A0A087XKS3_POEFO Loading...

CD99 antigen-like protein 2

AlphaFold DB , UniProt , Accession A0A087XKS3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 229 aa.

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

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
1M54.9Low68.8Low207 Ų207131.6 Ų131.6100%1.0266%0.662SS**  0-42.60-73.4-174.8174.100114T3 F4M1-T3 PolarHBondContact O-N 3.37Å; M1-F4 PolarHBondContact O-N 3.43Å
2L52.4Low70Confident157 Ų157126.4 Ų126.482%0.82264%0.641SS**Hα-helixtrans-57.2-42.5-178-114.168000114.7F4 R5 S6L2-F4 PolarHBondContact O-N 3.43Å; L2-R5 PolarHBondContact O-N 3.18Å; L2-S6 PolarHBondContact O-N 3.08Å
3T56.8Low70.6Confident106 Ų106124.4 Ų124.465%0.6563%0.632SS**Hα-helixtrans-62.3-39.6-178.847.60000113.4M1 R5 S6 V7M1-T3 PolarHBondContact O-N 3.37Å; T3-R5 VanDerWaalsContact C-N 3.32Å; T3-R5 PolarHBondContact O-N 2.95Å; T3-S6 WeakPolarHBondContact O-CB 3.37Å; T3-S6 PolarHBondContact O-N 2.95Å; T3-V7 WeakPolarHBondContact O-CG2 3.49Å; T3-V7 PolarHBondContact O-N 2.8Å
4F57.6Low71.2Confident167 Ų167120 Ų12073%0.73262%0.624SS**Hα-helixtrans-63.1-37.8179.9-122.1-88.8000112.5M1 L2 W8M1-F4 PolarHBondContact O-N 3.43Å; L2-F4 PolarHBondContact O-N 3.43Å; F4-W8 WeakPolarHBondContact O-CB 3.5Å; F4-W8 PolarHBondContact O-N 2.95Å; F4-W8 VanDerWaalsContact O-N 3.1Å
5R69.1Low71.4Confident199 Ų199120.4 Ų120.475%0.75163%0.627SS**Hα-helixtrans-68.5-39.8175.3-58.6-172.777.6152.53.4111.2L2 T3 W8 T9L2-R5 PolarHBondContact O-N 3.18Å; T3-R5 VanDerWaalsContact C-N 3.32Å; T3-R5 PolarHBondContact O-N 2.95Å; R5-W8 PolarHBondContact O-N 3.38Å; R5-T9 PolarHBondContact O-N 3.21Å; R5-T9 PolarHBondContact O-OG1 2.97Å
6S71Confident71.1Confident62 Ų62119.4 Ų119.443%0.43462%0.622SS.*Hα-helixtrans-62.7-47177-174.60000112.6L2 T3 W8 T9 L10L2-S6 PolarHBondContact O-N 3.08Å; T3-S6 WeakPolarHBondContact O-CB 3.37Å; T3-S6 PolarHBondContact O-N 2.95Å; S6-W8 PolarHBondContact O-N 2.86Å; S6-T9 WeakPolarHBondContact CA-OG1 3.19Å; S6-T9 PolarHBondContact O-N 2.79Å; S6-T9 PolarHBondContact O-OG1 2.95Å; S6-L10 PolarHBondContact O-N 3.09Å
7V75.9Confident70.8Confident90 Ų90118.8 Ų118.855%0.54562%0.619SS.*Hα-helixtrans-63.5-41.8176.9175.50000111.2T3 T9 L10 C11T3-V7 WeakPolarHBondContact O-CG2 3.49Å; T3-V7 PolarHBondContact O-N 2.8Å; V7-T9 PolarHBondContact O-N 3.26Å; V7-L10 PolarHBondContact O-N 3.48Å; V7-C11 PolarHBondContact O-N 3.38Å
8W80.3Confident70.2Confident190 Ų190116 Ų11672%0.7261%0.609SS**Hα-helixtrans-58.6-48.8173.4-170-58.5000111.6F4 R5 S6 L10 C11 V12F4-W8 WeakPolarHBondContact O-CB 3.5Å; F4-W8 PolarHBondContact O-N 2.95Å; F4-W8 VanDerWaalsContact O-N 3.1Å; R5-W8 PolarHBondContact O-N 3.38Å; S6-W8 PolarHBondContact O-N 2.86Å; W8-L10 VanDerWaalsContact C-N 3.33Å; W8-L10 PolarHBondContact O-N 3.24Å; W8-C11 PolarHBondContact O-N 3.2Å; W8-V12 WeakPolarHBondContact O-CG2 3.4Å; W8-V12 PolarHBondContact O-N 3.45Å
9T82Confident69.6Low86 Ų86115.4 Ų115.453%0.52861%0.606SS.*Hα-helixtrans-64-36.2179.345.40000112.9R5 S6 V7 L13R5-T9 PolarHBondContact O-N 3.21Å; R5-T9 PolarHBondContact O-OG1 2.97Å; S6-T9 WeakPolarHBondContact CA-OG1 3.19Å; S6-T9 PolarHBondContact O-N 2.79Å; S6-T9 PolarHBondContact O-OG1 2.95Å; V7-T9 PolarHBondContact O-N 3.26Å; T9-L13 VanDerWaalsContact O-CB 3.29Å; T9-L13 WeakPolarHBondContact O-CB 3.5Å; T9-L13 PolarHBondContact O-N 2.88Å
10L81.6Confident69.1Low109 Ų109112.2 Ų112.257%0.57160%0.601SS**Hα-helixtrans-68-41.6174.8-83.3166.7000112.2S6 V7 W8 L13 A14S6-L10 PolarHBondContact O-N 3.09Å; V7-L10 PolarHBondContact O-N 3.48Å; W8-L10 VanDerWaalsContact C-N 3.33Å; W8-L10 PolarHBondContact O-N 3.24Å; L10-L13 PolarHBondContact O-N 3.28Å; L10-A14 VanDerWaalsContact O-CB 3.27Å; L10-A14 WeakPolarHBondContact O-CB 3.39Å; L10-A14 PolarHBondContact O-N 3.31Å
11C75.7Confident68.4Low75 Ų75110.9 Ų110.951%0.50760%0.598SS.*Hα-helixtrans-62.8-45.1174.5-81.10000112.3V7 W8 A14 L15V7-C11 PolarHBondContact O-N 3.38Å; W8-C11 PolarHBondContact O-N 3.2Å; C11-A14 PolarHBondContact O-N 2.96Å; C11-L15 WeakPolarHBondContact O-CB 3.44Å; C11-L15 PolarHBondContact O-N 3.08Å
12V82.4Confident68.3Low69 Ų69106.8 Ų106.842%0.41858%0.579SS.*Hα-helixtrans-63.9-41.4177.9171.80000111.2W8 L15 L16W8-V12 WeakPolarHBondContact O-CG2 3.4Å; W8-V12 PolarHBondContact O-N 3.45Å; V12-L15 PolarHBondContact O-N 3.17Å; V12-L16 HydrophobicContact CG1-CD1 4.28Å; V12-L16 PolarHBondContact O-N 2.83Å; V12-L16 VanDerWaalsContact O-N 3.14Å
13L78.8Confident68.4Low100 Ų100104.4 Ų104.452%0.52458%0.576SS.*Hα-helixtrans-65.4-44.9176.8-172.364.9000111.5T9 L10 L15 L16 L17T9-L13 VanDerWaalsContact O-CB 3.29Å; T9-L13 WeakPolarHBondContact O-CB 3.5Å; T9-L13 PolarHBondContact O-N 2.88Å; L10-L13 PolarHBondContact O-N 3.28Å; L13-L15 VanDerWaalsContact C-N 3.28Å; L13-L15 PolarHBondContact O-N 3.34Å; L13-L16 PolarHBondContact O-N 3.45Å; L13-L17 HydrophobicContact CD1-CD1 4.28Å; L13-L17 HydrophobicContact CG-CD1 4.01Å; L13-L17 WeakPolarHBondContact O-CD1 3.18Å; L13-L17 PolarHBondContact O-N 3.29Å; L13-L17 VanDerWaalsContact O-N 3.11Å
14A78.6Confident68.3Low63 Ų63107.5 Ų107.552%0.52158%0.583SS.*Hα-helixtrans-62.5-32.6177.600000113.1L10 C11 P18L10-A14 VanDerWaalsContact O-CB 3.27Å; L10-A14 WeakPolarHBondContact O-CB 3.39Å; L10-A14 PolarHBondContact O-N 3.31Å; C11-A14 PolarHBondContact O-N 2.96Å; A14-P18 WeakPolarHBondContact O-CD 2.99Å
15L73.5Confident68Low126 Ų126106.8 Ų106.866%0.6658%0.58SS**Hα-helixtrans-71.4-28.4171.8-95.6158.3000113.3C11 V12 L13 P18 L19C11-L15 WeakPolarHBondContact O-CB 3.44Å; C11-L15 PolarHBondContact O-N 3.08Å; V12-L15 PolarHBondContact O-N 3.17Å; L13-L15 VanDerWaalsContact C-N 3.28Å; L13-L15 PolarHBondContact O-N 3.34Å; L15-P18 WeakPolarHBondContact O-CD 3.32Å; L15-P18 WeakPolarHBondContact O-CG 3.15Å; L15-L19 WeakPolarHBondContact O-CD1 3.36Å
16L67.1Low67.6Low104 Ų104104.7 Ų104.755%0.54558%0.583SS.*Hα-helixtrans-80.8-30179-99.4157.5000113.8V12 L13 L19 G20V12-L16 HydrophobicContact CG1-CD1 4.28Å; V12-L16 PolarHBondContact O-N 2.83Å; V12-L16 VanDerWaalsContact O-N 3.14Å; L13-L16 PolarHBondContact O-N 3.45Å; L16-L19 PolarHBondContact O-N 2.84Å; L16-G20 PolarHBondContact O-N 3Å
17L65.3Low66.6Low110 Ų110109.9 Ų109.958%0.57660%0.598SS**Hα-helixtrans-52.5-49.5177.2-96.676.2000114.4L13 L19 G20 V21L13-L17 HydrophobicContact CD1-CD1 4.28Å; L13-L17 HydrophobicContact CG-CD1 4.01Å; L13-L17 WeakPolarHBondContact O-CD1 3.18Å; L13-L17 PolarHBondContact O-N 3.29Å; L13-L17 VanDerWaalsContact O-N 3.11Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 3.29Å; L17-G20 PolarHBondContact O-N 3.48Å; L17-V21 PolarHBondContact O-N 2.86Å
18P61Low66.1Low68 Ų68110.2 Ų110.244%0.44260%0.597SS.*Hα-helixtrans-67-30-179.224.3-33.8000113.6A14 L15 G20 V21 L22A14-P18 WeakPolarHBondContact O-CD 2.99Å; L15-P18 WeakPolarHBondContact O-CD 3.32Å; L15-P18 WeakPolarHBondContact O-CG 3.15Å; P18-G20 VanDerWaalsContact C-N 3.33Å; P18-V21 PolarHBondContact O-N 3.34Å; P18-L22 PolarHBondContact O-N 2.62Å
19L59.3Low64.9Low105 Ų105106 Ų10655%0.5559%0.588SS.*Hα-helixtrans-65.3-38.1174.1-77.588.2000111.3L15 L16 L17 V21 L22 S23L15-L19 WeakPolarHBondContact O-CD1 3.36Å; L16-L19 PolarHBondContact O-N 2.84Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 3.29Å; L19-V21 VanDerWaalsContact C-N 3.31Å; L19-V21 PolarHBondContact O-N 2.76Å; L19-L22 PolarHBondContact O-N 3.48Å; L19-S23 PolarHBondContact O-N 3.01Å; L19-S23 PolarHBondContact O-OG 3.29Å; L19-S23 VanDerWaalsContact O-OG 3.1Å
