G4LWE5_SCHMA Loading...

Voltage-gated hydrogen channel 1

AlphaFold DB , UniProt , Accession G4LWE5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 279 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
1M46.6Very low57.5Low230 Ų230132.9 Ų132.9100%1.13371%0.711SS**  03.80-127.3-179-86.700113.8
2L51.9Low57.3Low160 Ų160132.8 Ų132.884%0.83871%0.709SS**  trans-92.6-6.2-172.9-133.1132.4000114.5
3A55.2Low57.3Low86 Ų86132.7 Ų132.771%0.71171%0.707SS**SBendtrans-83.5-14.7-175.300000114.3
4T60.4Low56.8Low102 Ų102133.4 Ų133.463%0.62671%0.71SS**SBendtrans-89.7-14.7-174.653.60000114.2
5M58.7Low56.1Low150 Ų150133 Ų13374%0.73971%0.709SS**Hα-helixtrans-79.6-24.8-178.7-76.3-178.278.400113.6
6D64.1Low55.6Low127 Ų127132.3 Ų132.368%0.67970%0.703SS**Hα-helixtrans-78.6-30.2-179-98.5-10.8000113.1N9 K10D6-N9 PolarHBondContact O-N 3.35Å; D6-K10 PolarHBondContact O-N 3.39Å
7E62.5Low55Low144 Ų144131 Ų13167%0.67370%0.704SS**Hα-helixtrans-73-37.5-177.3-146.9125.6-141.300111.7N9 K10 E11E7-N9 VanDerWaalsContact C-N 3.26Å; E7-N9 PolarHBondContact O-N 3.03Å; E7-K10 PolarHBondContact O-N 3.48Å; E7-E11 PolarHBondContact O-N 3.39Å
8A59.8Low54.5Low68 Ų68133.9 Ų133.956%0.56271%0.712SS**Hα-helixtrans-64-30.5175.200000112.8L12A8-L12 PolarHBondContact O-N 3.43Å
9N58.7Low54.1Low101 Ų101132.1 Ų132.154%0.5471%0.711SS.*Hα-helixtrans-76.5-29.5177.3-105.7-11000112.8D6 E7 I13D6-N9 PolarHBondContact O-N 3.35Å; E7-N9 VanDerWaalsContact C-N 3.26Å; E7-N9 PolarHBondContact O-N 3.03Å; N9-I13 WeakPolarHBondContact O-CG1 3.47Å
10K59.7Low53.6Low160 Ų160137.3 Ų137.370%0.69672%0.72SS**Hα-helixtrans-69.9-38.8175.3-88-175.9174.6-1790112.5D6 E7 L12 I13D6-K10 PolarHBondContact O-N 3.39Å; E7-K10 PolarHBondContact O-N 3.48Å; K10-L12 VanDerWaalsContact C-N 3.3Å; K10-L12 PolarHBondContact O-N 3.49Å; K10-I13 PolarHBondContact O-N 3.33Å
11E54.7Low53.3Low134 Ų134136.3 Ų136.363%0.62672%0.72SS**Hα-helixtrans-64.8-32.8176.8-76.5-81.5123.400112.4E7 I13E7-E11 PolarHBondContact O-N 3.39Å; E11-I13 PolarHBondContact O-N 3.22Å
12L55.4Low53.2Low132 Ų132134.9 Ų134.969%0.69171%0.707SS**Hα-helixtrans-72.5-27.3-179.5-155.975.9000113.1A8 K10A8-L12 PolarHBondContact O-N 3.43Å; K10-L12 VanDerWaalsContact C-N 3.3Å; K10-L12 PolarHBondContact O-N 3.49Å
13I57.1Low53.1Low131 Ų131133.5 Ų133.567%0.67271%0.705SS**Hα-helixtrans-77.7-30.9-179.6-64.1170000111.3N9 K10 E11N9-I13 WeakPolarHBondContact O-CG1 3.47Å; K10-I13 PolarHBondContact O-N 3.33Å; E11-I13 PolarHBondContact O-N 3.22Å
14N50.5Low52.5Low142 Ų142140.4 Ų140.476%0.75971%0.713SS**Hα-helixtrans-84-15.6-172.6-1276.5000114.3
15N46.2Very low51.9Low128 Ų128141.4 Ų141.468%0.68472%0.721SS**THydrogen-bonded Turntrans-102.430.9-176.9-81.3-32.6000114P17N15-P17 WeakPolarHBondContact O-CD 2.93Å
16I47.6Very low51.6Low121 Ų121138.3 Ų138.362%0.62171%0.714SS**  trans-85.499.8166.7-62.7170.9000107.9H18I16-H18 PolarHBondContact O-N 3.33Å
17P46Very low51.1Low111 Ų111134.4 Ų134.472%0.72170%0.704SS**  trans-63.5115.2173.225.7-33.6000108.4N15 S19N15-P17 WeakPolarHBondContact O-CD 2.93Å; P17-S19 PolarHBondContact O-N 2.91Å
18H45.3Very low50.9Low183 Ų183137 Ų13785%0.84771%0.713SS**  trans-61.372.6163.2-81.2-76000109.6I16 R20I16-H18 PolarHBondContact O-N 3.33Å; H18-R20 PolarHBondContact O-N 2.76Å
19S48.5Very low50.7Low99 Ų99138.7 Ų138.769%0.69272%0.72SS**  trans-68.294.8164.1-167.90000106.3P17 V21P17-S19 PolarHBondContact O-N 2.91Å; S19-V21 PolarHBondContact O-N 2.87Å
20R43.7Very low51Low236 Ų236136.5 Ų136.589%0.89171%0.71SS**  trans-6375.4177.8-157.8-174.8-70.6-179.5-3.1107.9H18 K22H18-R20 PolarHBondContact O-N 2.76Å; R20-K22 PolarHBondContact O-N 2.7Å
21V47.1Very low51.4Low118 Ų118133.6 Ų133.672%0.71570%0.701SS**  trans-65.5100173.7176.90000106.9S19 T23S19-V21 PolarHBondContact O-N 2.87Å; V21-T23 PolarHBondContact O-N 3.03Å
22K44.8Very low51.9Low199 Ų199129.5 Ų129.587%0.86569%0.691SS**  trans-50.1104.2169-84.5174.4171.3173.70109R20 R24R20-K22 PolarHBondContact O-N 2.7Å; K22-R24 PolarHBondContact O-N 2.93Å
23T48.6Very low52.7Low131 Ų131129.1 Ų129.180%0.80468%0.68SS**  trans-70.696.2166.546.40000107.7V21V21-T23 PolarHBondContact O-N 3.03Å
24R43.3Very low53.3Low232 Ų232129.9 Ų129.988%0.87568%0.678SS**  trans-56.5133.4165.9-111-179.6176.3169.2-1108K22 S26K22-R24 PolarHBondContact O-N 2.93Å; R24-S26 PolarHBondContact O-N 3.32Å
25P47.8Very low54.4Low122 Ų122131.3 Ų131.379%0.79267%0.673SS**  trans-64.5114.3-178.825.8-31.3000108.6G27P25-G27 PolarHBondContact O-N 2.98Å
26S52.6Low55.2Low85 Ų85125.9 Ų125.959%0.59464%0.644SS**  trans-67.392.2178.3-176.30000108.8R24 T30R24-S26 PolarHBondContact O-N 3.32Å; S26-T30 WeakPolarHBondContact OG-CB 3.49Å; S26-T30 WeakPolarHBondContact OG-CG2 3.33Å; S26-T30 PolarHBondContact OG-OG1 3.03Å
27G52.9Low56.1Low45 Ų45126.9 Ų126.946%0.46464%0.644SS.*  trans-54.4149.6179.500000112.4P25 C29 T30P25-G27 PolarHBondContact O-N 2.98Å; G27-C29 PolarHBondContact O-N 2.91Å; G27-T30 PolarHBondContact O-N 3.02Å; G27-T30 PolarHBondContact O-OG1 2.68Å
28K59Low57.1Low200 Ų200127.5 Ų127.587%0.8764%0.637SS**THydrogen-bonded Turntrans-40.3-26-176.6-61.3172.1-179.71770115.2T30 L31K28-T30 PolarHBondContact O-N 3.19Å; K28-L31 PolarHBondContact O-N 3.16Å
29C55.8Low57.9Low103 Ų103122.7 Ų122.770%0.69662%0.62SS**Hα-helixtrans-56-29.2172.9-60.20000114.4G27 R33G27-C29 PolarHBondContact O-N 2.91Å; C29-R33 WeakPolarHBondContact O-CB 3.42Å; C29-R33 PolarHBondContact O-N 2.97Å
30T64.6Low58.7Low55 Ų55118.8 Ų118.834%0.33759%0.591SS.*Hα-helixtrans-74-26.8-178.7670000113.2S26 G27 K28 K34S26-T30 WeakPolarHBondContact OG-CB 3.49Å; S26-T30 WeakPolarHBondContact OG-CG2 3.33Å; S26-T30 PolarHBondContact OG-OG1 3.03Å; G27-T30 PolarHBondContact O-N 3.02Å; G27-T30 PolarHBondContact O-OG1 2.68Å; K28-T30 PolarHBondContact O-N 3.19Å; T30-K34 WeakPolarHBondContact O-CB 3.03Å; T30-K34 VanDerWaalsContact O-CG 3.31Å; T30-K34 WeakPolarHBondContact O-CG 3.25Å; T30-K34 PolarHBondContact O-N 2.99Å
31L67.6Low59.7Low98 Ų98112.8 Ų112.851%0.51358%0.577SS.*Hα-helixtrans-73.6-44.1179.7-170.967000111.3K28 R33 K34 R35K28-L31 PolarHBondContact O-N 3.16Å; L31-R33 VanDerWaalsContact C-N 3.28Å; L31-R33 PolarHBondContact O-N 2.99Å; L31-K34 PolarHBondContact O-N 3.45Å; L31-R35 PolarHBondContact O-N 2.92Å
32A66.5Low60.7Low48 Ų48111.4 Ų111.440%0.39756%0.564SS.*Hα-helixtrans-59-43.3172.700000110.7K34 R35 L36 W109A32-K34 PolarHBondContact O-N 3.43Å; A32-R35 PolarHBondContact O-N 3.08Å; A32-L36 VanDerWaalsContact O-CB 3.26Å; A32-L36 WeakPolarHBondContact O-CB 3.07Å; A32-L36 PolarHBondContact O-N 3.5Å; A32-W109 HydrophobicContact CB-CH2 4.1Å
33R70.8Confident62Low125 Ų125111.8 Ų111.847%0.47256%0.559SS.*Hα-helixtrans-62.1-40.7174.3-169.6176.3-178.5-170.9-1.2113C29 L31 K37 M111C29-R33 WeakPolarHBondContact O-CB 3.42Å; C29-R33 PolarHBondContact O-N 2.97Å; L31-R33 VanDerWaalsContact C-N 3.28Å; L31-R33 PolarHBondContact O-N 2.99Å; R33-K37 WeakPolarHBondContact O-CB 3.1Å; R33-K37 PolarHBondContact O-N 2.99Å; R33-M111 PolarHBondContact NH2-O 3.46Å
34K71.1Confident63.4Low146 Ų146113.8 Ų113.864%0.63556%0.557SS**Hα-helixtrans-64.5-48.1176-79.7179.2-177.9-175.10111.8T30 L31 A32 L36 K37 Q38T30-K34 WeakPolarHBondContact O-CB 3.03Å; T30-K34 VanDerWaalsContact O-CG 3.31Å; T30-K34 WeakPolarHBondContact O-CG 3.25Å; T30-K34 PolarHBondContact O-N 2.99Å; L31-K34 PolarHBondContact O-N 3.45Å; A32-K34 PolarHBondContact O-N 3.43Å; K34-L36 VanDerWaalsContact C-N 3.32Å; K34-L36 PolarHBondContact O-N 3.39Å; K34-K37 PolarHBondContact O-N 3.42Å; K34-Q38 PolarHBondContact O-N 3.26Å
35R72.1Confident65.2Low172 Ų172104.7 Ų104.765%0.64952%0.523SS*.Hα-helixtrans-60.4-43.4176.6-73.2-175.3176.1-174.1-0.9111.1L31 A32 Q38 V39L31-R35 PolarHBondContact O-N 2.92Å; A32-R35 PolarHBondContact O-N 3.08Å; R35-Q38 WeakPolarHBondContact O-CB 3.45Å; R35-Q38 PolarHBondContact O-N 3.45Å; R35-V39 WeakPolarHBondContact O-CG2 3.35Å; R35-V39 PolarHBondContact O-N 3.48Å
36L63.5Low66.6Low15 Ų15101.4 Ų101.48%0.07950%0.495CS..Hα-helixtrans-65.9-42.2179.3-174.353.5000112.1A32 K34 Q38 V39 F40 F106 W109 A110A32-L36 VanDerWaalsContact O-CB 3.26Å; A32-L36 WeakPolarHBondContact O-CB 3.07Å; A32-L36 PolarHBondContact O-N 3.5Å; K34-L36 VanDerWaalsContact C-N 3.32Å; K34-L36 PolarHBondContact O-N 3.39Å; L36-Q38 PolarHBondContact O-N 2.94Å; L36-V39 PolarHBondContact O-N 2.88Å; L36-V39 VanDerWaalsContact O-N 3.09Å; L36-F40 HydrophobicContact CD1-CD2 3.68Å; L36-F40 HydrophobicContact CD1-CE2 3.49Å; L36-F40 VanDerWaalsContact CD1-CE2 3.49Å; L36-F40 HydrophobicContact CD2-CE2 3.98Å; L36-F40 HydrophobicContact CG-CD2 3.69Å; L36-F40 HydrophobicContact CG-CE2 3.58Å; L36-F40 WeakPolarHBondContact O-CD2 3.38Å; L36-F40 PolarHBondContact O-N 3.39Å; L36-F106 HydrophobicContact CD1-CD1 4.41Å; L36-F106 HydrophobicContact CD1-CE1 3.37Å; L36-F106 HydrophobicContact CD1-CE2 4.39Å; L36-F106 HydrophobicContact CD1-CZ 3.35Å; L36-F106 HydrophobicContact CD2-CD2 4.42Å; L36-F106 HydrophobicContact CD2-CE1 3.97Å; L36-F106 HydrophobicContact CD2-CE2 3.83Å; L36-F106 HydrophobicContact CD2-CZ 3.58Å; L36-F106 HydrophobicContact CG-CE1 4.29Å; L36-F106 HydrophobicContact CG-CZ 4.12Å; L36-W109 HydrophobicContact CD2-CE3 3.43Å; L36-W109 VanDerWaalsContact CD2-CE3 3.43Å; L36-W109 HydrophobicContact CD2-CZ3 3.43Å; L36-W109 VanDerWaalsContact CD2-CZ3 3.43Å; L36-A110 HydrophobicContact CD2-CB 3.54Å; L36-A110 HydrophobicContact CG-CB 3.82Å
37K65.8Low67.9Low142 Ų142103.2 Ų103.262%0.61750%0.498SS*.Hα-helixtrans-58.4-37.6173.3-170.3175.4-177.1179.10111.9R33 K34 N41R33-K37 WeakPolarHBondContact O-CB 3.1Å; R33-K37 PolarHBondContact O-N 2.99Å; K34-K37 PolarHBondContact O-N 3.42Å; K37-N41 PolarHBondContact O-N 3.06Å; K37-N41 VanDerWaalsContact O-N 3.09Å
38Q68.1Low69.4Low123 Ų123104.1 Ų104.158%0.57550%0.497SS*.Hα-helixtrans-65.9-42.7174.7-174.9173.2-4.100111.7K34 R35 L36 N41 M42K34-Q38 PolarHBondContact O-N 3.26Å; R35-Q38 WeakPolarHBondContact O-CB 3.45Å; R35-Q38 PolarHBondContact O-N 3.45Å; L36-Q38 PolarHBondContact O-N 2.94Å; Q38-N41 PolarHBondContact O-N 3.32Å; Q38-M42 HydrophobicContact CG-CE 3.85Å; Q38-M42 WeakPolarHBondContact O-CG 3.36Å; Q38-M42 PolarHBondContact O-N 2.93Å
39V62.4Low70.6Confident82 Ų8296 Ų9650%0.49746%0.464SS..Hα-helixtrans-62.5-45.4175.4174.30000111.7R35 L36 N41 M42R35-V39 WeakPolarHBondContact O-CG2 3.35Å; R35-V39 PolarHBondContact O-N 3.48Å; L36-V39 PolarHBondContact O-N 2.88Å; L36-V39 VanDerWaalsContact O-N 3.09Å; V39-N41 VanDerWaalsContact C-N 3.26Å; V39-N41 PolarHBondContact O-N 2.94Å; V39-M42 VanDerWaalsContact O-CB 3.23Å; V39-M42 WeakPolarHBondContact O-CB 3.31Å; V39-M42 PolarHBondContact O-N 2.79Å
40F64Low71.9Confident18 Ų1894.2 Ų94.28%0.07945%0.447CS..Hα-helixtrans-63.9-29.2176.2-87-76.7000113.4L36 M42 Y45 Y46 F106 K107 A110L36-F40 HydrophobicContact CD1-CD2 3.68Å; L36-F40 HydrophobicContact CD1-CE2 3.49Å; L36-F40 VanDerWaalsContact CD1-CE2 3.49Å; L36-F40 HydrophobicContact CD2-CE2 3.98Å; L36-F40 HydrophobicContact CG-CD2 3.69Å; L36-F40 HydrophobicContact CG-CE2 3.58Å; L36-F40 WeakPolarHBondContact O-CD2 3.38Å; L36-F40 PolarHBondContact O-N 3.39Å; F40-M42 PolarHBondContact O-N 2.79Å; F40-Y45 AromaticContact CD1-CD1 3.78Å; F40-Y45 HydrophobicContact CD1-CD1 3.78Å; F40-Y45 AromaticContact CD1-CE1 3.47Å; F40-Y45 HydrophobicContact CD1-CE1 3.47Å; F40-Y45 VanDerWaalsContact CD1-CE1 3.47Å; F40-Y45 HydrophobicContact CD1-CE2 4.22Å; F40-Y45 HydrophobicContact CD1-CG 4.31Å; F40-Y45 AromaticContact CD1-CZ 3.7Å; F40-Y45 HydrophobicContact CE1-CD1 4.22Å; F40-Y45 AromaticContact CE1-CE1 3.46Å; F40-Y45 HydrophobicContact CE1-CE1 3.46Å; F40-Y45 VanDerWaalsContact CE1-CE1 3.46Å; F40-Y45 AromaticContact CE1-CE2 3.89Å; F40-Y45 HydrophobicContact CE1-CE2 3.89Å; F40-Y45 AromaticContact CE1-CZ 3.25Å; F40-Y45 WeakPolarHBondContact CE1-OH 3.17Å; F40-Y45 HydrophobicContact CZ-CE2 4.45Å; F40-Y46 WeakPolarHBondContact O-CE2 3.45Å; F40-F106 HydrophobicContact CE2-CD1 4.09Å; F40-F106 HydrophobicContact CE2-CE1 4.09Å; F40-F106 AromaticContact CZ-CD1 3.89Å; F40-F106 HydrophobicContact CZ-CD1 3.89Å; F40-F106 HydrophobicContact CZ-CE1 4.27Å; F40-K107 HydrophobicContact CE1-CB 4.4Å; F40-K107 HydrophobicContact CE1-CG 3.99Å; F40-K107 HydrophobicContact CZ-CB 4.25Å; F40-K107 HydrophobicContact CZ-CG 4.27Å; F40-A110 HydrophobicContact CD2-CB 3.67Å; F40-A110 HydrophobicContact CE2-CB 3.28Å; F40-A110 HydrophobicContact CZ-CB 4.1Å
41N64.8Low72.9Confident110 Ų11093.7 Ų93.759%0.58845%0.452SS*.THydrogen-bonded Turntrans-76.8-10.6174.4-106.46.1000113.2K37 Q38 V39 R43K37-N41 PolarHBondContact O-N 3.06Å; K37-N41 VanDerWaalsContact O-N 3.09Å; Q38-N41 PolarHBondContact O-N 3.32Å; V39-N41 VanDerWaalsContact C-N 3.26Å; V39-N41 PolarHBondContact O-N 2.94Å; N41-R43 PolarHBondContact O-N 3.41Å
42M68.5Low73.8Confident89 Ų8991.3 Ų91.344%0.43844%0.44SS..SBendtrans-68.1128.8176.3-64.4-61.9172.600109.9Q38 V39 F40 K44 Y45Q38-M42 HydrophobicContact CG-CE 3.85Å; Q38-M42 WeakPolarHBondContact O-CG 3.36Å; Q38-M42 PolarHBondContact O-N 2.93Å; V39-M42 VanDerWaalsContact O-CB 3.23Å; V39-M42 WeakPolarHBondContact O-CB 3.31Å; V39-M42 PolarHBondContact O-N 2.79Å; F40-M42 PolarHBondContact O-N 2.79Å; M42-K44 HydrophobicContact CB-CB 4.47Å; M42-K44 PolarHBondContact O-N 3.02Å; M42-Y45 PolarHBondContact O-N 2.98Å
43R73.3Confident74.7Confident206 Ų20689.6 Ų89.678%0.77743%0.425SS*.Hα-helixtrans-50.5-31.1172.1-172.5-177.4-81.8-178.8-4.4111.7N41 Y46 L47N41-R43 PolarHBondContact O-N 3.41Å; R43-Y46 PolarHBondContact O-N 3.07Å; R43-L47 PolarHBondContact O-N 2.65Å
44K77.4Confident75.4Confident173 Ų17385.6 Ų85.675%0.75242%0.422SS*.Hα-helixtrans-61.9-39.9177.3-63.2-175.5179-177.60113.7M42 L47 S48M42-K44 HydrophobicContact CB-CB 4.47Å; M42-K44 PolarHBondContact O-N 3.02Å; K44-L47 PolarHBondContact O-N 3.5Å; K44-S48 WeakPolarHBondContact O-CB 3.35Å; K44-S48 PolarHBondContact O-N 3.24Å
45Y80Confident76.2Confident41 Ų4182.9 Ų82.916%0.16141%0.411CS..Hα-helixtrans-62.7-49.3179.2178.1-93.7000110.7F40 M42 L47 S48 V49 E103F40-Y45 AromaticContact CD1-CD1 3.78Å; F40-Y45 HydrophobicContact CD1-CD1 3.78Å; F40-Y45 AromaticContact CD1-CE1 3.47Å; F40-Y45 HydrophobicContact CD1-CE1 3.47Å; F40-Y45 VanDerWaalsContact CD1-CE1 3.47Å; F40-Y45 HydrophobicContact CD1-CE2 4.22Å; F40-Y45 HydrophobicContact CD1-CG 4.31Å; F40-Y45 AromaticContact CD1-CZ 3.7Å; F40-Y45 HydrophobicContact CE1-CD1 4.22Å; F40-Y45 AromaticContact CE1-CE1 3.46Å; F40-Y45 HydrophobicContact CE1-CE1 3.46Å; F40-Y45 VanDerWaalsContact CE1-CE1 3.46Å; F40-Y45 AromaticContact CE1-CE2 3.89Å; F40-Y45 HydrophobicContact CE1-CE2 3.89Å; F40-Y45 AromaticContact CE1-CZ 3.25Å; F40-Y45 WeakPolarHBondContact CE1-OH 3.17Å; F40-Y45 HydrophobicContact CZ-CE2 4.45Å; M42-Y45 PolarHBondContact O-N 2.98Å; Y45-L47 VanDerWaalsContact C-N 3.32Å; Y45-L47 PolarHBondContact O-N 3.33Å; Y45-S48 WeakPolarHBondContact O-CB 3.43Å; Y45-S48 PolarHBondContact O-N 2.82Å; Y45-S48 VanDerWaalsContact O-N 3.14Å; Y45-V49 HydrophobicContact CD1-CG2 4.11Å; Y45-V49 HydrophobicContact CE1-CG2 3.59Å; Y45-V49 HydrophobicContact CE2-CG2 4.28Å; Y45-V49 WeakPolarHBondContact O-CG2 3.48Å; Y45-V49 PolarHBondContact O-N 3.47Å; Y45-E103 WeakPolarHBondContact OH-CG 3.2Å; Y45-E103 PolarHBondContact OH-OE1 2.91Å
46Y78.2Confident76.9Confident53 Ų5375 Ų7521%0.20838%0.381CS..Hα-helixtrans-60.8-41.9177-67.7-63000112.4F40 R43 S48 V49 I50 F193F40-Y46 WeakPolarHBondContact O-CE2 3.45Å; R43-Y46 PolarHBondContact O-N 3.07Å; Y46-S48 VanDerWaalsContact C-N 3.31Å; Y46-S48 PolarHBondContact O-N 3.45Å; Y46-V49 PolarHBondContact O-N 3.03Å; Y46-I50 WeakPolarHBondContact O-CB 3.31Å; Y46-I50 VanDerWaalsContact O-CD1 3.25Å; Y46-I50 WeakPolarHBondContact O-CD1 3.4Å; Y46-I50 WeakPolarHBondContact O-CG1 3.45Å; Y46-I50 PolarHBondContact O-N 3.03Å; Y46-F193 AromaticContact CD1-CE1 3.56Å; Y46-F193 HydrophobicContact CD1-CE1 3.56Å; Y46-F193 AromaticContact CD1-CZ 3.76Å; Y46-F193 HydrophobicContact CD1-CZ 3.76Å; Y46-F193 AromaticContact CE1-CE1 3.69Å; Y46-F193 HydrophobicContact CE1-CE1 3.69Å; Y46-F193 AromaticContact CE1-CZ 3.36Å; Y46-F193 HydrophobicContact CE1-CZ 3.36Å
47L80.2Confident78Confident123 Ų12375.6 Ų75.664%0.64439%0.388SS*.Hα-helixtrans-62.2-40.8175.9-174.563000111.6R43 K44 Y45 I50 G51R43-L47 PolarHBondContact O-N 2.65Å; K44-L47 PolarHBondContact O-N 3.5Å; Y45-L47 VanDerWaalsContact C-N 3.32Å; Y45-L47 PolarHBondContact O-N 3.33Å; L47-I50 PolarHBondContact O-N 3.32Å; L47-G51 PolarHBondContact O-N 3.43Å
