A0A087XGP7_POEFO Loading...

Transcriptional adaptor 3 (NGG1 homolog, yeast)-like

AlphaFold DB (A0A3B3V4W9), UniProt , Accession A0A087XGP7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 431 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
1M41.1Very low60.6Low237 Ų237129.6 Ų129.6100%1.16768%0.683SS**  083.40-71-161.9-71.400107.9
2S45Very low61.8Low116 Ų116136.7 Ų136.781%0.81170%0.696SS**  trans-144.911.4-161.8-44.20000115.5
3E43.5Very low63.1Low191 Ų191132.8 Ų132.889%0.89367%0.669SS**  trans-123.441-172.5-62-161.9154.900113.6
4L50.1Low64.1Low159 Ų159132.4 Ų132.483%0.83267%0.669SS**  trans-122.524.1176.3-143.280.2000113.5
5K54.8Low65.2Low200 Ų200128.1 Ų128.187%0.8765%0.645SS**SBendtrans-100.2-19.6178.8-83.1-168.6173.6-171.20115.2
6D60.8Low66.1Low133 Ų133129.6 Ų129.671%0.71165%0.646SS**SBendtrans-106.833.3-173.6-70.1-11.6000113.2W75D6-W75 WeakPolarHBondContact O-CZ2 3.31Å
7C62.5Low66.8Low86 Ų86127.6 Ų127.658%0.58164%0.644SS**SBendtrans-102.1139.7171.3-72.50000110.7
8P68.4Low67.9Low26 Ų26121.9 Ų121.917%0.16962%0.617CS.*  trans-60.4140.5171.525-32.4000110.1L10 L72 W75P8-L10 HydrophobicContact CB-CG 4.49Å; P8-L10 HydrophobicContact CG-CG 4.36Å; P8-L10 PolarHBondContact O-N 2.68Å; P8-L72 HydrophobicContact CB-CD2 4.18Å; P8-L72 HydrophobicContact CG-CD2 3.68Å; P8-W75 HydrophobicContact CB-CB 4.17Å; P8-W75 HydrophobicContact CB-CD2 4.01Å; P8-W75 HydrophobicContact CB-CG 3.82Å; P8-W75 HydrophobicContact CG-CD2 4.27Å; P8-W75 HydrophobicContact CG-CE3 4.37Å
9P76.6Confident69Low104 Ų104121.4 Ų121.468%0.67561%0.612SS**  trans-77.867.3-175.733.2-36.8000111.5I71P9-I71 HydrophobicContact CG-CG2 4.47Å
10L81Confident70Confident55 Ų55118.7 Ų118.729%0.28860%0.597SS.*  trans-71.9133.7178.4-69.7178.5000111.8P8 Q68 L72P8-L10 HydrophobicContact CB-CG 4.49Å; P8-L10 HydrophobicContact CG-CG 4.36Å; P8-L10 PolarHBondContact O-N 2.68Å; L10-Q68 HydrophobicContact CD2-CB 4.06Å; L10-L72 HydrophobicContact CD1-CD1 4.46Å; L10-L72 HydrophobicContact CD1-CD2 4.25Å; L10-L72 HydrophobicContact CD2-CD1 4.25Å; L10-L72 HydrophobicContact CD2-CD2 4.36Å; L10-L72 HydrophobicContact CD2-CG 4Å
11K82.3Confident70.9Confident119 Ų119118 Ų11852%0.51760%0.599SS.*  trans-88.2117166.2-65.3172.6-171.2160.40108.8Y13 E67K11-Y13 HydrophobicContact CB-CD2 4.22Å; K11-Y13 HydrophobicContact CB-CE2 3.65Å; K11-Y13 HydrophobicContact CD-CE2 4.45Å; K11-Y13 VanDerWaalsContact O-CD2 3.24Å; K11-Y13 WeakPolarHBondContact O-CD2 3.34Å; K11-Y13 PolarHBondContact O-N 2.67Å; K11-E67 IonicContact NZ-OE1 3.45Å; K11-E67 PolarHBondContact NZ-OE1 2.72Å
12Y75.6Confident73.2Confident214 Ų214114 Ų11484%0.83958%0.575SS**  trans-77.8110168.5-65.6-84.4000109
13Y78.8Confident75.3Confident86 Ų86113.8 Ų113.834%0.33756%0.564SS.*  trans-90.2123.9176-68.5-92.5000110.2K11 F15 A64 Q68K11-Y13 HydrophobicContact CB-CD2 4.22Å; K11-Y13 HydrophobicContact CB-CE2 3.65Å; K11-Y13 HydrophobicContact CD-CE2 4.45Å; K11-Y13 VanDerWaalsContact O-CD2 3.24Å; K11-Y13 WeakPolarHBondContact O-CD2 3.34Å; K11-Y13 PolarHBondContact O-N 2.67Å; Y13-F15 VanDerWaalsContact CB-CE1 3.46Å; Y13-F15 VanDerWaalsContact CB-CZ 3.4Å; Y13-F15 HydrophobicContact CD1-CE1 4.38Å; Y13-F15 HydrophobicContact CD2-CZ 4.16Å; Y13-F15 AromaticContact CG-CE1 3.95Å; Y13-F15 HydrophobicContact CG-CE1 3.95Å; Y13-F15 AromaticContact CG-CZ 3.86Å; Y13-F15 HydrophobicContact CG-CZ 3.86Å; Y13-F15 PolarHBondContact O-N 2.95Å; Y13-F15 VanDerWaalsContact O-N 3.12Å; Y13-A64 HydrophobicContact CD1-CB 4.29Å; Y13-A64 HydrophobicContact CD2-CB 4.33Å; Y13-A64 HydrophobicContact CE1-CB 4.02Å; Y13-A64 HydrophobicContact CE2-CB 4.09Å; Y13-A64 HydrophobicContact CG-CB 4.44Å; Y13-Q68 HydrophobicContact CD2-CG 4.27Å; Y13-Q68 HydrophobicContact CE2-CG 3.82Å
14D77.4Confident77.7Confident127 Ų127104.7 Ų104.768%0.67952%0.521SS*.  trans-75.294.7165.5178.314.9000109.2K16D14-K16 VanDerWaalsContact C-N 3.3Å; D14-K16 PolarHBondContact O-N 3.13Å; D14-K16 WeakPolarHBondContact OD2-CE 3.24Å; D14-K16 IonicContact OD2-NZ 2.7Å
15F80.1Confident79.7Confident69 Ų69100.7 Ų100.730%0.30351%0.505SS..  trans-81.772.1-177.7-69.2-51.7000112.5Y13 R61 A64 L65Y13-F15 VanDerWaalsContact CB-CE1 3.46Å; Y13-F15 VanDerWaalsContact CB-CZ 3.4Å; Y13-F15 HydrophobicContact CD1-CE1 4.38Å; Y13-F15 HydrophobicContact CD2-CZ 4.16Å; Y13-F15 AromaticContact CG-CE1 3.95Å; Y13-F15 HydrophobicContact CG-CE1 3.95Å; Y13-F15 AromaticContact CG-CZ 3.86Å; Y13-F15 HydrophobicContact CG-CZ 3.86Å; Y13-F15 PolarHBondContact O-N 2.95Å; Y13-F15 VanDerWaalsContact O-N 3.12Å; F15-R61 HydrophobicContact CD1-CB 3.9Å; F15-R61 HydrophobicContact CD1-CG 3.5Å; F15-R61 HydrophobicContact CE1-CB 3.87Å; F15-R61 HydrophobicContact CE1-CG 3.89Å; F15-R61 HydrophobicContact CG-CG 4.28Å; F15-A64 HydrophobicContact CE1-CB 4.16Å; F15-A64 HydrophobicContact CZ-CB 4.18Å; F15-L65 HydrophobicContact CE2-CD1 4.14Å; F15-L65 HydrophobicContact CE2-CD2 3.67Å; F15-L65 HydrophobicContact CE2-CG 3.73Å; F15-L65 HydrophobicContact CZ-CD1 4.43Å; F15-L65 HydrophobicContact CZ-CD2 4.08Å; F15-L65 HydrophobicContact CZ-CG 3.77Å
16K79.1Confident81.5Confident151 Ų15195.5 Ų95.566%0.65748%0.48SS*.PPolyproline II helixtrans-57.8123.7170.2-59.8-168.7-176.7-172.40110.1D14D14-K16 VanDerWaalsContact C-N 3.3Å; D14-K16 PolarHBondContact O-N 3.13Å; D14-K16 WeakPolarHBondContact OD2-CE 3.24Å; D14-K16 IonicContact OD2-NZ 2.7Å
17P79.2Confident83.1Confident96 Ų9692.2 Ų92.262%0.62346%0.458SS*.PPolyproline II helixtrans-65.7159173.828.9-34.1000110.1E19P17-E19 PolarHBondContact O-N 3.46Å