20G59.4Low63.9Low50 Ų50107.3 Ų107.352%0.51559%0.592SS.*Hα-helixtrans-65.8-30.8176.200000113.9L16 L17 P18L16-G20 PolarHBondContact O-N 3Å; L17-G20 PolarHBondContact O-N 3.48Å; P18-G20 VanDerWaalsContact C-N 3.33Å
21V54.7Low63.1Low86 Ų86109.6 Ų109.652%0.52161%0.605SS.*Hα-helixtrans-80.7-35.6178177.70000111.7L17 P18 L19 S23 Q24 F25L17-V21 PolarHBondContact O-N 2.86Å; P18-V21 PolarHBondContact O-N 3.34Å; L19-V21 VanDerWaalsContact C-N 3.31Å; L19-V21 PolarHBondContact O-N 2.76Å; V21-S23 VanDerWaalsContact C-N 3.29Å; V21-S23 PolarHBondContact O-N 3.16Å; V21-Q24 PolarHBondContact O-N 3.01Å; V21-F25 HydrophobicContact CG1-CE2 4.25Å; V21-F25 WeakPolarHBondContact O-CD2 3.37Å
22L52.3Low62.5Low121 Ų121110.2 Ų110.263%0.63462%0.615SS**Hα-helixtrans-61.8-35.7173.4-84.8158.3000112.3P18 L19 Q24 F25P18-L22 PolarHBondContact O-N 2.62Å; L19-L22 PolarHBondContact O-N 3.48Å; L22-Q24 PolarHBondContact O-N 2.91Å; L22-F25 PolarHBondContact O-N 2.79Å; L22-F25 VanDerWaalsContact O-N 3.12Å
23S54.8Low61.2Low107 Ų107113.1 Ų113.175%0.74863%0.628SS**THydrogen-bonded Turntrans-65.4-3.1175.3-570000115.4L19 V21L19-S23 PolarHBondContact O-N 3.01Å; L19-S23 PolarHBondContact O-OG 3.29Å; L19-S23 VanDerWaalsContact O-OG 3.1Å; V21-S23 VanDerWaalsContact C-N 3.29Å; V21-S23 PolarHBondContact O-N 3.16Å
24Q53.4Low60.2Low170 Ų170115 Ų11579%0.79464%0.638SS**THydrogen-bonded Turntrans-106.1-7.6175.8-158.3174.6-1.400113V21 L22 D26V21-Q24 PolarHBondContact O-N 3.01Å; L22-Q24 PolarHBondContact O-N 2.91Å; Q24-D26 PolarHBondContact O-N 2.72Å
25F52.6Low58.9Low153 Ų153119.9 Ų119.967%0.67166%0.656SS**SBendtrans-91.893.5167.8-72.1-85.3000108.5V21 L22 F27V21-F25 HydrophobicContact CG1-CE2 4.25Å; V21-F25 WeakPolarHBondContact O-CD2 3.37Å; L22-F25 PolarHBondContact O-N 2.79Å; L22-F25 VanDerWaalsContact O-N 3.12Å; F25-F27 PolarHBondContact O-N 3.2Å
26D60.7Low57.9Low154 Ų154116.8 Ų116.882%0.82465%0.654SS**  trans-61.3100168-128.4-57.2000108Q24 D28Q24-D26 PolarHBondContact O-N 2.72Å; D26-D28 PolarHBondContact O-N 3.27Å
27F49.8Very low56.7Low171 Ų171117.2 Ų117.275%0.7567%0.666SS**  trans-80.168.8-179.9-172.3-99.6000108.5F25 L29F25-F27 PolarHBondContact O-N 3.2Å; F27-L29 HydrophobicContact CD1-CD1 3.69Å; F27-L29 HydrophobicContact CD1-CG 4Å; F27-L29 HydrophobicContact CE1-CD1 3.78Å; F27-L29 HydrophobicContact CE1-CD2 4.04Å; F27-L29 HydrophobicContact CE1-CG 3.74Å; F27-L29 PolarHBondContact O-N 3.02Å; F27-L29 VanDerWaalsContact O-N 3.09Å
28D64.1Low55.9Low97 Ų97118.8 Ų118.852%0.51968%0.679SS.*  trans-78.696.3-173-162.2-11.1000110.6D26 N30 D31D26-D28 PolarHBondContact O-N 3.27Å; D28-N30 PolarHBondContact O-N 2.79Å; D28-N30 VanDerWaalsContact OD1-CB 3.26Å; D28-N30 WeakPolarHBondContact OD1-CB 3.44Å; D28-N30 VanDerWaalsContact OD1-CG 3.23Å; D28-N30 PolarHBondContact OD1-N 2.99Å; D28-N30 PolarHBondContact OD1-ND2 2.8Å; D28-D31 PolarHBondContact O-N 3.48Å
29L55.5Low54.7Low102 Ų102124.8 Ų124.853%0.53470%0.699SS.*G310 helixtrans-63.7-7.4178.1-73.8116.5000113.6F27 D31 A32F27-L29 HydrophobicContact CD1-CD1 3.69Å; F27-L29 HydrophobicContact CD1-CG 4Å; F27-L29 HydrophobicContact CE1-CD1 3.78Å; F27-L29 HydrophobicContact CE1-CD2 4.04Å; F27-L29 HydrophobicContact CE1-CG 3.74Å; F27-L29 PolarHBondContact O-N 3.02Å; F27-L29 VanDerWaalsContact O-N 3.09Å; L29-D31 PolarHBondContact O-N 2.96Å; L29-A32 PolarHBondContact O-N 2.85Å
30N60.6Low54.1Low114 Ų114125.3 Ų125.361%0.6171%0.709SS**G310 helixtrans-61-28177.1-70.5-49.3000112.9D28 A32 L33D28-N30 PolarHBondContact O-N 2.79Å; D28-N30 VanDerWaalsContact OD1-CB 3.26Å; D28-N30 WeakPolarHBondContact OD1-CB 3.44Å; D28-N30 VanDerWaalsContact OD1-CG 3.23Å; D28-N30 PolarHBondContact OD1-N 2.99Å; D28-N30 PolarHBondContact OD1-ND2 2.8Å; N30-A32 VanDerWaalsContact C-N 3.28Å; N30-A32 PolarHBondContact O-N 3.45Å; N30-L33 PolarHBondContact O-N 3.38Å
31D65.6Low52.9Low156 Ų156129 Ų12983%0.83473%0.726SS**G310 helixtrans-71.3-21.6174.8-165.154.9000112.8D28 L29D28-D31 PolarHBondContact O-N 3.48Å; L29-D31 PolarHBondContact O-N 2.96Å
32A62.7Low52.2Low88 Ų88129.4 Ų129.473%0.72774%0.739SS**G310 helixtrans-90.6-2.8177.500000113.7L29 N30L29-A32 PolarHBondContact O-N 2.85Å; N30-A32 VanDerWaalsContact C-N 3.28Å; N30-A32 PolarHBondContact O-N 3.45Å
33L54.5Low51.3Low131 Ų131129.1 Ų129.169%0.68675%0.747SS**  trans-117-1.7-172.2-85.2158.9000114.5N30 D35N30-L33 PolarHBondContact O-N 3.38Å; L33-D35 VanDerWaalsContact C-N 3.26Å; L33-D35 PolarHBondContact O-N 3.47Å
34D58.8Low50.2Low139 Ų139130.1 Ų130.174%0.74375%0.748SS**  trans-77.172.8177.2-165.942.9000112.1G36D34-G36 PolarHBondContact O-N 3.15Å; D34-G36 VanDerWaalsContact O-N 3.17Å
35D50.8Low49.5Very low166 Ų166129.3 Ų129.389%0.88874%0.742SS**  trans-79.690.2171.8-172.420.2000111.3L33L33-D35 VanDerWaalsContact C-N 3.26Å; L33-D35 PolarHBondContact O-N 3.47Å
36G52.5Low48.6Very low61 Ų61127.9 Ų127.963%0.62975%0.748SS**  trans97.883.9142.200000118.5D34D34-G36 PolarHBondContact O-N 3.15Å; D34-G36 VanDerWaalsContact O-N 3.17Å
37S43.2Very low47.4Very low112 Ų112127.8 Ų127.878%0.78374%0.74SS**  trans-149.4142.9135.372.70000113.4
38V47.3Very low46.9Very low143 Ų143124.6 Ų124.687%0.86774%0.737SS**  trans-92123.8-165.5-1800000112.7
39K36.5Very low45.3Very low194 Ų194128.5 Ų128.584%0.84375%0.752SS**  trans-158.5121.9139.3-158.2170.9-175177.90113.9
40P46.2Very low44.5Very low117 Ų117127.5 Ų127.576%0.7676%0.758SS**  trans-79.2129.8169.231.9-31.7000110.5
41S34.6Very low43.3Very low127 Ų127127.9 Ų127.989%0.88877%0.767SS**  trans-120.1143.3166.7-164.80000110
42A39.6Very low41.5Very low95 Ų95125.5 Ų125.579%0.78576%0.758SS**  trans-102.4172.7-155.100000115.2
43S33Very low39.9Very low114 Ų114132.9 Ų132.980%0.79777%0.767SS**  trans102.2125.9163.6-143.90000113.5
44V33Very low38.7Very low128 Ų128130.1 Ų130.178%0.77677%0.771SS**  cis-130.9149.128.6172.80000112.3
45K37.4Very low37.8Very low154 Ų154131.4 Ų131.467%0.6778%0.776SS**  trans-136.4148.7161.2-149-169.7177.3146.50110.3K47K45-K47 HydrophobicContact CD-CB 4.18Å
46P33.6Very low37Very low122 Ų122132.1 Ų132.179%0.79277%0.774SS**  -117.5136.9119.1-8.127.3000113.5
47K35.5Very low36.5Very low152 Ų152138.5 Ų138.566%0.66179%0.787SS**  trans-81.4170.8158.9-140.8176.4166.1-172.30106.1K45K45-K47 HydrophobicContact CD-CB 4.18Å
48P40Very low35.9Very low104 Ų104136.5 Ų136.568%0.67578%0.778SS**  cis-142.2-173.81540.2-15.1000115.4
49E30.3Very low35.1Very low180 Ų180135.5 Ų135.584%0.84177%0.772SS**  cis-143.8172.223.2-70.5176.9138.200113.1
50A37.8Very low35.2Very low81 Ų81132.1 Ų132.167%0.66977%0.767SS**  trans-144.2146157.500000107.6
51P35.7Very low34.6Very low122 Ų122137.3 Ų137.379%0.79277%0.772SS**  -139.9164.5112.426.4-8.6000112.7
52T28.3Very low34.3Very low106 Ų106136.8 Ų136.865%0.6576%0.763SS**  cis165.1125.4-16.3-86.70000103.9
53R28.9Very low33.9Very low242 Ų242138.4 Ų138.491%0.91376%0.764SS**  trans57.5124.2161.4-66.9167.3179.2173.6-3.1119.6
54G29.7Very low33.8Very low74 Ų74138.7 Ų138.776%0.76376%0.76SS**  trans-157.795.6152.300000109.1
55I40.6Very low34.1Very low165 Ų165140.2 Ų140.285%0.84676%0.762SS**  trans-93.394.6174.2-52.7174.5000106.7Q57I55-Q57 PolarHBondContact O-N 3Å