48S84.1Confident79.1Confident65 Ų6573.2 Ų73.246%0.45538%0.382SS..Hα-helixtrans-62.7-49.9176.5-166.80000111.3K44 Y45 Y46 I50 G51 L52K44-S48 WeakPolarHBondContact O-CB 3.35Å; K44-S48 PolarHBondContact O-N 3.24Å; Y45-S48 WeakPolarHBondContact O-CB 3.43Å; Y45-S48 PolarHBondContact O-N 2.82Å; Y45-S48 VanDerWaalsContact O-N 3.14Å; Y46-S48 VanDerWaalsContact C-N 3.31Å; Y46-S48 PolarHBondContact O-N 3.45Å; S48-I50 VanDerWaalsContact C-N 3.3Å; S48-I50 PolarHBondContact O-N 3.29Å; S48-G51 PolarHBondContact O-N 2.9Å; S48-G51 VanDerWaalsContact O-N 3.13Å; S48-L52 WeakPolarHBondContact O-CD1 3.49Å; S48-L52 PolarHBondContact O-N 3.43Å; S48-L52 WeakPolarHBondContact OG-CD1 3.29Å
49V83.4Confident80Confident30 Ų3067.8 Ų67.818%0.18236%0.357CS..Hα-helixtrans-57.8-45.5178.5172.20000110.4Y45 Y46 G51 L52 T53 F100 E103Y45-V49 HydrophobicContact CD1-CG2 4.11Å; Y45-V49 HydrophobicContact CE1-CG2 3.59Å; Y45-V49 HydrophobicContact CE2-CG2 4.28Å; Y45-V49 WeakPolarHBondContact O-CG2 3.48Å; Y45-V49 PolarHBondContact O-N 3.47Å; Y46-V49 PolarHBondContact O-N 3.03Å; V49-G51 VanDerWaalsContact C-N 3.35Å; V49-G51 PolarHBondContact O-N 3.36Å; V49-L52 PolarHBondContact O-N 2.89Å; V49-T53 PolarHBondContact O-N 2.98Å; V49-T53 PolarHBondContact O-OG1 3.23Å; V49-F100 HydrophobicContact CG1-CE1 4.35Å; V49-E103 WeakPolarHBondContact CG2-OE1 3.34Å
50I83.1Confident81.1Confident64 Ų6464.3 Ų64.333%0.32834%0.335SS..Hα-helixtrans-60.9-44.3177.1-67160.2000111.2Y46 L47 S48 T53 G54 I190 I194Y46-I50 WeakPolarHBondContact O-CB 3.31Å; Y46-I50 VanDerWaalsContact O-CD1 3.25Å; Y46-I50 WeakPolarHBondContact O-CD1 3.4Å; Y46-I50 WeakPolarHBondContact O-CG1 3.45Å; Y46-I50 PolarHBondContact O-N 3.03Å; L47-I50 PolarHBondContact O-N 3.32Å; S48-I50 VanDerWaalsContact C-N 3.3Å; S48-I50 PolarHBondContact O-N 3.29Å; I50-T53 PolarHBondContact O-N 3.27Å; I50-G54 PolarHBondContact O-N 2.87Å; I50-I190 HydrophobicContact CG1-CG2 4.39Å; I50-I194 HydrophobicContact CD1-CD1 4.35Å; I50-I194 HydrophobicContact CD1-CG1 4.32Å
51G85.8Confident82.2Confident44 Ų4467.9 Ų67.945%0.45436%0.355SS..Hα-helixtrans-63.6-45.7177.800000112.7L47 S48 V49 T53 G54 F55L47-G51 PolarHBondContact O-N 3.43Å; S48-G51 PolarHBondContact O-N 2.9Å; S48-G51 VanDerWaalsContact O-N 3.13Å; V49-G51 VanDerWaalsContact C-N 3.35Å; V49-G51 PolarHBondContact O-N 3.36Å; G51-T53 VanDerWaalsContact C-N 3.33Å; G51-T53 PolarHBondContact O-N 3.37Å; G51-G54 PolarHBondContact O-N 2.94Å; G51-F55 WeakPolarHBondContact O-CB 3.45Å; G51-F55 PolarHBondContact O-N 3.29Å
52L87Confident83.3Confident48 Ų4864.8 Ų64.825%0.25134%0.341SS..Hα-helixtrans-60.2-41.2175.8-89.5119.5000111.7S48 V49 F55 E56 I96 L99 F100S48-L52 WeakPolarHBondContact O-CD1 3.49Å; S48-L52 PolarHBondContact O-N 3.43Å; S48-L52 WeakPolarHBondContact OG-CD1 3.29Å; V49-L52 PolarHBondContact O-N 2.89Å; L52-F55 PolarHBondContact O-N 2.89Å; L52-E56 WeakPolarHBondContact O-CB 3.43Å; L52-E56 PolarHBondContact O-N 3.17Å; L52-I96 HydrophobicContact CD2-CD1 4.15Å; L52-I96 HydrophobicContact CD2-CG2 4.4Å; L52-L99 HydrophobicContact CD2-CD1 3.89Å; L52-F100 HydrophobicContact CB-CE1 4.43Å; L52-F100 HydrophobicContact CB-CE2 4.42Å; L52-F100 HydrophobicContact CB-CZ 3.74Å
53T84.1Confident84Confident13 Ų1361.2 Ų61.28%0.0832%0.323CS..Hα-helixtrans-72.2-33.8178.2-45.20000112V49 I50 G51 F55 E56 A57 F100 R186 I190V49-T53 PolarHBondContact O-N 2.98Å; V49-T53 PolarHBondContact O-OG1 3.23Å; I50-T53 PolarHBondContact O-N 3.27Å; G51-T53 VanDerWaalsContact C-N 3.33Å; G51-T53 PolarHBondContact O-N 3.37Å; T53-F55 VanDerWaalsContact C-N 3.33Å; T53-E56 WeakPolarHBondContact O-CB 3.47Å; T53-E56 PolarHBondContact O-N 3.48Å; T53-A57 PolarHBondContact O-N 3.23Å; T53-F100 VanDerWaalsContact OG1-CZ 3.23Å; T53-F100 WeakPolarHBondContact OG1-CZ 3.49Å; T53-R186 HydrophobicContact CG2-CB 4.46Å; T53-I190 HydrophobicContact CG2-CD1 3.21Å; T53-I190 HydrophobicContact CG2-CG1 4.07Å
54G85.8Confident84.5Confident41 Ų4153.4 Ų53.442%0.42330%0.298SS..Hα-helixtrans-62.7-41.8170.700000112.1I50 G51 A57 L58I50-G54 PolarHBondContact O-N 2.87Å; G51-G54 PolarHBondContact O-N 2.94Å; G54-A57 PolarHBondContact O-N 3Å; G54-L58 PolarHBondContact O-N 2.9Å; G54-L58 VanDerWaalsContact O-N 3.09Å
55F88.6Confident85Confident88 Ų8849.3 Ų49.339%0.38628%0.283SS..Hα-helixtrans-65.8-41.4175.4-169.3-107.6000111.9G51 L52 T53 A57 L58 L59 L92 I96G51-F55 WeakPolarHBondContact O-CB 3.45Å; G51-F55 PolarHBondContact O-N 3.29Å; L52-F55 PolarHBondContact O-N 2.89Å; T53-F55 VanDerWaalsContact C-N 3.33Å; F55-A57 PolarHBondContact O-N 2.76Å; F55-L58 WeakPolarHBondContact O-CB 3.36Å; F55-L58 PolarHBondContact O-N 3.18Å; F55-L59 HydrophobicContact CD1-CD1 3.77Å; F55-L59 HydrophobicContact CD1-CG 4.13Å; F55-L59 HydrophobicContact CE1-CD1 3.58Å; F55-L59 HydrophobicContact CE1-CD2 4.1Å; F55-L59 HydrophobicContact CE1-CG 3.93Å; F55-L59 HydrophobicContact CZ-CD1 4.39Å; F55-L59 HydrophobicContact CZ-CD2 4.08Å; F55-L59 HydrophobicContact CZ-CG 4.31Å; F55-L59 WeakPolarHBondContact O-CG 3.34Å; F55-L59 PolarHBondContact O-N 3.45Å; F55-L92 HydrophobicContact CE1-CD2 4.29Å; F55-L92 HydrophobicContact CZ-CD2 4.31Å; F55-I96 HydrophobicContact CD1-CD1 4.06Å; F55-I96 HydrophobicContact CD1-CG1 4.13Å; F55-I96 HydrophobicContact CE1-CD1 4.31Å; F55-I96 HydrophobicContact CE1-CG1 4.34Å
56E87.6Confident85.2Confident8 Ų849.8 Ų49.84%0.03729%0.288CS..Hα-helixtrans-55.9-48.9172.5-172.2-165.516900111.5L52 T53 L58 L59 V60 I96 L97 F100 R186L52-E56 WeakPolarHBondContact O-CB 3.43Å; L52-E56 PolarHBondContact O-N 3.17Å; T53-E56 WeakPolarHBondContact O-CB 3.47Å; T53-E56 PolarHBondContact O-N 3.48Å; E56-L58 VanDerWaalsContact C-N 3.27Å; E56-L58 PolarHBondContact O-N 3.44Å; E56-L59 PolarHBondContact O-N 3.2Å; E56-V60 WeakPolarHBondContact O-CG2 3.38Å; E56-V60 PolarHBondContact O-N 2.88Å; E56-I96 HydrophobicContact CB-CG2 3.93Å; E56-I96 HydrophobicContact CG-CG2 4.29Å; E56-L97 WeakPolarHBondContact OE1-CD2 3.23Å; E56-F100 HydrophobicContact CB-CE2 4.38Å; E56-F100 WeakPolarHBondContact OE2-CE2 3.33Å; E56-R186 VanDerWaalsContact CD-NH1 3.3Å; E56-R186 WeakPolarHBondContact OE1-CD 3.39Å; E56-R186 IonicContact OE1-CZ 2.9Å; E56-R186 IonicContact OE1-NE 3.04Å; E56-R186 PolarHBondContact OE1-NE 3.42Å; E56-R186 IonicContact OE1-NH1 2.95Å; E56-R186 PolarHBondContact OE1-NH1 3.31Å; E56-R186 IonicContact OE1-NH2 3.53Å; E56-R186 IonicContact OE2-CZ 3.59Å; E56-R186 IonicContact OE2-NE 3.88Å; E56-R186 IonicContact OE2-NH1 2.84Å; E56-R186 PolarHBondContact OE2-NH1 3.49Å
57A85.3Confident85.3Confident26 Ų2649.7 Ų49.722%0.21529%0.29CS..Hα-helixtrans-60.2-38.1178.100000112.1T53 G54 F55 L61 I183T53-A57 PolarHBondContact O-N 3.23Å; G54-A57 PolarHBondContact O-N 3Å; F55-A57 PolarHBondContact O-N 2.76Å; A57-L61 WeakPolarHBondContact O-CB 3.26Å; A57-L61 PolarHBondContact O-N 3.45Å; A57-I183 HydrophobicContact CB-CG2 4.31Å
58L89.2Confident85.2Confident93 Ų9347.8 Ų47.849%0.48728%0.283SS..Hα-helixtrans-66.6-43.5175.6-176.163.8000111.9G54 F55 E56 V60 L61 C62G54-L58 PolarHBondContact O-N 2.9Å; G54-L58 VanDerWaalsContact O-N 3.09Å; F55-L58 WeakPolarHBondContact O-CB 3.36Å; F55-L58 PolarHBondContact O-N 3.18Å; E56-L58 VanDerWaalsContact C-N 3.27Å; E56-L58 PolarHBondContact O-N 3.44Å; L58-V60 PolarHBondContact O-N 3.41Å; L58-L61 WeakPolarHBondContact O-CB 3.39Å; L58-L61 PolarHBondContact O-N 2.82Å; L58-C62 PolarHBondContact O-N 3.34Å; L58-C62 PolarHBondContact O-SG 2.94Å
59L88.2Confident85.2Confident9 Ų948.5 Ų48.55%0.04728%0.28CS..Hα-helixtrans-62.2-43.2178.2-69.9175.8000112.3F55 E56 L61 C62 R63 L89 L92 I96F55-L59 HydrophobicContact CD1-CD1 3.77Å; F55-L59 HydrophobicContact CD1-CG 4.13Å; F55-L59 HydrophobicContact CE1-CD1 3.58Å; F55-L59 HydrophobicContact CE1-CD2 4.1Å; F55-L59 HydrophobicContact CE1-CG 3.93Å; F55-L59 HydrophobicContact CZ-CD1 4.39Å; F55-L59 HydrophobicContact CZ-CD2 4.08Å; F55-L59 HydrophobicContact CZ-CG 4.31Å; F55-L59 WeakPolarHBondContact O-CG 3.34Å; F55-L59 PolarHBondContact O-N 3.45Å; E56-L59 PolarHBondContact O-N 3.2Å; L59-L61 VanDerWaalsContact C-N 3.34Å; L59-C62 PolarHBondContact O-N 3.46Å; L59-R63 WeakPolarHBondContact O-CB 3.46Å; L59-R63 PolarHBondContact O-N 2.92Å; L59-L89 HydrophobicContact CD2-CD2 3.96Å; L59-L92 HydrophobicContact CD1-CB 4.43Å; L59-L92 HydrophobicContact CD1-CD2 4.1Å; L59-L92 HydrophobicContact CD1-CG 3.73Å; L59-L92 HydrophobicContact CD2-CD2 3.52Å; L59-L92 HydrophobicContact CD2-CG 4.05Å; L59-L92 HydrophobicContact CG-CD2 4.46Å; L59-I96 HydrophobicContact CD1-CG1 3.9Å
60V83.8Confident85Confident8 Ų849.2 Ų49.25%0.04829%0.286CS..Hα-helixtrans-65.9-39.9176.8-178.80000110.6E56 L58 R63 V64 F179 I183E56-V60 WeakPolarHBondContact O-CG2 3.38Å; E56-V60 PolarHBondContact O-N 2.88Å; L58-V60 PolarHBondContact O-N 3.41Å; V60-R63 WeakPolarHBondContact O-CB 3.37Å; V60-R63 PolarHBondContact O-N 3.38Å; V60-V64 WeakPolarHBondContact O-CG2 3.45Å; V60-V64 PolarHBondContact O-N 3.07Å; V60-F179 HydrophobicContact CG1-CB 4.16Å; V60-F179 HydrophobicContact CG1-CD1 4.02Å; V60-F179 HydrophobicContact CG1-CG 4.35Å; V60-I183 HydrophobicContact CB-CD1 4.1Å; V60-I183 HydrophobicContact CB-CG1 4.45Å; V60-I183 HydrophobicContact CG1-CD1 3.69Å; V60-I183 HydrophobicContact CG1-CG1 4.25Å
61L86.8Confident84.6Confident93 Ų9351.8 Ų51.849%0.48730%0.3SS..Hα-helixtrans-60.3-47.5173.7179.162.8000111.5A57 L58 L59 R63 V64 I65A57-L61 WeakPolarHBondContact O-CB 3.26Å; A57-L61 PolarHBondContact O-N 3.45Å; L58-L61 WeakPolarHBondContact O-CB 3.39Å; L58-L61 PolarHBondContact O-N 2.82Å; L59-L61 VanDerWaalsContact C-N 3.34Å; L61-R63 VanDerWaalsContact C-N 3.29Å; L61-R63 PolarHBondContact O-N 3.25Å; L61-V64 PolarHBondContact O-N 3.34Å; L61-I65 HydrophobicContact CD1-CD1 4Å; L61-I65 HydrophobicContact CD1-CG1 4.34Å; L61-I65 HydrophobicContact CG-CD1 3.88Å; L61-I65 VanDerWaalsContact O-CG1 3.3Å; L61-I65 WeakPolarHBondContact O-CG1 3.36Å; L61-I65 PolarHBondContact O-N 3.47Å
62C88.3Confident84.2Confident46 Ų4659.6 Ų59.631%0.31132%0.316SS..Hα-helixtrans-58.8-40.8175.6-70.90000112L58 L59 I65 L66 L89L58-C62 PolarHBondContact O-N 3.34Å; L58-C62 PolarHBondContact O-SG 2.94Å; L59-C62 PolarHBondContact O-N 3.46Å; C62-I65 PolarHBondContact O-N 3.04Å; C62-L66 PolarHBondContact O-N 2.91Å; C62-L89 HydrophobicContact CB-CD1 4.18Å
63R84.4Confident83.5Confident14 Ų1460.7 Ų60.75%0.05332%0.321CS..Hα-helixtrans-59.8-49.8176.1-176.6-174.2-175.4173.67.2111.7L59 V60 L61 I65 L66 E67 E90 D136L59-R63 WeakPolarHBondContact O-CB 3.46Å; L59-R63 PolarHBondContact O-N 2.92Å; V60-R63 WeakPolarHBondContact O-CB 3.37Å; V60-R63 PolarHBondContact O-N 3.38Å; L61-R63 VanDerWaalsContact C-N 3.29Å; L61-R63 PolarHBondContact O-N 3.25Å; R63-I65 VanDerWaalsContact C-N 3.35Å; R63-I65 PolarHBondContact O-N 3.1Å; R63-L66 PolarHBondContact O-N 3.36Å; R63-E67 PolarHBondContact O-N 3.34Å; R63-E90 IonicContact CZ-OE1 3.91Å; R63-E90 IonicContact NE-OE1 3.47Å; R63-E90 PolarHBondContact NE-OE1 3.19Å; R63-E90 VanDerWaalsContact NH2-CD 3.26Å; R63-E90 IonicContact NH2-OE1 3.93Å; R63-E90 PolarHBondContact NH2-OE1 3.04Å; R63-D136 IonicContact CZ-OD1 3.55Å; R63-D136 IonicContact NH1-OD1 2.84Å; R63-D136 PolarHBondContact NH1-OD1 3.35Å
64V83.2Confident82.8Confident42 Ų4264.9 Ų64.926%0.25535%0.349SS..Hα-helixtrans-64.1-40.1-179.9172.80000111.4V60 L61 E67 T68V60-V64 WeakPolarHBondContact O-CG2 3.45Å; V60-V64 PolarHBondContact O-N 3.07Å; L61-V64 PolarHBondContact O-N 3.34Å; V64-E67 PolarHBondContact O-N 2.93Å; V64-T68 PolarHBondContact O-N 3.36Å; V64-T68 PolarHBondContact O-OG1 2.97Å
65I86.7Confident81.9Confident86 Ų8668.5 Ų68.544%0.44137%0.365SS..Hα-helixtrans-62.7-45.9176.5-68.6167.7000110.6L61 C62 R63 E67 T68 E69L61-I65 HydrophobicContact CD1-CD1 4Å; L61-I65 HydrophobicContact CD1-CG1 4.34Å; L61-I65 HydrophobicContact CG-CD1 3.88Å; L61-I65 VanDerWaalsContact O-CG1 3.3Å; L61-I65 WeakPolarHBondContact O-CG1 3.36Å; L61-I65 PolarHBondContact O-N 3.47Å; C62-I65 PolarHBondContact O-N 3.04Å; R63-I65 VanDerWaalsContact C-N 3.35Å; R63-I65 PolarHBondContact O-N 3.1Å; I65-E67 VanDerWaalsContact C-N 3.34Å; I65-E67 PolarHBondContact O-N 3.49Å; I65-T68 WeakPolarHBondContact O-CB 3.43Å; I65-T68 PolarHBondContact O-N 2.88Å; I65-T68 VanDerWaalsContact O-N 3.13Å; I65-E69 HydrophobicContact CG2-CG 4.49Å; I65-E69 PolarHBondContact O-N 3.16Å
66L84.2Confident81.2Confident51 Ų5166 Ų6627%0.26737%0.365SS..Hα-helixtrans-65.4-37.2178.7-80.5162.9000112.8C62 R63 T68 E69 S70 L89C62-L66 PolarHBondContact O-N 2.91Å; R63-L66 PolarHBondContact O-N 3.36Å; L66-T68 VanDerWaalsContact C-N 3.27Å; L66-T68 PolarHBondContact O-N 3.32Å; L66-E69 PolarHBondContact O-N 2.89Å; L66-S70 WeakPolarHBondContact O-CB 3.36Å; L66-S70 PolarHBondContact O-N 3.03Å; L66-L89 HydrophobicContact CD1-CD1 3.06Å; L66-L89 HydrophobicContact CD1-CG 4.45Å; L66-L89 HydrophobicContact CG-CD1 4.48Å
67E80.4Confident80.6Confident51 Ų5173.4 Ų73.424%0.23840%0.404CS..Hα-helixtrans-61.7-39.9172.6-174.3165.9-162.700111R63 V64 I65 S70R63-E67 PolarHBondContact O-N 3.34Å; V64-E67 PolarHBondContact O-N 2.93Å; I65-E67 VanDerWaalsContact C-N 3.34Å; I65-E67 PolarHBondContact O-N 3.49Å; E67-S70 PolarHBondContact O-N 3.28Å; E67-S70 PolarHBondContact O-OG 2.99Å
68T80Confident80.3Confident83 Ų8374.8 Ų74.851%0.50941%0.412SS..Hα-helixtrans-65.1-44.5176-520000112.1V64 I65 L66 S70 L71V64-T68 PolarHBondContact O-N 3.36Å; V64-T68 PolarHBondContact O-OG1 2.97Å; I65-T68 WeakPolarHBondContact O-CB 3.43Å; I65-T68 PolarHBondContact O-N 2.88Å; I65-T68 VanDerWaalsContact O-N 3.13Å; L66-T68 VanDerWaalsContact C-N 3.27Å; L66-T68 PolarHBondContact O-N 3.32Å; T68-S70 VanDerWaalsContact C-N 3.33Å; T68-S70 PolarHBondContact O-N 3.48Å; T68-L71 PolarHBondContact O-N 2.98Å
69E84Confident79.7Confident80 Ų8076 Ų7637%0.37442%0.415SS..Hα-helixtrans-67.4-34.7177.5-71.2-59.5135.500111.9I65 L66 L71 R72 L73I65-E69 HydrophobicContact CG2-CG 4.49Å; I65-E69 PolarHBondContact O-N 3.16Å; L66-E69 PolarHBondContact O-N 2.89Å; E69-L71 PolarHBondContact O-N 3.17Å; E69-L71 VanDerWaalsContact O-N 3.13Å; E69-R72 PolarHBondContact O-N 3.08Å; E69-L73 HydrophobicContact CB-CD1 4.35Å; E69-L73 WeakPolarHBondContact O-CD1 3.37Å; E69-L73 PolarHBondContact O-N 2.94Å
70S78.3Confident79.2Confident45 Ų4585.1 Ų85.132%0.31545%0.449SS..Hα-helixtrans-59.5-26.8177.980.10000113.2L66 E67 T68L66-S70 WeakPolarHBondContact O-CB 3.36Å; L66-S70 PolarHBondContact O-N 3.03Å; E67-S70 PolarHBondContact O-N 3.28Å; E67-S70 PolarHBondContact O-OG 2.99Å; T68-S70 VanDerWaalsContact C-N 3.33Å; T68-S70 PolarHBondContact O-N 3.48Å
71L75.2Confident79.2Confident119 Ų11990.9 Ų90.962%0.62348%0.479SS*.THydrogen-bonded Turntrans-79.1-21.8176.1-64.9172.7000113T68 E69T68-L71 PolarHBondContact O-N 2.98Å; E69-L71 PolarHBondContact O-N 3.17Å; E69-L71 VanDerWaalsContact O-N 3.13Å
72R78Confident79Confident207 Ų20788.1 Ų88.178%0.78146%0.464SS*.THydrogen-bonded Turntrans-93.3-24.2-172.9-162172.3-172.9170.42.5113.2E69E69-R72 PolarHBondContact O-N 3.08Å
73L72Confident78.6Confident71 Ų7190.2 Ų90.237%0.37247%0.472SS..SBendtrans-88.3138.6-176.4-80.585.7000112.6E69 I82E69-L73 HydrophobicContact CB-CD1 4.35Å; E69-L73 WeakPolarHBondContact O-CD1 3.37Å; E69-L73 PolarHBondContact O-N 2.94Å; L73-I82 HydrophobicContact CD2-CD1 3.89Å
74P68.1Low78.6Confident101 Ų10195.9 Ų95.966%0.65650%0.499SS*.PPolyproline II helixtrans-67.6153.2173.127.6-33.3000111.9G76P74-G76 PolarHBondContact O-N 3.09Å
75P67.5Low78.8Confident117 Ų11795.2 Ų95.276%0.7650%0.501SS*.SBendtrans-63.3121-179.826.4-33.8000110.7
76G74.9Confident78.8Confident37 Ų3792.6 Ų92.638%0.38149%0.487SS..SBendtrans-170.4-174.8-17800000112.4P74 S78 Q79P74-G76 PolarHBondContact O-N 3.09Å; G76-S78 PolarHBondContact O-N 3.3Å; G76-S78 VanDerWaalsContact O-N 3.11Å; G76-Q79 WeakPolarHBondContact O-CB 3.37Å; G76-Q79 PolarHBondContact O-N 3.32Å
77N74.8Confident78.8Confident163 Ų16394 Ų9487%0.87250%0.495SS*.Hα-helixtrans-56.5-29.3-179.4-75.5-1.5000113.5Q79 R80N77-Q79 PolarHBondContact O-N 2.89Å; N77-R80 PolarHBondContact O-N 3.27Å
78S78.1Confident79.3Confident55 Ų5594.4 Ų94.439%0.38551%0.506SS..Hα-helixtrans-60.3-30.2172.946.40000113G76 R80 L81 I82G76-S78 PolarHBondContact O-N 3.3Å; G76-S78 VanDerWaalsContact O-N 3.11Å; S78-R80 VanDerWaalsContact C-N 3.33Å; S78-R80 PolarHBondContact O-N 3.09Å; S78-L81 PolarHBondContact O-N 3.4Å; S78-I82 WeakPolarHBondContact O-CG1 3.33Å; S78-I82 PolarHBondContact O-N 2.82Å; S78-I82 VanDerWaalsContact O-N 3.07Å