18V85.8Confident84.6Confident26 Ų2689.9 Ų89.916%0.15844%0.441CS..PPolyproline II helixtrans-66.9127.4170.4-1760000108H20 L23 L54 S57V18-H20 PolarHBondContact O-N 3.39Å; V18-L23 HydrophobicContact CG1-CB 4.08Å; V18-L23 HydrophobicContact CG1-CD1 3.79Å; V18-L54 HydrophobicContact CB-CD2 3.74Å; V18-L54 HydrophobicContact CG1-CD2 3.86Å; V18-L54 HydrophobicContact CG2-CD2 4.16Å; V18-S57 WeakPolarHBondContact CG2-OG 3.35Å
19E89Confident85.7Confident111 Ų11191 Ų9152%0.51945%0.452SS..  trans-71.274.8171.1-67.5-173.5-167.300109.7P17 V21 K22 L23P17-E19 PolarHBondContact O-N 3.46Å; E19-V21 PolarHBondContact O-N 2.96Å; E19-V21 VanDerWaalsContact O-N 3.13Å; E19-K22 PolarHBondContact O-N 3.11Å; E19-K22 VanDerWaalsContact OE2-CD 3.27Å; E19-K22 WeakPolarHBondContact OE2-CD 3.42Å; E19-K22 WeakPolarHBondContact OE2-CE 3.42Å; E19-K22 IonicContact OE2-NZ 3.48Å; E19-K22 PolarHBondContact OE2-NZ 3.4Å; E19-L23 PolarHBondContact O-N 2.88Å
20H89.3Confident86.4Confident67 Ų6787.6 Ų87.631%0.3143%0.43SS..Hα-helixtrans-56.1-31.9-175.766.183.5000112.2V18 K22 L23 C24 Y27 T28 L54V18-H20 PolarHBondContact O-N 3.39Å; H20-K22 PolarHBondContact O-N 3Å; H20-K22 VanDerWaalsContact O-N 3.13Å; H20-L23 PolarHBondContact O-N 3.39Å; H20-C24 HydrophobicContact CB-CB 4Å; H20-C24 CarbonylContact O-C 3.54Å; H20-C24 WeakPolarHBondContact O-CA 3.38Å; H20-C24 PolarHBondContact O-N 3.47Å; H20-Y27 HydrophobicContact CB-CD1 4.12Å; H20-Y27 HydrophobicContact CB-CE1 4.32Å; H20-T28 VanDerWaalsContact C-OG1 3.24Å; H20-T28 PolarHBondContact ND1-OG1 3.09Å; H20-T28 PolarHBondContact O-OG1 3.13Å; H20-L54 HydrophobicContact CB-CD2 4.27Å
21V88.8Confident86.9Confident104 Ų10490.1 Ų90.163%0.6344%0.443SS*.Hα-helixtrans-57.2-28.8175-1750000112.9E19 T28E19-V21 PolarHBondContact O-N 2.96Å; E19-V21 VanDerWaalsContact O-N 3.13Å; V21-T28 HydrophobicContact CG2-CG2 4.21Å; V21-T28 PolarHBondContact N-OG1 3.36Å
22K89Confident87.2Confident154 Ų15487.8 Ų87.867%0.6745%0.453SS*.Hα-helixtrans-104.1-37.1177.5-61.4-177.7-166.9152.90113.4E19 H20E19-K22 PolarHBondContact O-N 3.11Å; E19-K22 VanDerWaalsContact OE2-CD 3.27Å; E19-K22 WeakPolarHBondContact OE2-CD 3.42Å; E19-K22 WeakPolarHBondContact OE2-CE 3.42Å; E19-K22 IonicContact OE2-NZ 3.48Å; E19-K22 PolarHBondContact OE2-NZ 3.4Å; H20-K22 PolarHBondContact O-N 3Å; H20-K22 VanDerWaalsContact O-N 3.13Å
23L89.1Confident88Confident111 Ų11181.5 Ų81.558%0.58143%0.428SS*.Hα-helixtrans-99.6-15.7-170.7-64173.4000113.7V18 E19 H20V18-L23 HydrophobicContact CG1-CB 4.08Å; V18-L23 HydrophobicContact CG1-CD1 3.79Å; E19-L23 PolarHBondContact O-N 2.88Å; H20-L23 PolarHBondContact O-N 3.39Å
24C93.9Very high88.4Confident0 Ų080.3 Ų80.30%043%0.432CS..  trans-137.762.8-179.4-50.80000110.2H20 Y27 T28 E50H20-C24 HydrophobicContact CB-CB 4Å; H20-C24 CarbonylContact O-C 3.54Å; H20-C24 WeakPolarHBondContact O-CA 3.38Å; H20-C24 PolarHBondContact O-N 3.47Å; C24-Y27 HydrophobicContact CB-CD1 4.32Å; C24-T28 WeakPolarHBondContact O-CB 3.41Å; C24-T28 PolarHBondContact O-N 2.88Å; C24-T28 PolarHBondContact O-OG1 3.07Å; C24-E50 VanDerWaalsContact C-CD 3.49Å; C24-E50 VanDerWaalsContact CA-CD 3.42Å; C24-E50 WeakPolarHBondContact CA-OE2 3.46Å; C24-E50 HydrophobicContact CB-CB 3.97Å; C24-E50 HydrophobicContact CB-CG 4.19Å; C24-E50 WeakPolarHBondContact CB-OE2 3.38Å
25P92.7Very high88.5Confident75 Ų7583.8 Ų83.849%0.48744%0.444SS..Hα-helixtrans-65.8-33.9-175.927.2-35.8000113.6T28 A29 E50P25-T28 PolarHBondContact O-N 3.28Å; P25-A29 VanDerWaalsContact O-CB 3.31Å; P25-A29 WeakPolarHBondContact O-CB 3.33Å; P25-A29 PolarHBondContact O-N 3.03Å; P25-E50 VanDerWaalsContact CD-OE1 3.24Å; P25-E50 WeakPolarHBondContact CD-OE1 3.42Å
26R92.7Very high88.7Confident91 Ų9188 Ų8834%0.34347%0.47SS..Hα-helixtrans-68.7-45.9177-172.265.663.4171.30.1111.2T28 A29 V30 E43 T46 L47 E50R26-T28 VanDerWaalsContact C-N 3.32Å; R26-T28 PolarHBondContact O-N 3.17Å; R26-A29 PolarHBondContact O-N 2.82Å; R26-V30 WeakPolarHBondContact O-CG2 3.49Å; R26-V30 PolarHBondContact O-N 3.24Å; R26-E43 IonicContact CZ-OE1 3.28Å; R26-E43 IonicContact NE-OE1 3.09Å; R26-E43 IonicContact NH1-OE1 3.76Å; R26-E43 PolarHBondContact NH1-OE1 3.27Å; R26-T46 HydrophobicContact CB-CG2 3.99Å; R26-T46 HydrophobicContact CG-CG2 4.37Å; R26-L47 HydrophobicContact CG-CB 4.18Å; R26-L47 HydrophobicContact CG-CD1 4.46Å; R26-E50 WeakPolarHBondContact CA-OE2 3.38Å; R26-E50 VanDerWaalsContact CB-OE1 3.28Å; R26-E50 WeakPolarHBondContact CB-OE1 3.4Å; R26-E50 WeakPolarHBondContact CB-OE2 3.37Å; R26-E50 VanDerWaalsContact N-CD 3.34Å; R26-E50 PolarHBondContact N-OE1 3.39Å; R26-E50 PolarHBondContact N-OE2 3.03Å
27Y93.8Very high88.8Confident64 Ų6486 Ų8625%0.25147%0.466SS..Hα-helixtrans-56.8-47172.9171.9-101.7000111H20 C24 A29 V30 L31 L47 E50 L51 L54H20-Y27 HydrophobicContact CB-CD1 4.12Å; H20-Y27 HydrophobicContact CB-CE1 4.32Å; C24-Y27 HydrophobicContact CB-CD1 4.32Å; Y27-A29 VanDerWaalsContact C-N 3.33Å; Y27-A29 PolarHBondContact O-N 3.33Å; Y27-V30 PolarHBondContact O-N 3.18Å; Y27-L31 HydrophobicContact CD1-CD1 4.1Å; Y27-L31 HydrophobicContact CE1-CD1 3.49Å; Y27-L31 VanDerWaalsContact CE1-CD1 3.49Å; Y27-L31 HydrophobicContact CE1-CG 4.22Å; Y27-L31 HydrophobicContact CE2-CD1 4.44Å; Y27-L31 HydrophobicContact CE2-CD2 4.45Å; Y27-L31 HydrophobicContact CE2-CG 4.39Å; Y27-L31 WeakPolarHBondContact O-CG 3.24Å; Y27-L31 PolarHBondContact O-N 3.34Å; Y27-L47 HydrophobicContact CD2-CD1 4.39Å; Y27-E50 WeakPolarHBondContact CB-OE2 3.44Å; Y27-E50 PolarHBondContact N-OE2 2.98Å; Y27-L51 HydrophobicContact CD2-CD2 3.66Å; Y27-L51 HydrophobicContact CD2-CG 4.49Å; Y27-L51 HydrophobicContact CE2-CD2 3.83Å; Y27-L54 HydrophobicContact CD1-CD1 3.69Å; Y27-L54 HydrophobicContact CD2-CD1 4.16Å; Y27-L54 HydrophobicContact CE1-CD1 3.67Å; Y27-L54 HydrophobicContact CE2-CD1 4.17Å; Y27-L54 HydrophobicContact CG-CD1 3.93Å