56E33.8Very low33.9Very low182 Ų182141.8 Ų141.885%0.8577%0.769SS**  trans-88.694.3172.3-82.8-160.4115.200111.1A58E56-A58 PolarHBondContact O-N 3.47Å
57Q40.7Very low33.9Very low195 Ų195142.7 Ų142.791%0.91177%0.772SS**  trans-82.797.8157.8-178.9177.3-2.700108.1I55I55-Q57 PolarHBondContact O-N 3Å
58A32.3Very low34.1Very low70 Ų70140.9 Ų140.958%0.57978%0.776SS**  trans-127.7107.2-177.400000113.3E56E56-A58 PolarHBondContact O-N 3.47Å
59T30.4Very low33.6Very low122 Ų122142.3 Ų142.375%0.74878%0.783SS**  trans63.4104.2133.1-54.50000119.8
60V37.5Very low34Very low122 Ų122142.6 Ų142.674%0.73978%0.781SS**  trans-15.9123.8144.9179.60000114.7
61R33.1Very low33.8Very low227 Ų227145 Ų14586%0.85779%0.788SS**  trans-130.889.4157.8-76-167.8171.5176.8-1.3112
62T28.8Very low34.2Very low116 Ų116147.9 Ų147.971%0.71279%0.787SS**  trans-65125158.1-54.20000109.5
63T31.2Very low34.5Very low129 Ų129149.2 Ų149.279%0.79180%0.798SS**  trans-130.594.7167.951.40000112.1
64T32.1Very low34.6Very low119 Ų119147.2 Ų147.273%0.7380%0.796SS**  trans-56127.1168.3-57.10000113.3
65I37.8Very low35.1Very low160 Ų160150.9 Ų150.982%0.82180%0.797SS**  trans-134.692.4156.6-56-175.7000111.7
66K33.6Very low34.8Very low187 Ų187148.5 Ų148.581%0.81379%0.792SS**  trans27.9111.3142.5-60178.3-179.5177.80120.8
67V33.5Very low34.8Very low141 Ų141145.9 Ų145.986%0.85579%0.789SS**  trans-56139.6147.1172.30000109.9
68P39.5Very low34.5Very low114 Ų114141.3 Ų141.374%0.7478%0.778SS**  -144.7-170.371.638.7-15.9000113.8
69V31.2Very low34.6Very low134 Ų134144.7 Ų144.781%0.81279%0.792SS**  cis-135.316812.6-175.90000110.4
70K37.8Very low34.8Very low186 Ų186144.7 Ų144.781%0.80979%0.792SS**  trans-104.3124.7-179.8178.6172.5-175.2167.90112.4
71V33.1Very low34.8Very low133 Ų133143 Ų14381%0.80679%0.791SS**  trans-141.3131168.1-166.60000110.6
72K44.6Very low34.8Very low182 Ų182138.4 Ų138.479%0.79179%0.794SS**  trans-96.7125.9173-70.4-177.4174.3-173.20109.9
73P33.8Very low35.3Very low133 Ų133142.3 Ų142.386%0.86480%0.801SS**  trans-68.7144.8168.1-2034000111.7
74K32.3Very low35.6Very low200 Ų200145.3 Ų145.387%0.8780%0.803SS**  trans-116.5138.4-176.1-174.6159178.9169.20110.4
75L40.1Very low35.7Very low152 Ų152146 Ų14680%0.79681%0.807SS**PPolyproline II helixtrans-59.6134178.2-176.472.5000112
76P34.7Very low35.9Very low115 Ų115147.1 Ų147.175%0.74781%0.806SS**PPolyproline II helixtrans-91137.7163.833.3-29.2000111.7
77T31.9Very low36Very low126 Ų126143.9 Ų143.977%0.77380%0.804SS**PPolyproline II helixtrans-85.4152.7-174.3-530000112.7
78S35.2Very low36.7Very low99 Ų99146.4 Ų146.469%0.69280%0.803SS**PPolyproline II helixtrans-52.1148.4170.5178.30000114.8
79T35.1Very low36.7Very low141 Ų141145.4 Ų145.487%0.86580%0.799SS**  trans-131.5146.8162.4-58.90000109.9
80T33.3Very low37.7Very low122 Ų122146.6 Ų146.675%0.74881%0.807SS**  trans-110.9134.9-146.2-470000115
81A37.2Very low38Very low86 Ų86140 Ų14071%0.71179%0.791SS**  trans50.1141.2148.400000123.4
82S34.3Very low39.3Very low132 Ų132142.8 Ų142.892%0.92380%0.796SS**  trans-147.3152.4136.4-82.80000109.9
83K39.6Very low39.8Very low197 Ų197139.7 Ų139.786%0.85779%0.788SS**  trans-130154.3-155.9-165.5176.5-171.3173.40112.5
84K37.4Very low41.1Very low193 Ų193143 Ų14384%0.83979%0.789SS**  trans83.6147.1177.4-49.1176.5178.8179.20113.5
85T33.6Very low42.8Very low132 Ų132139.1 Ų139.181%0.8178%0.778SS**  cis-139151.515.726.80000112.6
86K41.6Very low44Very low184 Ų184138.6 Ų138.680%0.878%0.775SS**  trans-85.8143.9175.5-177.9168.8-172.2157.80112.2
87P35.6Very low45.5Very low119 Ų119136.4 Ų136.477%0.77377%0.767SS**  trans-119.2163.4131.631.2-20.6000111.6
88K49Very low47Very low194 Ų194136.6 Ų136.684%0.84376%0.763SS**  trans-97.9115-166.9-179.3-178.9-178.1179.20110.1
89S39.2Very low48.4Very low94 Ų94136 Ų13666%0.65777%0.765SS**  trans-120.5143.1166.348.60000111G91S89-G91 PolarHBondContact O-N 3Å
90T51.5Low49.8Very low158 Ų158135.2 Ų135.297%0.96975%0.754SS**  trans-77.6106.2-178.5-47.60000109.6
91G45.8Very low51.2Low47 Ų47133.1 Ų133.149%0.48574%0.738SS.*  trans-162.1146176.500000109.5S89 D93S89-G91 PolarHBondContact O-N 3Å; G91-D93 PolarHBondContact O-N 3.3Å; G91-D93 VanDerWaalsContact O-N 3.07Å
92Q60Low52.3Low193 Ų193137 Ų13790%0.90274%0.742SS**  trans-82.372.2167.5-70.1175.9-1.600107.5F94Q92-F94 PolarHBondContact O-N 2.74Å
93D55.1Low53.5Low116 Ų116137.4 Ų137.462%0.6273%0.734SS**  trans-67.8126.2176.1-60.6-30.5000107.9G91 D95G91-D93 PolarHBondContact O-N 3.3Å; G91-D93 VanDerWaalsContact O-N 3.07Å; D93-D95 PolarHBondContact O-N 2.94Å
94F60.8Low54.6Low203 Ų203134.6 Ų134.689%0.8972%0.723SS**  trans-72.567174.1-78.2-95.1000109.8Q92 L96Q92-F94 PolarHBondContact O-N 2.74Å; F94-L96 PolarHBondContact O-N 2.94Å
95D68.6Low55.9Low119 Ų119134.3 Ų134.364%0.63672%0.722SS**  trans-79.585-172.6-149.2-5.7000109.8D93 A97 D98D93-D95 PolarHBondContact O-N 2.94Å; D95-A97 PolarHBondContact O-N 3.02Å; D95-D98 PolarHBondContact O-N 3.27Å
96L64.2Low57.2Low140 Ų140134.1 Ų134.173%0.73372%0.723SS**THydrogen-bonded Turntrans-56.4-7.6179.8-71.2165.2000114F94 D98 A99 L100F94-L96 PolarHBondContact O-N 2.94Å; L96-D98 VanDerWaalsContact C-N 3.29Å; L96-D98 PolarHBondContact O-N 3.46Å; L96-A99 PolarHBondContact O-N 3.46Å; L96-L100 PolarHBondContact O-N 3.18Å
97A65.9Low58.1Low70 Ų70128.9 Ų128.958%0.57972%0.721SS**THydrogen-bonded Turntrans-61.2-32.9172.800000113.3D95 L100D95-A97 PolarHBondContact O-N 3.02Å; A97-L100 PolarHBondContact O-N 3.39Å
98D65Low59.7Low130 Ų130126.7 Ų126.770%0.69572%0.721SS**G310 helixtrans-74.5-32.1177.4-162.142.3000111.8D95 L96 L100 D101D95-D98 PolarHBondContact O-N 3.27Å; L96-D98 VanDerWaalsContact C-N 3.29Å; L96-D98 PolarHBondContact O-N 3.46Å; D98-L100 PolarHBondContact O-N 3.35Å; D98-D101 PolarHBondContact O-N 2.85Å
99A64Low60.8Low87 Ų87120.6 Ų120.672%0.71971%0.712SS**G310 helixtrans-71.4-7.1171.600000113.6L96L96-A99 PolarHBondContact O-N 3.46Å
100L63.8Low62.4Low124 Ų124124.3 Ų124.365%0.64972%0.717SS**G310 helixtrans-112.618.7179.6-161.162000113L96 A97 D98 Q102L96-L100 PolarHBondContact O-N 3.18Å; A97-L100 PolarHBondContact O-N 3.39Å; D98-L100 PolarHBondContact O-N 3.35Å; L100-Q102 PolarHBondContact O-N 2.83Å
101D63.3Low63.5Low77 Ų77119.1 Ų119.141%0.41269%0.687SS.*  trans-70.195.8165.1-17720.6000110.9D98 N103 Q104D98-D101 PolarHBondContact O-N 2.85Å; D101-N103 PolarHBondContact O-N 3.34Å; D101-N103 VanDerWaalsContact O-N 3.08Å; D101-N103 WeakPolarHBondContact OD1-CB 3.27Å; D101-N103 PolarHBondContact OD1-N 2.99Å; D101-N103 PolarHBondContact OD1-ND2 3.25Å; D101-Q104 HydrophobicContact CB-CG 4.22Å; D101-Q104 WeakPolarHBondContact O-CB 3.48Å; D101-Q104 PolarHBondContact O-N 3.43Å; D101-Q104 VanDerWaalsContact O-N 3.09Å
102Q60.9Low64.9Low169 Ų169123.1 Ų123.179%0.7970%0.698SS**THydrogen-bonded Turntrans-65.9-3.6176.2-62.8-179.5-6.600113.7L100L100-Q102 PolarHBondContact O-N 2.83Å
103N59.4Low65.8Low140 Ų140118 Ų11875%0.74968%0.683SS**THydrogen-bonded Turntrans-92.2-5.3171.9-61.2-81.2000113.8D101 K105D101-N103 PolarHBondContact O-N 3.34Å; D101-N103 VanDerWaalsContact O-N 3.08Å; D101-N103 WeakPolarHBondContact OD1-CB 3.27Å; D101-N103 PolarHBondContact OD1-N 2.99Å; D101-N103 PolarHBondContact OD1-ND2 3.25Å; N103-K105 PolarHBondContact O-N 3.24Å