79Q76.1Confident79.7Confident117 Ų11792.1 Ų92.155%0.54749%0.491SS..Hα-helixtrans-64.3-37179.7-169.11792.900112G76 N77 I82 L83G76-Q79 WeakPolarHBondContact O-CB 3.37Å; G76-Q79 PolarHBondContact O-N 3.32Å; N77-Q79 PolarHBondContact O-N 2.89Å; Q79-I82 PolarHBondContact O-N 3.46Å; Q79-L83 WeakPolarHBondContact O-CB 3.45Å; Q79-L83 PolarHBondContact O-N 2.99Å
80R78.6Confident79.7Confident202 Ų20288.9 Ų88.976%0.76248%0.476SS*.Hα-helixtrans-66.4-42178.1-173.4177177.6-179.5-0.4111.6N77 S78 L83 E84N77-R80 PolarHBondContact O-N 3.27Å; S78-R80 VanDerWaalsContact C-N 3.33Å; S78-R80 PolarHBondContact O-N 3.09Å; R80-L83 PolarHBondContact O-N 3.01Å; R80-E84 PolarHBondContact O-N 3.39Å; R80-E84 VanDerWaalsContact O-N 3.07Å
81L83.2Confident80.3Confident128 Ų12890.1 Ų90.167%0.6748%0.484SS*.Hα-helixtrans-64.7-41.2177.6-175.867.8000111.5S78 E84 G85S78-L81 PolarHBondContact O-N 3.4Å; L81-E84 PolarHBondContact O-N 3.34Å; L81-G85 PolarHBondContact O-N 3.25Å
82I82.6Confident81Confident35 Ų3587.5 Ų87.518%0.17947%0.47CS..Hα-helixtrans-66-42.6177.2-67.5166.8000110.9L73 S78 Q79 E84 G85 Q86L73-I82 HydrophobicContact CD2-CD1 3.89Å; S78-I82 WeakPolarHBondContact O-CG1 3.33Å; S78-I82 PolarHBondContact O-N 2.82Å; S78-I82 VanDerWaalsContact O-N 3.07Å; Q79-I82 PolarHBondContact O-N 3.46Å; I82-E84 VanDerWaalsContact C-N 3.32Å; I82-E84 PolarHBondContact O-N 3.45Å; I82-G85 PolarHBondContact O-N 3.47Å; I82-Q86 WeakPolarHBondContact O-CB 3.42Å; I82-Q86 PolarHBondContact O-N 3.44Å
83L80.9Confident81.5Confident91 Ų9177.7 Ų77.748%0.47643%0.433SS..Hα-helixtrans-61-42.2178.1-175.467.3000111.8Q79 R80 Q86 L87Q79-L83 WeakPolarHBondContact O-CB 3.45Å; Q79-L83 PolarHBondContact O-N 2.99Å; R80-L83 PolarHBondContact O-N 3.01Å; L83-Q86 PolarHBondContact O-N 2.86Å; L83-L87 PolarHBondContact O-N 2.87Å; L83-L87 VanDerWaalsContact O-N 3.07Å
84E84.8Confident82.3Confident132 Ų13276.2 Ų76.262%0.61743%0.425SS*.Hα-helixtrans-63.6-44.1175.3-173.9174-179.800111.6R80 L81 I82 Q86 L87 A88R80-E84 PolarHBondContact O-N 3.39Å; R80-E84 VanDerWaalsContact O-N 3.07Å; L81-E84 PolarHBondContact O-N 3.34Å; I82-E84 VanDerWaalsContact C-N 3.32Å; I82-E84 PolarHBondContact O-N 3.45Å; E84-Q86 VanDerWaalsContact C-N 3.34Å; E84-Q86 PolarHBondContact O-N 3.05Å; E84-L87 PolarHBondContact O-N 3.27Å; E84-A88 WeakPolarHBondContact O-CB 3.47Å; E84-A88 PolarHBondContact O-N 3.38Å
85G87.1Confident83.4Confident29 Ų2976.8 Ų76.830%0.29942%0.418SS..Hα-helixtrans-61.6-39.4174.600000113.2L81 I82 A88 L89L81-G85 PolarHBondContact O-N 3.25Å; I82-G85 PolarHBondContact O-N 3.47Å; G85-A88 PolarHBondContact O-N 2.88Å; G85-L89 WeakPolarHBondContact O-CG 3.32Å; G85-L89 PolarHBondContact O-N 3.13Å
86Q85.5Confident84.4Confident30 Ų3071.8 Ų71.814%0.1438%0.384CS..Hα-helixtrans-62.4-49.8176.4-177.5177.9-15.200110.9I82 L83 E84 A88 L89 E90I82-Q86 WeakPolarHBondContact O-CB 3.42Å; I82-Q86 PolarHBondContact O-N 3.44Å; L83-Q86 PolarHBondContact O-N 2.86Å; E84-Q86 VanDerWaalsContact C-N 3.34Å; E84-Q86 PolarHBondContact O-N 3.05Å; Q86-A88 VanDerWaalsContact C-N 3.31Å; Q86-A88 PolarHBondContact O-N 3.36Å; Q86-L89 PolarHBondContact O-N 3.2Å; Q86-E90 PolarHBondContact NE2-OE1 3.25Å; Q86-E90 WeakPolarHBondContact O-CG 3.47Å; Q86-E90 PolarHBondContact O-N 3.02Å
87L85.1Confident85.1Confident82 Ų8270.2 Ų70.243%0.42937%0.367SS..Hα-helixtrans-60.2-41.8178.4-177.768.5000111.9L83 E84 L89 E90 C91L83-L87 PolarHBondContact O-N 2.87Å; L83-L87 VanDerWaalsContact O-N 3.07Å; E84-L87 PolarHBondContact O-N 3.27Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-L89 PolarHBondContact O-N 3.44Å; L87-E90 PolarHBondContact O-N 3.39Å; L87-C91 WeakPolarHBondContact O-CB 3.26Å; L87-C91 PolarHBondContact O-N 2.89Å
88A90Very high85.7Confident59 Ų5964.3 Ų64.349%0.48834%0.339SS..Hα-helixtrans-61.8-42.1178.100000111.9E84 G85 Q86 C91 L92E84-A88 WeakPolarHBondContact O-CB 3.47Å; E84-A88 PolarHBondContact O-N 3.38Å; G85-A88 PolarHBondContact O-N 2.88Å; Q86-A88 VanDerWaalsContact C-N 3.31Å; Q86-A88 PolarHBondContact O-N 3.36Å; A88-C91 PolarHBondContact O-N 3.49Å; A88-L92 WeakPolarHBondContact O-CB 3.23Å; A88-L92 PolarHBondContact O-N 2.9Å
89L89.1Confident86.2Confident34 Ų3465.3 Ų65.318%0.17834%0.339CS..Hα-helixtrans-70.2-36.9177.1-72.6172.6000113L59 C62 L66 G85 Q86 L87 C91 L92 S93L59-L89 HydrophobicContact CD2-CD2 3.96Å; C62-L89 HydrophobicContact CB-CD1 4.18Å; L66-L89 HydrophobicContact CD1-CD1 3.06Å; L66-L89 HydrophobicContact CD1-CG 4.45Å; L66-L89 HydrophobicContact CG-CD1 4.48Å; G85-L89 WeakPolarHBondContact O-CG 3.32Å; G85-L89 PolarHBondContact O-N 3.13Å; Q86-L89 PolarHBondContact O-N 3.2Å; L87-L89 VanDerWaalsContact C-N 3.34Å; L87-L89 PolarHBondContact O-N 3.44Å; L89-C91 VanDerWaalsContact C-N 3.34Å; L89-L92 PolarHBondContact O-N 2.92Å; L89-S93 WeakPolarHBondContact O-CB 3.4Å; L89-S93 PolarHBondContact O-N 3.44Å; L89-S93 PolarHBondContact O-OG 3.25Å
90E85.3Confident86.7Confident12 Ų1260.4 Ų60.46%0.05632%0.316CS..Hα-helixtrans-62.7-41.6172.8-70.5-172165.500111.6R63 Q86 L87 S93 L94 H143R63-E90 IonicContact CZ-OE1 3.91Å; R63-E90 IonicContact NE-OE1 3.47Å; R63-E90 PolarHBondContact NE-OE1 3.19Å; R63-E90 VanDerWaalsContact NH2-CD 3.26Å; R63-E90 IonicContact NH2-OE1 3.93Å; R63-E90 PolarHBondContact NH2-OE1 3.04Å; Q86-E90 PolarHBondContact NE2-OE1 3.25Å; Q86-E90 WeakPolarHBondContact O-CG 3.47Å; Q86-E90 PolarHBondContact O-N 3.02Å; L87-E90 PolarHBondContact O-N 3.39Å; E90-S93 PolarHBondContact O-OG 3.04Å; E90-S93 VanDerWaalsContact O-OG 3.05Å; E90-L94 VanDerWaalsContact O-CB 3.26Å; E90-L94 WeakPolarHBondContact O-CB 3.39Å; E90-L94 PolarHBondContact O-N 3.09Å; E90-H143 IonicContact OE2-CG 2.8Å
91C89.4Confident87.2Confident72 Ų7252.7 Ų52.749%0.48629%0.292SS..Hα-helixtrans-65.3-42.9175.7-171.30000111.5L87 A88 L89 L94 F95L87-C91 WeakPolarHBondContact O-CB 3.26Å; L87-C91 PolarHBondContact O-N 2.89Å; A88-C91 PolarHBondContact O-N 3.49Å; L89-C91 VanDerWaalsContact C-N 3.34Å; C91-L94 PolarHBondContact O-N 3Å; C91-F95 WeakPolarHBondContact O-CB 3.49Å; C91-F95 PolarHBondContact O-N 3.46Å
92L90.8Very high87.4Confident64 Ų6451 Ų5134%0.33529%0.287SS..Hα-helixtrans-68.4-40.6179.7-173.259.1000112.1F55 L59 A88 L89 F95 I96F55-L92 HydrophobicContact CE1-CD2 4.29Å; F55-L92 HydrophobicContact CZ-CD2 4.31Å; L59-L92 HydrophobicContact CD1-CB 4.43Å; L59-L92 HydrophobicContact CD1-CD2 4.1Å; L59-L92 HydrophobicContact CD1-CG 3.73Å; L59-L92 HydrophobicContact CD2-CD2 3.52Å; L59-L92 HydrophobicContact CD2-CG 4.05Å; L59-L92 HydrophobicContact CG-CD2 4.46Å; A88-L92 WeakPolarHBondContact O-CB 3.23Å; A88-L92 PolarHBondContact O-N 2.9Å; L89-L92 PolarHBondContact O-N 2.92Å; L92-F95 WeakPolarHBondContact O-CB 3.42Å; L92-F95 PolarHBondContact O-N 3.37Å; L92-I96 WeakPolarHBondContact O-CG1 3.16Å; L92-I96 PolarHBondContact O-N 3.37Å
93S88.4Confident87.6Confident1 Ų151 Ų511%0.00729%0.286CS..Hα-helixtrans-64-43.3174.870.40000111.2L89 E90 F95 I96 L97L89-S93 WeakPolarHBondContact O-CB 3.4Å; L89-S93 PolarHBondContact O-N 3.44Å; L89-S93 PolarHBondContact O-OG 3.25Å; E90-S93 PolarHBondContact O-OG 3.04Å; E90-S93 VanDerWaalsContact O-OG 3.05Å; S93-F95 VanDerWaalsContact C-N 3.32Å; S93-F95 PolarHBondContact O-N 3.34Å; S93-I96 PolarHBondContact O-N 2.85Å; S93-L97 WeakPolarHBondContact O-CB 3.46Å; S93-L97 PolarHBondContact O-N 3.14Å
94L88.1Confident87.8Confident39 Ų3948.4 Ų48.420%0.20427%0.272CS..Hα-helixtrans-60.7-41175-176.3150.9000111.6E90 C91 L97 S98 F133 I137 I140E90-L94 VanDerWaalsContact O-CB 3.26Å; E90-L94 WeakPolarHBondContact O-CB 3.39Å; E90-L94 PolarHBondContact O-N 3.09Å; C91-L94 PolarHBondContact O-N 3Å; L94-L97 PolarHBondContact O-N 3.33Å; L94-S98 WeakPolarHBondContact O-CB 3.23Å; L94-S98 PolarHBondContact O-N 3.44Å; L94-F133 HydrophobicContact CG-CE2 4.44Å; L94-I137 HydrophobicContact CD1-CG1 4.04Å; L94-I140 HydrophobicContact CD1-CD1 4.46Å; L94-I140 HydrophobicContact CD1-CG2 3.98Å
95F91.3Very high87.8Confident114 Ų11445.5 Ų45.550%0.527%0.265SS..Hα-helixtrans-61-50176.8177.3-104.6000111.8C91 L92 S93 L97 S98 L99C91-F95 WeakPolarHBondContact O-CB 3.49Å; C91-F95 PolarHBondContact O-N 3.46Å; L92-F95 WeakPolarHBondContact O-CB 3.42Å; L92-F95 PolarHBondContact O-N 3.37Å; S93-F95 VanDerWaalsContact C-N 3.32Å; S93-F95 PolarHBondContact O-N 3.34Å; F95-L97 VanDerWaalsContact C-N 3.35Å; F95-L97 PolarHBondContact O-N 3.24Å; F95-S98 WeakPolarHBondContact O-CB 3.26Å; F95-S98 PolarHBondContact O-N 2.76Å; F95-S98 VanDerWaalsContact O-N 3.16Å; F95-L99 HydrophobicContact CD1-CD1 4.38Å; F95-L99 HydrophobicContact CE1-CD1 3.85Å; F95-L99 HydrophobicContact CE1-CG 4.38Å; F95-L99 HydrophobicContact CZ-CD1 4.2Å; F95-L99 HydrophobicContact CZ-CD2 4.34Å; F95-L99 HydrophobicContact CZ-CG 4.42Å; F95-L99 PolarHBondContact O-N 3.47Å
96I89.4Confident87.7Confident12 Ų1248.9 Ų48.96%0.06227%0.271CS..Hα-helixtrans-62.9-41.7178.8-62.4-64000111.2L52 F55 E56 L59 L92 S93 S98 L99 F100L52-I96 HydrophobicContact CD2-CD1 4.15Å; L52-I96 HydrophobicContact CD2-CG2 4.4Å; F55-I96 HydrophobicContact CD1-CD1 4.06Å; F55-I96 HydrophobicContact CD1-CG1 4.13Å; F55-I96 HydrophobicContact CE1-CD1 4.31Å; F55-I96 HydrophobicContact CE1-CG1 4.34Å; E56-I96 HydrophobicContact CB-CG2 3.93Å; E56-I96 HydrophobicContact CG-CG2 4.29Å; L59-I96 HydrophobicContact CD1-CG1 3.9Å; L92-I96 WeakPolarHBondContact O-CG1 3.16Å; L92-I96 PolarHBondContact O-N 3.37Å; S93-I96 PolarHBondContact O-N 2.85Å; I96-S98 VanDerWaalsContact C-N 3.33Å; I96-S98 PolarHBondContact O-N 3.45Å; I96-L99 HydrophobicContact CD1-CD1 4.35Å; I96-L99 WeakPolarHBondContact O-CB 3.44Å; I96-L99 PolarHBondContact O-N 3.31Å; I96-F100 HydrophobicContact CG2-CD2 4.23Å; I96-F100 HydrophobicContact CG2-CE2 3.8Å; I96-F100 VanDerWaalsContact O-CD2 3.3Å; I96-F100 WeakPolarHBondContact O-CD2 3.23Å; I96-F100 PolarHBondContact O-N 2.81Å
97L87.8Confident87.5Confident3 Ų348.7 Ų48.72%0.01627%0.27CS..Hα-helixtrans-62.6-38.9173.7-83.6166.2000112.7E56 S93 L94 F95 L99 F100 V101 C132 F133 D136E56-L97 WeakPolarHBondContact OE1-CD2 3.23Å; S93-L97 WeakPolarHBondContact O-CB 3.46Å; S93-L97 PolarHBondContact O-N 3.14Å; L94-L97 PolarHBondContact O-N 3.33Å; F95-L97 VanDerWaalsContact C-N 3.35Å; F95-L97 PolarHBondContact O-N 3.24Å; L97-L99 VanDerWaalsContact C-N 3.29Å; L97-L99 PolarHBondContact O-N 2.95Å; L97-F100 WeakPolarHBondContact O-CB 3.18Å; L97-F100 PolarHBondContact O-N 3.33Å; L97-F100 VanDerWaalsContact O-N 3.1Å; L97-V101 WeakPolarHBondContact O-CG2 3.48Å; L97-V101 PolarHBondContact O-N 2.94Å; L97-C132 HydrophobicContact CD2-CB 4.11Å; L97-F133 HydrophobicContact CB-CD2 4.33Å; L97-D136 HydrophobicContact CD1-CB 4.31Å; L97-D136 WeakPolarHBondContact CD1-OD2 3.21Å
98S88.8Confident87.4Confident40 Ų4046.7 Ų46.728%0.2826%0.259SS..Hα-helixtrans-62.2-38.7175.9-159.60000111.4L94 F95 I96 F100 V101 V102L94-S98 WeakPolarHBondContact O-CB 3.23Å; L94-S98 PolarHBondContact O-N 3.44Å; F95-S98 WeakPolarHBondContact O-CB 3.26Å; F95-S98 PolarHBondContact O-N 2.76Å; F95-S98 VanDerWaalsContact O-N 3.16Å; I96-S98 VanDerWaalsContact C-N 3.33Å; I96-S98 PolarHBondContact O-N 3.45Å; S98-F100 VanDerWaalsContact C-N 3.3Å; S98-F100 PolarHBondContact O-N 3.33Å; S98-V101 PolarHBondContact O-N 2.82Å; S98-V102 WeakPolarHBondContact O-CG2 3.31Å; S98-V102 PolarHBondContact O-N 3.38Å
99L88.8Confident87Confident75 Ų7550.7 Ų50.739%0.39326%0.262SS..Hα-helixtrans-59.3-40.9172.4-63.9178.9000111.7L52 F95 I96 L97 V102 E103L52-L99 HydrophobicContact CD2-CD1 3.89Å; F95-L99 HydrophobicContact CD1-CD1 4.38Å; F95-L99 HydrophobicContact CE1-CD1 3.85Å; F95-L99 HydrophobicContact CE1-CG 4.38Å; F95-L99 HydrophobicContact CZ-CD1 4.2Å; F95-L99 HydrophobicContact CZ-CD2 4.34Å; F95-L99 HydrophobicContact CZ-CG 4.42Å; F95-L99 PolarHBondContact O-N 3.47Å; I96-L99 HydrophobicContact CD1-CD1 4.35Å; I96-L99 WeakPolarHBondContact O-CB 3.44Å; I96-L99 PolarHBondContact O-N 3.31Å; L97-L99 VanDerWaalsContact C-N 3.29Å; L97-L99 PolarHBondContact O-N 2.95Å; L99-V102 PolarHBondContact O-N 3.44Å; L99-E103 VanDerWaalsContact O-CB 3.31Å; L99-E103 WeakPolarHBondContact O-CB 3.32Å; L99-E103 PolarHBondContact O-N 2.87Å
100F87.1Confident86.4Confident15 Ų1549.5 Ų49.57%0.06626%0.257CS..Hα-helixtrans-67.3-40.8174.4-73.6-60.6000113V49 L52 T53 E56 I96 L97 S98 V102 E103 I104V49-F100 HydrophobicContact CG1-CE1 4.35Å; L52-F100 HydrophobicContact CB-CE1 4.43Å; L52-F100 HydrophobicContact CB-CE2 4.42Å; L52-F100 HydrophobicContact CB-CZ 3.74Å; T53-F100 VanDerWaalsContact OG1-CZ 3.23Å; T53-F100 WeakPolarHBondContact OG1-CZ 3.49Å; E56-F100 HydrophobicContact CB-CE2 4.38Å; E56-F100 WeakPolarHBondContact OE2-CE2 3.33Å; I96-F100 HydrophobicContact CG2-CD2 4.23Å; I96-F100 HydrophobicContact CG2-CE2 3.8Å; I96-F100 VanDerWaalsContact O-CD2 3.3Å; I96-F100 WeakPolarHBondContact O-CD2 3.23Å; I96-F100 PolarHBondContact O-N 2.81Å; L97-F100 WeakPolarHBondContact O-CB 3.18Å; L97-F100 PolarHBondContact O-N 3.33Å; L97-F100 VanDerWaalsContact O-N 3.1Å; S98-F100 VanDerWaalsContact C-N 3.3Å; S98-F100 PolarHBondContact O-N 3.33Å; F100-V102 VanDerWaalsContact C-N 3.29Å; F100-V102 PolarHBondContact O-N 3.38Å; F100-E103 WeakPolarHBondContact O-CB 3.42Å; F100-E103 PolarHBondContact O-N 3.08Å; F100-I104 WeakPolarHBondContact O-CG1 3.45Å; F100-I104 PolarHBondContact O-N 3.41Å; F100-I104 VanDerWaalsContact O-N 3.14Å
101V88.4Confident85.8Confident40 Ų4051 Ų5124%0.24226%0.264CS..Hα-helixtrans-61.6-39.9176.5174.20000111.1L97 S98 P105 F133L97-V101 WeakPolarHBondContact O-CG2 3.48Å; L97-V101 PolarHBondContact O-N 2.94Å; S98-V101 PolarHBondContact O-N 2.82Å; V101-P105 WeakPolarHBondContact O-CD 3.45Å; V101-F133 HydrophobicContact CG2-CB 3.73Å; V101-F133 HydrophobicContact CG2-CD1 4.22Å; V101-F133 HydrophobicContact CG2-CD2 4.14Å; V101-F133 HydrophobicContact CG2-CG 3.78Å
102V87.6Confident85Confident93 Ų9348.3 Ų48.356%0.56425%0.249SC*.Hα-helixtrans-75.3-29.8175.61750000112.1S98 L99 F100 I104 P105S98-V102 WeakPolarHBondContact O-CG2 3.31Å; S98-V102 PolarHBondContact O-N 3.38Å; L99-V102 PolarHBondContact O-N 3.44Å; F100-V102 VanDerWaalsContact C-N 3.29Å; F100-V102 PolarHBondContact O-N 3.38Å; V102-I104 VanDerWaalsContact C-N 3.34Å; V102-I104 PolarHBondContact O-N 2.94Å; V102-P105 VanDerWaalsContact O-CD 3.23Å; V102-P105 WeakPolarHBondContact O-CD 2.9Å; V102-P105 VanDerWaalsContact O-CG 3.26Å; V102-P105 WeakPolarHBondContact O-CG 3.29Å
103E86.8Confident84Confident35 Ų3551 Ų5116%0.16426%0.262CS..Hα-helixtrans-62.3-40.2175-171-169.5149.200111.6Y45 V49 L99 F100 F106 K107Y45-E103 WeakPolarHBondContact OH-CG 3.2Å; Y45-E103 PolarHBondContact OH-OE1 2.91Å; V49-E103 WeakPolarHBondContact CG2-OE1 3.34Å; L99-E103 VanDerWaalsContact O-CB 3.31Å; L99-E103 WeakPolarHBondContact O-CB 3.32Å; L99-E103 PolarHBondContact O-N 2.87Å; F100-E103 WeakPolarHBondContact O-CB 3.42Å; F100-E103 PolarHBondContact O-N 3.08Å; E103-F106 WeakPolarHBondContact O-CB 3.41Å; E103-F106 PolarHBondContact O-N 3.03Å; E103-K107 WeakPolarHBondContact O-CB 3.42Å; E103-K107 PolarHBondContact O-N 3.4Å
104I85.1Confident83.1Confident35 Ų3562.1 Ų62.118%0.17930%0.304CS..Hα-helixtrans-55.5-57.2-178.2-66.4156.6000113.1F100 V102 F106 K107 I108 G126 C129F100-I104 WeakPolarHBondContact O-CG1 3.45Å; F100-I104 PolarHBondContact O-N 3.41Å; F100-I104 VanDerWaalsContact O-N 3.14Å; V102-I104 VanDerWaalsContact C-N 3.34Å; V102-I104 PolarHBondContact O-N 2.94Å; I104-F106 VanDerWaalsContact C-N 3.26Å; I104-F106 PolarHBondContact O-N 2.92Å; I104-K107 WeakPolarHBondContact O-CB 3.44Å; I104-K107 PolarHBondContact O-N 2.87Å; I104-K107 VanDerWaalsContact O-N 3.14Å; I104-I108 HydrophobicContact CG2-CD1 3.8Å; I104-I108 HydrophobicContact CG2-CG1 4.44Å; I104-I108 VanDerWaalsContact O-CG1 3.31Å; I104-I108 WeakPolarHBondContact O-CG1 3.31Å; I104-I108 PolarHBondContact O-N 3Å; I104-G126 VanDerWaalsContact CD1-CA 3.48Å; I104-C129 HydrophobicContact CD1-CB 3.91Å
105P85.2Confident82Confident72 Ų7265.9 Ų65.947%0.46832%0.32SS..Hα-helixtrans-62.8-34.9178.924.6-33.3000111.7V101 V102 K107 I108 W109V101-P105 WeakPolarHBondContact O-CD 3.45Å; V102-P105 VanDerWaalsContact O-CD 3.23Å; V102-P105 WeakPolarHBondContact O-CD 2.9Å; V102-P105 VanDerWaalsContact O-CG 3.26Å; V102-P105 WeakPolarHBondContact O-CG 3.29Å; P105-K107 VanDerWaalsContact C-N 3.32Å; P105-K107 PolarHBondContact O-N 3.35Å; P105-I108 PolarHBondContact O-N 2.88Å; P105-W109 WeakPolarHBondContact O-CB 3.49Å; P105-W109 PolarHBondContact O-N 2.94Å