28T93.9Very high89Confident37 Ų3783.2 Ų83.223%0.22746%0.455CS..Hα-helixtrans-63.7-37.7177.5-55.40000112.1H20 V21 C24 P25 R26H20-T28 VanDerWaalsContact C-OG1 3.24Å; H20-T28 PolarHBondContact ND1-OG1 3.09Å; H20-T28 PolarHBondContact O-OG1 3.13Å; V21-T28 HydrophobicContact CG2-CG2 4.21Å; V21-T28 PolarHBondContact N-OG1 3.36Å; C24-T28 WeakPolarHBondContact O-CB 3.41Å; C24-T28 PolarHBondContact O-N 2.88Å; C24-T28 PolarHBondContact O-OG1 3.07Å; P25-T28 PolarHBondContact O-N 3.28Å; R26-T28 VanDerWaalsContact C-N 3.32Å; R26-T28 PolarHBondContact O-N 3.17Å
29A91.9Very high89.2Confident49 Ų4986.5 Ų86.541%0.40547%0.47SS..Hα-helixtrans-68.2-39175.400000112.4P25 R26 Y27 G32P25-A29 VanDerWaalsContact O-CB 3.31Å; P25-A29 WeakPolarHBondContact O-CB 3.33Å; P25-A29 PolarHBondContact O-N 3.03Å; R26-A29 PolarHBondContact O-N 2.82Å; Y27-A29 VanDerWaalsContact C-N 3.33Å; Y27-A29 PolarHBondContact O-N 3.33Å; A29-G32 PolarHBondContact O-N 2.81Å
30V92.1Very high89.1Confident34 Ų3482.8 Ų82.821%0.20646%0.462CS..Hα-helixtrans-65.3-39.5175.7169.80000111.4R26 Y27 G32 R33 I39 L47R26-V30 WeakPolarHBondContact O-CG2 3.49Å; R26-V30 PolarHBondContact O-N 3.24Å; Y27-V30 PolarHBondContact O-N 3.18Å; V30-G32 PolarHBondContact O-N 2.77Å; V30-G32 VanDerWaalsContact O-N 3.14Å; V30-R33 PolarHBondContact O-N 2.8Å; V30-I39 HydrophobicContact CG1-CD1 4.31Å; V30-I39 HydrophobicContact CG1-CG1 4.23Å; V30-L47 HydrophobicContact CG2-CD1 4.46Å; V30-L47 HydrophobicContact CG2-CD2 4.43Å
31L91.5Very high89Confident107 Ų10786.7 Ų86.756%0.5648%0.484SS*.THydrogen-bonded Turntrans-61-18.6173.8-72.4-179.4000114.2Y27Y27-L31 HydrophobicContact CD1-CD1 4.1Å; Y27-L31 HydrophobicContact CE1-CD1 3.49Å; Y27-L31 VanDerWaalsContact CE1-CD1 3.49Å; Y27-L31 HydrophobicContact CE1-CG 4.22Å; Y27-L31 HydrophobicContact CE2-CD1 4.44Å; Y27-L31 HydrophobicContact CE2-CD2 4.45Å; Y27-L31 HydrophobicContact CE2-CG 4.39Å; Y27-L31 WeakPolarHBondContact O-CG 3.24Å; Y27-L31 PolarHBondContact O-N 3.34Å
32G88.4Confident89Confident70 Ų7090.6 Ų90.672%0.72250%0.495SS*.THydrogen-bonded Turntrans-96.24.6179.100000115.2A29 V30A29-G32 PolarHBondContact O-N 2.81Å; V30-G32 PolarHBondContact O-N 2.77Å; V30-G32 VanDerWaalsContact O-N 3.14Å
33R92.1Very high89.1Confident83 Ų8384.4 Ų84.431%0.31347%0.469SS..SBendtrans-90.4163.7-178.7-67.4-178.3-173.8175.41112.6V30 D37 G38 E43V30-R33 PolarHBondContact O-N 2.8Å; R33-D37 HydrophobicContact CB-CB 4.15Å; R33-G38 PolarHBondContact NH1-O 3.48Å; R33-E43 IonicContact CZ-OE1 2.72Å; R33-E43 IonicContact CZ-OE2 3.35Å; R33-E43 IonicContact NH1-OE1 2.72Å; R33-E43 IonicContact NH1-OE2 3.17Å; R33-E43 PolarHBondContact NH1-OE2 2.92Å; R33-E43 IonicContact NH2-OE1 2.68Å; R33-E43 PolarHBondContact NH2-OE1 2.88Å; R33-E43 IonicContact NH2-OE2 3.73Å; R33-E43 PolarHBondContact NH2-OE2 3.24Å
34S86.6Confident89.3Confident60 Ų6083.3 Ų83.342%0.4246%0.463SS..  trans-76.7159.4165.7730000110.8D36 D37S34-D36 PolarHBondContact O-N 3.46Å; S34-D37 WeakPolarHBondContact CB-OD2 3.46Å; S34-D37 PolarHBondContact N-OD2 3.02Å; S34-D37 PolarHBondContact O-N 3.07Å; S34-D37 PolarHBondContact OG-OD2 3.18Å
35E79.9Confident89.1Confident200 Ų20089.5 Ų89.594%0.93550%0.496SS*.THydrogen-bonded Turntrans-63.1-24.8177.9-63-172.7153.700112.4
36D83.4Confident89.1Confident159 Ų15988.8 Ų88.885%0.8549%0.49SS*.THydrogen-bonded Turntrans-76.9-22.1179.5-64.3-46.2000113.9S34S34-D36 PolarHBondContact O-N 3.46Å
37D82.8Confident89.2Confident108 Ų10885 Ų8558%0.57848%0.477SS*.THydrogen-bonded Turntrans-76.3-24.5-174.6-68.7-56.2000113.6R33 S34R33-D37 HydrophobicContact CB-CB 4.15Å; S34-D37 WeakPolarHBondContact CB-OD2 3.46Å; S34-D37 PolarHBondContact N-OD2 3.02Å; S34-D37 PolarHBondContact O-N 3.07Å; S34-D37 PolarHBondContact OG-OD2 3.18Å
38G83.4Confident89.2Confident38 Ų3885.8 Ų85.839%0.39248%0.483SS..  trans60.9-162.5179.200000116.1R33R33-G38 PolarHBondContact NH1-O 3.48Å
39I89.4Confident89.1Confident94 Ų9489.4 Ų89.448%0.48250%0.5SS..  trans-124.6121.5179.5-60170.5000108.4V30 L47V30-I39 HydrophobicContact CG1-CD1 4.31Å; V30-I39 HydrophobicContact CG1-CG1 4.23Å; I39-L47 HydrophobicContact CD1-CD2 3.89Å; I39-L47 HydrophobicContact CG2-CD2 3.99Å
40G87.4Confident89.3Confident33 Ų3388 Ų8834%0.3449%0.485SS..  trans-73145.4178.700000112.3E42 E43 L44G40-E42 PolarHBondContact O-N 3.23Å; G40-E43 PolarHBondContact N-OE2 3.48Å; G40-E43 VanDerWaalsContact N-OE2 3.16Å; G40-E43 WeakPolarHBondContact O-CB 3.48Å; G40-E43 PolarHBondContact O-N 2.97Å; G40-L44 PolarHBondContact O-N 3.39Å
41I87.1Confident89.4Confident150 Ų15090 Ų9077%0.76949%0.494SS*.G310 helixtrans-61.1-32.5-178.7-162.4165.4000112.8E43 L44I41-E43 PolarHBondContact O-N 3.44Å; I41-L44 WeakPolarHBondContact O-CB 3.49Å; I41-L44 PolarHBondContact O-N 2.87Å
42E88.8Confident89.5Confident185 Ų18588.4 Ų88.486%0.86448%0.484SS*.G310 helixtrans-70.9-17176.3-58.6-174.4-162.800113.3G40G40-E42 PolarHBondContact O-N 3.23Å
43E91.2Very high89.6Confident25 Ų2588.1 Ų88.112%0.11747%0.468CS..G310 helixtrans-91.3-17179.6-53.5-172.3105.900112.5R26 R33 G40 I41 D45 T46 L47R26-E43 IonicContact CZ-OE1 3.28Å; R26-E43 IonicContact NE-OE1 3.09Å; R26-E43 IonicContact NH1-OE1 3.76Å; R26-E43 PolarHBondContact NH1-OE1 3.27Å; R33-E43 IonicContact CZ-OE1 2.72Å; R33-E43 IonicContact CZ-OE2 3.35Å; R33-E43 IonicContact NH1-OE1 2.72Å; R33-E43 IonicContact NH1-OE2 3.17Å; R33-E43 PolarHBondContact NH1-OE2 2.92Å; R33-E43 IonicContact NH2-OE1 2.68Å; R33-E43 PolarHBondContact NH2-OE1 2.88Å; R33-E43 IonicContact NH2-OE2 3.73Å; R33-E43 PolarHBondContact NH2-OE2 3.24Å; G40-E43 PolarHBondContact N-OE2 3.48Å; G40-E43 VanDerWaalsContact N-OE2 3.16Å; G40-E43 WeakPolarHBondContact O-CB 3.48Å; G40-E43 PolarHBondContact O-N 2.97Å; I41-E43 PolarHBondContact O-N 3.44Å; E43-D45 PolarHBondContact O-N 2.67Å; E43-T46 PolarHBondContact O-N 2.89Å; E43-L47 WeakPolarHBondContact O-CB 3.35Å; E43-L47 PolarHBondContact O-N 3.41Å