104Q61.3Low67Low137 Ų137116.1 Ų116.164%0.6467%0.673SS**SBendtrans-62.6106.5159.7-62.7-125.943.400107.2D101 P106D101-Q104 HydrophobicContact CB-CG 4.22Å; D101-Q104 WeakPolarHBondContact O-CB 3.48Å; D101-Q104 PolarHBondContact O-N 3.43Å; D101-Q104 VanDerWaalsContact O-N 3.09Å; Q104-P106 VanDerWaalsContact O-N 3.16Å
105K64.4Low67.7Low188 Ų188111.2 Ų111.282%0.81766%0.656SS**  trans-46.8126.4168.7-73-179.6177.9178.80106.7N103 G107N103-K105 PolarHBondContact O-N 3.24Å; K105-G107 WeakPolarHBondContact O-CA 3.36Å; K105-G107 PolarHBondContact O-N 3.11Å
106P61.9Low68Low128 Ų128111.6 Ų111.683%0.83165%0.653SS**  trans-51.7111.4-173.518.2-31.2000108.8Q104 G108Q104-P106 VanDerWaalsContact O-N 3.16Å; P106-G108 PolarHBondContact O-N 3.14Å
107G61.5Low68.4Low73 Ų73106.7 Ų106.775%0.75364%0.637SS**  trans-62.3121.9-163.200000110.1K105 G109K105-G107 WeakPolarHBondContact O-CA 3.36Å; K105-G107 PolarHBondContact O-N 3.11Å; G107-G109 PolarHBondContact O-N 2.79Å
108G67.6Low68.7Low74 Ų74107 Ų10776%0.76363%0.632SS**  trans21.482175.600000114.8P106 F110P106-G108 PolarHBondContact O-N 3.14Å; G108-F110 PolarHBondContact O-N 3.17Å
109G71.9Confident68.9Low65 Ų65105 Ų10567%0.6763%0.627SS**  trans-56.3114.6175.700000110.1G107 S111G107-G109 PolarHBondContact O-N 2.79Å; G109-S111 PolarHBondContact O-N 3.4Å
110F73.3Confident69.3Low172 Ų172105.6 Ų105.675%0.75462%0.619SS**  trans-57.1109179.5-135.2-87.8000108.7G108 D114G108-F110 PolarHBondContact O-N 3.17Å; F110-D114 HydrophobicContact CD1-CB 4.16Å; F110-D114 HydrophobicContact CE1-CB 4.08Å
111S75.1Confident69.9Low50 Ų50104.5 Ų104.535%0.3561%0.614SS.*  trans-96.4158.6-179.272.40000110.1G109 S113 D114 L115G109-S111 PolarHBondContact O-N 3.4Å; S111-S113 PolarHBondContact O-N 2.98Å; S111-S113 VanDerWaalsContact O-N 3.16Å; S111-D114 WeakPolarHBondContact CA-OD2 3.09Å; S111-D114 WeakPolarHBondContact CB-OD2 3.45Å; S111-D114 PolarHBondContact N-OD2 3.07Å; S111-D114 WeakPolarHBondContact O-CB 3.34Å; S111-D114 PolarHBondContact O-N 3.31Å; S111-D114 PolarHBondContact OG-OD2 2.89Å; S111-L115 PolarHBondContact O-N 3.32Å
112D74.7Confident70.1Confident131 Ų131106.5 Ų106.570%0.70162%0.624SS**Hα-helixtrans-61.3-26.4179.1-144.29.2000111.5D114 L115 E116D112-D114 VanDerWaalsContact C-N 3.3Å; D112-D114 PolarHBondContact O-N 3.01Å; D112-L115 WeakPolarHBondContact O-CB 3.39Å; D112-L115 PolarHBondContact O-N 2.72Å; D112-E116 PolarHBondContact O-N 3.35Å
113S78.4Confident70.8Confident84 Ų84103.2 Ų103.259%0.58762%0.616SS**Hα-helixtrans-59.9-35.2170.6-38.40000113.4S111 L115 E116 G117S111-S113 PolarHBondContact O-N 2.98Å; S111-S113 VanDerWaalsContact O-N 3.16Å; S113-L115 VanDerWaalsContact C-N 3.33Å; S113-E116 PolarHBondContact O-N 2.88Å; S113-G117 PolarHBondContact O-N 3.47Å
114D81.1Confident71.5Confident78 Ų78104.3 Ų104.342%0.41761%0.611SS.*Hα-helixtrans-72.7-30.8178.3-56.5-64.8000110.8F110 S111 D112 V118F110-D114 HydrophobicContact CD1-CB 4.16Å; F110-D114 HydrophobicContact CE1-CB 4.08Å; S111-D114 WeakPolarHBondContact CA-OD2 3.09Å; S111-D114 WeakPolarHBondContact CB-OD2 3.45Å; S111-D114 PolarHBondContact N-OD2 3.07Å; S111-D114 WeakPolarHBondContact O-CB 3.34Å; S111-D114 PolarHBondContact O-N 3.31Å; S111-D114 PolarHBondContact OG-OD2 2.89Å; D112-D114 VanDerWaalsContact C-N 3.3Å; D112-D114 PolarHBondContact O-N 3.01Å; D114-V118 PolarHBondContact O-N 2.99Å
115L75.9Confident72.2Confident100 Ų100105.4 Ų105.452%0.52461%0.613SS.*Hα-helixtrans-71.5-42.3172-175.866000111.5S111 D112 S113 G117 V118 S119S111-L115 PolarHBondContact O-N 3.32Å; D112-L115 WeakPolarHBondContact O-CB 3.39Å; D112-L115 PolarHBondContact O-N 2.72Å; S113-L115 VanDerWaalsContact C-N 3.33Å; L115-G117 VanDerWaalsContact C-N 3.31Å; L115-G117 PolarHBondContact O-N 3.36Å; L115-V118 PolarHBondContact O-N 3.01Å; L115-S119 PolarHBondContact O-N 2.81Å
116E75.5Confident72.5Confident126 Ų126100.2 Ų100.259%0.58960%0.599SS**Hα-helixtrans-62-40.5175.3-144.5-153.8140.100111.2D112 S113 V118 S119 N120D112-E116 PolarHBondContact O-N 3.35Å; S113-E116 PolarHBondContact O-N 2.88Å; E116-V118 PolarHBondContact O-N 3.49Å; E116-S119 PolarHBondContact O-N 2.96Å; E116-N120 VanDerWaalsContact O-CB 3.31Å; E116-N120 WeakPolarHBondContact O-CB 3.32Å; E116-N120 VanDerWaalsContact O-CG 3.29Å; E116-N120 PolarHBondContact O-N 2.93Å; E116-N120 PolarHBondContact O-ND2 2.89Å; E116-N120 PolarHBondContact OE1-ND2 3.28Å
117G71.2Confident73.1Confident38 Ų38101.2 Ų101.239%0.39260%0.597SS.*Hα-helixtrans-55-49.7172.500000112.7S113 L115 S119 N120 D121S113-G117 PolarHBondContact O-N 3.47Å; L115-G117 VanDerWaalsContact C-N 3.31Å; L115-G117 PolarHBondContact O-N 3.36Å; G117-S119 VanDerWaalsContact C-N 3.33Å; G117-S119 PolarHBondContact O-N 2.8Å; G117-N120 PolarHBondContact O-N 3.21Å; G117-D121 WeakPolarHBondContact O-CB 3.26Å; G117-D121 PolarHBondContact O-N 3.32Å
118V73.3Confident73.3Confident76 Ų76107.6 Ų107.646%0.46160%0.604SS.*Hα-helixtrans-61.7-38.5176.31650000112.4D114 L115 E116D114-V118 PolarHBondContact O-N 2.99Å; L115-V118 PolarHBondContact O-N 3.01Å; E116-V118 PolarHBondContact O-N 3.49Å
119S68.7Low73.2Confident87 Ų87105.9 Ų105.961%0.60859%0.587SS**Hα-helixtrans-72-32.3179.2-170.40000113L115 E116 G117L115-S119 PolarHBondContact O-N 2.81Å; E116-S119 PolarHBondContact O-N 2.96Å; G117-S119 VanDerWaalsContact C-N 3.33Å; G117-S119 PolarHBondContact O-N 2.8Å
120N73.1Confident72.8Confident100 Ų100113.4 Ų113.454%0.53560%0.601SS.*Hα-helixtrans-90-30.5-175.6-72.4-31.2000113.4E116 G117 N122E116-N120 VanDerWaalsContact O-CB 3.31Å; E116-N120 WeakPolarHBondContact O-CB 3.32Å; E116-N120 VanDerWaalsContact O-CG 3.29Å; E116-N120 PolarHBondContact O-N 2.93Å; E116-N120 PolarHBondContact O-ND2 2.89Å; E116-N120 PolarHBondContact OE1-ND2 3.28Å; G117-N120 PolarHBondContact O-N 3.21Å; N120-N122 VanDerWaalsContact C-N 3.27Å; N120-N122 PolarHBondContact O-N 3.47Å
121D74.8Confident72.3Confident102 Ų102107.5 Ų107.555%0.54559%0.588SS.*Hα-helixtrans-65.9-26.4-176-177.515.7000112.5G117 T123G117-D121 WeakPolarHBondContact O-CB 3.26Å; G117-D121 PolarHBondContact O-N 3.32Å; D121-T123 VanDerWaalsContact CG-CB 3.47Å; D121-T123 VanDerWaalsContact CG-OG1 3.26Å; D121-T123 PolarHBondContact O-N 3.48Å; D121-T123 PolarHBondContact O-OG1 3.27Å; D121-T123 WeakPolarHBondContact OD1-CB 3.3Å; D121-T123 PolarHBondContact OD1-OG1 3.36Å; D121-T123 VanDerWaalsContact OD2-CB 3.27Å; D121-T123 WeakPolarHBondContact OD2-CB 3.32Å; D121-T123 PolarHBondContact OD2-OG1 3.17Å
122N67.5Low71.4Confident118 Ų118108.3 Ų108.363%0.63160%0.604SS**  trans56-4.9-174.5-75.8-41.3000115.3N120 Y124 K125N120-N122 VanDerWaalsContact C-N 3.27Å; N120-N122 PolarHBondContact O-N 3.47Å; N122-Y124 VanDerWaalsContact C-N 3.28Å; N122-Y124 PolarHBondContact O-N 3.2Å; N122-K125 PolarHBondContact O-NZ 3.42Å
123T77.3Confident70.4Confident101 Ų101112.3 Ų112.362%0.6261%0.611SS**  trans-67.4-28.7177.5-63.30000111.8D121 K125D121-T123 VanDerWaalsContact CG-CB 3.47Å; D121-T123 VanDerWaalsContact CG-OG1 3.26Å; D121-T123 PolarHBondContact O-N 3.48Å; D121-T123 PolarHBondContact O-OG1 3.27Å; D121-T123 WeakPolarHBondContact OD1-CB 3.3Å; D121-T123 PolarHBondContact OD1-OG1 3.36Å; D121-T123 VanDerWaalsContact OD2-CB 3.27Å; D121-T123 WeakPolarHBondContact OD2-CB 3.32Å; D121-T123 PolarHBondContact OD2-OG1 3.17Å; T123-K125 PolarHBondContact O-N 2.9Å