106F84.7Confident80.7Confident99 Ų9962.5 Ų62.543%0.43430%0.304SS..Hα-helixtrans-63.4-39.2175.6-166.9-116.1000112L36 F40 E103 I104 W109 A110L36-F106 HydrophobicContact CD1-CD1 4.41Å; L36-F106 HydrophobicContact CD1-CE1 3.37Å; L36-F106 HydrophobicContact CD1-CE2 4.39Å; L36-F106 HydrophobicContact CD1-CZ 3.35Å; L36-F106 HydrophobicContact CD2-CD2 4.42Å; L36-F106 HydrophobicContact CD2-CE1 3.97Å; L36-F106 HydrophobicContact CD2-CE2 3.83Å; L36-F106 HydrophobicContact CD2-CZ 3.58Å; L36-F106 HydrophobicContact CG-CE1 4.29Å; L36-F106 HydrophobicContact CG-CZ 4.12Å; F40-F106 HydrophobicContact CE2-CD1 4.09Å; F40-F106 HydrophobicContact CE2-CE1 4.09Å; F40-F106 AromaticContact CZ-CD1 3.89Å; F40-F106 HydrophobicContact CZ-CD1 3.89Å; F40-F106 HydrophobicContact CZ-CE1 4.27Å; E103-F106 WeakPolarHBondContact O-CB 3.41Å; E103-F106 PolarHBondContact O-N 3.03Å; I104-F106 VanDerWaalsContact C-N 3.26Å; I104-F106 PolarHBondContact O-N 2.92Å; F106-W109 PolarHBondContact O-N 3.14Å; F106-A110 WeakPolarHBondContact O-CB 3.43Å; F106-A110 PolarHBondContact O-N 2.84Å
107K80.2Confident79.3Confident27 Ų2763.7 Ų63.712%0.11732%0.32CS..Hα-helixtrans-69.9-41.4176-160.4176.6-174.2167.60112.2F40 E103 I104 P105 W109 A110 M111F40-K107 HydrophobicContact CE1-CB 4.4Å; F40-K107 HydrophobicContact CE1-CG 3.99Å; F40-K107 HydrophobicContact CZ-CB 4.25Å; F40-K107 HydrophobicContact CZ-CG 4.27Å; E103-K107 WeakPolarHBondContact O-CB 3.42Å; E103-K107 PolarHBondContact O-N 3.4Å; I104-K107 WeakPolarHBondContact O-CB 3.44Å; I104-K107 PolarHBondContact O-N 2.87Å; I104-K107 VanDerWaalsContact O-N 3.14Å; P105-K107 VanDerWaalsContact C-N 3.32Å; P105-K107 PolarHBondContact O-N 3.35Å; K107-W109 VanDerWaalsContact C-N 3.31Å; K107-W109 PolarHBondContact O-N 3.06Å; K107-A110 PolarHBondContact O-N 3.18Å; K107-M111 HydrophobicContact CD-CE 4.43Å; K107-M111 HydrophobicContact CG-CE 3.76Å; K107-M111 HydrophobicContact CG-SD 4.31Å; K107-M111 WeakPolarHBondContact O-CG 3.37Å; K107-M111 PolarHBondContact O-N 3.49Å
108I82.9Confident78.5Confident40 Ų4071.7 Ų71.721%0.20536%0.357CS..Hα-helixtrans-59.7-45173.3-66.7167.5000109.9I104 P105 G112 I113 W116I104-I108 HydrophobicContact CG2-CD1 3.8Å; I104-I108 HydrophobicContact CG2-CG1 4.44Å; I104-I108 VanDerWaalsContact O-CG1 3.31Å; I104-I108 WeakPolarHBondContact O-CG1 3.31Å; I104-I108 PolarHBondContact O-N 3Å; P105-I108 PolarHBondContact O-N 2.88Å; I108-G112 WeakPolarHBondContact O-CA 3.13Å; I108-G112 PolarHBondContact O-N 2.91Å; I108-I113 HydrophobicContact CG2-CD1 4.03Å; I108-W116 HydrophobicContact CD1-CD2 4.29Å; I108-W116 HydrophobicContact CD1-CE3 4.45Å; I108-W116 HydrophobicContact CD1-CH2 3.73Å; I108-W116 HydrophobicContact CD1-CZ2 3.56Å; I108-W116 HydrophobicContact CD1-CZ3 4.18Å; I108-W116 HydrophobicContact CG1-CD2 3.86Å; I108-W116 HydrophobicContact CG1-CE3 4.37Å; I108-W116 HydrophobicContact CG1-CG 4.2Å; I108-W116 HydrophobicContact CG1-CH2 4.36Å; I108-W116 HydrophobicContact CG1-CZ2 3.89Å
109W81.9Confident77.8Confident142 Ų14272.8 Ų72.854%0.53836%0.358SS..Hα-helixtrans-63.3-42.5178.4-173.676000112.2A32 L36 P105 F106 K107A32-W109 HydrophobicContact CB-CH2 4.1Å; L36-W109 HydrophobicContact CD2-CE3 3.43Å; L36-W109 VanDerWaalsContact CD2-CE3 3.43Å; L36-W109 HydrophobicContact CD2-CZ3 3.43Å; L36-W109 VanDerWaalsContact CD2-CZ3 3.43Å; P105-W109 WeakPolarHBondContact O-CB 3.49Å; P105-W109 PolarHBondContact O-N 2.94Å; F106-W109 PolarHBondContact O-N 3.14Å; K107-W109 VanDerWaalsContact C-N 3.31Å; K107-W109 PolarHBondContact O-N 3.06Å
110A76.3Confident77.2Confident9 Ų974.9 Ų74.97%0.07437%0.369CS..Hα-helixtrans-67.1-51.5-179.400000113.5L36 F40 F106 K107 G112L36-A110 HydrophobicContact CD2-CB 3.54Å; L36-A110 HydrophobicContact CG-CB 3.82Å; F40-A110 HydrophobicContact CD2-CB 3.67Å; F40-A110 HydrophobicContact CE2-CB 3.28Å; F40-A110 HydrophobicContact CZ-CB 4.1Å; F106-A110 WeakPolarHBondContact O-CB 3.43Å; F106-A110 PolarHBondContact O-N 2.84Å; K107-A110 PolarHBondContact O-N 3.18Å; A110-G112 VanDerWaalsContact C-N 3.32Å
111M72.3Confident76.7Confident44 Ų4475.8 Ų75.822%0.21737%0.374CS..Hα-helixtrans-72.9-30.4-177.5-62.4-172.9-56.400111.2R33 K107 F122R33-M111 PolarHBondContact NH2-O 3.46Å; K107-M111 HydrophobicContact CD-CE 4.43Å; K107-M111 HydrophobicContact CG-CE 3.76Å; K107-M111 HydrophobicContact CG-SD 4.31Å; K107-M111 WeakPolarHBondContact O-CG 3.37Å; K107-M111 PolarHBondContact O-N 3.49Å; M111-F122 HydrophobicContact CE-CD2 4.46Å
112G72.7Confident76.3Confident16 Ų1675 Ų7517%0.16537%0.368CS..  trans85.5138.5-171.900000111I108 A110 R114 Q115 W116I108-G112 WeakPolarHBondContact O-CA 3.13Å; I108-G112 PolarHBondContact O-N 2.91Å; A110-G112 VanDerWaalsContact C-N 3.32Å; G112-R114 PolarHBondContact O-N 3.42Å; G112-R114 VanDerWaalsContact O-N 3.08Å; G112-Q115 PolarHBondContact O-N 3.4Å; G112-Q115 VanDerWaalsContact O-N 3.16Å; G112-W116 PolarHBondContact O-N 3.2Å
113I69.3Low76.1Confident119 Ų11973.4 Ų73.461%0.6136%0.355SS*.Hα-helixtrans-52.6-35.6-173.1-167.967.3000113.9I108 Q115 W116 G117I108-I113 HydrophobicContact CG2-CD1 4.03Å; I113-Q115 PolarHBondContact O-N 2.55Å; I113-W116 HydrophobicContact CD1-CE3 3.78Å; I113-W116 HydrophobicContact CD1-CZ3 4.17Å; I113-W116 PolarHBondContact O-N 3.14Å; I113-G117 PolarHBondContact O-N 2.96Å
114R69.6Low76Confident236 Ų23675.4 Ų75.489%0.89137%0.366SS*.Hα-helixtrans-66.4-38.7-177.1-174.2175.5173.7177.2-1.2113.3G112G112-R114 PolarHBondContact O-N 3.42Å; G112-R114 VanDerWaalsContact O-N 3.08Å
115Q66.3Low75.9Confident117 Ų11774.8 Ų74.855%0.54736%0.363SS..Hα-helixtrans-81.1-28.4179.1-169.8171.4-10.300111.4G112 I113 H118G112-Q115 PolarHBondContact O-N 3.4Å; G112-Q115 VanDerWaalsContact O-N 3.16Å; I113-Q115 PolarHBondContact O-N 2.55Å; Q115-H118 PolarHBondContact O-N 2.89Å
116W62.7Low75.9Confident43 Ų4371.8 Ų71.816%0.16335%0.346CS..Hα-helixtrans-63.9-43.6176.9-173.365.5000112.3I108 G112 I113 H118 Q119 I123I108-W116 HydrophobicContact CD1-CD2 4.29Å; I108-W116 HydrophobicContact CD1-CE3 4.45Å; I108-W116 HydrophobicContact CD1-CH2 3.73Å; I108-W116 HydrophobicContact CD1-CZ2 3.56Å; I108-W116 HydrophobicContact CD1-CZ3 4.18Å; I108-W116 HydrophobicContact CG1-CD2 3.86Å; I108-W116 HydrophobicContact CG1-CE3 4.37Å; I108-W116 HydrophobicContact CG1-CG 4.2Å; I108-W116 HydrophobicContact CG1-CH2 4.36Å; I108-W116 HydrophobicContact CG1-CZ2 3.89Å; G112-W116 PolarHBondContact O-N 3.2Å; I113-W116 HydrophobicContact CD1-CE3 3.78Å; I113-W116 HydrophobicContact CD1-CZ3 4.17Å; I113-W116 PolarHBondContact O-N 3.14Å; W116-H118 VanDerWaalsContact C-N 3.26Å; W116-H118 PolarHBondContact O-N 2.71Å; W116-Q119 CarbonylContact O-C 3.59Å; W116-Q119 WeakPolarHBondContact O-CA 3.42Å; W116-Q119 PolarHBondContact O-N 2.79Å; W116-I123 HydrophobicContact CD2-CG1 4.03Å; W116-I123 HydrophobicContact CE3-CD1 4.34Å; W116-I123 HydrophobicContact CE3-CG1 4.01Å; W116-I123 HydrophobicContact CH2-CB 4.29Å; W116-I123 HydrophobicContact CH2-CD1 4.49Å; W116-I123 HydrophobicContact CH2-CG1 3.63Å; W116-I123 HydrophobicContact CH2-CG2 4.33Å; W116-I123 HydrophobicContact CZ2-CB 4.17Å; W116-I123 HydrophobicContact CZ2-CG1 3.58Å; W116-I123 HydrophobicContact CZ3-CD1 4.25Å; W116-I123 HydrophobicContact CZ3-CG1 3.83Å
117G60.8Low76Confident38 Ų3872.4 Ų72.439%0.39235%0.353SS..Hα-helixtrans-59.7-32.6178.300000114.3I113 Q119I113-G117 PolarHBondContact O-N 2.96Å; G117-Q119 PolarHBondContact O-N 2.87Å
118H70Confident76.2Confident170 Ų17072.5 Ų72.579%0.78735%0.354SS*.THydrogen-bonded Turntrans-69.7-16.8176.3-164.4-70.5000112.5Q115 W116Q115-H118 PolarHBondContact O-N 2.89Å; W116-H118 VanDerWaalsContact C-N 3.26Å; W116-H118 PolarHBondContact O-N 2.71Å
119Q74.7Confident76.3Confident64 Ų6470.8 Ų70.830%0.29935%0.346SS..  trans-112.768.1-177.2-64.8175.3-2200109.8W116 G117 L121 F122W116-Q119 CarbonylContact O-C 3.59Å; W116-Q119 WeakPolarHBondContact O-CA 3.42Å; W116-Q119 PolarHBondContact O-N 2.79Å; G117-Q119 PolarHBondContact O-N 2.87Å; Q119-L121 PolarHBondContact O-N 3.14Å; Q119-F122 HydrophobicContact CB-CD2 3.52Å; Q119-F122 HydrophobicContact CB-CE2 3.91Å; Q119-F122 HydrophobicContact CG-CD2 4.42Å; Q119-F122 HydrophobicContact CG-CE2 4.37Å; Q119-F122 PolarHBondContact O-N 3.42Å
120L76.4Confident76.5Confident118 Ų11867 Ų6762%0.61834%0.341SS*.Hα-helixtrans-43.5-32.1-179.6-68.5174.2000114.8F122 I123 I124L120-F122 VanDerWaalsContact C-N 3.26Å; L120-F122 PolarHBondContact O-N 3.31Å; L120-I123 HydrophobicContact CD2-CD1 4.3Å; L120-I123 WeakPolarHBondContact O-CB 3.35Å; L120-I123 PolarHBondContact O-N 3.28Å; L120-I123 VanDerWaalsContact O-N 3.08Å; L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.99Å; L120-I124 VanDerWaalsContact O-N 3.09Å
121L77.4Confident77.1Confident34 Ų3470.1 Ų70.118%0.17836%0.359CS..Hα-helixtrans-58.8-33.9177.9-64.4-179.1000113.8Q119 I123 D125 R192 K196Q119-L121 PolarHBondContact O-N 3.14Å; L121-I123 VanDerWaalsContact C-N 3.31Å; L121-D125 VanDerWaalsContact O-CB 3.25Å; L121-D125 WeakPolarHBondContact O-CB 3.12Å; L121-D125 PolarHBondContact O-N 3.48Å; L121-R192 HydrophobicContact CD1-CG 4.32Å; L121-K196 HydrophobicContact CD1-CD 3.98Å
122F79.9Confident77.6Confident25 Ų2568.6 Ų68.611%0.1135%0.352CS..Hα-helixtrans-73-27.7177.8-69.2-62.5000112.5M111 Q119 L120 G126 Y189 F193M111-F122 HydrophobicContact CE-CD2 4.46Å; Q119-F122 HydrophobicContact CB-CD2 3.52Å; Q119-F122 HydrophobicContact CB-CE2 3.91Å; Q119-F122 HydrophobicContact CG-CD2 4.42Å; Q119-F122 HydrophobicContact CG-CE2 4.37Å; Q119-F122 PolarHBondContact O-N 3.42Å; L120-F122 VanDerWaalsContact C-N 3.26Å; L120-F122 PolarHBondContact O-N 3.31Å; F122-G126 PolarHBondContact O-N 2.94Å; F122-G126 VanDerWaalsContact O-N 3.08Å; F122-Y189 WeakPolarHBondContact CD1-OH 3.37Å; F122-F193 HydrophobicContact CE1-CD2 4.09Å; F122-F193 AromaticContact CE1-CE2 3.96Å; F122-F193 HydrophobicContact CE1-CE2 3.96Å; F122-F193 HydrophobicContact CZ-CD2 4.12Å; F122-F193 AromaticContact CZ-CE2 3.76Å; F122-F193 HydrophobicContact CZ-CE2 3.76Å
123I83Confident78.3Confident59 Ų5970 Ų7030%0.30335%0.354SS..Hα-helixtrans-70.8-48.5175.5-58.8173.2000109.1W116 L120 L121 D125 G126 L127W116-I123 HydrophobicContact CD2-CG1 4.03Å; W116-I123 HydrophobicContact CE3-CD1 4.34Å; W116-I123 HydrophobicContact CE3-CG1 4.01Å; W116-I123 HydrophobicContact CH2-CB 4.29Å; W116-I123 HydrophobicContact CH2-CD1 4.49Å; W116-I123 HydrophobicContact CH2-CG1 3.63Å; W116-I123 HydrophobicContact CH2-CG2 4.33Å; W116-I123 HydrophobicContact CZ2-CB 4.17Å; W116-I123 HydrophobicContact CZ2-CG1 3.58Å; W116-I123 HydrophobicContact CZ3-CD1 4.25Å; W116-I123 HydrophobicContact CZ3-CG1 3.83Å; L120-I123 HydrophobicContact CD2-CD1 4.3Å; L120-I123 WeakPolarHBondContact O-CB 3.35Å; L120-I123 PolarHBondContact O-N 3.28Å; L120-I123 VanDerWaalsContact O-N 3.08Å; L121-I123 VanDerWaalsContact C-N 3.31Å; I123-D125 PolarHBondContact O-N 3.27Å; I123-G126 PolarHBondContact O-N 3.47Å; I123-L127 WeakPolarHBondContact O-CB 3.32Å; I123-L127 PolarHBondContact O-N 3.5Å
124I84.3Confident79.2Confident77 Ų7767.6 Ų67.640%0.39535%0.348SS..Hα-helixtrans-62.4-45.2-179.9-60.3170.5000110.5L120 G126 L127 I128 Y185L120-I124 WeakPolarHBondContact O-CG1 3.37Å; L120-I124 PolarHBondContact O-N 2.99Å; L120-I124 VanDerWaalsContact O-N 3.09Å; I124-G126 VanDerWaalsContact C-N 3.34Å; I124-G126 PolarHBondContact O-N 3.08Å; I124-L127 PolarHBondContact O-N 3Å; I124-I128 HydrophobicContact CG2-CD1 3.64Å; I124-I128 HydrophobicContact CG2-CG1 4.46Å; I124-I128 WeakPolarHBondContact O-CB 3.39Å; I124-I128 WeakPolarHBondContact O-CD1 3.13Å; I124-I128 VanDerWaalsContact O-CG1 3.29Å; I124-I128 WeakPolarHBondContact O-CG1 3.19Å; I124-I128 PolarHBondContact O-N 2.88Å; I124-Y185 VanDerWaalsContact CG2-OH 3.26Å; I124-Y185 WeakPolarHBondContact CG2-OH 3.43Å
125D82.9Confident79.8Confident21 Ų2159 Ų5911%0.11232%0.319CS..Hα-helixtrans-59.2-44.5175.7-18050000111.9L121 I123 L127 I128 C129 Y189L121-D125 VanDerWaalsContact O-CB 3.25Å; L121-D125 WeakPolarHBondContact O-CB 3.12Å; L121-D125 PolarHBondContact O-N 3.48Å; I123-D125 PolarHBondContact O-N 3.27Å; D125-L127 PolarHBondContact O-N 3.27Å; D125-I128 PolarHBondContact O-N 2.89Å; D125-C129 WeakPolarHBondContact O-CB 3.42Å; D125-C129 PolarHBondContact O-N 3.09Å; D125-C129 PolarHBondContact O-SG 3.48Å; D125-Y189 HydrophobicContact CB-CD2 4.23Å; D125-Y189 HydrophobicContact CB-CE1 4.25Å; D125-Y189 HydrophobicContact CB-CE2 3.74Å; D125-Y189 WeakPolarHBondContact OD1-CE1 3.4Å; D125-Y189 WeakPolarHBondContact OD2-CE1 3.18Å; D125-Y189 PolarHBondContact OD2-OH 2.8Å
126G84.8Confident80.7Confident10 Ų1053.8 Ų53.810%0.10330%0.295CS..Hα-helixtrans-64.5-39.917700000113.2I104 F122 I123 I124 C129 S130I104-G126 VanDerWaalsContact CD1-CA 3.48Å; F122-G126 PolarHBondContact O-N 2.94Å; F122-G126 VanDerWaalsContact O-N 3.08Å; I123-G126 PolarHBondContact O-N 3.47Å; I124-G126 VanDerWaalsContact C-N 3.34Å; I124-G126 PolarHBondContact O-N 3.08Å; G126-C129 PolarHBondContact O-N 3.46Å; G126-S130 WeakPolarHBondContact O-CB 3.25Å; G126-S130 PolarHBondContact O-N 3.27Å
127L86.8Confident81.8Confident111 Ų11155.1 Ų55.158%0.58130%0.304SS*.Hα-helixtrans-63.1-44175.2-177.6130.6000111.2I123 I124 D125 S130 V131I123-L127 WeakPolarHBondContact O-CB 3.32Å; I123-L127 PolarHBondContact O-N 3.5Å; I124-L127 PolarHBondContact O-N 3Å; D125-L127 PolarHBondContact O-N 3.27Å; L127-S130 WeakPolarHBondContact O-CB 3.34Å; L127-S130 PolarHBondContact O-N 3.42Å; L127-V131 WeakPolarHBondContact O-CG2 3.26Å; L127-V131 PolarHBondContact O-N 3.13Å
128I85.1Confident83Confident29 Ų2959.6 Ų59.615%0.14931%0.31CS..Hα-helixtrans-65.7-44.9178.9-73166.6000110.8I124 D125 S130 V131 C132 M182 Y185I124-I128 HydrophobicContact CG2-CD1 3.64Å; I124-I128 HydrophobicContact CG2-CG1 4.46Å; I124-I128 WeakPolarHBondContact O-CB 3.39Å; I124-I128 WeakPolarHBondContact O-CD1 3.13Å; I124-I128 VanDerWaalsContact O-CG1 3.29Å; I124-I128 WeakPolarHBondContact O-CG1 3.19Å; I124-I128 PolarHBondContact O-N 2.88Å; D125-I128 PolarHBondContact O-N 2.89Å; I128-S130 VanDerWaalsContact C-N 3.27Å; I128-S130 PolarHBondContact O-N 2.82Å; I128-V131 PolarHBondContact O-N 3.37Å; I128-V131 VanDerWaalsContact O-N 3.17Å; I128-C132 PolarHBondContact O-N 3.48Å; I128-C132 PolarHBondContact O-SG 2.91Å; I128-M182 HydrophobicContact CG2-CE 3.38Å; I128-M182 HydrophobicContact CG2-SD 3.85Å; I128-Y185 HydrophobicContact CB-CE1 4.27Å; I128-Y185 HydrophobicContact CD1-CD1 3.75Å; I128-Y185 HydrophobicContact CD1-CD2 4.24Å; I128-Y185 HydrophobicContact CD1-CE1 3.12Å; I128-Y185 HydrophobicContact CD1-CE2 3.64Å; I128-Y185 HydrophobicContact CD1-CG 4.29Å; I128-Y185 VanDerWaalsContact CD1-OH 3.24Å; I128-Y185 WeakPolarHBondContact CD1-OH 3.43Å; I128-Y185 HydrophobicContact CG1-CE1 4.26Å; I128-Y185 HydrophobicContact CG2-CD1 3.87Å; I128-Y185 HydrophobicContact CG2-CE1 4Å
129C84.8Confident83.4Confident5 Ų552.2 Ų52.23%0.03428%0.277CS..Hα-helixtrans-58.3-40.3173.2-71.10000112.4I104 D125 G126 C132 F133I104-C129 HydrophobicContact CD1-CB 3.91Å; D125-C129 WeakPolarHBondContact O-CB 3.42Å; D125-C129 PolarHBondContact O-N 3.09Å; D125-C129 PolarHBondContact O-SG 3.48Å; G126-C129 PolarHBondContact O-N 3.46Å; C129-C132 PolarHBondContact O-N 2.9Å; C129-F133 WeakPolarHBondContact O-CB 3.29Å; C129-F133 PolarHBondContact O-N 2.99Å
130S86.9Confident83.8Confident62 Ų6251.5 Ų51.543%0.43428%0.275SS..Hα-helixtrans-64.1-42.2176.2-172.30000112.1G126 L127 I128 F133 S134G126-S130 WeakPolarHBondContact O-CB 3.25Å; G126-S130 PolarHBondContact O-N 3.27Å; L127-S130 WeakPolarHBondContact O-CB 3.34Å; L127-S130 PolarHBondContact O-N 3.42Å; I128-S130 VanDerWaalsContact C-N 3.27Å; I128-S130 PolarHBondContact O-N 2.82Å; S130-F133 PolarHBondContact O-N 3.16Å; S130-S134 PolarHBondContact O-N 3.46Å; S130-S134 PolarHBondContact O-OG 3.1Å; S130-S134 VanDerWaalsContact O-OG 3.07Å
131V87.3Confident84.1Confident74 Ų7452.8 Ų52.845%0.44827%0.272SS..Hα-helixtrans-65.2-41.7176.81730000110.7L127 I128 F133 S134 L135L127-V131 WeakPolarHBondContact O-CG2 3.26Å; L127-V131 PolarHBondContact O-N 3.13Å; I128-V131 PolarHBondContact O-N 3.37Å; I128-V131 VanDerWaalsContact O-N 3.17Å; V131-F133 PolarHBondContact O-N 2.84Å; V131-S134 PolarHBondContact O-N 3.04Å; V131-L135 HydrophobicContact CG1-CD1 4.19Å; V131-L135 WeakPolarHBondContact O-CG 3.44Å; V131-L135 PolarHBondContact O-N 3.23Å