44L92.1Very high89.6Confident88 Ų8885.9 Ų85.946%0.46146%0.462SS..Hα-helixtrans-64.1-45.1-166.6-170.562.8000112.6G40 I41 T46 L47 Q48G40-L44 PolarHBondContact O-N 3.39Å; I41-L44 WeakPolarHBondContact O-CB 3.49Å; I41-L44 PolarHBondContact O-N 2.87Å; L44-T46 VanDerWaalsContact C-N 3.34Å; L44-T46 PolarHBondContact O-N 3.39Å; L44-L47 PolarHBondContact O-N 3.36Å; L44-Q48 WeakPolarHBondContact O-CB 3.41Å; L44-Q48 PolarHBondContact O-N 3.24Å
45D90.2Very high89.9Confident130 Ų13088.2 Ų88.270%0.69547%0.47SS*.Hα-helixtrans-63-40179.4-69.1-18000111.9E43 L49E43-D45 PolarHBondContact O-N 2.67Å; D45-L49 PolarHBondContact O-N 2.86Å
46T92.4Very high90.4Very high60 Ų6082.1 Ų82.137%0.36845%0.449SS..Hα-helixtrans-69.9-43.9177.3-57.50000110.7R26 E43 L44 Q48 L49 E50R26-T46 HydrophobicContact CB-CG2 3.99Å; R26-T46 HydrophobicContact CG-CG2 4.37Å; E43-T46 PolarHBondContact O-N 2.89Å; L44-T46 VanDerWaalsContact C-N 3.34Å; L44-T46 PolarHBondContact O-N 3.39Å; T46-Q48 VanDerWaalsContact C-N 3.33Å; T46-Q48 PolarHBondContact O-N 3.4Å; T46-L49 PolarHBondContact O-N 3.41Å; T46-E50 WeakPolarHBondContact O-CG 3.48Å; T46-E50 PolarHBondContact O-N 3.16Å; T46-E50 VanDerWaalsContact O-N 3.12Å
47L94Very high90.7Very high11 Ų1175.9 Ų75.96%0.05842%0.418CS..Hα-helixtrans-62.8-39.9177.5-177.962.7000111.6R26 Y27 V30 I39 E43 L44 E50 L51R26-L47 HydrophobicContact CG-CB 4.18Å; R26-L47 HydrophobicContact CG-CD1 4.46Å; Y27-L47 HydrophobicContact CD2-CD1 4.39Å; V30-L47 HydrophobicContact CG2-CD1 4.46Å; V30-L47 HydrophobicContact CG2-CD2 4.43Å; I39-L47 HydrophobicContact CD1-CD2 3.89Å; I39-L47 HydrophobicContact CG2-CD2 3.99Å; E43-L47 WeakPolarHBondContact O-CB 3.35Å; E43-L47 PolarHBondContact O-N 3.41Å; L44-L47 PolarHBondContact O-N 3.36Å; L47-E50 PolarHBondContact O-N 3.23Å; L47-L51 HydrophobicContact CD1-CD1 4.35Å; L47-L51 HydrophobicContact CD1-CG 4.38Å; L47-L51 HydrophobicContact CG-CD1 4Å; L47-L51 HydrophobicContact CG-CG 4.47Å; L47-L51 WeakPolarHBondContact O-CB 3.33Å; L47-L51 VanDerWaalsContact O-CG 3.25Å; L47-L51 WeakPolarHBondContact O-CG 3.43Å; L47-L51 PolarHBondContact O-N 3.07Å
48Q93.8Very high91Very high80 Ų8072.7 Ų72.737%0.37441%0.406SS..Hα-helixtrans-60.6-47.6175.4-174.5-176.5-42.900111.2L44 T46 E50 L51 E52 N148L44-Q48 WeakPolarHBondContact O-CB 3.41Å; L44-Q48 PolarHBondContact O-N 3.24Å; T46-Q48 VanDerWaalsContact C-N 3.33Å; T46-Q48 PolarHBondContact O-N 3.4Å; Q48-E50 VanDerWaalsContact C-N 3.31Å; Q48-E50 PolarHBondContact O-N 3.18Å; Q48-L51 PolarHBondContact O-N 3.17Å; Q48-E52 HydrophobicContact CG-CG 4.44Å; Q48-E52 WeakPolarHBondContact CG-OE1 3.36Å; Q48-E52 PolarHBondContact NE2-OE1 2.86Å; Q48-E52 WeakPolarHBondContact O-CB 3.36Å; Q48-E52 WeakPolarHBondContact O-CG 3.49Å; Q48-E52 PolarHBondContact O-N 3.36Å; Q48-N148 PolarHBondContact NE2-ND2 3.46Å
49L93.4Very high91.3Very high113 Ų11372.5 Ų72.559%0.59240%0.399SS*.Hα-helixtrans-60.8-39.5179.4-177.665.1000112.6D45 T46 T53D45-L49 PolarHBondContact O-N 2.86Å; T46-L49 PolarHBondContact O-N 3.41Å; L49-T53 PolarHBondContact O-N 3.09Å; L49-T53 PolarHBondContact O-OG1 3.07Å
50E95.4Very high91.2Very high19 Ų1976.8 Ų76.89%0.08941%0.409CS..Hα-helixtrans-69.1-41.2175.9-70.8-176.4-167.300112.1C24 P25 R26 Y27 T46 L47 Q48 T53 L54C24-E50 VanDerWaalsContact C-CD 3.49Å; C24-E50 VanDerWaalsContact CA-CD 3.42Å; C24-E50 WeakPolarHBondContact CA-OE2 3.46Å; C24-E50 HydrophobicContact CB-CB 3.97Å; C24-E50 HydrophobicContact CB-CG 4.19Å; C24-E50 WeakPolarHBondContact CB-OE2 3.38Å; P25-E50 VanDerWaalsContact CD-OE1 3.24Å; P25-E50 WeakPolarHBondContact CD-OE1 3.42Å; R26-E50 WeakPolarHBondContact CA-OE2 3.38Å; R26-E50 VanDerWaalsContact CB-OE1 3.28Å; R26-E50 WeakPolarHBondContact CB-OE1 3.4Å; R26-E50 WeakPolarHBondContact CB-OE2 3.37Å; R26-E50 VanDerWaalsContact N-CD 3.34Å; R26-E50 PolarHBondContact N-OE1 3.39Å; R26-E50 PolarHBondContact N-OE2 3.03Å; Y27-E50 WeakPolarHBondContact CB-OE2 3.44Å; Y27-E50 PolarHBondContact N-OE2 2.98Å; T46-E50 WeakPolarHBondContact O-CG 3.48Å; T46-E50 PolarHBondContact O-N 3.16Å; T46-E50 VanDerWaalsContact O-N 3.12Å; L47-E50 PolarHBondContact O-N 3.23Å; Q48-E50 VanDerWaalsContact C-N 3.31Å; Q48-E50 PolarHBondContact O-N 3.18Å; E50-T53 VanDerWaalsContact O-CB 3.31Å; E50-T53 WeakPolarHBondContact O-CB 3.47Å; E50-T53 PolarHBondContact O-N 3.47Å; E50-T53 VanDerWaalsContact O-N 3.16Å; E50-L54 WeakPolarHBondContact O-CG 3.42Å; E50-L54 PolarHBondContact O-N 2.96Å
51L94.5Very high91.3Very high77 Ų7779.3 Ų79.340%0.40341%0.408SS..Hα-helixtrans-64.1-39.4173.8-72.3170.4000112.1Y27 L47 Q48 T53 L54 L55Y27-L51 HydrophobicContact CD2-CD2 3.66Å; Y27-L51 HydrophobicContact CD2-CG 4.49Å; Y27-L51 HydrophobicContact CE2-CD2 3.83Å; L47-L51 HydrophobicContact CD1-CD1 4.35Å; L47-L51 HydrophobicContact CD1-CG 4.38Å; L47-L51 HydrophobicContact CG-CD1 4Å; L47-L51 HydrophobicContact CG-CG 4.47Å; L47-L51 WeakPolarHBondContact O-CB 3.33Å; L47-L51 VanDerWaalsContact O-CG 3.25Å; L47-L51 WeakPolarHBondContact O-CG 3.43Å; L47-L51 PolarHBondContact O-N 3.07Å; Q48-L51 PolarHBondContact O-N 3.17Å; L51-T53 VanDerWaalsContact C-N 3.27Å; L51-T53 PolarHBondContact O-N 2.94Å; L51-L54 HydrophobicContact CD2-CD1 4.48Å; L51-L54 PolarHBondContact O-N 3.47Å; L51-L55 VanDerWaalsContact O-CB 3.28Å; L51-L55 WeakPolarHBondContact O-CB 3.37Å; L51-L55 PolarHBondContact O-N 2.84Å