124Y72.6Confident69.4Low163 Ų163117.7 Ų117.764%0.63962%0.624SS**  trans-68.1106.4171.1-167.1-110.7000110.9N122 P126N122-Y124 VanDerWaalsContact C-N 3.28Å; N122-Y124 PolarHBondContact O-N 3.2Å; Y124-P126 HydrophobicContact CD1-CB 4.44Å; Y124-P126 HydrophobicContact CD1-CG 4.37Å; Y124-P126 HydrophobicContact CE1-CB 3.76Å; Y124-P126 HydrophobicContact CE1-CG 4.12Å; Y124-P126 WeakPolarHBondContact O-CD 3.01Å
125K76.1Confident68.1Low160 Ų160123 Ų12370%0.69664%0.643SS**  trans-106.891.2171.7-68.4-77.1176.5-79.20107N122 T123 D127N122-K125 PolarHBondContact O-NZ 3.42Å; T123-K125 PolarHBondContact O-N 2.9Å; K125-D127 PolarHBondContact O-N 3.03Å
126P71.7Confident66.8Low79 Ų79126 Ų12651%0.51366%0.655SS.*  trans-58.8132.4174.523.9-31.4000108.6Y124 K128Y124-P126 HydrophobicContact CD1-CB 4.44Å; Y124-P126 HydrophobicContact CD1-CG 4.37Å; Y124-P126 HydrophobicContact CE1-CB 3.76Å; Y124-P126 HydrophobicContact CE1-CG 4.12Å; Y124-P126 WeakPolarHBondContact O-CD 3.01Å; P126-K128 PolarHBondContact O-N 2.83Å
127D74Confident65.4Low149 Ų149126.2 Ų126.280%0.79766%0.66SS**  trans-57.7134.4176.6178.728.2000109.4K125 G129K125-D127 PolarHBondContact O-N 3.03Å; D127-G129 PolarHBondContact O-N 2.95Å
128K66.6Low64.5Low207 Ų207129.1 Ų129.190%0.967%0.67SS**  trans-80.739.5175.4-68.7-179.1177178.10110.8P126P126-K128 PolarHBondContact O-N 2.83Å
129G65.4Low63.3Low38 Ų38129.8 Ų129.839%0.39268%0.678SS.*  trans-58.5158.6166.800000110.5D127 G131D127-G129 PolarHBondContact O-N 2.95Å; G129-G131 PolarHBondContact O-N 3.49Å
130K63.2Low62.8Low223 Ų223134.7 Ų134.797%0.9769%0.691SS**SBendtrans-67.412.1-167.8-59.9-167.8176-169.60116G132K130-G132 VanDerWaalsContact C-N 3.28Å; K130-G132 PolarHBondContact O-N 2.89Å
131G62.9Low61.5Low47 Ų47134.3 Ų134.349%0.48570%0.697SS.*  trans-88.234.2177.500000114G129 Y133G129-G131 PolarHBondContact O-N 3.49Å; G131-Y133 VanDerWaalsContact C-N 3.33Å; G131-Y133 WeakPolarHBondContact O-CD1 3.34Å; G131-Y133 VanDerWaalsContact O-CE1 3.25Å; G131-Y133 WeakPolarHBondContact O-CE1 3.32Å; G131-Y133 WeakPolarHBondContact O-CE2 3.27Å; G131-Y133 VanDerWaalsContact O-CZ 3.25Å; G131-Y133 PolarHBondContact O-N 3.42Å
132G55.8Low60Low67 Ų67134 Ų13469%0.69170%0.702SS**  trans-71.686.3176.300000111.1K130 K134K130-G132 VanDerWaalsContact C-N 3.28Å; K130-G132 PolarHBondContact O-N 2.89Å; G132-K134 PolarHBondContact O-N 3.2Å
133Y54.3Low59.3Low216 Ų216135.9 Ų135.985%0.84771%0.707SS**  trans-57.2103.3171.9-9.8-92.2000108.4G131 K135G131-Y133 VanDerWaalsContact C-N 3.33Å; G131-Y133 WeakPolarHBondContact O-CD1 3.34Å; G131-Y133 VanDerWaalsContact O-CE1 3.25Å; G131-Y133 WeakPolarHBondContact O-CE1 3.32Å; G131-Y133 WeakPolarHBondContact O-CE2 3.27Å; G131-Y133 VanDerWaalsContact O-CZ 3.25Å; G131-Y133 PolarHBondContact O-N 3.42Å; Y133-K135 PolarHBondContact O-N 2.9Å
134K57.5Low57.5Low196 Ų196137.5 Ų137.585%0.85271%0.712SS**  trans-56.8121.5161.2-75.2-79-172.9165.20105.6G132 E136G132-K134 PolarHBondContact O-N 3.2Å; K134-E136 PolarHBondContact O-N 3.39Å
135K52.4Low56.6Low190 Ų190137.9 Ų137.983%0.82672%0.72SS**  trans-68.989.3174.8-161.9-171.4-175-159.10107Y133 D137Y133-K135 PolarHBondContact O-N 2.9Å; K135-D137 VanDerWaalsContact C-N 3.33Å; K135-D137 PolarHBondContact O-N 3.34Å
136E50.1Low55.3Low163 Ų163136.5 Ų136.576%0.76272%0.72SS**  trans-66.696.2171.2-173.1176.6153.300106.9K134 T138K134-E136 PolarHBondContact O-N 3.39Å; E136-T138 VanDerWaalsContact C-N 3.27Å; E136-T138 PolarHBondContact O-N 3.47Å
137D44.7Very low54.3Low131 Ų131137.5 Ų137.570%0.70173%0.729SS**  trans-71.992.7169.4-128.6-29.2000106.3K135 S139K135-D137 VanDerWaalsContact C-N 3.33Å; K135-D137 PolarHBondContact O-N 3.34Å; D137-S139 PolarHBondContact O-N 2.88Å
138T53.5Low53.2Low99 Ų99137.8 Ų137.861%0.60773%0.725SS**  trans-67.572.6-179.5-49.90000110.5E136 Q140E136-T138 VanDerWaalsContact C-N 3.27Å; E136-T138 PolarHBondContact O-N 3.47Å; T138-Q140 HydrophobicContact CG2-CG 4.35Å; T138-Q140 PolarHBondContact O-N 3.07Å
139S46.9Very low52.8Low90 Ų90133.2 Ų133.263%0.62971%0.714SS**  trans-82.5105163.1-68.90000108.1D137 S141D137-S139 PolarHBondContact O-N 2.88Å; S139-S141 VanDerWaalsContact C-N 3.3Å; S139-S141 PolarHBondContact O-N 3.33Å
140Q57.9Low52.2Low189 Ų189137.1 Ų137.188%0.88373%0.731SS**  trans-69.781177.8-64.3177.5-4700111.4T138T138-Q140 HydrophobicContact CG2-CG 4.35Å; T138-Q140 PolarHBondContact O-N 3.07Å
141S46.9Very low51.8Low93 Ų93128.6 Ų128.665%0.6570%0.702SS**  trans-174.6129.816955.60000107.8S139S139-S141 VanDerWaalsContact C-N 3.3Å; S139-S141 PolarHBondContact O-N 3.33Å
142S43.3Very low51.5Low94 Ų94134.4 Ų134.466%0.65772%0.716SS**  cis-147.9175.315-67.20000111.1D144S142-D144 VanDerWaalsContact C-N 3.34Å; S142-D144 PolarHBondContact O-N 2.97Å
143H51.5Low51.7Low158 Ų158135.2 Ų135.273%0.73172%0.717SS**  trans-66.888.2163.7-177.4-38000109.8E145H143-E145 IonicContact CE1-OE1 3.32Å; H143-E145 PolarHBondContact CE1-OE1 3.17Å
144D40.4Very low52.2Low136 Ų136127.9 Ų127.973%0.72771%0.707SS**  trans-112113.6172.6-86.1-53.3000111.2S142 N146S142-D144 VanDerWaalsContact C-N 3.34Å; S142-D144 PolarHBondContact O-N 2.97Å; D144-N146 PolarHBondContact O-N 2.9Å
145E53.7Low52.7Low171 Ų171122.1 Ų122.180%0.79969%0.688SS**  trans-73.464.2172.3-69.9-69.3158.100110.3H143H143-E145 IonicContact CE1-OE1 3.32Å; H143-E145 PolarHBondContact CE1-OE1 3.17Å
146N47.6Very low53.4Low131 Ų131116 Ų11670%0.70166%0.664SS**  trans-142.488.1166-170.323.7000110.2D144 E148D144-N146 PolarHBondContact O-N 2.9Å; N146-E148 VanDerWaalsContact C-N 3.3Å; N146-E148 PolarHBondContact O-N 2.92Å
147S51.7Low54.3Low99 Ų99111.1 Ų111.169%0.69265%0.651SS**  trans-67.888.5170.347.50000110V149S147-V149 VanDerWaalsContact C-N 3.28Å; S147-V149 PolarHBondContact O-N 3.31Å
148E51.7Low55.9Low156 Ų156106.7 Ų106.773%0.72964%0.637SS**  trans-62.993.7166.4-169.6178.3132.400108.7N146 T150N146-E148 VanDerWaalsContact C-N 3.3Å; N146-E148 PolarHBondContact O-N 2.92Å; E148-T150 PolarHBondContact O-N 2.94Å
149V57.8Low57.3Low111 Ų111107 Ų10767%0.67363%0.634SS**THydrogen-bonded Turntrans-72.852.6-176.3-79.70000112.6S147 I156S147-V149 VanDerWaalsContact C-N 3.28Å; S147-V149 PolarHBondContact O-N 3.31Å; V149-I156 HydrophobicContact CB-CD1 4.37Å; V149-I156 HydrophobicContact CG1-CD1 4.41Å
150T53.1Low59.1Low120 Ų120107.6 Ų107.674%0.73663%0.633SS**THydrogen-bonded Turntrans-134.919.2168.6-37.10000112.5E148E148-T150 PolarHBondContact O-N 2.94Å
151A53.9Low60.1Low44 Ų44102.2 Ų102.236%0.36462%0.616SS.*SBendtrans-68.3137.6153.500000108.7A153 T155 I156A151-A153 PolarHBondContact O-N 3.43Å; A151-T155 HydrophobicContact CB-CG2 4.36Å; A151-I156 HydrophobicContact CB-CG1 4.13Å; A151-I156 WeakPolarHBondContact O-CD1 3.17Å; A151-I156 WeakPolarHBondContact O-CG1 3.26Å
152E57.8Low61.9Low168 Ų168100.7 Ų100.779%0.78561%0.609SS**  trans-51.4138.1-175.2-52-173.5-161.900110.9G154 T155E152-G154 PolarHBondContact O-N 2.68Å; E152-T155 WeakPolarHBondContact O-CB 3.31Å; E152-T155 PolarHBondContact O-N 3.36Å
153A59.1Low64Low84 Ų84100.1 Ų100.169%0.69460%0.602SS**Hα-helixtrans-55-24.5-161.800000115.4A151 A157A151-A153 PolarHBondContact O-N 3.43Å; A153-A157 WeakPolarHBondContact O-CB 3.32Å; A153-A157 PolarHBondContact O-N 3.27Å; A153-A157 VanDerWaalsContact O-N 3.1Å