132C83.1Confident84.2Confident12 Ų1256.1 Ų56.18%0.08128%0.283CS..Hα-helixtrans-60.3-46.4174.8-58.60000112.4L97 I128 C129 S134 L135 D136 M182 R186L97-C132 HydrophobicContact CD2-CB 4.11Å; I128-C132 PolarHBondContact O-N 3.48Å; I128-C132 PolarHBondContact O-SG 2.91Å; C129-C132 PolarHBondContact O-N 2.9Å; C132-S134 VanDerWaalsContact C-N 3.27Å; C132-S134 PolarHBondContact O-N 3.22Å; C132-L135 PolarHBondContact O-N 3.43Å; C132-L135 VanDerWaalsContact O-N 3.15Å; C132-D136 PolarHBondContact O-N 2.84Å; C132-M182 WeakPolarHBondContact SG-CE 3.5Å; C132-M182 PolarHBondContact SG-SD 3.44Å; C132-R186 PolarHBondContact SG-NH2 2.9Å; C132-R186 VanDerWaalsContact SG-NH2 3.45Å
133F87.2Confident83.8Confident47 Ų4757.1 Ų57.121%0.20629%0.288CS..Hα-helixtrans-60.5-42179.9-177.9-110.5000110.9L94 L97 V101 C129 S130 V131 D136 I137L94-F133 HydrophobicContact CG-CE2 4.44Å; L97-F133 HydrophobicContact CB-CD2 4.33Å; V101-F133 HydrophobicContact CG2-CB 3.73Å; V101-F133 HydrophobicContact CG2-CD1 4.22Å; V101-F133 HydrophobicContact CG2-CD2 4.14Å; V101-F133 HydrophobicContact CG2-CG 3.78Å; C129-F133 WeakPolarHBondContact O-CB 3.29Å; C129-F133 PolarHBondContact O-N 2.99Å; S130-F133 PolarHBondContact O-N 3.16Å; V131-F133 PolarHBondContact O-N 2.84Å; F133-D136 PolarHBondContact O-N 3.46Å; F133-I137 HydrophobicContact CD1-CD1 3.59Å; F133-I137 HydrophobicContact CD2-CD1 4.36Å; F133-I137 HydrophobicContact CE1-CD1 3.21Å; F133-I137 HydrophobicContact CE1-CG1 4.38Å; F133-I137 HydrophobicContact CE2-CD1 4.03Å; F133-I137 HydrophobicContact CE2-CG1 4.45Å; F133-I137 HydrophobicContact CG-CD1 4.17Å; F133-I137 HydrophobicContact CZ-CD1 3.46Å; F133-I137 VanDerWaalsContact CZ-CD1 3.46Å; F133-I137 HydrophobicContact CZ-CG1 4.3Å; F133-I137 WeakPolarHBondContact O-CB 3.25Å; F133-I137 VanDerWaalsContact O-CG1 3.27Å; F133-I137 WeakPolarHBondContact O-CG1 3.46Å; F133-I137 PolarHBondContact O-N 2.83Å
134S88.7Confident83.6Confident68 Ų6858.8 Ų58.848%0.47630%0.304SS..Hα-helixtrans-62.3-43173.3-61.30000112.8S130 V131 C132 I137 Y138S130-S134 PolarHBondContact O-N 3.46Å; S130-S134 PolarHBondContact O-OG 3.1Å; S130-S134 VanDerWaalsContact O-OG 3.07Å; V131-S134 PolarHBondContact O-N 3.04Å; C132-S134 VanDerWaalsContact C-N 3.27Å; C132-S134 PolarHBondContact O-N 3.22Å; S134-I137 PolarHBondContact O-N 3.4Å; S134-Y138 WeakPolarHBondContact O-CB 3.38Å; S134-Y138 PolarHBondContact O-N 3.43Å
135L83.8Confident83.1Confident56 Ų5659 Ų5929%0.29331%0.306SS..Hα-helixtrans-65.1-40.9177.4-75.4172.8000111.9V131 C132 Y138 N139 I178V131-L135 HydrophobicContact CG1-CD1 4.19Å; V131-L135 WeakPolarHBondContact O-CG 3.44Å; V131-L135 PolarHBondContact O-N 3.23Å; C132-L135 PolarHBondContact O-N 3.43Å; C132-L135 VanDerWaalsContact O-N 3.15Å; L135-Y138 WeakPolarHBondContact O-CB 3.32Å; L135-Y138 PolarHBondContact O-N 3.4Å; L135-N139 WeakPolarHBondContact O-CB 3.43Å; L135-N139 PolarHBondContact O-N 2.95Å; L135-N139 PolarHBondContact O-ND2 2.97Å; L135-I178 HydrophobicContact CD1-CG2 4.16Å
136D83.5Confident82Confident6 Ų664.2 Ų64.23%0.03232%0.324CS..Hα-helixtrans-69.7-38.5177.7-90-13.2000112.6R63 L97 C132 F133 Y138 N139 I140 F179R63-D136 IonicContact CZ-OD1 3.55Å; R63-D136 IonicContact NH1-OD1 2.84Å; R63-D136 PolarHBondContact NH1-OD1 3.35Å; L97-D136 HydrophobicContact CD1-CB 4.31Å; L97-D136 WeakPolarHBondContact CD1-OD2 3.21Å; C132-D136 PolarHBondContact O-N 2.84Å; F133-D136 PolarHBondContact O-N 3.46Å; D136-Y138 VanDerWaalsContact C-N 3.31Å; D136-Y138 PolarHBondContact O-N 2.95Å; D136-N139 PolarHBondContact O-N 3.3Å; D136-I140 WeakPolarHBondContact O-CG2 3.3Å; D136-I140 PolarHBondContact O-N 3.15Å; D136-F179 WeakPolarHBondContact OD1-CE1 3.45Å; D136-F179 WeakPolarHBondContact OD1-CZ 3.38Å
137I87Confident80.2Confident71 Ų7168.4 Ų68.436%0.36435%0.35SS..Hα-helixtrans-60.6-42.9169.7-71.4168.2000110.9L94 F133 S134 N139 I140 Y141L94-I137 HydrophobicContact CD1-CG1 4.04Å; F133-I137 HydrophobicContact CD1-CD1 3.59Å; F133-I137 HydrophobicContact CD2-CD1 4.36Å; F133-I137 HydrophobicContact CE1-CD1 3.21Å; F133-I137 HydrophobicContact CE1-CG1 4.38Å; F133-I137 HydrophobicContact CE2-CD1 4.03Å; F133-I137 HydrophobicContact CE2-CG1 4.45Å; F133-I137 HydrophobicContact CG-CD1 4.17Å; F133-I137 HydrophobicContact CZ-CD1 3.46Å; F133-I137 VanDerWaalsContact CZ-CD1 3.46Å; F133-I137 HydrophobicContact CZ-CG1 4.3Å; F133-I137 WeakPolarHBondContact O-CB 3.25Å; F133-I137 VanDerWaalsContact O-CG1 3.27Å; F133-I137 WeakPolarHBondContact O-CG1 3.46Å; F133-I137 PolarHBondContact O-N 2.83Å; S134-I137 PolarHBondContact O-N 3.4Å; I137-N139 VanDerWaalsContact C-N 3.31Å; I137-N139 PolarHBondContact O-N 2.89Å; I137-I140 WeakPolarHBondContact O-CG2 3.23Å; I137-Y141 VanDerWaalsContact O-CB 3.26Å; I137-Y141 WeakPolarHBondContact O-CB 3.15Å; I137-Y141 PolarHBondContact O-N 3.13Å
138Y85.1Confident78.3Confident132 Ų13269 Ų6952%0.51836%0.363SS..Hα-helixtrans-63.9-40177.6179.8-100.2000111.5S134 L135 D136 Y141 R142S134-Y138 WeakPolarHBondContact O-CB 3.38Å; S134-Y138 PolarHBondContact O-N 3.43Å; L135-Y138 WeakPolarHBondContact O-CB 3.32Å; L135-Y138 PolarHBondContact O-N 3.4Å; D136-Y138 VanDerWaalsContact C-N 3.31Å; D136-Y138 PolarHBondContact O-N 2.95Å; Y138-Y141 PolarHBondContact O-N 3.04Å; Y138-R142 WeakPolarHBondContact O-CB 3.27Å; Y138-R142 PolarHBondContact O-N 3.42Å
139N78.5Confident76.1Confident16 Ų1678.4 Ų78.49%0.08640%0.397CS..Hα-helixtrans-66-46.1178.4-71.3-23.4000112.3L135 D136 I137 Y141 R142 H143 F179L135-N139 WeakPolarHBondContact O-CB 3.43Å; L135-N139 PolarHBondContact O-N 2.95Å; L135-N139 PolarHBondContact O-ND2 2.97Å; D136-N139 PolarHBondContact O-N 3.3Å; I137-N139 VanDerWaalsContact C-N 3.31Å; I137-N139 PolarHBondContact O-N 2.89Å; N139-Y141 VanDerWaalsContact C-N 3.31Å; N139-Y141 PolarHBondContact O-N 3.41Å; N139-R142 PolarHBondContact O-N 3.07Å; N139-H143 WeakPolarHBondContact O-CB 3.4Å; N139-H143 PolarHBondContact O-N 3.43Å; N139-F179 VanDerWaalsContact ND2-CZ 3.33Å; N139-F179 WeakPolarHBondContact ND2-CZ 3.39Å
140I82.5Confident74.2Confident48 Ų4886.6 Ų86.625%0.24644%0.437CS..Hα-helixtrans-64.9-37.6176.1-169.6170.3000111.4L94 D136 I137 H143 S144L94-I140 HydrophobicContact CD1-CD1 4.46Å; L94-I140 HydrophobicContact CD1-CG2 3.98Å; D136-I140 WeakPolarHBondContact O-CG2 3.3Å; D136-I140 PolarHBondContact O-N 3.15Å; I137-I140 WeakPolarHBondContact O-CG2 3.23Å; I140-H143 PolarHBondContact O-N 3.49Å; I140-S144 WeakPolarHBondContact O-CB 3.37Å; I140-S144 PolarHBondContact O-N 3.4Å
141Y84.1Confident72.4Confident145 Ų14591.5 Ų91.557%0.56946%0.455SS*.Hα-helixtrans-62.5-45.2175.1179.2-103.8000111.5I137 Y138 N139 H143 S144 N145I137-Y141 VanDerWaalsContact O-CB 3.26Å; I137-Y141 WeakPolarHBondContact O-CB 3.15Å; I137-Y141 PolarHBondContact O-N 3.13Å; Y138-Y141 PolarHBondContact O-N 3.04Å; N139-Y141 VanDerWaalsContact C-N 3.31Å; N139-Y141 PolarHBondContact O-N 3.41Å; Y141-H143 VanDerWaalsContact C-N 3.35Å; Y141-H143 PolarHBondContact O-N 2.95Å; Y141-S144 PolarHBondContact O-N 2.94Å; Y141-N145 WeakPolarHBondContact CE1-ND2 3.2Å; Y141-N145 WeakPolarHBondContact CE2-ND2 3.25Å; Y141-N145 VanDerWaalsContact O-CB 3.31Å; Y141-N145 WeakPolarHBondContact O-CB 3.43Å; Y141-N145 PolarHBondContact O-N 3.17Å; Y141-N145 PolarHBondContact OH-ND2 3.32Å; Y141-N145 VanDerWaalsContact OH-ND2 3.12Å
142R78.6Confident70.2Confident105 Ų10595.6 Ų95.640%0.39647%0.474SS..Hα-helixtrans-62.8-40.7175.4-174.7-176.5179.1-166.2-0.2111.9Y138 N139 N145 R146Y138-R142 WeakPolarHBondContact O-CB 3.27Å; Y138-R142 PolarHBondContact O-N 3.42Å; N139-R142 PolarHBondContact O-N 3.07Å; R142-N145 PolarHBondContact O-N 2.93Å; R142-R146 PolarHBondContact O-N 3.24Å
143H71.6Confident68.5Low46 Ų4698 Ų9821%0.21349%0.491CS..Hα-helixtrans-64.4-46.2177.6-168.399000111.4E90 N139 I140 Y141 N145 R146E90-H143 IonicContact OE2-CG 2.8Å; N139-H143 WeakPolarHBondContact O-CB 3.4Å; N139-H143 PolarHBondContact O-N 3.43Å; I140-H143 PolarHBondContact O-N 3.49Å; Y141-H143 VanDerWaalsContact C-N 3.35Å; Y141-H143 PolarHBondContact O-N 2.95Å; H143-N145 VanDerWaalsContact C-N 3.26Å; H143-N145 PolarHBondContact O-N 3.34Å; H143-R146 PolarHBondContact O-N 2.88Å
144S78.4Confident66.8Low94 Ų94100.8 Ų100.866%0.65752%0.516SS*.Hα-helixtrans-63.5-31.6176.9-173.90000112.9I140 Y141I140-S144 WeakPolarHBondContact O-CB 3.37Å; I140-S144 PolarHBondContact O-N 3.4Å; Y141-S144 PolarHBondContact O-N 2.94Å
145N73.7Confident65Low81 Ų81106.3 Ų106.343%0.43353%0.532SS..THydrogen-bonded Turntrans-88.3-0.3-177.6-78.7-1.9000114.5Y141 R142 H143 P147Y141-N145 WeakPolarHBondContact CE1-ND2 3.2Å; Y141-N145 WeakPolarHBondContact CE2-ND2 3.25Å; Y141-N145 VanDerWaalsContact O-CB 3.31Å; Y141-N145 WeakPolarHBondContact O-CB 3.43Å; Y141-N145 PolarHBondContact O-N 3.17Å; Y141-N145 PolarHBondContact OH-ND2 3.32Å; Y141-N145 VanDerWaalsContact OH-ND2 3.12Å; R142-N145 PolarHBondContact O-N 2.93Å; H143-N145 VanDerWaalsContact C-N 3.26Å; H143-N145 PolarHBondContact O-N 3.34Å; N145-P147 WeakPolarHBondContact O-CD 3.45Å
146R60.7Low63.6Low131 Ų131107.6 Ų107.649%0.49454%0.542SS..  trans-68.299.9167.7-97.9-175.2167.2162.6-0.5107.3R142 H143 S148 H164R142-R146 PolarHBondContact O-N 3.24Å; H143-R146 PolarHBondContact O-N 2.88Å; R146-S148 PolarHBondContact O-N 3.07Å; R146-H164 PolarHBondContact NH2-CE1 2.97Å; R146-H164 PolarHBondContact NH2-NE2 2.94Å
147P46.5Very low62.2Low97 Ų97112.9 Ų112.963%0.6357%0.569SS**  trans-73.1139.1177.1120000106N145 R149N145-P147 WeakPolarHBondContact O-CD 3.45Å; P147-R149 HydrophobicContact CB-CG 4.43Å; P147-R149 PolarHBondContact O-N 2.75Å
148S48.1Very low60.6Low124 Ų124116.5 Ų116.587%0.86759%0.585SS**  trans-61.963.5166.6-42.80000110.6R146 M150R146-S148 PolarHBondContact O-N 3.07Å; S148-M150 PolarHBondContact O-N 3.31Å
149R38.5Very low59.4Low227 Ų227116.5 Ų116.586%0.85759%0.593SS**  trans-78.955.3167.5-81.4-17771149.70.1108.8P147 M151P147-R149 HydrophobicContact CB-CG 4.43Å; P147-R149 PolarHBondContact O-N 2.75Å; R149-M151 VanDerWaalsContact C-N 3.26Å; R149-M151 PolarHBondContact O-N 3.07Å
150M45Very low58.2Low177 Ų177118.7 Ų118.787%0.87261%0.609SS**  trans-94.661.9170.6-154.7169.597.900107.8S148S148-M150 PolarHBondContact O-N 3.31Å
151M48Very low57.2Low165 Ų165120.4 Ų120.481%0.81362%0.618SS**SBendtrans-171.9108.8163-105.4171.7179.200107.1R149R149-M151 VanDerWaalsContact C-N 3.26Å; R149-M151 PolarHBondContact O-N 3.07Å
152N42.4Very low55.7Low160 Ų160121.3 Ų121.386%0.85662%0.622SS**SBendtrans127.4102.4162.2-59-11.3000112.4
153S47.2Very low54.8Low63 Ų63121.4 Ų121.444%0.44163%0.63SS.*  trans108.584.3160.7-160.30000116.3K155 V156 L157S153-K155 VanDerWaalsContact C-N 3.29Å; S153-K155 PolarHBondContact O-N 3.24Å; S153-V156 PolarHBondContact O-N 2.87Å; S153-V156 WeakPolarHBondContact OG-CB 3.48Å; S153-V156 WeakPolarHBondContact OG-CG2 3.44Å; S153-V156 PolarHBondContact OG-N 2.91Å; S153-L157 VanDerWaalsContact O-CB 3.28Å; S153-L157 WeakPolarHBondContact O-CB 3.36Å; S153-L157 PolarHBondContact O-N 2.89Å
154S52Low54.2Low105 Ų105123.2 Ų123.273%0.73464%0.638SS**Hα-helixtrans-60.8-27.4175.8-56.40000114.9E158S154-E158 PolarHBondContact O-N 3.38Å
155K50.8Low53.5Low183 Ų183123.4 Ų123.480%0.79663%0.631SS**Hα-helixtrans-84.1-35.7177.1-73.4-169.5175.8175.30113S153 L157 E158 L159S153-K155 VanDerWaalsContact C-N 3.29Å; S153-K155 PolarHBondContact O-N 3.24Å; K155-L157 VanDerWaalsContact C-N 3.27Å; K155-E158 PolarHBondContact O-N 3.43Å; K155-L159 PolarHBondContact O-N 3.44Å
156V54.2Low53.1Low83 Ų83122 Ų12250%0.50363%0.625SS.*Hα-helixtrans-68.4-35169.1175.70000109.1S153 E158 C160S153-V156 PolarHBondContact O-N 2.87Å; S153-V156 WeakPolarHBondContact OG-CB 3.48Å; S153-V156 WeakPolarHBondContact OG-CG2 3.44Å; S153-V156 PolarHBondContact OG-N 2.91Å; V156-E158 VanDerWaalsContact C-N 3.33Å; V156-E158 PolarHBondContact O-N 3.45Å; V156-C160 WeakPolarHBondContact O-CA 3.46Å; V156-C160 WeakPolarHBondContact O-CB 3.38Å; V156-C160 PolarHBondContact O-N 3.31Å; V156-C160 PolarHBondContact O-SG 3.06Å; V156-C160 VanDerWaalsContact O-SG 3.35Å
157L54Low53Low117 Ų117120.4 Ų120.461%0.61363%0.626SS**Hα-helixtrans-62.1-35.7175.5-171.567000112.3S153 K155 N161S153-L157 VanDerWaalsContact O-CB 3.28Å; S153-L157 WeakPolarHBondContact O-CB 3.36Å; S153-L157 PolarHBondContact O-N 2.89Å; K155-L157 VanDerWaalsContact C-N 3.27Å; L157-N161 VanDerWaalsContact O-CA 3.3Å; L157-N161 WeakPolarHBondContact O-CA 3.3Å; L157-N161 WeakPolarHBondContact O-CB 3.44Å; L157-N161 PolarHBondContact O-N 2.95Å
158E53.6Low54Low148 Ų148117.7 Ų117.769%0.69261%0.605SS**Hα-helixtrans-75.5-45.7-179.4-164.3174.6-171.800112.5S154 K155 V156 N161 Y162S154-E158 PolarHBondContact O-N 3.38Å; K155-E158 PolarHBondContact O-N 3.43Å; V156-E158 VanDerWaalsContact C-N 3.33Å; V156-E158 PolarHBondContact O-N 3.45Å; E158-N161 PolarHBondContact O-N 3.34Å; E158-Y162 PolarHBondContact O-N 3.45Å
159L59Low54.8Low132 Ų132114.4 Ų114.469%0.69159%0.585SS**Hα-helixtrans-68.8-38.9174.9-169.268.2000111.4K155 L163K155-L159 PolarHBondContact O-N 3.44Å; L159-L163 WeakPolarHBondContact O-CB 3.47Å; L159-L163 PolarHBondContact O-N 3.43Å
160C54.3Low56.5Low62 Ų62108.4 Ų108.442%0.41957%0.57SS.*Hα-helixtrans-66-39169.3-77.50000110.9V156 Y162 L163 H164V156-C160 WeakPolarHBondContact O-CA 3.46Å; V156-C160 WeakPolarHBondContact O-CB 3.38Å; V156-C160 PolarHBondContact O-N 3.31Å; V156-C160 PolarHBondContact O-SG 3.06Å; V156-C160 VanDerWaalsContact O-SG 3.35Å; C160-Y162 VanDerWaalsContact C-N 3.34Å; C160-L163 PolarHBondContact O-N 3.02Å; C160-H164 VanDerWaalsContact O-CA 3.28Å; C160-H164 WeakPolarHBondContact O-CA 3.5Å; C160-H164 WeakPolarHBondContact O-CB 3.42Å; C160-H164 PolarHBondContact O-N 2.95Å
161N59.9Low57.7Low83 Ų83101.6 Ų101.644%0.44454%0.538SS..Hα-helixtrans-67.1-38.9178.9-17142000109.8L157 E158 H164 I165L157-N161 VanDerWaalsContact O-CA 3.3Å; L157-N161 WeakPolarHBondContact O-CA 3.3Å; L157-N161 WeakPolarHBondContact O-CB 3.44Å; L157-N161 PolarHBondContact O-N 2.95Å; E158-N161 PolarHBondContact O-N 3.34Å; N161-H164 PolarHBondContact O-N 3.42Å; N161-I165 VanDerWaalsContact O-CB 3.25Å; N161-I165 WeakPolarHBondContact O-CB 3.41Å; N161-I165 VanDerWaalsContact O-CD1 3.29Å; N161-I165 WeakPolarHBondContact O-CD1 3.48Å; N161-I165 WeakPolarHBondContact O-CG1 3.35Å; N161-I165 PolarHBondContact O-N 2.95Å
162Y54.2Low58.8Low165 Ų16594.5 Ų94.565%0.64751%0.506SS*.Hα-helixtrans-65.3-52.4172.8-171.7-95.3000112E158 C160 H164 I165 T166E158-Y162 PolarHBondContact O-N 3.45Å; C160-Y162 VanDerWaalsContact C-N 3.34Å; Y162-H164 PolarHBondContact O-N 3.48Å; Y162-I165 PolarHBondContact O-N 3.27Å; Y162-T166 HydrophobicContact CD1-CG2 4.44Å; Y162-T166 HydrophobicContact CE1-CG2 4.1Å; Y162-T166 WeakPolarHBondContact O-CG2 3.38Å; Y162-T166 PolarHBondContact O-N 3.43Å; Y162-T166 PolarHBondContact O-OG1 2.85Å
163L58.7Low60.4Low107 Ų10789.4 Ų89.456%0.5648%0.483SS*.Hα-helixtrans-62.2-31.4176.7-174.366.9000112.2L159 C160 T166 L167L159-L163 WeakPolarHBondContact O-CB 3.47Å; L159-L163 PolarHBondContact O-N 3.43Å; C160-L163 PolarHBondContact O-N 3.02Å; L163-T166 WeakPolarHBondContact CA-OG1 3.24Å; L163-T166 PolarHBondContact O-OG1 3.02Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 PolarHBondContact O-N 3.33Å
164H58.9Low62Low84 Ų8489.8 Ų89.839%0.38948%0.483SS..Hα-helixtrans-79.4-36.3177.8-177.8-88.6000110.6R146 C160 N161 Y162 Q168R146-H164 PolarHBondContact NH2-CE1 2.97Å; R146-H164 PolarHBondContact NH2-NE2 2.94Å; C160-H164 VanDerWaalsContact O-CA 3.28Å; C160-H164 WeakPolarHBondContact O-CA 3.5Å; C160-H164 WeakPolarHBondContact O-CB 3.42Å; C160-H164 PolarHBondContact O-N 2.95Å; N161-H164 PolarHBondContact O-N 3.42Å; Y162-H164 PolarHBondContact O-N 3.48Å; H164-Q168 PolarHBondContact CE1-OE1 3.49Å; H164-Q168 PolarHBondContact ND1-OE1 2.96Å; H164-Q168 VanDerWaalsContact O-CA 3.3Å; H164-Q168 WeakPolarHBondContact O-CA 3.45Å; H164-Q168 WeakPolarHBondContact O-CB 3.49Å; H164-Q168 PolarHBondContact O-N 3.45Å
165I63.5Low63.2Low97 Ų9787 Ų8750%0.49746%0.457SS..Hα-helixtrans-63.8-45.2171.3-72.5160.4000109N161 Y162 A169N161-I165 VanDerWaalsContact O-CB 3.25Å; N161-I165 WeakPolarHBondContact O-CB 3.41Å; N161-I165 VanDerWaalsContact O-CD1 3.29Å; N161-I165 WeakPolarHBondContact O-CD1 3.48Å; N161-I165 WeakPolarHBondContact O-CG1 3.35Å; N161-I165 PolarHBondContact O-N 2.95Å; Y162-I165 PolarHBondContact O-N 3.27Å; I165-A169 WeakPolarHBondContact O-CB 3.37Å; I165-A169 PolarHBondContact O-N 3.37Å
166T66.4Low64.4Low51 Ų5180.2 Ų80.231%0.31344%0.436SS..Hα-helixtrans-68-50.3178.357.40000111.9Y162 L163 Q168 A169 D170Y162-T166 HydrophobicContact CD1-CG2 4.44Å; Y162-T166 HydrophobicContact CE1-CG2 4.1Å; Y162-T166 WeakPolarHBondContact O-CG2 3.38Å; Y162-T166 PolarHBondContact O-N 3.43Å; Y162-T166 PolarHBondContact O-OG1 2.85Å; L163-T166 WeakPolarHBondContact CA-OG1 3.24Å; L163-T166 PolarHBondContact O-OG1 3.02Å; T166-Q168 PolarHBondContact O-N 3.04Å; T166-A169 PolarHBondContact O-N 3.12Å; T166-D170 VanDerWaalsContact O-CG 3.32Å; T166-D170 PolarHBondContact O-N 2.9Å