52E93.6Very high91.4Very high74 Ų7476.7 Ų76.735%0.34640%0.395SS..Hα-helixtrans-62.8-33.5172.8-75.7179.2-16400111.9Q48 S56Q48-E52 HydrophobicContact CG-CG 4.44Å; Q48-E52 WeakPolarHBondContact CG-OE1 3.36Å; Q48-E52 PolarHBondContact NE2-OE1 2.86Å; Q48-E52 WeakPolarHBondContact O-CB 3.36Å; Q48-E52 WeakPolarHBondContact O-CG 3.49Å; Q48-E52 PolarHBondContact O-N 3.36Å; E52-S56 WeakPolarHBondContact O-CB 3.45Å; E52-S56 PolarHBondContact O-N 2.95Å; E52-S56 PolarHBondContact O-OG 2.87Å
53T90.9Very high91.4Very high64 Ų6475.2 Ų75.239%0.39338%0.382SS..Hα-helixtrans-67.3-46.3174.2-60.90000111.5L49 E50 L51 S56 S57L49-T53 PolarHBondContact O-N 3.09Å; L49-T53 PolarHBondContact O-OG1 3.07Å; E50-T53 VanDerWaalsContact O-CB 3.31Å; E50-T53 WeakPolarHBondContact O-CB 3.47Å; E50-T53 PolarHBondContact O-N 3.47Å; E50-T53 VanDerWaalsContact O-N 3.16Å; L51-T53 VanDerWaalsContact C-N 3.27Å; L51-T53 PolarHBondContact O-N 2.94Å; T53-S56 PolarHBondContact O-N 3.33Å; T53-S57 PolarHBondContact O-N 3.45Å; T53-S57 VanDerWaalsContact O-N 3.12Å
54L91.9Very high91.2Very high36 Ų3674.7 Ų74.719%0.18838%0.382CS..Hα-helixtrans-61.8-46.6174.5-66.7173.6000111.7V18 H20 Y27 E50 L51 S56 S57 A58V18-L54 HydrophobicContact CB-CD2 3.74Å; V18-L54 HydrophobicContact CG1-CD2 3.86Å; V18-L54 HydrophobicContact CG2-CD2 4.16Å; H20-L54 HydrophobicContact CB-CD2 4.27Å; Y27-L54 HydrophobicContact CD1-CD1 3.69Å; Y27-L54 HydrophobicContact CD2-CD1 4.16Å; Y27-L54 HydrophobicContact CE1-CD1 3.67Å; Y27-L54 HydrophobicContact CE2-CD1 4.17Å; Y27-L54 HydrophobicContact CG-CD1 3.93Å; E50-L54 WeakPolarHBondContact O-CG 3.42Å; E50-L54 PolarHBondContact O-N 2.96Å; L51-L54 HydrophobicContact CD2-CD1 4.48Å; L51-L54 PolarHBondContact O-N 3.47Å; L54-S56 PolarHBondContact O-N 3.2Å; L54-S57 PolarHBondContact O-N 2.98Å; L54-A58 PolarHBondContact O-N 3.4Å
55L92.6Very high91Very high109 Ų10974.9 Ų74.957%0.57138%0.383SS*.Hα-helixtrans-61.7-40.4177.317960.9000112.2L51 S57 A58 S59L51-L55 VanDerWaalsContact O-CB 3.28Å; L51-L55 WeakPolarHBondContact O-CB 3.37Å; L51-L55 PolarHBondContact O-N 2.84Å; L55-S57 VanDerWaalsContact C-N 3.34Å; L55-S57 PolarHBondContact O-N 2.99Å; L55-A58 PolarHBondContact O-N 2.7Å; L55-S59 VanDerWaalsContact O-CB 3.25Å; L55-S59 WeakPolarHBondContact O-CB 3.27Å; L55-S59 PolarHBondContact O-N 3.37Å; L55-S59 PolarHBondContact O-OG 2.93Å
56S90.9Very high91Very high71 Ų7172.2 Ų72.250%0.49737%0.366SS..Hα-helixtrans-63.6-39.2176.3-67.80000112.1E52 T53 L54 R60E52-S56 WeakPolarHBondContact O-CB 3.45Å; E52-S56 PolarHBondContact O-N 2.95Å; E52-S56 PolarHBondContact O-OG 2.87Å; T53-S56 PolarHBondContact O-N 3.33Å; L54-S56 PolarHBondContact O-N 3.2Å; S56-R60 WeakPolarHBondContact O-CB 3.33Å; S56-R60 PolarHBondContact O-N 3.09Å; S56-R60 VanDerWaalsContact O-N 3.14Å
57S88.8Confident90.8Very high29 Ų2973.7 Ų73.720%0.20337%0.369CS..Hα-helixtrans-67.8-47.7173.4-179.70000112V18 T53 L54 L55 S59 R60 R61V18-S57 WeakPolarHBondContact CG2-OG 3.35Å; T53-S57 PolarHBondContact O-N 3.45Å; T53-S57 VanDerWaalsContact O-N 3.12Å; L54-S57 PolarHBondContact O-N 2.98Å; L55-S57 VanDerWaalsContact C-N 3.34Å; L55-S57 PolarHBondContact O-N 2.99Å; S57-S59 PolarHBondContact O-N 3.39Å; S57-R60 PolarHBondContact O-N 2.92Å; S57-R61 WeakPolarHBondContact O-CG 3.48Å; S57-R61 PolarHBondContact O-N 3.31Å; S57-R61 VanDerWaalsContact O-N 3.1Å
58A89.4Confident90.5Very high40 Ų4073.9 Ų73.933%0.33137%0.37SS..Hα-helixtrans-58.8-45.6177.100000111.9L54 L55 R60 R61 L62L54-A58 PolarHBondContact O-N 3.4Å; L55-A58 PolarHBondContact O-N 2.7Å; A58-R60 VanDerWaalsContact C-N 3.31Å; A58-R60 PolarHBondContact O-N 3.1Å; A58-R61 PolarHBondContact O-N 3.36Å; A58-L62 PolarHBondContact O-N 2.81Å
59S90.1Very high90.1Very high35 Ų3577 Ų7725%0.24538%0.378CS..Hα-helixtrans-62.4-34.7177.4-59.50000113.1L55 S57 R63L55-S59 VanDerWaalsContact O-CB 3.25Å; L55-S59 WeakPolarHBondContact O-CB 3.27Å; L55-S59 PolarHBondContact O-N 3.37Å; L55-S59 PolarHBondContact O-OG 2.93Å; S57-S59 PolarHBondContact O-N 3.39Å; S59-R63 WeakPolarHBondContact O-CG 3.45Å; S59-R63 PolarHBondContact O-N 3.03Å
60R86.6Confident89.9Confident184 Ų18476.3 Ų76.369%0.69437%0.372SS*.Hα-helixtrans-67.2-42.4174.9-171-174.3-58.6-112.22111.4S56 S57 A58 A64S56-R60 WeakPolarHBondContact O-CB 3.33Å; S56-R60 PolarHBondContact O-N 3.09Å; S56-R60 VanDerWaalsContact O-N 3.14Å; S57-R60 PolarHBondContact O-N 2.92Å; A58-R60 VanDerWaalsContact C-N 3.31Å; A58-R60 PolarHBondContact O-N 3.1Å; R60-A64 PolarHBondContact O-N 3.21Å
61R88.6Confident89.4Confident85 Ų8577.4 Ų77.432%0.32138%0.378SS..Hα-helixtrans-66.3-42.7176.4-64.4-173.8-75156.41.7111.7F15 S57 A58 A64 L65F15-R61 HydrophobicContact CD1-CB 3.9Å; F15-R61 HydrophobicContact CD1-CG 3.5Å; F15-R61 HydrophobicContact CE1-CB 3.87Å; F15-R61 HydrophobicContact CE1-CG 3.89Å; F15-R61 HydrophobicContact CG-CG 4.28Å; S57-R61 WeakPolarHBondContact O-CG 3.48Å; S57-R61 PolarHBondContact O-N 3.31Å; S57-R61 VanDerWaalsContact O-N 3.1Å; A58-R61 PolarHBondContact O-N 3.36Å; R61-A64 PolarHBondContact O-N 3.22Å; R61-L65 PolarHBondContact O-N 2.88Å
62L90.7Very high88.9Confident95 Ų9577.2 Ų77.250%0.49738%0.377SS..Hα-helixtrans-58.2-53.6175.4-178.161.4000111.1A58 A64 L65 E66A58-L62 PolarHBondContact O-N 2.81Å; L62-A64 VanDerWaalsContact C-N 3.29Å; L62-A64 PolarHBondContact O-N 2.87Å; L62-L65 WeakPolarHBondContact O-CB 3.48Å; L62-L65 PolarHBondContact O-N 3.4Å; L62-E66 HydrophobicContact CD1-CG 4.23Å; L62-E66 HydrophobicContact CG-CG 4.37Å; L62-E66 WeakPolarHBondContact O-CG 3.49Å; L62-E66 PolarHBondContact O-N 3.22Å
