-K271 PolarHBondContact O-N 3.01Å; K271-R273 VanDerWaalsContact C-N 3.31Å; K271-R273 PolarHBondContact O-N 3.06Å; K271-L274 PolarHBondContact O-N 3.44Å; K271-L274 VanDerWaalsContact O-N 3.16Å; K271-N275 VanDerWaalsContact O-CG 3.31Å; K271-N275 PolarHBondContact O-N 3.31Å
272E78.2Confident78.7Confident136 Ų136122.2 Ų122.264%0.63661%0.614SS**Hα-helixtrans-59.9-42.2175.1-75.3-178.316400111.8T268 L274 N275 A276T268-E272 PolarHBondContact O-N 3.4Å; E272-L274 VanDerWaalsContact C-N 3.35Å; E272-L274 PolarHBondContact O-N 3.04Å; E272-N275 PolarHBondContact O-N 3.41Å; E272-A276 PolarHBondContact O-N 3.41Å; E272-A276 VanDerWaalsContact O-N 3.1Å
273R71.9Confident77.9Confident162 Ų162122.1 Ų122.161%0.61161%0.612SS**Hα-helixtrans-62.4-40.7174.1-77.1-164-176.1-165.13.9112.2R269 S270 K271 A276 Y277R269-R273 WeakPolarHBondContact O-CG 3.47Å; R269-R273 PolarHBondContact O-N 3.39Å; R269-R273 VanDerWaalsContact O-N 3.13Å; S270-R273 PolarHBondContact O-N 2.93Å; K271-R273 VanDerWaalsContact C-N 3.31Å; K271-R273 PolarHBondContact O-N 3.06Å; R273-A276 PolarHBondContact O-N 3.48Å; R273-Y277 VanDerWaalsContact O-CD2 3.3Å; R273-Y277 WeakPolarHBondContact O-CD2 3.3Å
274L71.2Confident77.1Confident130 Ų130121.1 Ų121.168%0.68161%0.61SS**Hα-helixtrans-64-42.9178.7-129.286.6000111.8S270 K271 E272 A276 Y277S270-L274 PolarHBondContact O-N 3.16Å; K271-L274 PolarHBondContact O-N 3.44Å; K271-L274 VanDerWaalsContact O-N 3.16Å; E272-L274 VanDerWaalsContact C-N 3.35Å; E272-L274 PolarHBondContact O-N 3.04Å; L274-A276 VanDerWaalsContact C-N 3.29Å; L274-A276 PolarHBondContact O-N 3.49Å; L274-Y277 PolarHBondContact O-N 3.41Å
275N71.7Confident76.1Confident118 Ų118122.8 Ų122.863%0.63162%0.617SS**Hα-helixtrans-70.4-23.9-179.1-66.1-15.2000113K271 E272 Y277 T278K271-N275 VanDerWaalsContact O-CG 3.31Å; K271-N275 PolarHBondContact O-N 3.31Å; E272-N275 PolarHBondContact O-N 3.41Å; N275-Y277 PolarHBondContact O-N 3.1Å; N275-T278 PolarHBondContact O-N 3.13Å
276A68Low74.9Confident78 Ų78123.8 Ų123.865%0.64562%0.621SS**THydrogen-bonded Turntrans-73.3-13.3176.500000114.1E272 R273 L274E272-A276 PolarHBondContact O-N 3.41Å; E272-A276 VanDerWaalsContact O-N 3.1Å; R273-A276 PolarHBondContact O-N 3.48Å; L274-A276 VanDerWaalsContact C-N 3.29Å; L274-A276 PolarHBondContact O-N 3.49Å
277Y60.5Low73.8Confident214 Ų214123 Ų12384%0.83962%0.621SS**THydrogen-bonded Turntrans-103.44.7177.5-77.8-88.6000113.5R273 L274 N275R273-Y277 VanDerWaalsContact O-CD2 3.3Å; R273-Y277 WeakPolarHBondContact O-CD2 3.3Å; L274-Y277 PolarHBondContact O-N 3.41Å; N275-Y277 PolarHBondContact O-N 3.1Å
278T53.9Low72.7Confident177 Ų177129.9 Ų129.9100%1.08665%0.648SS**  trans-109.60173.9-44.60000109.6N275N275-T278 PolarHBondContact O-N 3.13Å

Retrieved 278 of 278 residues in 291.1 ms (Link to these results)