154G63.9Low65.9Low62 Ų6294.2 Ų94.264%0.63958%0.584SS**Hα-helixtrans-65.6-34.6171.600000114.3E152 G158E152-G154 PolarHBondContact O-N 2.68Å; G154-G158 PolarHBondContact O-N 3.5Å
155T69.3Low68.3Low76 Ų7694.8 Ų94.847%0.46658%0.584SS.*Hα-helixtrans-73.1-43.1177.8-51.70000111.4A151 E152 G158 I159A151-T155 HydrophobicContact CB-CG2 4.36Å; E152-T155 WeakPolarHBondContact O-CB 3.31Å; E152-T155 PolarHBondContact O-N 3.36Å; T155-G158 PolarHBondContact O-N 2.78Å; T155-G158 VanDerWaalsContact O-N 3.15Å; T155-I159 HydrophobicContact CG2-CD1 4.13Å; T155-I159 WeakPolarHBondContact O-CG1 3.39Å; T155-I159 PolarHBondContact O-N 3.07Å
156I66.6Low70Confident61 Ų6189.6 Ų89.631%0.31357%0.57SS.*Hα-helixtrans-61.6-46.7175.4-60.8175.3000110V149 A151 G158 I159 V160V149-I156 HydrophobicContact CB-CD1 4.37Å; V149-I156 HydrophobicContact CG1-CD1 4.41Å; A151-I156 HydrophobicContact CB-CG1 4.13Å; A151-I156 WeakPolarHBondContact O-CD1 3.17Å; A151-I156 WeakPolarHBondContact O-CG1 3.26Å; I156-G158 VanDerWaalsContact C-N 3.3Å; I156-G158 PolarHBondContact O-N 3.44Å; I156-I159 PolarHBondContact O-N 3.19Å; I156-V160 WeakPolarHBondContact O-CG2 3.41Å; I156-V160 PolarHBondContact O-N 3.37Å; I156-V160 VanDerWaalsContact O-N 3.16Å
157A68.7Low71.9Confident60 Ų6088.5 Ų88.550%0.49656%0.564SS.*Hα-helixtrans-61.2-38.4173.800000112.3A153 S161A153-A157 WeakPolarHBondContact O-CB 3.32Å; A153-A157 PolarHBondContact O-N 3.27Å; A153-A157 VanDerWaalsContact O-N 3.1Å; A157-S161 WeakPolarHBondContact O-CB 3.48Å; A157-S161 PolarHBondContact O-N 2.91Å
158G79.5Confident73.6Confident39 Ų3988.2 Ų88.240%0.40256%0.558SS.*Hα-helixtrans-62.2-47.6177.200000113.4G154 T155 I156 S161 A162G154-G158 PolarHBondContact O-N 3.5Å; T155-G158 PolarHBondContact O-N 2.78Å; T155-G158 VanDerWaalsContact O-N 3.15Å; I156-G158 VanDerWaalsContact C-N 3.3Å; I156-G158 PolarHBondContact O-N 3.44Å; G158-S161 PolarHBondContact O-N 2.89Å; G158-A162 WeakPolarHBondContact O-CB 3.42Å; G158-A162 PolarHBondContact O-N 2.9Å
159I82.6Confident75.3Confident105 Ų10582.6 Ų82.654%0.53854%0.542SS..Hα-helixtrans-65.1-48.4179.6-64.5163.7000110.5T155 I156 S161 A162 V163T155-I159 HydrophobicContact CG2-CD1 4.13Å; T155-I159 WeakPolarHBondContact O-CG1 3.39Å; T155-I159 PolarHBondContact O-N 3.07Å; I156-I159 PolarHBondContact O-N 3.19Å; I159-S161 VanDerWaalsContact C-N 3.3Å; I159-S161 PolarHBondContact O-N 3.09Å; I159-A162 PolarHBondContact O-N 3.44Å; I159-V163 HydrophobicContact CG2-CG2 4.5Å; I159-V163 WeakPolarHBondContact O-CG2 3.35Å; I159-V163 PolarHBondContact O-N 3.16Å
160V83.7Confident76.6Confident102 Ų10280.1 Ų80.162%0.61853%0.533SS*.Hα-helixtrans-63.1-38.4179.1177.10000111.2I156 G164I156-V160 WeakPolarHBondContact O-CG2 3.41Å; I156-V160 PolarHBondContact O-N 3.37Å; I156-V160 VanDerWaalsContact O-N 3.16Å; V160-G164 PolarHBondContact O-N 2.93Å
161S79.8Confident78.1Confident76 Ų7679.5 Ų79.553%0.53152%0.524SS..Hα-helixtrans-62.5-46.8173.4-175.10000112A157 G158 I159 V163 G164 M165A157-S161 WeakPolarHBondContact O-CB 3.48Å; A157-S161 PolarHBondContact O-N 2.91Å; G158-S161 PolarHBondContact O-N 2.89Å; I159-S161 VanDerWaalsContact C-N 3.3Å; I159-S161 PolarHBondContact O-N 3.09Å; S161-V163 PolarHBondContact O-N 3.15Å; S161-G164 PolarHBondContact O-N 3.42Å; S161-M165 WeakPolarHBondContact O-CB 3.38Å; S161-M165 PolarHBondContact O-N 3.33Å
162A83.8Confident79.4Confident61 Ų6181.1 Ų81.150%0.50453%0.529SS..Hα-helixtrans-61.9-44.3178.700000112.2G158 I159 M165 A166G158-A162 WeakPolarHBondContact O-CB 3.42Å; G158-A162 PolarHBondContact O-N 2.9Å; I159-A162 PolarHBondContact O-N 3.44Å; A162-M165 PolarHBondContact O-N 2.92Å; A162-A166 VanDerWaalsContact O-CB 3.27Å; A162-A166 WeakPolarHBondContact O-CB 3.41Å; A162-A166 PolarHBondContact O-N 3.41Å
163V88.1Confident80.3Confident83 Ų8376.8 Ų76.850%0.50352%0.518SS..Hα-helixtrans-63.7-45.2176.2174.10000111I159 S161 M165 A166 L167I159-V163 HydrophobicContact CG2-CG2 4.5Å; I159-V163 WeakPolarHBondContact O-CG2 3.35Å; I159-V163 PolarHBondContact O-N 3.16Å; S161-V163 PolarHBondContact O-N 3.15Å; V163-M165 PolarHBondContact O-N 3.46Å; V163-A166 PolarHBondContact O-N 3.38Å; V163-L167 HydrophobicContact CG1-CD1 4.28Å; V163-L167 WeakPolarHBondContact O-CG 3.4Å; V163-L167 PolarHBondContact O-N 3.04Å
164G91.4Very high81.1Confident34 Ų3479.4 Ų79.435%0.35151%0.511SS..Hα-helixtrans-60.5-44.6176.300000112.7V160 S161 L167 V168V160-G164 PolarHBondContact O-N 2.93Å; S161-G164 PolarHBondContact O-N 3.42Å; G164-L167 PolarHBondContact O-N 3.32Å; G164-V168 WeakPolarHBondContact O-CG2 3.46Å; G164-V168 PolarHBondContact O-N 2.87Å; G164-V168 VanDerWaalsContact O-N 3.07Å
165M90.5Very high81.6Confident147 Ų14781 Ų8172%0.72450%0.504SS*.Hα-helixtrans-69.3-34.7179.4-153.5168.5-164.100112.1S161 A162 V163 G169S161-M165 WeakPolarHBondContact O-CB 3.38Å; S161-M165 PolarHBondContact O-N 3.33Å; A162-M165 PolarHBondContact O-N 2.92Å; V163-M165 PolarHBondContact O-N 3.46Å; M165-G169 PolarHBondContact O-N 2.65Å
166A88.7Confident81.5Confident63 Ų6378.7 Ų78.752%0.52149%0.491SS..Hα-helixtrans-64.5-42.4172.900000112.3A162 V163 G169 A170A162-A166 VanDerWaalsContact O-CB 3.27Å; A162-A166 WeakPolarHBondContact O-CB 3.41Å; A162-A166 PolarHBondContact O-N 3.41Å; V163-A166 PolarHBondContact O-N 3.38Å; A166-G169 PolarHBondContact O-N 2.94Å; A166-A170 WeakPolarHBondContact O-CB 3.27Å; A166-A170 PolarHBondContact O-N 2.79Å
167L89.1Confident81.4Confident107 Ų10783.4 Ų83.456%0.5651%0.506SS*.Hα-helixtrans-65.2-44.3176.2-71.1171.9000112V163 G164 G169 A170 I171V163-L167 HydrophobicContact CG1-CD1 4.28Å; V163-L167 WeakPolarHBondContact O-CG 3.4Å; V163-L167 PolarHBondContact O-N 3.04Å; G164-L167 PolarHBondContact O-N 3.32Å; L167-G169 VanDerWaalsContact C-N 3.32Å; L167-G169 PolarHBondContact O-N 3.45Å; L167-A170 PolarHBondContact O-N 3.12Å; L167-I171 WeakPolarHBondContact O-CG1 3.4Å; L167-I171 PolarHBondContact O-N 3.19Å
168V86.9Confident81.4Confident93 Ų9386 Ų8656%0.56451%0.507SS*.Hα-helixtrans-61.3-42.9174.1173.30000110.9G164 I171 T172G164-V168 WeakPolarHBondContact O-CG2 3.46Å; G164-V168 PolarHBondContact O-N 2.87Å; G164-V168 VanDerWaalsContact O-N 3.07Å; V168-I171 PolarHBondContact O-N 3.43Å; V168-T172 VanDerWaalsContact O-CB 3.26Å; V168-T172 WeakPolarHBondContact O-CB 3.26Å; V168-T172 PolarHBondContact O-N 2.69Å; V168-T172 PolarHBondContact O-OG1 2.93Å
169G87.1Confident80.6Confident39 Ų3991.7 Ų91.740%0.40252%0.521SS..Hα-helixtrans-61.3-42.5174.900000112.8M165 A166 L167 S173M165-G169 PolarHBondContact O-N 2.65Å; A166-G169 PolarHBondContact O-N 2.94Å; L167-G169 VanDerWaalsContact C-N 3.32Å; L167-G169 PolarHBondContact O-N 3.45Å; G169-S173 WeakPolarHBondContact O-CB 3.4Å; G169-S173 PolarHBondContact O-N 3.46Å
170A85.4Confident79.5Confident58 Ų5895.9 Ų95.948%0.47954%0.536SS..Hα-helixtrans-66.3-44.4177.900000112.4A166 L167 S173 Y174A166-A170 WeakPolarHBondContact O-CB 3.27Å; A166-A170 PolarHBondContact O-N 2.79Å; L167-A170 PolarHBondContact O-N 3.12Å; A170-S173 PolarHBondContact O-N 3.02Å; A170-Y174 WeakPolarHBondContact O-CB 3.25Å; A170-Y174 PolarHBondContact O-N 3.04Å
171I83.8Confident78.1Confident107 Ų10799.9 Ų99.955%0.54954%0.544SS..Hα-helixtrans-65.2-44.7177-65.6164.4000110.4L167 V168 S173 Y174 I175L167-I171 WeakPolarHBondContact O-CG1 3.4Å; L167-I171 PolarHBondContact O-N 3.19Å; V168-I171 PolarHBondContact O-N 3.43Å; I171-S173 VanDerWaalsContact C-N 3.35Å; I171-S173 PolarHBondContact O-N 3.43Å; I171-Y174 PolarHBondContact O-N 3.31Å; I171-I175 HydrophobicContact CG2-CD1 3.98Å; I171-I175 WeakPolarHBondContact O-CG1 3.49Å; I171-I175 PolarHBondContact O-N 3.23Å