63R89.1Confident88.5Confident155 Ų15576.4 Ų76.459%0.58538%0.377SS*.Hα-helixtrans-57.8-38.7178.3-73.9-171.7-65.3-101.93.3113.3S59 E66 E67S59-R63 WeakPolarHBondContact O-CG 3.45Å; S59-R63 PolarHBondContact O-N 3.03Å; R63-E66 PolarHBondContact O-N 2.88Å; R63-E67 PolarHBondContact O-N 2.68Å
64A86.1Confident88.1Confident13 Ų1376.6 Ų76.611%0.10738%0.375CS..Hα-helixtrans-64.4-41.3175.500000112.3Y13 F15 R60 R61 L62 E67 Q68Y13-A64 HydrophobicContact CD1-CB 4.29Å; Y13-A64 HydrophobicContact CD2-CB 4.33Å; Y13-A64 HydrophobicContact CE1-CB 4.02Å; Y13-A64 HydrophobicContact CE2-CB 4.09Å; Y13-A64 HydrophobicContact CG-CB 4.44Å; F15-A64 HydrophobicContact CE1-CB 4.16Å; F15-A64 HydrophobicContact CZ-CB 4.18Å; R60-A64 PolarHBondContact O-N 3.21Å; R61-A64 PolarHBondContact O-N 3.22Å; L62-A64 VanDerWaalsContact C-N 3.29Å; L62-A64 PolarHBondContact O-N 2.87Å; A64-E67 PolarHBondContact O-N 3.47Å; A64-Q68 WeakPolarHBondContact O-CG 3.32Å; A64-Q68 PolarHBondContact O-N 3.13Å; A64-Q68 VanDerWaalsContact O-N 3.17Å
65L87.9Confident87.6Confident93 Ų9378.6 Ų78.649%0.48738%0.381SS..Hα-helixtrans-66-38.4173.5-76.3170.7000112.4F15 R61 L62 Q68 R69F15-L65 HydrophobicContact CE2-CD1 4.14Å; F15-L65 HydrophobicContact CE2-CD2 3.67Å; F15-L65 HydrophobicContact CE2-CG 3.73Å; F15-L65 HydrophobicContact CZ-CD1 4.43Å; F15-L65 HydrophobicContact CZ-CD2 4.08Å; F15-L65 HydrophobicContact CZ-CG 3.77Å; R61-L65 PolarHBondContact O-N 2.88Å; L62-L65 WeakPolarHBondContact O-CB 3.48Å; L62-L65 PolarHBondContact O-N 3.4Å; L65-Q68 PolarHBondContact O-N 2.84Å; L65-R69 WeakPolarHBondContact O-CB 3.27Å; L65-R69 PolarHBondContact O-N 3.37Å
66E90.2Very high86.8Confident73 Ų7380 Ų8034%0.34138%0.384SS..Hα-helixtrans-66.5-38.2176.7-67.6-175.4125.300112.3L62 R63 R69 Q70L62-E66 HydrophobicContact CD1-CG 4.23Å; L62-E66 HydrophobicContact CG-CG 4.37Å; L62-E66 WeakPolarHBondContact O-CG 3.49Å; L62-E66 PolarHBondContact O-N 3.22Å; R63-E66 PolarHBondContact O-N 2.88Å; E66-R69 PolarHBondContact O-N 2.68Å; E66-R69 IonicContact OE1-NH2 3.31Å; E66-R69 PolarHBondContact OE1-NH2 2.72Å; E66-Q70 WeakPolarHBondContact O-CB 3.32Å; E66-Q70 PolarHBondContact O-N 3.35Å
67E88.4Confident86Confident92 Ų9281.9 Ų81.943%0.4339%0.389SS..Hα-helixtrans-58.6-46.7170.2-172.6-170.8153.700110.8K11 R63 A64 Q70 I71K11-E67 IonicContact NZ-OE1 3.45Å; K11-E67 PolarHBondContact NZ-OE1 2.72Å; R63-E67 PolarHBondContact O-N 2.68Å; A64-E67 PolarHBondContact O-N 3.47Å; E67-Q70 PolarHBondContact O-N 3.29Å; E67-I71 HydrophobicContact CG-CD1 4.35Å; E67-I71 WeakPolarHBondContact O-CG1 3.35Å; E67-I71 PolarHBondContact O-N 3.22Å
68Q87.3Confident85.1Confident15 Ų1588 Ų887%0.0741%0.411CS..Hα-helixtrans-67.3-37177.7-62.2-37.8-76.600112.8L10 Y13 A64 L65 I71 L72L10-Q68 HydrophobicContact CD2-CB 4.06Å; Y13-Q68 HydrophobicContact CD2-CG 4.27Å; Y13-Q68 HydrophobicContact CE2-CG 3.82Å; A64-Q68 WeakPolarHBondContact O-CG 3.32Å; A64-Q68 PolarHBondContact O-N 3.13Å; A64-Q68 VanDerWaalsContact O-N 3.17Å; L65-Q68 PolarHBondContact O-N 2.84Å; Q68-I71 PolarHBondContact O-N 3.37Å; Q68-L72 PolarHBondContact O-N 2.81Å; Q68-L72 VanDerWaalsContact O-N 3.12Å
69R86.7Confident83.8Confident145 Ų14592 Ų9255%0.54742%0.422SS..Hα-helixtrans-62-44.1173.8-175.1-176.966.4-155.3-7.1110.9L65 E66 L72 T73L65-R69 WeakPolarHBondContact O-CB 3.27Å; L65-R69 PolarHBondContact O-N 3.37Å; E66-R69 PolarHBondContact O-N 2.68Å; E66-R69 IonicContact OE1-NH2 3.31Å; E66-R69 PolarHBondContact OE1-NH2 2.72Å; R69-L72 WeakPolarHBondContact O-CB 3.4Å; R69-L72 PolarHBondContact O-N 2.79Å; R69-T73 PolarHBondContact O-N 3.4Å; R69-T73 PolarHBondContact O-OG1 3.01Å
70Q87.6Confident82.1Confident98 Ų9893.4 Ų93.446%0.45844%0.442SS..Hα-helixtrans-64.4-41.1177.5-16863.249.100111.8E66 E67 L72 T73 D74E66-Q70 WeakPolarHBondContact O-CB 3.32Å; E66-Q70 PolarHBondContact O-N 3.35Å; E67-Q70 PolarHBondContact O-N 3.29Å; Q70-L72 PolarHBondContact O-N 3Å; Q70-T73 PolarHBondContact O-N 2.96Å; Q70-D74 PolarHBondContact NE2-OD1 3.27Å; Q70-D74 WeakPolarHBondContact O-CB 3.47Å; Q70-D74 PolarHBondContact O-N 2.88Å
71I86.1Confident80.5Confident43 Ų4389.1 Ų89.122%0.22143%0.432CS..Hα-helixtrans-58.1-37.2173.9-69.8164.6000111.4P9 E67 Q68 W75P9-I71 HydrophobicContact CG-CG2 4.47Å; E67-I71 HydrophobicContact CG-CD1 4.35Å; E67-I71 WeakPolarHBondContact O-CG1 3.35Å; E67-I71 PolarHBondContact O-N 3.22Å; Q68-I71 PolarHBondContact O-N 3.37Å; I71-W75 WeakPolarHBondContact O-CB 3.47Å; I71-W75 PolarHBondContact O-N 3.15Å
72L82.9Confident78.7Confident73 Ų7393.8 Ų93.838%0.38246%0.455SS..Hα-helixtrans-68.8-44.4175.1-75.7165.8000112.9P8 L10 Q68 R69 Q70 W75 Q76P8-L72 HydrophobicContact CB-CD2 4.18Å; P8-L72 HydrophobicContact CG-CD2 3.68Å; L10-L72 HydrophobicContact CD1-CD1 4.46Å; L10-L72 HydrophobicContact CD1-CD2 4.25Å; L10-L72 HydrophobicContact CD2-CD1 4.25Å; L10-L72 HydrophobicContact CD2-CD2 4.36Å; L10-L72 HydrophobicContact CD2-CG 4Å; Q68-L72 PolarHBondContact O-N 2.81Å; Q68-L72 VanDerWaalsContact O-N 3.12Å; R69-L72 WeakPolarHBondContact O-CB 3.4Å; R69-L72 PolarHBondContact O-N 2.79Å; Q70-L72 PolarHBondContact O-N 3Å; L72-W75 PolarHBondContact O-N 3.37Å; L72-Q76 WeakPolarHBondContact O-CB 3.45Å; L72-Q76 PolarHBondContact O-N 3.35Å
73T84.7Confident76.7Confident57 Ų5799 Ų9935%0.3547%0.468SS..Hα-helixtrans-60.6-52.5175.9-56.70000111R69 Q70 W75 Q76 D77R69-T73 PolarHBondContact O-N 3.4Å; R69-T73 PolarHBondContact O-OG1 3.01Å; Q70-T73 PolarHBondContact O-N 2.96Å; T73-W75 PolarHBondContact O-N 3.26Å; T73-Q76 WeakPolarHBondContact O-CB 3.39Å; T73-Q76 PolarHBondContact O-N 3.27Å; T73-Q76 VanDerWaalsContact O-N 3.1Å; T73-D77 PolarHBondContact O-N 3.2Å