167L59Low65.7Low99 Ų9982.4 Ų82.452%0.51844%0.441SS..Hα-helixtrans-67.6-35.6179.2-173.966.7000112.5L163 T171L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 PolarHBondContact O-N 3.33Å; L167-T171 HydrophobicContact CD1-CG2 4.44Å; L167-T171 WeakPolarHBondContact O-CB 3.26Å; L167-T171 VanDerWaalsContact O-CG2 3.29Å; L167-T171 WeakPolarHBondContact O-CG2 3.26Å; L167-T171 PolarHBondContact O-N 3.49Å; L167-T171 PolarHBondContact O-OG1 3.22Å
168Q65.5Low67Low40 Ų4080 Ų8019%0.18743%0.428CS..Hα-helixtrans-69.9-37.7172.8-173.2171.9-45.500110.3H164 T166 T171 A172H164-Q168 PolarHBondContact CE1-OE1 3.49Å; H164-Q168 PolarHBondContact ND1-OE1 2.96Å; H164-Q168 VanDerWaalsContact O-CA 3.3Å; H164-Q168 WeakPolarHBondContact O-CA 3.45Å; H164-Q168 WeakPolarHBondContact O-CB 3.49Å; H164-Q168 PolarHBondContact O-N 3.45Å; T166-Q168 PolarHBondContact O-N 3.04Å; Q168-T171 WeakPolarHBondContact CA-OG1 3.47Å; Q168-T171 PolarHBondContact O-OG1 2.84Å; Q168-A172 WeakPolarHBondContact O-CA 3.45Å; Q168-A172 WeakPolarHBondContact O-CB 3.14Å; Q168-A172 PolarHBondContact O-N 3.42Å
169A65.7Low68.1Low54 Ų5474.2 Ų74.245%0.44640%0.4SS..Hα-helixtrans-64-43.8174.200000111.6I165 T166 S173I165-A169 WeakPolarHBondContact O-CB 3.37Å; I165-A169 PolarHBondContact O-N 3.37Å; T166-A169 PolarHBondContact O-N 3.12Å; A169-S173 VanDerWaalsContact O-CB 3.25Å; A169-S173 WeakPolarHBondContact O-CB 3.42Å; A169-S173 PolarHBondContact O-N 3.15Å; A169-S173 PolarHBondContact O-OG 3.27Å; A169-S173 VanDerWaalsContact O-OG 3.06Å
170D73.4Confident69.1Low101 Ų10169.3 Ų69.354%0.5438%0.382SS..Hα-helixtrans-68-40178.5-69.6-21.1000112.3T166 S173 T174T166-D170 VanDerWaalsContact O-CG 3.32Å; T166-D170 PolarHBondContact O-N 2.9Å; D170-S173 WeakPolarHBondContact CA-OG 2.85Å; D170-S173 PolarHBondContact O-OG 2.94Å; D170-T174 WeakPolarHBondContact O-CB 3.18Å; D170-T174 PolarHBondContact O-N 3.39Å; D170-T174 VanDerWaalsContact O-N 3.13Å; D170-T174 PolarHBondContact O-OG1 3.4Å
171T70.4Confident70.5Confident34 Ų3472.3 Ų72.321%0.20939%0.393CS..Hα-helixtrans-73.6-42.3175.754.50000111.2L167 Q168 S173 T174 F175L167-T171 HydrophobicContact CD1-CG2 4.44Å; L167-T171 WeakPolarHBondContact O-CB 3.26Å; L167-T171 VanDerWaalsContact O-CG2 3.29Å; L167-T171 WeakPolarHBondContact O-CG2 3.26Å; L167-T171 PolarHBondContact O-N 3.49Å; L167-T171 PolarHBondContact O-OG1 3.22Å; Q168-T171 WeakPolarHBondContact CA-OG1 3.47Å; Q168-T171 PolarHBondContact O-OG1 2.84Å; T171-S173 VanDerWaalsContact C-N 3.34Å; T171-S173 PolarHBondContact O-N 2.85Å; T171-T174 PolarHBondContact O-N 2.97Å; T171-F175 WeakPolarHBondContact O-CB 3.46Å; T171-F175 WeakPolarHBondContact O-CD2 3.2Å; T171-F175 WeakPolarHBondContact O-CG 3.42Å; T171-F175 PolarHBondContact O-N 3.45Å
172A71.3Confident71.5Confident17 Ų1769.9 Ų69.914%0.1438%0.38CS..Hα-helixtrans-64.3-37.4177.200000111.7Q168 F175 A176Q168-A172 WeakPolarHBondContact O-CA 3.45Å; Q168-A172 WeakPolarHBondContact O-CB 3.14Å; Q168-A172 PolarHBondContact O-N 3.42Å; A172-F175 PolarHBondContact O-N 2.88Å; A172-A176 WeakPolarHBondContact O-CB 3.37Å; A172-A176 PolarHBondContact O-N 3.46Å
173S76.4Confident72.6Confident52 Ų5264 Ų6436%0.36436%0.359SS..Hα-helixtrans-64.2-49.1173.263.40000110.7A169 D170 T171 F175 A176 E177A169-S173 VanDerWaalsContact O-CB 3.25Å; A169-S173 WeakPolarHBondContact O-CB 3.42Å; A169-S173 PolarHBondContact O-N 3.15Å; A169-S173 PolarHBondContact O-OG 3.27Å; A169-S173 VanDerWaalsContact O-OG 3.06Å; D170-S173 WeakPolarHBondContact CA-OG 2.85Å; D170-S173 PolarHBondContact O-OG 2.94Å; T171-S173 VanDerWaalsContact C-N 3.34Å; T171-S173 PolarHBondContact O-N 2.85Å; S173-F175 VanDerWaalsContact C-N 3.33Å; S173-F175 PolarHBondContact O-N 3.24Å; S173-A176 PolarHBondContact O-N 3.19Å; S173-E177 WeakPolarHBondContact O-CB 3.48Å; S173-E177 VanDerWaalsContact O-CG 3.32Å; S173-E177 WeakPolarHBondContact O-CG 3.34Å; S173-E177 PolarHBondContact O-N 3.32Å
174T80Confident73.7Confident72 Ų7263.3 Ų63.344%0.44236%0.359SS..Hα-helixtrans-59.6-43.2176.8-54.30000111.6D170 T171 E177 I178D170-T174 WeakPolarHBondContact O-CB 3.18Å; D170-T174 PolarHBondContact O-N 3.39Å; D170-T174 VanDerWaalsContact O-N 3.13Å; D170-T174 PolarHBondContact O-OG1 3.4Å; T171-T174 PolarHBondContact O-N 2.97Å; T174-E177 PolarHBondContact O-N 3.38Å; T174-I178 HydrophobicContact CG2-CD1 3.91Å; T174-I178 WeakPolarHBondContact O-CB 3.43Å; T174-I178 WeakPolarHBondContact O-CG1 3.44Å; T174-I178 PolarHBondContact O-N 2.89Å
175F77.6Confident74.8Confident45 Ų4561.8 Ų61.820%0.19735%0.35CS..Hα-helixtrans-65.3-47.6176.7-76.6-59.8000111T171 A172 S173 E177 I178 F179T171-F175 WeakPolarHBondContact O-CB 3.46Å; T171-F175 WeakPolarHBondContact O-CD2 3.2Å; T171-F175 WeakPolarHBondContact O-CG 3.42Å; T171-F175 PolarHBondContact O-N 3.45Å; A172-F175 PolarHBondContact O-N 2.88Å; S173-F175 VanDerWaalsContact C-N 3.33Å; S173-F175 PolarHBondContact O-N 3.24Å; F175-E177 VanDerWaalsContact C-N 3.27Å; F175-E177 PolarHBondContact O-N 2.84Å; F175-I178 PolarHBondContact O-N 3.47Å; F175-F179 HydrophobicContact CB-CD2 4.21Å; F175-F179 HydrophobicContact CB-CE2 4.29Å; F175-F179 HydrophobicContact CD1-CE2 4.43Å; F175-F179 WeakPolarHBondContact O-CB 3.15Å; F175-F179 WeakPolarHBondContact O-CD2 2.98Å; F175-F179 PolarHBondContact O-N 3.47Å
176A77.4Confident75.6Confident42 Ų4258.1 Ų58.135%0.34733%0.33SS..Hα-helixtrans-59.6-38.6177.600000111.6A172 S173 G180A172-A176 WeakPolarHBondContact O-CB 3.37Å; A172-A176 PolarHBondContact O-N 3.46Å; S173-A176 PolarHBondContact O-N 3.19Å; A176-G180 WeakPolarHBondContact O-CA 3.19Å; A176-G180 PolarHBondContact O-N 2.87Å
177E79.7Confident76.2Confident129 Ų12960 Ų6060%0.60334%0.338SS*.Hα-helixtrans-64.4-48.5173.4-75.4-178.6-172.300111.7S173 T174 F175 F179 G180 L181S173-E177 WeakPolarHBondContact O-CB 3.48Å; S173-E177 VanDerWaalsContact O-CG 3.32Å; S173-E177 WeakPolarHBondContact O-CG 3.34Å; S173-E177 PolarHBondContact O-N 3.32Å; T174-E177 PolarHBondContact O-N 3.38Å; F175-E177 VanDerWaalsContact C-N 3.27Å; F175-E177 PolarHBondContact O-N 2.84Å; E177-F179 PolarHBondContact O-N 2.93Å; E177-G180 PolarHBondContact O-N 3.05Å; E177-L181 WeakPolarHBondContact O-CB 3.4Å; E177-L181 VanDerWaalsContact O-CG 3.29Å; E177-L181 WeakPolarHBondContact O-CG 3.34Å; E177-L181 PolarHBondContact O-N 2.95Å
178I81.7Confident77.4Confident65 Ų6561 Ų6133%0.33334%0.335SS..Hα-helixtrans-60.9-47.8177.6-68.4165.9000110.1L135 T174 F175 G180 L181 M182L135-I178 HydrophobicContact CD1-CG2 4.16Å; T174-I178 HydrophobicContact CG2-CD1 3.91Å; T174-I178 WeakPolarHBondContact O-CB 3.43Å; T174-I178 WeakPolarHBondContact O-CG1 3.44Å; T174-I178 PolarHBondContact O-N 2.89Å; F175-I178 PolarHBondContact O-N 3.47Å; I178-G180 PolarHBondContact O-N 3.33Å; I178-L181 PolarHBondContact O-N 2.93Å; I178-M182 HydrophobicContact CG2-CG 4.36Å; I178-M182 WeakPolarHBondContact O-CB 3.41Å; I178-M182 WeakPolarHBondContact O-CG 3.43Å; I178-M182 PolarHBondContact O-N 3.43Å
179F77.7Confident78.1Confident27 Ų2760.2 Ų60.212%0.11833%0.33CS..Hα-helixtrans-62.7-40.6177.1-80-66.2000112V60 D136 N139 F175 E177 M182 I183V60-F179 HydrophobicContact CG1-CB 4.16Å; V60-F179 HydrophobicContact CG1-CD1 4.02Å; V60-F179 HydrophobicContact CG1-CG 4.35Å; D136-F179 WeakPolarHBondContact OD1-CE1 3.45Å; D136-F179 WeakPolarHBondContact OD1-CZ 3.38Å; N139-F179 VanDerWaalsContact ND2-CZ 3.33Å; N139-F179 WeakPolarHBondContact ND2-CZ 3.39Å; F175-F179 HydrophobicContact CB-CD2 4.21Å; F175-F179 HydrophobicContact CB-CE2 4.29Å; F175-F179 HydrophobicContact CD1-CE2 4.43Å; F175-F179 WeakPolarHBondContact O-CB 3.15Å; F175-F179 WeakPolarHBondContact O-CD2 2.98Å; F175-F179 PolarHBondContact O-N 3.47Å; E177-F179 PolarHBondContact O-N 2.93Å; F179-M182 WeakPolarHBondContact O-CB 3.36Å; F179-M182 PolarHBondContact O-N 3.36Å; F179-I183 WeakPolarHBondContact O-CD1 3.46Å; F179-I183 VanDerWaalsContact O-CG1 3.29Å; F179-I183 WeakPolarHBondContact O-CG1 3.37Å; F179-I183 PolarHBondContact O-N 3.18Å
180G80.2Confident78.6Confident30 Ų3058.8 Ų58.831%0.30932%0.315SS..Hα-helixtrans-62.4-51.5175.600000112.2A176 E177 I178 M182 I183 V184A176-G180 WeakPolarHBondContact O-CA 3.19Å; A176-G180 PolarHBondContact O-N 2.87Å; E177-G180 PolarHBondContact O-N 3.05Å; I178-G180 PolarHBondContact O-N 3.33Å; G180-M182 PolarHBondContact O-N 2.85Å; G180-I183 PolarHBondContact O-N 2.91Å; G180-V184 WeakPolarHBondContact O-CG2 3.28Å; G180-V184 PolarHBondContact O-N 3.36Å
181L83Confident78.9Confident124 Ų12461.7 Ų61.765%0.64932%0.318SS*.Hα-helixtrans-60.5-37.4175.9-71.7174.2000111.5E177 I178 V184 Y185E177-L181 WeakPolarHBondContact O-CB 3.4Å; E177-L181 VanDerWaalsContact O-CG 3.29Å; E177-L181 WeakPolarHBondContact O-CG 3.34Å; E177-L181 PolarHBondContact O-N 2.95Å; I178-L181 PolarHBondContact O-N 2.93Å; L181-V184 PolarHBondContact O-N 3.33Å; L181-Y185 WeakPolarHBondContact O-CB 3.41Å; L181-Y185 PolarHBondContact O-N 3.09Å
182M80.4Confident79.5Confident33 Ų3364.4 Ų64.416%0.16333%0.325CS..Hα-helixtrans-60.8-45.4175.1-86.3-56.5-31.200112.4I128 C132 I178 F179 G180 Y185 R186I128-M182 HydrophobicContact CG2-CE 3.38Å; I128-M182 HydrophobicContact CG2-SD 3.85Å; C132-M182 WeakPolarHBondContact SG-CE 3.5Å; C132-M182 PolarHBondContact SG-SD 3.44Å; I178-M182 HydrophobicContact CG2-CG 4.36Å; I178-M182 WeakPolarHBondContact O-CB 3.41Å; I178-M182 WeakPolarHBondContact O-CG 3.43Å; I178-M182 PolarHBondContact O-N 3.43Å; F179-M182 WeakPolarHBondContact O-CB 3.36Å; F179-M182 PolarHBondContact O-N 3.36Å; G180-M182 PolarHBondContact O-N 2.85Å; M182-Y185 PolarHBondContact O-N 3.49Å; M182-R186 HydrophobicContact CE-CG 4.27Å; M182-R186 WeakPolarHBondContact O-CG 3.46Å; M182-R186 PolarHBondContact O-N 3.02Å
183I76.8Confident79.9Confident40 Ų4065.3 Ų65.321%0.20533%0.325CS..Hα-helixtrans-63-47.5175.8-66.8156.1000110.5A57 V60 F179 G180 Y185 R186 L187A57-I183 HydrophobicContact CB-CG2 4.31Å; V60-I183 HydrophobicContact CB-CD1 4.1Å; V60-I183 HydrophobicContact CB-CG1 4.45Å; V60-I183 HydrophobicContact CG1-CD1 3.69Å; V60-I183 HydrophobicContact CG1-CG1 4.25Å; F179-I183 WeakPolarHBondContact O-CD1 3.46Å; F179-I183 VanDerWaalsContact O-CG1 3.29Å; F179-I183 WeakPolarHBondContact O-CG1 3.37Å; F179-I183 PolarHBondContact O-N 3.18Å; G180-I183 PolarHBondContact O-N 2.91Å; I183-Y185 VanDerWaalsContact C-N 3.29Å; I183-Y185 PolarHBondContact O-N 3.46Å; I183-R186 PolarHBondContact O-N 3.39Å; I183-L187 HydrophobicContact CG2-CD1 3.88Å; I183-L187 HydrophobicContact CG2-CG 4.28Å; I183-L187 WeakPolarHBondContact O-CG 3.45Å; I183-L187 PolarHBondContact O-N 3.4Å
184V81.6Confident79.9Confident94 Ų9466 Ų6657%0.5732%0.324SS*.Hα-helixtrans-59.3-43.2179.2174.20000110.6G180 L181 L187 W188G180-V184 WeakPolarHBondContact O-CG2 3.28Å; G180-V184 PolarHBondContact O-N 3.36Å; L181-V184 PolarHBondContact O-N 3.33Å; V184-L187 PolarHBondContact O-N 3.46Å; V184-W188 VanDerWaalsContact O-CB 3.28Å; V184-W188 WeakPolarHBondContact O-CB 3.43Å; V184-W188 PolarHBondContact O-N 3.18Å
185Y82.9Confident79.9Confident51 Ų5168.7 Ų68.720%0.233%0.326CS..Hα-helixtrans-61-47.6176.1-178.6-87.8000111.7I124 I128 L181 M182 I183 W188 Y189I124-Y185 VanDerWaalsContact CG2-OH 3.26Å; I124-Y185 WeakPolarHBondContact CG2-OH 3.43Å; I128-Y185 HydrophobicContact CB-CE1 4.27Å; I128-Y185 HydrophobicContact CD1-CD1 3.75Å; I128-Y185 HydrophobicContact CD1-CD2 4.24Å; I128-Y185 HydrophobicContact CD1-CE1 3.12Å; I128-Y185 HydrophobicContact CD1-CE2 3.64Å; I128-Y185 HydrophobicContact CD1-CG 4.29Å; I128-Y185 VanDerWaalsContact CD1-OH 3.24Å; I128-Y185 WeakPolarHBondContact CD1-OH 3.43Å; I128-Y185 HydrophobicContact CG1-CE1 4.26Å; I128-Y185 HydrophobicContact CG2-CD1 3.87Å; I128-Y185 HydrophobicContact CG2-CE1 4Å; L181-Y185 WeakPolarHBondContact O-CB 3.41Å; L181-Y185 PolarHBondContact O-N 3.09Å; M182-Y185 PolarHBondContact O-N 3.49Å; I183-Y185 VanDerWaalsContact C-N 3.29Å; I183-Y185 PolarHBondContact O-N 3.46Å; Y185-W188 HydrophobicContact CD2-CE3 4.19Å; Y185-W188 HydrophobicContact CD2-CZ3 4.41Å; Y185-W188 AromaticContact CE2-CE3 3.96Å; Y185-W188 HydrophobicContact CE2-CE3 3.96Å; Y185-W188 AromaticContact CE2-CZ3 3.78Å; Y185-W188 HydrophobicContact CE2-CZ3 3.78Å; Y185-W188 PolarHBondContact O-N 3.39Å; Y185-Y189 WeakPolarHBondContact O-CB 3.41Å; Y185-Y189 PolarHBondContact O-N 3.35Å
186R79.8Confident79.9Confident20 Ų2071.1 Ų71.18%0.07534%0.337CS..Hα-helixtrans-60.1-47.2177.7-75-179.3-178-99.6-7.6111.5T53 E56 C132 M182 I183 W188 Y189 I190T53-R186 HydrophobicContact CG2-CB 4.46Å; E56-R186 VanDerWaalsContact CD-NH1 3.3Å; E56-R186 WeakPolarHBondContact OE1-CD 3.39Å; E56-R186 IonicContact OE1-CZ 2.9Å; E56-R186 IonicContact OE1-NE 3.04Å; E56-R186 PolarHBondContact OE1-NE 3.42Å; E56-R186 IonicContact OE1-NH1 2.95Å; E56-R186 PolarHBondContact OE1-NH1 3.31Å; E56-R186 IonicContact OE1-NH2 3.53Å; E56-R186 IonicContact OE2-CZ 3.59Å; E56-R186 IonicContact OE2-NE 3.88Å; E56-R186 IonicContact OE2-NH1 2.84Å; E56-R186 PolarHBondContact OE2-NH1 3.49Å; C132-R186 PolarHBondContact SG-NH2 2.9Å; C132-R186 VanDerWaalsContact SG-NH2 3.45Å; M182-R186 HydrophobicContact CE-CG 4.27Å; M182-R186 WeakPolarHBondContact O-CG 3.46Å; M182-R186 PolarHBondContact O-N 3.02Å; I183-R186 PolarHBondContact O-N 3.39Å; R186-W188 PolarHBondContact O-N 3Å; R186-Y189 WeakPolarHBondContact O-CB 3.29Å; R186-Y189 PolarHBondContact O-N 2.88Å; R186-I190 WeakPolarHBondContact O-CD1 3.33Å; R186-I190 WeakPolarHBondContact O-CG1 3.43Å; R186-I190 PolarHBondContact O-N 2.84Å
187L79.5Confident79.8Confident90 Ų9070.2 Ų70.247%0.47133%0.327SS..Hα-helixtrans-61.9-43.2177.3-70.4175.3000112.2I183 V184 Y189 I190 R191I183-L187 HydrophobicContact CG2-CD1 3.88Å; I183-L187 HydrophobicContact CG2-CG 4.28Å; I183-L187 WeakPolarHBondContact O-CG 3.45Å; I183-L187 PolarHBondContact O-N 3.4Å; V184-L187 PolarHBondContact O-N 3.46Å; L187-Y189 VanDerWaalsContact C-N 3.32Å; L187-Y189 PolarHBondContact O-N 3.29Å; L187-I190 HydrophobicContact CD2-CD1 4.38Å; L187-I190 PolarHBondContact O-N 3.05Å; L187-R191 WeakPolarHBondContact O-CB 3.08Å; L187-R191 PolarHBondContact O-N 3.18Å
188W84Confident79.6Confident122 Ų12268.3 Ų68.346%0.46232%0.324SS..Hα-helixtrans-60.4-44.2175.6174.377.3000111.6V184 Y185 R186 R191 R192V184-W188 VanDerWaalsContact O-CB 3.28Å; V184-W188 WeakPolarHBondContact O-CB 3.43Å; V184-W188 PolarHBondContact O-N 3.18Å; Y185-W188 HydrophobicContact CD2-CE3 4.19Å; Y185-W188 HydrophobicContact CD2-CZ3 4.41Å; Y185-W188 AromaticContact CE2-CE3 3.96Å; Y185-W188 HydrophobicContact CE2-CE3 3.96Å; Y185-W188 AromaticContact CE2-CZ3 3.78Å; Y185-W188 HydrophobicContact CE2-CZ3 3.78Å; Y185-W188 PolarHBondContact O-N 3.39Å; R186-W188 PolarHBondContact O-N 3Å; W188-R191 PolarHBondContact O-N 2.98Å; W188-R192 WeakPolarHBondContact O-CB 3.17Å; W188-R192 PolarHBondContact O-N 3.36Å
189Y79.5Confident79.4Confident23 Ų2372 Ų729%0.0934%0.338CS..Hα-helixtrans-61.5-49.8176.2168.3-102.9000111.7F122 D125 Y185 R186 L187 R191 R192 F193F122-Y189 WeakPolarHBondContact CD1-OH 3.37Å; D125-Y189 HydrophobicContact CB-CD2 4.23Å; D125-Y189 HydrophobicContact CB-CE1 4.25Å; D125-Y189 HydrophobicContact CB-CE2 3.74Å; D125-Y189 WeakPolarHBondContact OD1-CE1 3.4Å; D125-Y189 WeakPolarHBondContact OD2-CE1 3.18Å; D125-Y189 PolarHBondContact OD2-OH 2.8Å; Y185-Y189 WeakPolarHBondContact O-CB 3.41Å; Y185-Y189 PolarHBondContact O-N 3.35Å; R186-Y189 WeakPolarHBondContact O-CB 3.29Å; R186-Y189 PolarHBondContact O-N 2.88Å; L187-Y189 VanDerWaalsContact C-N 3.32Å; L187-Y189 PolarHBondContact O-N 3.29Å; Y189-R191 VanDerWaalsContact C-N 3.32Å; Y189-R191 PolarHBondContact O-N 3.35Å; Y189-R192 CarbonylContact O-C 3.54Å; Y189-R192 WeakPolarHBondContact O-CA 3.35Å; Y189-R192 WeakPolarHBondContact O-CB 3.39Å; Y189-R192 PolarHBondContact O-N 3.37Å; Y189-F193 WeakPolarHBondContact O-CB 3.22Å; Y189-F193 PolarHBondContact O-N 2.85Å