172T82.1Confident77Confident78 Ų7899.3 Ų99.348%0.47954%0.535SS..Hα-helixtrans-63.7-39.6176.4-58.40000112V168 S176V168-T172 VanDerWaalsContact O-CB 3.26Å; V168-T172 WeakPolarHBondContact O-CB 3.26Å; V168-T172 PolarHBondContact O-N 2.69Å; V168-T172 PolarHBondContact O-OG1 2.93Å; T172-S176 WeakPolarHBondContact O-CB 3.44Å; T172-S176 PolarHBondContact O-N 3.1Å; T172-S176 PolarHBondContact O-OG 3.25Å
173S75.6Confident75.6Confident77 Ų77101.1 Ų101.154%0.53854%0.543SS..Hα-helixtrans-63.8-45.4174.4-178.40000111.4G169 A170 I171 I175 S176 Y177G169-S173 WeakPolarHBondContact O-CB 3.4Å; G169-S173 PolarHBondContact O-N 3.46Å; A170-S173 PolarHBondContact O-N 3.02Å; I171-S173 VanDerWaalsContact C-N 3.35Å; I171-S173 PolarHBondContact O-N 3.43Å; S173-I175 PolarHBondContact O-N 3.29Å; S173-S176 CarbonylContact O-C 3.51Å; S173-S176 WeakPolarHBondContact O-CB 3.12Å; S173-S176 PolarHBondContact O-N 2.8Å; S173-S176 VanDerWaalsContact O-N 3.15Å; S173-Y177 WeakPolarHBondContact O-CB 3.36Å; S173-Y177 PolarHBondContact O-N 3.28Å
174Y75.8Confident73.9Confident139 Ų139105.2 Ų105.255%0.54555%0.554SS.*Hα-helixtrans-63.2-42.8178.7-176.1-108.4000112.6A170 I171 S176 Y177 Q178A170-Y174 WeakPolarHBondContact O-CB 3.25Å; A170-Y174 PolarHBondContact O-N 3.04Å; I171-Y174 PolarHBondContact O-N 3.31Å; Y174-S176 VanDerWaalsContact C-N 3.32Å; Y174-S176 PolarHBondContact O-N 3.42Å; Y174-Y177 PolarHBondContact O-N 3.11Å; Y174-Q178 HydrophobicContact CD1-CG 4.47Å; Y174-Q178 HydrophobicContact CE1-CG 4.11Å; Y174-Q178 HydrophobicContact CE2-CG 4.33Å; Y174-Q178 WeakPolarHBondContact O-CB 3.12Å; Y174-Q178 WeakPolarHBondContact O-CG 3.41Å; Y174-Q178 PolarHBondContact O-N 3.04Å; Y174-Q178 PolarHBondContact OH-NE2 3.33Å
175I76.1Confident72.1Confident96 Ų96106 Ų10649%0.49255%0.554SS.*Hα-helixtrans-62.6-40.3173.6-66.7165.3000111I171 S173 K179I171-I175 HydrophobicContact CG2-CD1 3.98Å; I171-I175 WeakPolarHBondContact O-CG1 3.49Å; I171-I175 PolarHBondContact O-N 3.23Å; S173-I175 PolarHBondContact O-N 3.29Å; I175-K179 PolarHBondContact O-N 3.41Å
176S66.4Low70.5Confident28 Ų28103.3 Ų103.320%0.19654%0.543CS..Hα-helixtrans-67.5-36.4178-59.60000112.7T172 S173 Y174T172-S176 WeakPolarHBondContact O-CB 3.44Å; T172-S176 PolarHBondContact O-N 3.1Å; T172-S176 PolarHBondContact O-OG 3.25Å; S173-S176 CarbonylContact O-C 3.51Å; S173-S176 WeakPolarHBondContact O-CB 3.12Å; S173-S176 PolarHBondContact O-N 2.8Å; S173-S176 VanDerWaalsContact O-N 3.15Å; Y174-S176 VanDerWaalsContact C-N 3.32Å; Y174-S176 PolarHBondContact O-N 3.42Å
177Y64.7Low68.9Low160 Ų160107.1 Ų107.163%0.62755%0.55SS*.Hα-helixtrans-68.5-49.1176.2-177.5-105.3000111.7S173 Y174 K179 K180S173-Y177 WeakPolarHBondContact O-CB 3.36Å; S173-Y177 PolarHBondContact O-N 3.28Å; Y174-Y177 PolarHBondContact O-N 3.11Å; Y177-K179 PolarHBondContact O-N 2.78Å; Y177-K180 PolarHBondContact O-N 3.14Å; Y177-K180 VanDerWaalsContact O-N 3.08Å
178Q68.3Low67.3Low114 Ų114108.3 Ų108.353%0.53355%0.552SS.*Hα-helixtrans-56.4-33177.2-77.5-73.79.700112.8Y174 K180Y174-Q178 HydrophobicContact CD1-CG 4.47Å; Y174-Q178 HydrophobicContact CE1-CG 4.11Å; Y174-Q178 HydrophobicContact CE2-CG 4.33Å; Y174-Q178 WeakPolarHBondContact O-CB 3.12Å; Y174-Q178 WeakPolarHBondContact O-CG 3.41Å; Y174-Q178 PolarHBondContact O-N 3.04Å; Y174-Q178 PolarHBondContact OH-NE2 3.33Å; Q178-K180 PolarHBondContact O-N 3Å
179K63.8Low65.9Low158 Ų158107 Ų10769%0.68755%0.547SS*.THydrogen-bonded Turntrans-83.95.4179.4-72.5-157.4176.7-177.60115.9I175 Y177 K181I175-K179 PolarHBondContact O-N 3.41Å; Y177-K179 PolarHBondContact O-N 2.78Å; K179-K181 WeakPolarHBondContact O-CG 3.16Å; K179-K181 PolarHBondContact O-N 3.36Å
180K57.9Low64.4Low194 Ų194110 Ų11084%0.84355%0.554SS**THydrogen-bonded Turntrans46.420.2168.8-68.4-167.3177.7-175.50117.6Y177 Q178Y177-K180 PolarHBondContact O-N 3.14Å; Y177-K180 VanDerWaalsContact O-N 3.08Å; Q178-K180 PolarHBondContact O-N 3Å
181K55.4Low63Low185 Ų185112 Ų11280%0.80456%0.556SS**SBendtrans-130.3-1.2-174.9-71-161.2177.3-166.70115.2K179K179-K181 WeakPolarHBondContact O-CG 3.16Å; K179-K181 PolarHBondContact O-N 3.36Å
182L56.1Low61.7Low65 Ų65110.9 Ų110.934%0.3455%0.554SS.*SBendtrans-113.2-10.9-175.1-63.3177.9000115F184 S185 L186L182-F184 PolarHBondContact O-N 2.9Å; L182-S185 WeakPolarHBondContact CD2-OG 3.49Å; L182-S185 PolarHBondContact O-N 3.39Å; L182-L186 PolarHBondContact O-N 2.76Å
183C55Low60.5Low99 Ų99112.3 Ų112.367%0.66956%0.559SS**THydrogen-bonded Turntrans-64.70.9175.1-67.80000115.1
184F52.1Low59.4Low168 Ų168113.8 Ų113.874%0.73756%0.56SS**THydrogen-bonded Turntrans-124.1-22.4173.9-150-96.2000113.4L182L182-F184 PolarHBondContact O-N 2.9Å
185S52.9Low58.6Low50 Ų50111.8 Ų111.835%0.3556%0.558SS.*Hα-helixtrans-90.9-19.6-179.584.30000113.8L182 Q187 Q188 S189L182-S185 WeakPolarHBondContact CD2-OG 3.49Å; L182-S185 PolarHBondContact O-N 3.39Å; S185-Q187 VanDerWaalsContact C-N 3.35Å; S185-Q188 PolarHBondContact O-N 3.1Å; S185-S189 WeakPolarHBondContact O-CB 3.42Å; S185-S189 PolarHBondContact O-N 3.3Å
186L58.3Low57.5Low92 Ų92114.8 Ų114.848%0.48257%0.568SS.*Hα-helixtrans-69.6-32.8176.6-117.775.8000112.5L182 S189 L190L182-L186 PolarHBondContact O-N 2.76Å; L186-S189 PolarHBondContact O-N 2.85Å; L186-L190 PolarHBondContact O-N 3.44Å
187Q53.3Low56.8Low143 Ų143117 Ų11767%0.66859%0.588SS**Hα-helixtrans-66.1-40.3172.7-72.2-178.8-24.700111S185 N191S185-Q187 VanDerWaalsContact C-N 3.35Å; Q187-N191 WeakPolarHBondContact O-CB 3.11Å; Q187-N191 PolarHBondContact O-N 2.92Å
188Q55.3Low55.8Low132 Ų132117 Ų11762%0.61759%0.593SS**Hα-helixtrans-69.3-35.7172.1-165.1171.8-5.500111.9S185 V192S185-Q188 PolarHBondContact O-N 3.1Å; Q188-V192 HydrophobicContact CG-CG2 4.3Å; Q188-V192 WeakPolarHBondContact O-CB 3.27Å; Q188-V192 WeakPolarHBondContact O-CG2 3.15Å; Q188-V192 PolarHBondContact O-N 2.94Å
189S58.5Low54.5Low65 Ų65117.7 Ų117.746%0.45560%0.599SS.*Hα-helixtrans-66.9-55.3178.2-163.90000111.6S185 L186 N191 V192 D193S185-S189 WeakPolarHBondContact O-CB 3.42Å; S185-S189 PolarHBondContact O-N 3.3Å; L186-S189 PolarHBondContact O-N 2.85Å; S189-N191 PolarHBondContact O-N 3.34Å; S189-V192 PolarHBondContact O-N 3.44Å; S189-D193 VanDerWaalsContact O-CB 3.3Å; S189-D193 WeakPolarHBondContact O-CB 3.44Å; S189-D193 PolarHBondContact O-N 3.5Å
190L56.5Low53.4Low102 Ų102115.3 Ų115.353%0.53460%0.6SS.*Hα-helixtrans-65.2-38.3177.7-9784.6000111.9L186 D193 I194L186-L190 PolarHBondContact O-N 3.44Å; L190-D193 PolarHBondContact O-N 2.97Å; L190-I194 HydrophobicContact CB-CD1 4.49Å; L190-I194 HydrophobicContact CD2-CD1 4.5Å; L190-I194 WeakPolarHBondContact O-CB 3.36Å; L190-I194 VanDerWaalsContact O-CG1 3.26Å; L190-I194 WeakPolarHBondContact O-CG1 3.47Å; L190-I194 PolarHBondContact O-N 2.97Å
191N54.3Low52.8Low100 Ų100115.7 Ų115.754%0.53561%0.605SS.*Hα-helixtrans-69.6-34.5178.2-167.564.3000111.6Q187 S189 N195Q187-N191 WeakPolarHBondContact O-CB 3.11Å; Q187-N191 PolarHBondContact O-N 2.92Å; S189-N191 PolarHBondContact O-N 3.34Å; N191-N195 VanDerWaalsContact CG-ND2 3.3Å; N191-N195 PolarHBondContact ND2-ND2 2.8Å; N191-N195 VanDerWaalsContact O-CB 3.27Å; N191-N195 WeakPolarHBondContact O-CB 3.46Å; N191-N195 PolarHBondContact O-N 3.42Å; N191-N195 PolarHBondContact O-ND2 2.97Å; N191-N195 PolarHBondContact OD1-ND2 3.18Å