74D82.6Confident74.3Confident67 Ų67100.4 Ų100.436%0.35848%0.479SS..Hα-helixtrans-58.4-34.5177.9-71.210.6000112.5Q70 K78Q70-D74 PolarHBondContact NE2-OD1 3.27Å; Q70-D74 WeakPolarHBondContact O-CB 3.47Å; Q70-D74 PolarHBondContact O-N 2.88Å; D74-K78 WeakPolarHBondContact O-CB 3.41Å; D74-K78 WeakPolarHBondContact O-CD 3.45Å; D74-K78 VanDerWaalsContact O-CG 3.23Å; D74-K78 WeakPolarHBondContact O-CG 3.37Å; D74-K78 PolarHBondContact O-N 3.32Å
75W81.5Confident72.1Confident79 Ų79108.1 Ų108.130%0.29952%0.517SS..Hα-helixtrans-75.3-38.1177.5-17686.9000112.3D6 P8 I71 L72 T73 K78 K79D6-W75 WeakPolarHBondContact O-CZ2 3.31Å; P8-W75 HydrophobicContact CB-CB 4.17Å; P8-W75 HydrophobicContact CB-CD2 4.01Å; P8-W75 HydrophobicContact CB-CG 3.82Å; P8-W75 HydrophobicContact CG-CD2 4.27Å; P8-W75 HydrophobicContact CG-CE3 4.37Å; I71-W75 WeakPolarHBondContact O-CB 3.47Å; I71-W75 PolarHBondContact O-N 3.15Å; L72-W75 PolarHBondContact O-N 3.37Å; T73-W75 PolarHBondContact O-N 3.26Å; W75-K78 PolarHBondContact O-N 2.85Å; W75-K79 HydrophobicContact CH2-CD 3.68Å; W75-K79 HydrophobicContact CZ2-CD 4.15Å; W75-K79 HydrophobicContact CZ3-CD 3.95Å; W75-K79 WeakPolarHBondContact O-CB 3.28Å; W75-K79 PolarHBondContact O-N 3.44Å
76Q76.2Confident69.6Low137 Ų137112.9 Ų112.964%0.6453%0.534SS*.Hα-helixtrans-62.4-45.8174.6-177.9171.71.400111.1L72 T73 K78 K79 G80L72-Q76 WeakPolarHBondContact O-CB 3.45Å; L72-Q76 PolarHBondContact O-N 3.35Å; T73-Q76 WeakPolarHBondContact O-CB 3.39Å; T73-Q76 PolarHBondContact O-N 3.27Å; T73-Q76 VanDerWaalsContact O-N 3.1Å; Q76-K78 PolarHBondContact O-N 3.32Å; Q76-K79 WeakPolarHBondContact O-CB 3.43Å; Q76-K79 PolarHBondContact O-N 3.19Å; Q76-K79 VanDerWaalsContact O-N 3.11Å; Q76-G80 PolarHBondContact O-N 2.8Å
77D75.3Confident67.4Low111 Ų111115.7 Ų115.759%0.59456%0.558SS**Hα-helixtrans-62.2-44177.1-69.3-20000111.5T73 K79 G80 D81T73-D77 PolarHBondContact O-N 3.2Å; D77-K79 VanDerWaalsContact C-N 3.26Å; D77-K79 PolarHBondContact O-N 2.81Å; D77-G80 PolarHBondContact O-N 2.89Å; D77-G80 VanDerWaalsContact O-N 3.08Å; D77-D81 PolarHBondContact O-N 3.1Å
78K68.4Low64.7Low157 Ų157116.9 Ų116.968%0.68358%0.577SS**Hα-helixtrans-62.5-29.2173.6-76.8168.2-176.9160.10113.6D74 W75 Q76 G80D74-K78 WeakPolarHBondContact O-CB 3.41Å; D74-K78 WeakPolarHBondContact O-CD 3.45Å; D74-K78 VanDerWaalsContact O-CG 3.23Å; D74-K78 WeakPolarHBondContact O-CG 3.37Å; D74-K78 PolarHBondContact O-N 3.32Å; W75-K78 PolarHBondContact O-N 2.85Å; Q76-K78 PolarHBondContact O-N 3.32Å; K78-G80 VanDerWaalsContact C-N 3.31Å
79K63.1Low62.4Low126 Ų126125.5 Ų125.555%0.54861%0.614SS.*Hα-helixtrans-75.6-21.7175.7-151.5-175.5-167.5-178.10112.6W75 Q76 D77W75-K79 HydrophobicContact CH2-CD 3.68Å; W75-K79 HydrophobicContact CZ2-CD 4.15Å; W75-K79 HydrophobicContact CZ3-CD 3.95Å; W75-K79 WeakPolarHBondContact O-CB 3.28Å; W75-K79 PolarHBondContact O-N 3.44Å; Q76-K79 WeakPolarHBondContact O-CB 3.43Å; Q76-K79 PolarHBondContact O-N 3.19Å; Q76-K79 VanDerWaalsContact O-N 3.11Å; D77-K79 VanDerWaalsContact C-N 3.26Å; D77-K79 PolarHBondContact O-N 2.81Å
80G53.7Low60.3Low64 Ų64126.1 Ų126.166%0.6663%0.628SS**Hα-helixtrans-73.1-37.9174.800000113.6Q76 D77 K78 K82Q76-G80 PolarHBondContact O-N 2.8Å; D77-G80 PolarHBondContact O-N 2.89Å; D77-G80 VanDerWaalsContact O-N 3.08Å; K78-G80 VanDerWaalsContact C-N 3.31Å; G80-K82 VanDerWaalsContact C-N 3.35Å; G80-K82 PolarHBondContact O-N 2.99Å
81D52.6Low57.9Low93 Ų93127.3 Ų127.350%0.49764%0.644SS.*  trans-86.867-175.2-161.613.7000113.6D77 R83D77-D81 PolarHBondContact O-N 3.1Å; D81-R83 PolarHBondContact O-N 2.77Å
82K52Low55.4Low184 Ų184132.7 Ų132.780%0.867%0.674SS**THydrogen-bonded Turntrans-70.841.5176.3-70.2-171.5175.2-178.40114.3G80G80-K82 VanDerWaalsContact C-N 3.35Å; G80-K82 PolarHBondContact O-N 2.99Å
83R47.6Very low53.4Low204 Ų204134.9 Ų134.977%0.7769%0.692SS**THydrogen-bonded Turntrans-1212.3177.3-75.6-168.1-65.8-173.4-2.8116.5D81D81-R83 PolarHBondContact O-N 2.77Å
84F38.6Very low51.3Low185 Ų185136.9 Ų136.981%0.81172%0.715SS**  trans-130.270.3171.9-76.8-79000113.9
85L40.4Very low48.9Very low174 Ų174138.1 Ų138.191%0.91173%0.734SS**  trans-91.297.7158.3-70.6177.6000110.2
86K34.7Very low46.9Very low193 Ų193140.6 Ų140.684%0.83976%0.761SS**  trans-130.3121.5153.8-92.7-171.1175.3179.50108.9S88K86-S88 PolarHBondContact O-N 2.7Å
87P45Very low44.9Very low132 Ų132140.1 Ų140.186%0.85777%0.766SS**  trans-79.2113.6179.630.5-32.2000110.4
88S31.8Very low43.1Very low117 Ų117145.9 Ų145.982%0.81878%0.78SS**  trans-113.887.9169-78.70000110.6K86K86-S88 PolarHBondContact O-N 2.7Å
89K39Very low41.4Very low197 Ų197147 Ų14786%0.85779%0.787SS**  trans28.2121135.6-157.9167.1-175174.40117.8
90D41.8Very low39.9Very low158 Ų158150.2 Ų150.285%0.84580%0.801SS**  trans-53.4151.3174.1-50.1-84.6000114
91P37.1Very low39Very low122 Ų122153.4 Ų153.479%0.79281%0.81SS**  trans-127.6140.7142.834.8-23.7000113.4
92D34.4Very low38Very low156 Ų156158.6 Ų158.683%0.83483%0.829SS**  trans-61.6159172.5-120.4-18.9000112.9A94D92-A94 PolarHBondContact O-N 3.46Å
93P41.6Very low37.3Very low120 Ų120159.4 Ų159.478%0.77983%0.832SS**SBendtrans-91.189.1-16935.6-33.3000113.6
94A40.2Very low36.8Very low99 Ų99159.2 Ų159.282%0.81884%0.84SS**  trans-160.583.1165.100000115.3D92D92-A94 PolarHBondContact O-N 3.46Å
95A31.9Very low36.5Very low93 Ų93158.5 Ų158.577%0.76984%0.836SS**  trans180141.9147.100000112.6
96P39.9Very low36.3Very low131 Ų131158.1 Ų158.185%0.85184%0.835SS**  trans-93.2133.5173.534.8-31.1000112.4
97V34.1Very low36.2Very low126 Ų126155.2 Ų155.276%0.76483%0.828SS**  trans-131.1125.2170.1-177.20000111.7
98R36.6Very low35.6Very low233 Ų233152.5 Ų152.588%0.87982%0.824SS**  trans-78.9145.7177-60.5169.1167-170.5-5.3111.3