190I77.1Confident79.4Confident23 Ų2375.4 Ų75.412%0.11836%0.356CS..Hα-helixtrans-57.2-47.2177.7-62.7157.2000110.2I50 T53 R186 L187 R192 F193 I194I50-I190 HydrophobicContact CG1-CG2 4.39Å; T53-I190 HydrophobicContact CG2-CD1 3.21Å; T53-I190 HydrophobicContact CG2-CG1 4.07Å; R186-I190 WeakPolarHBondContact O-CD1 3.33Å; R186-I190 WeakPolarHBondContact O-CG1 3.43Å; R186-I190 PolarHBondContact O-N 2.84Å; L187-I190 HydrophobicContact CD2-CD1 4.38Å; L187-I190 PolarHBondContact O-N 3.05Å; I190-R192 VanDerWaalsContact C-N 3.29Å; I190-R192 PolarHBondContact O-N 2.9Å; I190-F193 WeakPolarHBondContact O-CB 3.49Å; I190-F193 PolarHBondContact O-N 2.78Å; I190-F193 VanDerWaalsContact O-N 3.15Å; I190-I194 HydrophobicContact CG2-CD1 3.78Å; I190-I194 HydrophobicContact CG2-CG1 4.34Å; I190-I194 VanDerWaalsContact O-CG1 3.3Å; I190-I194 WeakPolarHBondContact O-CG1 3.31Å; I190-I194 PolarHBondContact O-N 3.5Å
191R80.6Confident79.2Confident163 Ų16378.3 Ų78.362%0.61536%0.361SS*.Hα-helixtrans-59.7-40.6177.2-175.9-178.9177.61791.3111.7L187 W188 Y189 R195L187-R191 WeakPolarHBondContact O-CB 3.08Å; L187-R191 PolarHBondContact O-N 3.18Å; W188-R191 PolarHBondContact O-N 2.98Å; Y189-R191 VanDerWaalsContact C-N 3.32Å; Y189-R191 PolarHBondContact O-N 3.35Å; R191-R195 WeakPolarHBondContact O-CG 3.38Å; R191-R195 PolarHBondContact O-N 3.45Å; R191-R195 VanDerWaalsContact O-N 3.13Å; R191-R195 PolarHBondContact O-NE 3.01Å
192R82.8Confident79Confident91 Ų9175.8 Ų75.834%0.34335%0.353SS..Hα-helixtrans-67.2-41.6176.1-175.5173.6178.783.6-2111.1L121 W188 Y189 I190 R195 K196L121-R192 HydrophobicContact CD1-CG 4.32Å; W188-R192 WeakPolarHBondContact O-CB 3.17Å; W188-R192 PolarHBondContact O-N 3.36Å; Y189-R192 CarbonylContact O-C 3.54Å; Y189-R192 WeakPolarHBondContact O-CA 3.35Å; Y189-R192 WeakPolarHBondContact O-CB 3.39Å; Y189-R192 PolarHBondContact O-N 3.37Å; I190-R192 VanDerWaalsContact C-N 3.29Å; I190-R192 PolarHBondContact O-N 2.9Å; R192-R195 PolarHBondContact O-N 3.17Å; R192-K196 WeakPolarHBondContact O-CG 3.48Å; R192-K196 PolarHBondContact O-N 2.92Å
193F79Confident78.8Confident35 Ų3580.1 Ų80.115%0.15437%0.371CS..Hα-helixtrans-63.8-44.6178178.7-95.1000111.9Y46 F122 Y189 I190 K196 T197Y46-F193 AromaticContact CD1-CE1 3.56Å; Y46-F193 HydrophobicContact CD1-CE1 3.56Å; Y46-F193 AromaticContact CD1-CZ 3.76Å; Y46-F193 HydrophobicContact CD1-CZ 3.76Å; Y46-F193 AromaticContact CE1-CE1 3.69Å; Y46-F193 HydrophobicContact CE1-CE1 3.69Å; Y46-F193 AromaticContact CE1-CZ 3.36Å; Y46-F193 HydrophobicContact CE1-CZ 3.36Å; F122-F193 HydrophobicContact CE1-CD2 4.09Å; F122-F193 AromaticContact CE1-CE2 3.96Å; F122-F193 HydrophobicContact CE1-CE2 3.96Å; F122-F193 HydrophobicContact CZ-CD2 4.12Å; F122-F193 AromaticContact CZ-CE2 3.76Å; F122-F193 HydrophobicContact CZ-CE2 3.76Å; Y189-F193 WeakPolarHBondContact O-CB 3.22Å; Y189-F193 PolarHBondContact O-N 2.85Å; I190-F193 WeakPolarHBondContact O-CB 3.49Å; I190-F193 PolarHBondContact O-N 2.78Å; I190-F193 VanDerWaalsContact O-N 3.15Å; F193-K196 PolarHBondContact O-N 2.83Å; F193-T197 WeakPolarHBondContact CE1-OG1 3.29Å; F193-T197 WeakPolarHBondContact CZ-OG1 3.37Å; F193-T197 WeakPolarHBondContact O-CB 3.42Å; F193-T197 PolarHBondContact O-N 3.43Å; F193-T197 PolarHBondContact O-OG1 3.46Å
194I76.7Confident79.1Confident68 Ų6883.5 Ų83.535%0.34939%0.386SS..Hα-helixtrans-59.4-51.9174.7-67.5165.4000109.9I50 I190 K196 T197 V198I50-I194 HydrophobicContact CD1-CD1 4.35Å; I50-I194 HydrophobicContact CD1-CG1 4.32Å; I190-I194 HydrophobicContact CG2-CD1 3.78Å; I190-I194 HydrophobicContact CG2-CG1 4.34Å; I190-I194 VanDerWaalsContact O-CG1 3.3Å; I190-I194 WeakPolarHBondContact O-CG1 3.31Å; I190-I194 PolarHBondContact O-N 3.5Å; I194-K196 VanDerWaalsContact C-N 3.28Å; I194-K196 PolarHBondContact O-N 3.02Å; I194-T197 PolarHBondContact O-N 3.39Å; I194-T197 VanDerWaalsContact O-N 3.14Å; I194-V198 HydrophobicContact CG2-CG2 3.9Å; I194-V198 WeakPolarHBondContact O-CB 3.34Å; I194-V198 VanDerWaalsContact O-CG2 3.25Å; I194-V198 WeakPolarHBondContact O-CG2 3.45Å; I194-V198 PolarHBondContact O-N 3.06Å
195R79.5Confident79.1Confident128 Ų12881.8 Ų81.848%0.48338%0.378SS..Hα-helixtrans-55.3-44178.3-78.6-175.3-76.4-166-0.8112R191 R192 F199R191-R195 WeakPolarHBondContact O-CG 3.38Å; R191-R195 PolarHBondContact O-N 3.45Å; R191-R195 VanDerWaalsContact O-N 3.13Å; R191-R195 PolarHBondContact O-NE 3.01Å; R192-R195 PolarHBondContact O-N 3.17Å; R195-F199 WeakPolarHBondContact O-CB 3.48Å; R195-F199 PolarHBondContact O-N 3.07Å
196K77Confident79Confident95 Ų9584 Ų8441%0.41339%0.392SS..Hα-helixtrans-64.4-45.5176.9-74.1-176.9174.1-142.90112.4L121 R192 F193 I194 F199 I200L121-K196 HydrophobicContact CD1-CD 3.98Å; R192-K196 WeakPolarHBondContact O-CG 3.48Å; R192-K196 PolarHBondContact O-N 2.92Å; F193-K196 PolarHBondContact O-N 2.83Å; I194-K196 VanDerWaalsContact C-N 3.28Å; I194-K196 PolarHBondContact O-N 3.02Å; K196-F199 PolarHBondContact O-N 3.39Å; K196-I200 WeakPolarHBondContact O-CD1 3.3Å; K196-I200 WeakPolarHBondContact O-CG1 3.43Å; K196-I200 PolarHBondContact O-N 3.36Å
197T75.8Confident79.3Confident24 Ų2488.5 Ų88.515%0.14741%0.412CS..Hα-helixtrans-68.3-43.3-178.7-58.60000111.7F193 I194 I200 K201F193-T197 WeakPolarHBondContact CE1-OG1 3.29Å; F193-T197 WeakPolarHBondContact CZ-OG1 3.37Å; F193-T197 WeakPolarHBondContact O-CB 3.42Å; F193-T197 PolarHBondContact O-N 3.43Å; F193-T197 PolarHBondContact O-OG1 3.46Å; I194-T197 PolarHBondContact O-N 3.39Å; I194-T197 VanDerWaalsContact O-N 3.14Å; T197-I200 PolarHBondContact O-N 2.84Å; T197-K201 HydrophobicContact CG2-CD 4.46Å; T197-K201 WeakPolarHBondContact O-CB 2.92Å; T197-K201 WeakPolarHBondContact O-CG 3.12Å; T197-K201 PolarHBondContact O-N 3.35Å
198V76.9Confident79.7Confident88 Ų8889.1 Ų89.153%0.53341%0.412SS..Hα-helixtrans-62.3-45174.4172.80000110.1I194 I200 K201 S202I194-V198 HydrophobicContact CG2-CG2 3.9Å; I194-V198 WeakPolarHBondContact O-CB 3.34Å; I194-V198 VanDerWaalsContact O-CG2 3.25Å; I194-V198 WeakPolarHBondContact O-CG2 3.45Å; I194-V198 PolarHBondContact O-N 3.06Å; V198-I200 PolarHBondContact O-N 2.9Å; V198-K201 PolarHBondContact O-N 2.86Å; V198-S202 WeakPolarHBondContact O-CB 3.49Å; V198-S202 PolarHBondContact O-N 3.49Å
199F76.7Confident79.8Confident142 Ų14287.5 Ų87.562%0.62341%0.411SS*.Hα-helixtrans-60.8-42.9176.6-178.6-100.5000112.4R195 K196 S202 K203R195-F199 WeakPolarHBondContact O-CB 3.48Å; R195-F199 PolarHBondContact O-N 3.07Å; K196-F199 PolarHBondContact O-N 3.39Å; F199-S202 PolarHBondContact O-N 3.31Å; F199-K203 WeakPolarHBondContact O-CB 3.42Å; F199-K203 PolarHBondContact O-N 3.23Å
200I77.5Confident80.3Confident99 Ų9991.3 Ų91.351%0.50843%0.43SS..Hα-helixtrans-64-46.3176.9-69162.9000110.8K196 T197 V198 K203 Q204K196-I200 WeakPolarHBondContact O-CD1 3.3Å; K196-I200 WeakPolarHBondContact O-CG1 3.43Å; K196-I200 PolarHBondContact O-N 3.36Å; T197-I200 PolarHBondContact O-N 2.84Å; V198-I200 PolarHBondContact O-N 2.9Å; I200-K203 PolarHBondContact O-N 3.39Å; I200-Q204 WeakPolarHBondContact O-CB 2.9Å; I200-Q204 PolarHBondContact O-N 3.26Å
201K76.3Confident80.9Confident92 Ų9296 Ų9640%0.445%0.452SS..Hα-helixtrans-65.6-40.2177.9-74.8-175.8177.9-178.90112.1T197 V198 Q204 S205T197-K201 HydrophobicContact CG2-CD 4.46Å; T197-K201 WeakPolarHBondContact O-CB 2.92Å; T197-K201 WeakPolarHBondContact O-CG 3.12Å; T197-K201 PolarHBondContact O-N 3.35Å; V198-K201 PolarHBondContact O-N 2.86Å; K201-Q204 PolarHBondContact O-N 3.3Å; K201-S205 WeakPolarHBondContact O-CB 3.48Å; K201-S205 PolarHBondContact O-N 3.27Å
202S78.4Confident81.2Confident71 Ų7194 Ų9450%0.49745%0.452SS..Hα-helixtrans-61.6-46.6174.9175.20000110.9V198 F199 Q204 S205 M206V198-S202 WeakPolarHBondContact O-CB 3.49Å; V198-S202 PolarHBondContact O-N 3.49Å; F199-S202 PolarHBondContact O-N 3.31Å; S202-Q204 VanDerWaalsContact C-N 3.33Å; S202-Q204 PolarHBondContact O-N 3.35Å; S202-S205 PolarHBondContact O-N 3.47Å; S202-M206 VanDerWaalsContact O-CB 3.29Å; S202-M206 WeakPolarHBondContact O-CB 3.34Å; S202-M206 PolarHBondContact O-N 3.3Å
203K77.2Confident81.6Confident123 Ų12394.9 Ų94.954%0.53546%0.461SS..Hα-helixtrans-62.3-39.5176-171.3173.3-176173.60112.3F199 I200 K207F199-K203 WeakPolarHBondContact O-CB 3.42Å; F199-K203 PolarHBondContact O-N 3.23Å; I200-K203 PolarHBondContact O-N 3.39Å; K203-K207 WeakPolarHBondContact O-CG 3.32Å; K203-K207 PolarHBondContact O-N 3Å; K203-K207 VanDerWaalsContact O-N 3.13Å
204Q82.4Confident82.3Confident112 Ų11299.6 Ų99.652%0.52348%0.483SS..Hα-helixtrans-68.4-45.6176.5-176.5176.4-1900111.7I200 K201 S202 M206 K207 Q208I200-Q204 WeakPolarHBondContact O-CB 2.9Å; I200-Q204 PolarHBondContact O-N 3.26Å; K201-Q204 PolarHBondContact O-N 3.3Å; S202-Q204 VanDerWaalsContact C-N 3.33Å; S202-Q204 PolarHBondContact O-N 3.35Å; Q204-M206 VanDerWaalsContact C-N 3.29Å; Q204-M206 PolarHBondContact O-N 3.47Å; Q204-K207 PolarHBondContact O-N 2.99Å; Q204-Q208 WeakPolarHBondContact O-CG 3.43Å; Q204-Q208 PolarHBondContact O-N 3.29Å
205S81Confident83.1Confident57 Ų57100.4 Ų100.440%0.39949%0.491SS..Hα-helixtrans-61-40.9176-169.40000111.2K201 S202 K207 Q208 I209K201-S205 WeakPolarHBondContact O-CB 3.48Å; K201-S205 PolarHBondContact O-N 3.27Å; S202-S205 PolarHBondContact O-N 3.47Å; S205-K207 VanDerWaalsContact C-N 3.34Å; S205-K207 PolarHBondContact O-N 2.79Å; S205-Q208 PolarHBondContact O-N 3.48Å; S205-I209 WeakPolarHBondContact O-CB 3.38Å; S205-I209 VanDerWaalsContact O-CG1 3.23Å; S205-I209 WeakPolarHBondContact O-CG1 3.44Å; S205-I209 PolarHBondContact O-N 2.78Å
206M82Confident83.6Confident99 Ų9997.8 Ų97.849%0.48849%0.491SS..Hα-helixtrans-62.4-41.5177.7-170.265.9-174.900111.4S202 Q204 I209 Q210S202-M206 VanDerWaalsContact O-CB 3.29Å; S202-M206 WeakPolarHBondContact O-CB 3.34Å; S202-M206 PolarHBondContact O-N 3.3Å; Q204-M206 VanDerWaalsContact C-N 3.29Å; Q204-M206 PolarHBondContact O-N 3.47Å; M206-I209 PolarHBondContact O-N 3.48Å; M206-Q210 HydrophobicContact CE-CG 4.36Å; M206-Q210 WeakPolarHBondContact O-CB 3.35Å; M206-Q210 VanDerWaalsContact O-CG 3.26Å; M206-Q210 WeakPolarHBondContact O-CG 3.38Å; M206-Q210 PolarHBondContact O-N 3.29Å
207K85Confident84.4Confident113 Ų11397.2 Ų97.249%0.49149%0.493SS..Hα-helixtrans-62.7-45.1174.4-74.5-179.2173.4-160.40112.3K203 Q204 S205 I209 Q210 E211K203-K207 WeakPolarHBondContact O-CG 3.32Å; K203-K207 PolarHBondContact O-N 3Å; K203-K207 VanDerWaalsContact O-N 3.13Å; Q204-K207 PolarHBondContact O-N 2.99Å; S205-K207 VanDerWaalsContact C-N 3.34Å; S205-K207 PolarHBondContact O-N 2.79Å; K207-I209 VanDerWaalsContact C-N 3.31Å; K207-I209 PolarHBondContact O-N 3.37Å; K207-Q210 PolarHBondContact O-N 3.13Å; K207-E211 WeakPolarHBondContact O-CG 3.38Å; K207-E211 PolarHBondContact O-N 3.47Å
208Q88Confident85.3Confident104 Ų10499.9 Ų99.949%0.48650%0.503SS..Hα-helixtrans-63.5-38.8178-70.1-177.6-46.200111.9Q204 S205 L212Q204-Q208 WeakPolarHBondContact O-CG 3.43Å; Q204-Q208 PolarHBondContact O-N 3.29Å; S205-Q208 PolarHBondContact O-N 3.48Å; Q208-L212 WeakPolarHBondContact O-CB 3.45Å; Q208-L212 WeakPolarHBondContact O-CG 2.93Å; Q208-L212 PolarHBondContact O-N 3.35Å
209I87.2Confident86Confident87 Ų8798.2 Ų98.245%0.44650%0.496SS..Hα-helixtrans-65.7-42.2174.2-68.4164.9000110.5S205 M206 K207 L212 Q213S205-I209 WeakPolarHBondContact O-CB 3.38Å; S205-I209 VanDerWaalsContact O-CG1 3.23Å; S205-I209 WeakPolarHBondContact O-CG1 3.44Å; S205-I209 PolarHBondContact O-N 2.78Å; M206-I209 PolarHBondContact O-N 3.48Å; K207-I209 VanDerWaalsContact C-N 3.31Å; K207-I209 PolarHBondContact O-N 3.37Å; I209-L212 PolarHBondContact O-N 3.44Å; I209-Q213 VanDerWaalsContact O-CB 3.23Å; I209-Q213 WeakPolarHBondContact O-CB 3.39Å; I209-Q213 PolarHBondContact O-N 3.23Å
210Q89.2Confident86.8Confident104 Ų10495.6 Ų95.649%0.48649%0.488SS..Hα-helixtrans-63.8-42.2176.7-77176.8-26.500112.5M206 K207 Q213 Q214M206-Q210 HydrophobicContact CE-CG 4.36Å; M206-Q210 WeakPolarHBondContact O-CB 3.35Å; M206-Q210 VanDerWaalsContact O-CG 3.26Å; M206-Q210 WeakPolarHBondContact O-CG 3.38Å; M206-Q210 PolarHBondContact O-N 3.29Å; K207-Q210 PolarHBondContact O-N 3.13Å; Q210-Q213 PolarHBondContact O-N 2.78Å; Q210-Q214 WeakPolarHBondContact O-CB 2.83Å; Q210-Q214 PolarHBondContact O-N 2.76Å
211E89.6Confident87.5Confident121 Ų12197 Ų9757%0.56549%0.493SS*.Hα-helixtrans-62.6-45.4175.2-73.7169.2-167.600111.1K207 Q214 V215K207-E211 WeakPolarHBondContact O-CG 3.38Å; K207-E211 PolarHBondContact O-N 3.47Å; E211-Q214 PolarHBondContact O-N 3.4Å; E211-V215 WeakPolarHBondContact O-CG2 3.3Å; E211-V215 PolarHBondContact O-N 3.07Å; E211-V215 VanDerWaalsContact O-N 3.1Å
212L88.1Confident88.4Confident120 Ų12099.5 Ų99.563%0.62850%0.5SS*.Hα-helixtrans-64.2-42.3175.7-76.4166.2000112.2Q208 I209 Q214 V215 C216Q208-L212 WeakPolarHBondContact O-CB 3.45Å; Q208-L212 WeakPolarHBondContact O-CG 2.93Å; Q208-L212 PolarHBondContact O-N 3.35Å; I209-L212 PolarHBondContact O-N 3.44Å; L212-Q214 VanDerWaalsContact C-N 3.31Å; L212-Q214 PolarHBondContact O-N 2.82Å; L212-V215 PolarHBondContact O-N 3.03Å; L212-C216 PolarHBondContact O-N 3.23Å
213Q91.2Very high89.1Confident111 Ų111100.2 Ų100.252%0.51950%0.497SS..Hα-helixtrans-64.7-37177.6-173.5176-1800111.5I209 Q210 C216 N217I209-Q213 VanDerWaalsContact O-CB 3.23Å; I209-Q213 WeakPolarHBondContact O-CB 3.39Å; I209-Q213 PolarHBondContact O-N 3.23Å; Q210-Q213 PolarHBondContact O-N 2.78Å; Q213-C216 PolarHBondContact O-N 3.47Å; Q213-N217 WeakPolarHBondContact O-CB 3.29Å; Q213-N217 PolarHBondContact O-N 2.94Å; Q213-N217 PolarHBondContact O-OD1 3.31Å
214Q93.5Very high89.9Confident134 Ų13498.7 Ų98.763%0.62650%0.495SS*.Hα-helixtrans-62.4-44.5173.7-177.2178.9-12.900111.4Q210 E211 L212 N217 E218Q210-Q214 WeakPolarHBondContact O-CB 2.83Å; Q210-Q214 PolarHBondContact O-N 2.76Å; E211-Q214 PolarHBondContact O-N 3.4Å; L212-Q214 VanDerWaalsContact C-N 3.31Å; L212-Q214 PolarHBondContact O-N 2.82Å; Q214-N217 PolarHBondContact O-N 2.98Å; Q214-E218 WeakPolarHBondContact O-CB 3.01Å; Q214-E218 PolarHBondContact O-N 3.44Å
215V92.1Very high90.5Very high85 Ų8599.1 Ų99.152%0.51550%0.497SS..Hα-helixtrans-65.5-37.4177173.90000111.9E211 L212 S219E211-V215 WeakPolarHBondContact O-CG2 3.3Å; E211-V215 PolarHBondContact O-N 3.07Å; E211-V215 VanDerWaalsContact O-N 3.1Å; L212-V215 PolarHBondContact O-N 3.03Å; V215-S219 WeakPolarHBondContact O-CB 3.33Å; V215-S219 PolarHBondContact O-N 3.46Å; V215-S219 PolarHBondContact O-OG 3.46Å
216C91.3Very high91Very high72 Ų72102 Ų10249%0.48651%0.507SS..Hα-helixtrans-63.1-49.5172.5-77.20000111.6L212 Q213 E218 S219 D220L212-C216 PolarHBondContact O-N 3.23Å; Q213-C216 PolarHBondContact O-N 3.47Å; C216-E218 VanDerWaalsContact C-N 3.3Å; C216-E218 PolarHBondContact O-N 2.67Å; C216-S219 WeakPolarHBondContact O-CB 3.14Å; C216-S219 PolarHBondContact O-N 3.13Å; C216-D220 PolarHBondContact O-N 3.44Å
217N93.8Very high91.5Very high83 Ų83102.1 Ų102.144%0.44451%0.506SS..Hα-helixtrans-60.1-39.6178.9-69.6-8.7000112.3Q213 Q214 S219 D220 Q221Q213-N217 WeakPolarHBondContact O-CB 3.29Å; Q213-N217 PolarHBondContact O-N 2.94Å; Q213-N217 PolarHBondContact O-OD1 3.31Å; Q214-N217 PolarHBondContact O-N 2.98Å; N217-S219 VanDerWaalsContact C-N 3.32Å; N217-D220 PolarHBondContact O-N 3.4Å; N217-Q221 WeakPolarHBondContact O-CG 3.25Å; N217-Q221 PolarHBondContact O-N 3.47Å
218E94.3Very high91.9Very high80 Ų80101.2 Ų101.237%0.37451%0.511SS..Hα-helixtrans-64.7-37.8175.2-173.3-176.5159.400111.7Q214 C216 R222Q214-E218 WeakPolarHBondContact O-CB 3.01Å; Q214-E218 PolarHBondContact O-N 3.44Å; C216-E218 VanDerWaalsContact C-N 3.3Å; C216-E218 PolarHBondContact O-N 2.67Å; E218-R222 WeakPolarHBondContact O-CG 3.46Å; E218-R222 PolarHBondContact O-N 2.95Å; E218-R222 VanDerWaalsContact O-N 3.17Å; E218-R222 IonicContact OE1-CZ 3.32Å; E218-R222 VanDerWaalsContact OE1-CZ 3.32Å; E218-R222 IonicContact OE1-NE 3.83Å; E218-R222 IonicContact OE1-NH2 2.65Å; E218-R222 PolarHBondContact OE1-NH2 2.87Å
219S91.2Very high92.2Very high54 Ų54100.8 Ų100.838%0.37851%0.511SS..Hα-helixtrans-69.1-42.7177.3-57.80000111.8V215 C216 N217 Q221 R222 I223V215-S219 WeakPolarHBondContact O-CB 3.33Å; V215-S219 PolarHBondContact O-N 3.46Å; V215-S219 PolarHBondContact O-OG 3.46Å; C216-S219 WeakPolarHBondContact O-CB 3.14Å; C216-S219 PolarHBondContact O-N 3.13Å; N217-S219 VanDerWaalsContact C-N 3.32Å; S219-Q221 VanDerWaalsContact C-N 3.32Å; S219-Q221 PolarHBondContact O-N 2.98Å; S219-R222 PolarHBondContact O-N 2.97Å; S219-I223 WeakPolarHBondContact O-CG1 2.98Å; S219-I223 PolarHBondContact O-N 3.46Å
220D93Very high92.5Very high86 Ų86101.8 Ų101.846%0.4652%0.516SS..Hα-helixtrans-62.9-38.8176.1-71.3-21.4000111.4C216 N217 R222 I223 N224C216-D220 PolarHBondContact O-N 3.44Å; N217-D220 PolarHBondContact O-N 3.4Å; D220-R222 PolarHBondContact O-N 2.82Å; D220-I223 PolarHBondContact O-N 3.38Å; D220-N224 WeakPolarHBondContact O-CB 3.36Å; D220-N224 VanDerWaalsContact O-CG 3.23Å; D220-N224 PolarHBondContact O-N 2.88Å; D220-N224 PolarHBondContact O-ND2 3.37Å