192V58.3Low52.4Low83 Ų83109.5 Ų109.550%0.50359%0.594SS.*Hα-helixtrans-72.3-36.5171.6168.80000111.4Q188 S189 K196Q188-V192 HydrophobicContact CG-CG2 4.3Å; Q188-V192 WeakPolarHBondContact O-CB 3.27Å; Q188-V192 WeakPolarHBondContact O-CG2 3.15Å; Q188-V192 PolarHBondContact O-N 2.94Å; S189-V192 PolarHBondContact O-N 3.44Å; V192-K196 WeakPolarHBondContact O-CB 3.29Å; V192-K196 PolarHBondContact O-N 3.03Å
193D55.9Low51.4Low109 Ų109113.1 Ų113.158%0.58362%0.618SS**Hα-helixtrans-69.6-48.9180-146.9-71.8000111.2S189 L190 K196 A197S189-D193 VanDerWaalsContact O-CB 3.3Å; S189-D193 WeakPolarHBondContact O-CB 3.44Å; S189-D193 PolarHBondContact O-N 3.5Å; L190-D193 PolarHBondContact O-N 2.97Å; D193-K196 CarbonylContact O-C 3.6Å; D193-K196 PolarHBondContact O-N 3.26Å; D193-K196 VanDerWaalsContact O-N 3.11Å; D193-A197 WeakPolarHBondContact O-CB 3.41Å; D193-A197 PolarHBondContact O-N 2.97Å
194I52.6Low51.2Low108 Ų108114.9 Ų114.955%0.55463%0.626SS**Hα-helixtrans-64.5-47.7179-65.9168000111.4L190 K196 A197 E198L190-I194 HydrophobicContact CB-CD1 4.49Å; L190-I194 HydrophobicContact CD2-CD1 4.5Å; L190-I194 WeakPolarHBondContact O-CB 3.36Å; L190-I194 VanDerWaalsContact O-CG1 3.26Å; L190-I194 WeakPolarHBondContact O-CG1 3.47Å; L190-I194 PolarHBondContact O-N 2.97Å; I194-K196 PolarHBondContact O-N 3.49Å; I194-K196 VanDerWaalsContact O-N 3.14Å; I194-A197 PolarHBondContact O-N 3.43Å; I194-E198 PolarHBondContact O-N 3.1Å
195N58.2Low51Low96 Ų96110.6 Ų110.651%0.51362%0.621SS.*Hα-helixtrans-69.3-8176.8-68.9-60.9000113.4N191N191-N195 VanDerWaalsContact CG-ND2 3.3Å; N191-N195 PolarHBondContact ND2-ND2 2.8Å; N191-N195 VanDerWaalsContact O-CB 3.27Å; N191-N195 WeakPolarHBondContact O-CB 3.46Å; N191-N195 PolarHBondContact O-N 3.42Å; N191-N195 PolarHBondContact O-ND2 2.97Å; N191-N195 PolarHBondContact OD1-ND2 3.18Å
196K54.4Low50.7Low160 Ų160114.3 Ų114.370%0.69664%0.642SS**Hα-helixtrans-104.4-22.4174.8-168.9-177.6-178.1-164.90112.6V192 D193 I194 E198V192-K196 WeakPolarHBondContact O-CB 3.29Å; V192-K196 PolarHBondContact O-N 3.03Å; D193-K196 CarbonylContact O-C 3.6Å; D193-K196 PolarHBondContact O-N 3.26Å; D193-K196 VanDerWaalsContact O-N 3.11Å; I194-K196 PolarHBondContact O-N 3.49Å; I194-K196 VanDerWaalsContact O-N 3.14Å; K196-E198 VanDerWaalsContact C-N 3.33Å
197A51.3Low50.2Low75 Ų75116.8 Ų116.862%0.6265%0.651SS**Hα-helixtrans-76.8-17.5174.700000113.2D193 I194 I199D193-A197 WeakPolarHBondContact O-CB 3.41Å; D193-A197 PolarHBondContact O-N 2.97Å; I194-A197 PolarHBondContact O-N 3.43Å; A197-I199 VanDerWaalsContact C-N 3.3Å; A197-I199 PolarHBondContact O-N 3.25Å
198E43.5Very low50Low158 Ų158115.3 Ų115.374%0.73865%0.654SS**THydrogen-bonded Turntrans-80.4-3.2176.9-149.6-174.7151.200114.1I194 K196 P200I194-E198 PolarHBondContact O-N 3.1Å; K196-E198 VanDerWaalsContact C-N 3.33Å; E198-P200 WeakPolarHBondContact O-CD 3.36Å
199I40.6Very low49.6Very low129 Ų129117 Ų11766%0.66266%0.662SS**SBendtrans-119.990.6175-52.5-174.7000110A197 E201A197-I199 VanDerWaalsContact C-N 3.3Å; A197-I199 PolarHBondContact O-N 3.25Å; I199-E201 PolarHBondContact O-N 3.4Å
200P41.9Very low49Very low108 Ų108117.6 Ų117.670%0.70167%0.671SS**  trans-68.2123.3173.627.4-33.2000111.1E198 G202E198-P200 WeakPolarHBondContact O-CD 3.36Å; P200-G202 PolarHBondContact O-N 3.35Å
201E45Very low48.6Very low202 Ų202121.8 Ų121.894%0.94469%0.688SS**SBendtrans37.869.7151.9-70.9-69.813700116I199I199-E201 PolarHBondContact O-N 3.4Å
202G46.5Very low48.2Very low55 Ų55126.7 Ų126.757%0.56771%0.707SS**  trans-155.2107179.400000114.7P200P200-G202 PolarHBondContact O-N 3.35Å
203V35.9Very low47.8Very low142 Ų142129.2 Ų129.286%0.86172%0.723SS**  trans73.393.4163-172.20000116.8
204V50.1Low47.2Very low135 Ų135131.7 Ų131.782%0.81874%0.735SS**  trans-3.6118.4130.5175.20000115.6
205A46.8Very low46.9Very low78 Ų78134.8 Ų134.865%0.64575%0.752SS**  160.1149.312400000114.2
206T46.7Very low46.5Very low128 Ų128139.3 Ų139.379%0.78577%0.77SS**  trans58.2103.8151.435.60000120.4
207E48.8Very low45.9Very low144 Ų144140.5 Ų140.567%0.67378%0.778SS**  trans-26.4130130.5173.3-177.9-179.800114.2Q209E207-Q209 HydrophobicContact CG-CG 4.2Å; E207-Q209 WeakPolarHBondContact OE1-CG 3.44Å; E207-Q209 PolarHBondContact OE1-NE2 3.44Å
208P49Very low45.6Very low113 Ų113142.1 Ų142.173%0.73478%0.782SS**  trans-110.196.7162.832.7-21.8000111.7A210P208-A210 PolarHBondContact O-N 3.38Å
209Q46.7Very low45.2Very low168 Ų168144.3 Ų144.379%0.78579%0.79SS**  trans-65.181.3155.5-67.7-79.6-16.500109.6E207E207-Q209 HydrophobicContact CG-CG 4.2Å; E207-Q209 WeakPolarHBondContact OE1-CG 3.44Å; E207-Q209 PolarHBondContact OE1-NE2 3.44Å
210A46.4Very low45.1Very low77 Ų77143.7 Ų143.764%0.63680%0.797SS**  trans-159.6115.5171.300000111.1P208P208-A210 PolarHBondContact O-N 3.38Å
211Q47Very low44.8Very low190 Ų190142 Ų14289%0.88880%0.799SS**SBendtrans170.7-8.2142.7-76.9-125.77.200112T213Q211-T213 VanDerWaalsContact C-N 3.32Å; Q211-T213 PolarHBondContact O-N 3.36Å
212Q46.2Very low45.1Very low203 Ų203138.2 Ų138.295%0.94979%0.792SS**SBendtrans-84.26176.4-66.9-164.6-42.100115.3
213T50Low45.2Very low135 Ų135140.7 Ų140.783%0.82880%0.798SS**SBendtrans-114.744.5-174.1-43.50000112.7Q211Q211-T213 VanDerWaalsContact C-N 3.32Å; Q211-T213 PolarHBondContact O-N 3.36Å
214L44.4Very low45.4Very low161 Ų161140.1 Ų140.184%0.84380%0.798SS**SBendtrans-150.731.3178.3-151.891.2000116.8
215L45.3Very low45.6Very low174 Ų174140.7 Ų140.791%0.91180%0.797SS**SBendtrans-146.1-3.1169.1-115.3174.9000117.6
216E51Low45.7Very low191 Ų191146.1 Ų146.189%0.89381%0.809SS**  trans-136.989.4179.2-162.6168.7115.700113.3
217Q41.3Very low45.6Very low185 Ų185147.9 Ų147.986%0.86481%0.813SS**  trans173.9157.6148.1-101.91806.400109.8
218P44.3Very low45.3Very low109 Ų109145.2 Ų145.271%0.70882%0.816SS**  cis-137.1-168.1-15.937.7-18.6000114
219K34.9Very low44.8Very low204 Ų204150.5 Ų150.589%0.88785%0.846SS**  trans78.6132.3164-112.9171.2176.667.90115.5
220S38.2Very low44.7Very low116 Ų116149.7 Ų149.781%0.81185%0.849SS**  cis-151.4139.46.753.10000110.4
221G35.7Very low44.6Very low72 Ų72153.5 Ų153.574%0.74286%0.86SS**  127.4155.493.600000110.9
222P51.2Low44.4Very low123 Ų123151.4 Ų151.480%0.79986%0.859SS**  trans-122.9-161.2-150.541.2-25.7000114.3
223P49.5Very low44.3Very low107 Ų107148.4 Ų148.470%0.69585%0.854SS**  -106.1174.6-74.938.8-27.1000111.6
224C40.5Very low44Very low129 Ų129149.3 Ų149.387%0.87286%0.855SS**  trans-133.8140.8160.5-72.50000109.3
225D52.8Low44Very low148 Ų148148.5 Ų148.579%0.79186%0.856SS**  trans-83141.2-159.7-46.4-90.4000114
226E50.4Low43.9Very low191 Ų191146.6 Ų146.689%0.89385%0.852SS**  trans-12996.2150.564.3-176.5173.100110.2
227N44Very low43.3Very low165 Ų165143.2 Ų143.288%0.88285%0.849SS**  trans-80.8125.2161.6-91-52.9000108.3
228A41.5Very low43.5Very low88 Ų88139.8 Ų139.873%0.72785%0.848SS**  trans-135.2145.7167.900000109.5
229V38.7Very low43.4Very low225 Ų225142.5 Ų142.5100%1.36486%0.86SS**  trans83.70-170.5-170.50000114.1

Retrieved 229 of 229 residues in 158.9 ms (Link to these results)