221Q93.7Very high92.6Very high129 Ų129102.4 Ų102.460%0.60352%0.519SS*.Hα-helixtrans-61.4-43173.7-77.3179.6-9.800112.4N217 S219 N224 Q225N217-Q221 WeakPolarHBondContact O-CG 3.25Å; N217-Q221 PolarHBondContact O-N 3.47Å; S219-Q221 VanDerWaalsContact C-N 3.32Å; S219-Q221 PolarHBondContact O-N 2.98Å; Q221-N224 PolarHBondContact O-N 2.8Å; Q221-Q225 VanDerWaalsContact O-CG 3.29Å; Q221-Q225 WeakPolarHBondContact O-CG 2.78Å; Q221-Q225 PolarHBondContact O-N 3.18Å
222R94.1Very high92.7Very high144 Ų144101 Ų10154%0.54351%0.512SS..Hα-helixtrans-64.8-41.2177-71.4176.9-178.9177.24111.6E218 S219 D220 Q225 L226E218-R222 WeakPolarHBondContact O-CG 3.46Å; E218-R222 PolarHBondContact O-N 2.95Å; E218-R222 VanDerWaalsContact O-N 3.17Å; E218-R222 IonicContact OE1-CZ 3.32Å; E218-R222 VanDerWaalsContact OE1-CZ 3.32Å; E218-R222 IonicContact OE1-NE 3.83Å; E218-R222 IonicContact OE1-NH2 2.65Å; E218-R222 PolarHBondContact OE1-NH2 2.87Å; S219-R222 PolarHBondContact O-N 2.97Å; D220-R222 PolarHBondContact O-N 2.82Å; R222-Q225 PolarHBondContact O-N 3.1Å; R222-L226 WeakPolarHBondContact O-CD1 3.28Å; R222-L226 PolarHBondContact O-N 2.72Å
223I93.2Very high92.8Very high86 Ų8699.9 Ų99.944%0.44150%0.504SS..Hα-helixtrans-62.4-49.2176.6-67.1167000110.1S219 D220 Q225 L226 E227S219-I223 WeakPolarHBondContact O-CG1 2.98Å; S219-I223 PolarHBondContact O-N 3.46Å; D220-I223 PolarHBondContact O-N 3.38Å; I223-Q225 VanDerWaalsContact C-N 3.31Å; I223-Q225 PolarHBondContact O-N 2.75Å; I223-L226 CarbonylContact O-C 3.46Å; I223-L226 PolarHBondContact O-N 2.73Å; I223-L226 VanDerWaalsContact O-N 3.07Å; I223-E227 HydrophobicContact CG2-CG 4.26Å; I223-E227 WeakPolarHBondContact O-CG 3.36Å; I223-E227 PolarHBondContact O-N 3.46Å
224N93.9Very high92.7Very high91 Ų9198.3 Ų98.349%0.48750%0.498SS..Hα-helixtrans-60.9-37.5179-69.7-19.6000112.8D220 Q221 E227 T228D220-N224 WeakPolarHBondContact O-CB 3.36Å; D220-N224 VanDerWaalsContact O-CG 3.23Å; D220-N224 PolarHBondContact O-N 2.88Å; D220-N224 PolarHBondContact O-ND2 3.37Å; Q221-N224 PolarHBondContact O-N 2.8Å; N224-E227 PolarHBondContact O-N 2.89Å; N224-T228 WeakPolarHBondContact O-CB 3.36Å; N224-T228 PolarHBondContact O-N 2.86Å; N224-T228 PolarHBondContact O-OG1 2.82Å
225Q94Very high92.5Very high121 Ų12196.2 Ų96.257%0.56549%0.491SS*.Hα-helixtrans-63.1-45.5173.2-76.4176.7-2100111.6Q221 R222 I223 T228 I229Q221-Q225 VanDerWaalsContact O-CG 3.29Å; Q221-Q225 WeakPolarHBondContact O-CG 2.78Å; Q221-Q225 PolarHBondContact O-N 3.18Å; R222-Q225 PolarHBondContact O-N 3.1Å; I223-Q225 VanDerWaalsContact C-N 3.31Å; I223-Q225 PolarHBondContact O-N 2.75Å; Q225-T228 PolarHBondContact O-N 2.86Å; Q225-I229 VanDerWaalsContact O-CG1 3.31Å; Q225-I229 WeakPolarHBondContact O-CG1 3.04Å; Q225-I229 PolarHBondContact O-N 3.35Å
226L93.2Very high92.1Very high118 Ų11897.2 Ų97.262%0.61849%0.486SS*.Hα-helixtrans-64.3-40.8176.9-92.876.8000111.7R222 I223 I229 L230R222-L226 WeakPolarHBondContact O-CD1 3.28Å; R222-L226 PolarHBondContact O-N 2.72Å; I223-L226 CarbonylContact O-C 3.46Å; I223-L226 PolarHBondContact O-N 2.73Å; I223-L226 VanDerWaalsContact O-N 3.07Å; L226-I229 PolarHBondContact O-N 3.07Å; L226-L230 WeakPolarHBondContact O-CB 3.25Å; L226-L230 PolarHBondContact O-N 2.86Å
227E92.7Very high91.9Very high101 Ų101100.5 Ų100.547%0.47249%0.492SS..Hα-helixtrans-62.9-41.5175.7-73.8-179.1176.800111.7I223 N224 L230 H231I223-E227 HydrophobicContact CG2-CG 4.26Å; I223-E227 WeakPolarHBondContact O-CG 3.36Å; I223-E227 PolarHBondContact O-N 3.46Å; N224-E227 PolarHBondContact O-N 2.89Å; E227-L230 PolarHBondContact O-N 3.36Å; E227-H231 PolarHBondContact O-CD2 3.06Å; E227-H231 VanDerWaalsContact O-CD2 3.29Å; E227-H231 PolarHBondContact O-N 2.81Å
228T93Very high91.4Very high95 Ų95100.6 Ų100.658%0.58349%0.493SS*.Hα-helixtrans-64-45.5176.8-54.20000111.4N224 Q225 L230 H231 E232N224-T228 WeakPolarHBondContact O-CB 3.36Å; N224-T228 PolarHBondContact O-N 2.86Å; N224-T228 PolarHBondContact O-OG1 2.82Å; Q225-T228 PolarHBondContact O-N 2.86Å; T228-L230 VanDerWaalsContact C-N 3.31Å; T228-L230 PolarHBondContact O-N 2.68Å; T228-H231 PolarHBondContact O-N 3.33Å; T228-E232 PolarHBondContact O-N 3.42Å
229I94Very high90.7Very high94 Ų94102.7 Ų102.748%0.48251%0.506SS..Hα-helixtrans-62.7-40.9176.5-66.6165.6000110.2Q225 L226 E232 Q233Q225-I229 VanDerWaalsContact O-CG1 3.31Å; Q225-I229 WeakPolarHBondContact O-CG1 3.04Å; Q225-I229 PolarHBondContact O-N 3.35Å; L226-I229 PolarHBondContact O-N 3.07Å; I229-E232 PolarHBondContact O-N 3.45Å; I229-Q233 VanDerWaalsContact O-CG 3.25Å; I229-Q233 WeakPolarHBondContact O-CG 3.29Å; I229-Q233 PolarHBondContact O-N 3.33Å
230L92.4Very high89.7Confident109 Ų109106.1 Ų106.157%0.57152%0.52SS*.Hα-helixtrans-64-45.1178.4-169.674000111.5L226 E227 T228 E232 Q233 I234L226-L230 WeakPolarHBondContact O-CB 3.25Å; L226-L230 PolarHBondContact O-N 2.86Å; E227-L230 PolarHBondContact O-N 3.36Å; T228-L230 VanDerWaalsContact C-N 3.31Å; T228-L230 PolarHBondContact O-N 2.68Å; L230-E232 PolarHBondContact O-N 3.13Å; L230-Q233 PolarHBondContact O-N 3.35Å; L230-I234 HydrophobicContact CG-CD1 4.18Å; L230-I234 WeakPolarHBondContact O-CG1 3.48Å; L230-I234 PolarHBondContact O-N 2.9Å
231H91.2Very high88.3Confident117 Ų117110.3 Ų110.354%0.54253%0.529SS..Hα-helixtrans-59.5-44.5175-86.9-65.1000112E227 T228 Q233 I234 D235E227-H231 PolarHBondContact O-CD2 3.06Å; E227-H231 VanDerWaalsContact O-CD2 3.29Å; E227-H231 PolarHBondContact O-N 2.81Å; T228-H231 PolarHBondContact O-N 3.33Å; H231-Q233 VanDerWaalsContact C-N 3.29Å; H231-Q233 PolarHBondContact O-N 3.31Å; H231-I234 PolarHBondContact O-N 3.23Å; H231-I234 VanDerWaalsContact O-N 3.16Å; H231-D235 PolarHBondContact O-N 3.5Å
232E91.7Very high86.5Confident90 Ų90108.8 Ų108.842%0.42153%0.531SS..Hα-helixtrans-61.6-36.4177.1-165.8-165.5170.600112.4T228 I229 L230 R236T228-E232 PolarHBondContact O-N 3.42Å; I229-E232 PolarHBondContact O-N 3.45Å; L230-E232 PolarHBondContact O-N 3.13Å; E232-R236 WeakPolarHBondContact O-CB 3.09Å; E232-R236 WeakPolarHBondContact O-CG 3.21Å; E232-R236 PolarHBondContact O-N 3.39Å; E232-R236 IonicContact OE1-CZ 3.19Å; E232-R236 IonicContact OE1-NH1 2.68Å; E232-R236 PolarHBondContact OE1-NH1 2.72Å; E232-R236 IonicContact OE1-NH2 3.03Å; E232-R236 PolarHBondContact OE1-NH2 3.2Å; E232-R236 IonicContact OE2-NH2 3.32Å; E232-R236 PolarHBondContact OE2-NH2 3.48Å
233Q90.6Very high84.6Confident98 Ų98108.8 Ų108.846%0.45854%0.54SS..Hα-helixtrans-70.7-37.5176-66.7-65.2-29.500112.3I229 L230 H231 K237I229-Q233 VanDerWaalsContact O-CG 3.25Å; I229-Q233 WeakPolarHBondContact O-CG 3.29Å; I229-Q233 PolarHBondContact O-N 3.33Å; L230-Q233 PolarHBondContact O-N 3.35Å; H231-Q233 VanDerWaalsContact C-N 3.29Å; H231-Q233 PolarHBondContact O-N 3.31Å; Q233-K237 WeakPolarHBondContact O-CB 3.41Å; Q233-K237 PolarHBondContact O-N 2.93Å
234I90.4Very high82.8Confident77 Ų77109.3 Ų109.340%0.39555%0.551SS.*Hα-helixtrans-64.6-48.9174.5-67.7166000109.6L230 H231 R236 K237 D238L230-I234 HydrophobicContact CG-CD1 4.18Å; L230-I234 WeakPolarHBondContact O-CG1 3.48Å; L230-I234 PolarHBondContact O-N 2.9Å; H231-I234 PolarHBondContact O-N 3.23Å; H231-I234 VanDerWaalsContact O-N 3.16Å; I234-R236 PolarHBondContact O-N 2.65Å; I234-K237 WeakPolarHBondContact O-CB 3.28Å; I234-K237 PolarHBondContact O-N 2.65Å; I234-K237 VanDerWaalsContact O-N 3.08Å; I234-D238 PolarHBondContact O-N 3.47Å
235D87.6Confident80.8Confident90 Ų90112.2 Ų112.248%0.48157%0.567SS.*Hα-helixtrans-62.3-40.9178.2-71.7-16.2000112.2H231 K237 D238 N239H231-D235 PolarHBondContact O-N 3.5Å; D235-K237 VanDerWaalsContact C-N 3.34Å; D235-K237 PolarHBondContact O-N 3.3Å; D235-D238 PolarHBondContact O-N 2.87Å; D235-N239 WeakPolarHBondContact O-CB 3.1Å; D235-N239 PolarHBondContact O-N 3.03Å; D235-N239 PolarHBondContact O-ND2 3.35Å
236R85.6Confident78.6Confident107 Ų107111.7 Ų111.740%0.40457%0.571SS.*Hα-helixtrans-59.7-45.9172.3-85.7-160.1-85-98.5-9.6111.1E232 I234 D238 N239 L240E232-R236 WeakPolarHBondContact O-CB 3.09Å; E232-R236 WeakPolarHBondContact O-CG 3.21Å; E232-R236 PolarHBondContact O-N 3.39Å; E232-R236 IonicContact OE1-CZ 3.19Å; E232-R236 IonicContact OE1-NH1 2.68Å; E232-R236 PolarHBondContact OE1-NH1 2.72Å; E232-R236 IonicContact OE1-NH2 3.03Å; E232-R236 PolarHBondContact OE1-NH2 3.2Å; E232-R236 IonicContact OE2-NH2 3.32Å; E232-R236 PolarHBondContact OE2-NH2 3.48Å; I234-R236 PolarHBondContact O-N 2.65Å; R236-D238 VanDerWaalsContact C-N 3.33Å; R236-D238 PolarHBondContact O-N 2.85Å; R236-N239 PolarHBondContact O-N 3.4Å; R236-L240 WeakPolarHBondContact O-CD1 3.17Å; R236-L240 PolarHBondContact O-N 2.74Å
237K85.6Confident76.2Confident140 Ų140111.9 Ų111.961%0.60958%0.578SS**Hα-helixtrans-63.3-39.2-179.6-175.3-179.8177.7-178.40112.3Q233 I234 D235 R241Q233-K237 WeakPolarHBondContact O-CB 3.41Å; Q233-K237 PolarHBondContact O-N 2.93Å; I234-K237 WeakPolarHBondContact O-CB 3.28Å; I234-K237 PolarHBondContact O-N 2.65Å; I234-K237 VanDerWaalsContact O-N 3.08Å; D235-K237 VanDerWaalsContact C-N 3.34Å; D235-K237 PolarHBondContact O-N 3.3Å; K237-R241 PolarHBondContact O-N 2.92Å
238D84.4Confident73.8Confident86 Ų86112.2 Ų112.246%0.4659%0.591SS.*Hα-helixtrans-73.3-37.1178.6-71.4-21.9000111.9I234 D235 R236 L240 R241I234-D238 PolarHBondContact O-N 3.47Å; D235-D238 PolarHBondContact O-N 2.87Å; R236-D238 VanDerWaalsContact C-N 3.33Å; R236-D238 PolarHBondContact O-N 2.85Å; D238-L240 PolarHBondContact O-N 3.25Å; D238-R241 WeakPolarHBondContact O-CB 3.3Å; D238-R241 PolarHBondContact O-N 3.11Å
239N78.2Confident71.2Confident123 Ų123114.9 Ų114.966%0.65860%0.602SS**Hα-helixtrans-69-27.6173.5-76.9-52.6000114D235 R236 R241 P242D235-N239 WeakPolarHBondContact O-CB 3.1Å; D235-N239 PolarHBondContact O-N 3.03Å; D235-N239 PolarHBondContact O-ND2 3.35Å; R236-N239 PolarHBondContact O-N 3.4Å; N239-R241 VanDerWaalsContact C-N 3.31Å; N239-P242 WeakPolarHBondContact O-CD 2.88Å
240L71.3Confident68.7Low126 Ų126117.1 Ų117.166%0.6662%0.615SS**THydrogen-bonded Turntrans-79.2-12.9174.8-91.883.8000113.2R236 D238 P242R236-L240 WeakPolarHBondContact O-CD1 3.17Å; R236-L240 PolarHBondContact O-N 2.74Å; D238-L240 PolarHBondContact O-N 3.25Å; L240-P242 VanDerWaalsContact C-CD 3.47Å
241R62.9Low66.2Low174 Ų174120.3 Ų120.366%0.65762%0.624SS**THydrogen-bonded Turntrans-73.7-19.4-176.9-117.1177.4-176.4-173.2-2.1117K237 D238 N239K237-R241 PolarHBondContact O-N 2.92Å; D238-R241 WeakPolarHBondContact O-CB 3.3Å; D238-R241 PolarHBondContact O-N 3.11Å; N239-R241 VanDerWaalsContact C-N 3.31Å
242P55.8Low63.4Low98 Ų98124.1 Ų124.164%0.63664%0.642SS**THydrogen-bonded Turntrans-80.8-14.6179.1-13.329.4000115.6N239 L240N239-P242 WeakPolarHBondContact O-CD 2.88Å; L240-P242 VanDerWaalsContact C-CD 3.47Å
243I55.9Low60.8Low143 Ų143123.3 Ų123.373%0.73366%0.658SS**SBendtrans-96.8-18.6-169-62.1177.2000113.7
244S54.7Low58.2Low97 Ų97127.2 Ų127.268%0.67868%0.676SS**THydrogen-bonded Turntrans-96.910.8-17553.10000115.9V246S244-V246 VanDerWaalsContact C-N 3.31Å
245N51Low55.5Low153 Ų153132.2 Ų132.282%0.81870%0.698SS**THydrogen-bonded Turntrans-9111.1166.6-75.21.4000113.2
246V48.6Very low53.1Low109 Ų109137.5 Ų137.566%0.66172%0.72SS**SBendtrans-125.5122.8175-177.30000108.8S244S244-V246 VanDerWaalsContact C-N 3.31Å
247T42.8Very low50.6Low123 Ų123139.1 Ų139.176%0.75574%0.741SS**  trans80.988.8172.8-39.30000114.6
248S42.6Very low48.2Very low108 Ų108144.2 Ų144.276%0.75576%0.757SS**  10512866.4-86.30000111.6
249D39.1Very low46.2Very low150 Ų150145.7 Ų145.780%0.80277%0.771SS**  trans4114.3145.3-68.9-45.4000117.2
250N39.8Very low44.1Very low141 Ų141149 Ų14975%0.75479%0.785SS**  179.4137.1111.2-113.6-42.1000113.2
251K39.6Very low42.7Very low176 Ų176147.2 Ų147.277%0.76578%0.783SS**  trans72.890.3149.6-63.8-178.9-176.8-176.30119
252Q34.2Very low41.5Very low198 Ų198148.9 Ų148.993%0.92580%0.795SS**  21119.9113.9-67.7178.4-1400117.6
253G35.6Very low40.8Very low73 Ų73148.8 Ų148.875%0.75379%0.793SS**  trans166.191.1160.400000114.6
254Q37.2Very low39.7Very low180 Ų180148.9 Ų148.984%0.84180%0.795SS**  trans49.2105.5153.4-73.9174.1-35.900119.5
255Q33.9Very low39.1Very low181 Ų181154.6 Ų154.685%0.84680%0.803SS**  62.695.792.9-78-176.1-5.400115.7
256Q37.4Very low38.7Very low202 Ų202151.1 Ų151.194%0.94479%0.791SS**  -155.3104.3124.1-128.1168.59.400110.9
257T32Very low38.3Very low140 Ų140153.3 Ų153.386%0.85980%0.799SS**  trans-74.7125.2171.237.80000110.8
258R36Very low38.1Very low247 Ų247158.9 Ų158.993%0.93281%0.806SS**  trans-136.9118.8151.6-133.5-177.7-170.6-177.33.5109
259P42Very low38.2Very low118 Ų118159.2 Ų159.277%0.76681%0.805SS**  trans-95.4133.4-176.634.8-28.8000110.6
260M34.1Very low38.4Very low191 Ų191159.5 Ų159.594%0.94181%0.805SS**  trans-166.7139.1152.2-86.2-138.5177.900106.4
261S41.5Very low38.5Very low90 Ų90158.4 Ų158.463%0.62981%0.806SS**  cis-162.3125.6-4.2169.70000103.3V263S261-V263 PolarHBondContact O-N 3.24Å
262K37.9Very low38.5Very low208 Ų208161 Ų16190%0.90481%0.811SS**  trans-65.2101168.3-96.2179.5174.9176.70106.8N264K262-N264 VanDerWaalsContact C-N 3.33Å; K262-N264 PolarHBondContact O-N 2.8Å
263V41.5Very low38.6Very low97 Ų97160.2 Ų160.259%0.58881%0.807SS**  trans-70.997.8168-174.90000106.8S261 Y265S261-V263 PolarHBondContact O-N 3.24Å; V263-Y265 HydrophobicContact CB-CD2 4.38Å; V263-Y265 HydrophobicContact CB-CE2 4Å; V263-Y265 HydrophobicContact CG1-CD2 3.75Å; V263-Y265 HydrophobicContact CG1-CE1 4.27Å; V263-Y265 HydrophobicContact CG1-CE2 3.33Å; V263-Y265 HydrophobicContact CG1-CG 4.38Å; V263-Y265 PolarHBondContact O-N 3.48Å
264N32.9Very low38.9Very low145 Ų145166.6 Ų166.678%0.77582%0.815SS**  trans-77.696.1175.5-150.614.2000107.5K262 S266K262-N264 VanDerWaalsContact C-N 3.33Å; K262-N264 PolarHBondContact O-N 2.8Å; N264-S266 PolarHBondContact O-N 3.36Å
265Y41.5Very low39.1Very low216 Ų216162.6 Ų162.685%0.84781%0.806SS**  trans-7879.1169.5-72.5-83.7000108.7V263V263-Y265 HydrophobicContact CB-CD2 4.38Å; V263-Y265 HydrophobicContact CB-CE2 4Å; V263-Y265 HydrophobicContact CG1-CD2 3.75Å; V263-Y265 HydrophobicContact CG1-CE1 4.27Å; V263-Y265 HydrophobicContact CG1-CE2 3.33Å; V263-Y265 HydrophobicContact CG1-CG 4.38Å; V263-Y265 PolarHBondContact O-N 3.48Å
266S42.7Very low39.2Very low81 Ų81158.9 Ų158.957%0.56680%0.8SS**  trans-133.1124163-1700000107.6N264N264-S266 PolarHBondContact O-N 3.36Å
267N40.8Very low39.2Very low154 Ų154154.7 Ų154.782%0.82479%0.789SS**  trans84.582.3175.5-53.5-28000116.9
268R38.9Very low39.4Very low240 Ų240156.2 Ų156.291%0.90679%0.786SS**  trans-128.2148.2134.7-94.5-162.5-170.7-165.13.8111
269P43Very low39.6Very low115 Ų115159.9 Ų159.975%0.74780%0.8SS**  trans-84144-149.2-1.719.9000111.5
270I43.2Very low39.5Very low156 Ų156162 Ų16280%0.880%0.802SS**  trans-45.6124.3164.9-61.6163.5000108.5R272I270-R272 PolarHBondContact O-N 3.31Å
271P43.2Very low39.8Very low118 Ų118160.4 Ų160.477%0.76679%0.794SS**  trans-59.1112.7173-18.330000108.1Q273P271-Q273 PolarHBondContact O-N 2.84Å; P271-Q273 VanDerWaalsContact O-N 3.09Å
272R38.9Very low39.7Very low231 Ų231164.3 Ų164.387%0.87280%0.804SS**  trans-53.3119.2170.8-80.4-179.2179.2160.3-0.4107.8I270 F274I270-R272 PolarHBondContact O-N 3.31Å; R272-F274 PolarHBondContact O-N 3.31Å
273Q37.7Very low39.8Very low181 Ų181161.8 Ų161.885%0.84680%0.798SS**  trans-47.6114159.6-70.3-176.2-22.900107.7P271 S275P271-Q273 PolarHBondContact O-N 2.84Å; P271-Q273 VanDerWaalsContact O-N 3.09Å; Q273-S275 PolarHBondContact O-N 3.46Å
274F41.6Very low39.7Very low208 Ų208165.8 Ų165.891%0.91281%0.811SS**  trans-72.783.7160.8-96.5-86.6000106.5R272 S276R272-F274 PolarHBondContact O-N 3.31Å; F274-S276 PolarHBondContact O-N 3.44Å
275S41.4Very low40.1Very low95 Ų95167.2 Ų167.266%0.66481%0.813SS**  trans-61.6129.4154.648.70000107.7Q273Q273-S275 PolarHBondContact O-N 3.46Å
276S35Very low40Very low103 Ų103163.7 Ų163.772%0.7281%0.811SS**  trans-36142.2153.146.10000111.6F274F274-S276 PolarHBondContact O-N 3.44Å
277T37.7Very low39.8Very low115 Ų115170.1 Ų170.171%0.70683%0.83SS**  166.7135.2126.7-64.10000111.4
278E35.8Very low39.7Very low172 Ų172171.4 Ų171.480%0.80483%0.83SS**  trans7295.2155.6-80.2170.8147.300122.4
279R40.6Very low39.8Very low323 Ų323165.2 Ų165.2100%1.21982%0.823SS**  175.5092.4-96.2-171.8-139170.96.5111.4

Retrieved 279 of 279 residues in 118.8 ms (Link to these results)