99H32.7Very low35.9Very low181 Ų181157.5 Ų157.584%0.83883%0.831SS**  trans-139160.7153.9-90.9-73.9000113.8
100K31.8Very low35.4Very low192 Ų192152.1 Ų152.184%0.83583%0.832SS**  trans-96154.6-155.3-62.3171176.6174.60113.5
101P34.7Very low34.8Very low131 Ų131147.9 Ų147.985%0.85183%0.825SS**  trans-77.3144.9171.132.6-34.5000112.2
102K32.8Very low34.6Very low203 Ų203151.9 Ų151.988%0.88383%0.832SS**  trans-107.6118.8178-166.2173.1-177.8-179.70109.9
103K37.4Very low34.5Very low201 Ų201147.5 Ų147.587%0.87483%0.825SS**  trans-73.7148.7175-74.5-178.3173.1-179.20111.2
104Q36.3Very low34.4Very low199 Ų199148.3 Ų148.393%0.9383%0.83SS**  trans-139.9167.7155.3-131.5164.2-19.100110.8
105K31.6Very low34Very low170 Ų170146.9 Ų146.974%0.73982%0.824SS**  trans-109.2157.9-141.2-167.9-169172.4-135.70113.9D107K105-D107 WeakPolarHBondContact CE-OD2 3.43Å; K105-D107 IonicContact NZ-OD1 3.33Å; K105-D107 PolarHBondContact NZ-OD1 3.04Å; K105-D107 IonicContact NZ-OD2 2.72Å; K105-D107 PolarHBondContact NZ-OD2 3.38Å
106L36.1Very low34.8Very low167 Ų167148.8 Ų148.887%0.87483%0.829SS**  trans-99.3132.8173.1-113.9131000111.8
107D32.7Very low34.4Very low131 Ų131146.1 Ų146.170%0.70183%0.825SS**  trans-165147.9165.7-63.6-72000106.8K105K105-D107 WeakPolarHBondContact CE-OD2 3.43Å; K105-D107 IonicContact NZ-OD1 3.33Å; K105-D107 PolarHBondContact NZ-OD1 3.04Å; K105-D107 IonicContact NZ-OD2 2.72Å; K105-D107 PolarHBondContact NZ-OD2 3.38Å
108G32.5Very low34.9Very low75 Ų75146.7 Ų146.777%0.77383%0.832SS**  cis176.770-9.600000118.7
109K37.8Very low34.7Very low223 Ų223139.5 Ų139.597%0.9783%0.83SS**  trans81.9133.7147.8-153.8-179.6-171.8-178.90122.9
110G29.9Very low34.9Very low84 Ų84142.2 Ų142.287%0.86683%0.833SS**  trans99.1138150.500000118.4
111G29Very low35.3Very low68 Ų68138.9 Ų138.970%0.70183%0.83SS**  cis179.3-177.4-3.300000114.3
112H32.8Very low35.5Very low206 Ų206142.4 Ų142.495%0.95483%0.832SS**  trans79.9130.6175.9-60.3-77000120.2
113G32.8Very low35.7Very low65 Ų65138.2 Ų138.267%0.6783%0.829SS**  trans-136.2-172.2159.800000109.3
114P39Very low35.6Very low137 Ų137137.7 Ų137.789%0.8983%0.827SS**  trans-138.3157.9131.436.3-24.1000113.8
115G31Very low35.3Very low68 Ų68135.1 Ų135.170%0.70182%0.819SS**  trans-110.3-147.916200000110.3
116P49.7Very low35.4Very low133 Ų133134.5 Ų134.586%0.86482%0.823SS**  cis-142.1161.7-1540.4-22.9000117
117G31.9Very low35.3Very low75 Ų75134.4 Ų134.477%0.77382%0.818SS**  trans81.5175.2152.600000118.4
118P44.8Very low35.6Very low139 Ų139133.9 Ų133.990%0.90382%0.822SS**  cis-108.2179-6.240.3-29.2000112.2
119G31.7Very low35.6Very low81 Ų81140.1 Ų140.184%0.83583%0.828SS**  cis141.789.8-100000112.6
120R36.5Very low35.6Very low238 Ų238135.5 Ų135.590%0.89882%0.818SS**  trans-141.1135.6168.3-162.8172.9-175.9-161.8-0.3110.4
121P40.8Very low35.8Very low122 Ų122140.4 Ų140.479%0.79282%0.818SS**PPolyproline II helixtrans-80.3138.7-162.129.4-35.9000114.5
122K38.2Very low35.8Very low205 Ų205145.7 Ų145.789%0.89183%0.825SS**PPolyproline II helixtrans-74.9119.6165.9-69.6-174176.3-176.20110K124K122-K124 PolarHBondContact O-N 2.98Å
123S37.1Very low35.7Very low115 Ų115146 Ų14680%0.80482%0.819SS**PPolyproline II helixtrans-66.7118.8172.448.90000111N125S123-N125 PolarHBondContact O-N 3.32Å
124K35.6Very low35.7Very low191 Ų191151.2 Ų151.283%0.8383%0.826SS**  trans-72.4104.6167.1-73.2-177.5177.7179.60108.9K122 L126K122-K124 PolarHBondContact O-N 2.98Å; K124-L126 PolarHBondContact O-N 3.3Å
125N30Very low35.3Very low145 Ų145152.9 Ų152.978%0.77582%0.819SS**  trans-79100.5171-144.228.5000108.3S123 Q127S123-N125 PolarHBondContact O-N 3.32Å; N125-Q127 PolarHBondContact O-N 3.4Å
126L34.1Very low35.9Very low156 Ų156155.8 Ų155.882%0.81782%0.824SS**  trans-73.9103.8167.4-79.892.1000108K124K124-L126 PolarHBondContact O-N 3.3Å
127Q34.2Very low35.4Very low166 Ų166156.2 Ų156.278%0.77682%0.819SS**  trans-75.9138.8158.8-76-162.8-25.700109.6N125 K129N125-Q127 PolarHBondContact O-N 3.4Å; Q127-K129 PolarHBondContact O-N 3.49Å
128P38.1Very low35.8Very low119 Ų119159.4 Ų159.477%0.77382%0.818SS**  trans-59.9132.8171.2-21.133.1000110.2V130P128-V130 PolarHBondContact O-N 2.94Å
129K33.3Very low35.9Very low207 Ų207158.5 Ų158.590%0.981%0.812SS**  trans-71.495.5179.2-168.2170.6-176.2177.60109.2Q127 Q131Q127-K129 PolarHBondContact O-N 3.49Å; K129-Q131 PolarHBondContact O-N 3.22Å
130V36.7Very low36.6Very low125 Ų125162.6 Ų162.676%0.75881%0.81SS**  trans-64.5128.3164.9-179.60000107P128 E132P128-V130 PolarHBondContact O-N 2.94Å; V130-E132 PolarHBondContact O-N 3.09Å; V130-E132 VanDerWaalsContact O-N 3.1Å
131Q34.2Very low37.6Very low188 Ų188158.9 Ų158.988%0.87981%0.808SS**  trans-8483.4-178-171.8169.4-3.600108.1K129 Y133K129-Q131 PolarHBondContact O-N 3.22Å; Q131-Y133 PolarHBondContact O-N 3.46Å
132E30.1Very low38.1Very low179 Ų179159.1 Ų159.184%0.83680%0.801SS**  trans-61.4129.2170.8-79.3-179147.200109.6V130 E134V130-E132 PolarHBondContact O-N 3.09Å; V130-E132 VanDerWaalsContact O-N 3.1Å; E132-E134 PolarHBondContact O-N 2.86Å
133Y30.9Very low38.9Very low212 Ų212154.6 Ų154.683%0.83179%0.792SS**  trans-81.3110.4177.5-165.6-93000107.5Q131 F135Q131-Y133 PolarHBondContact O-N 3.46Å; Y133-F135 PolarHBondContact O-N 2.94Å
134E32.4Very low40Very low174 Ų174160.7 Ų160.781%0.81380%0.798SS**  trans-68.996.6-172.9-169.8169.7-149.600110.7E132E132-E134 PolarHBondContact O-N 2.86Å
135F30.7Very low40.9Very low172 Ų172157 Ų15775%0.75479%0.792SS**  trans-83.6115.7162.6-132.1-94.7000107.3Y133 D137Y133-F135 PolarHBondContact O-N 2.94Å; F135-D137 PolarHBondContact O-N 3.46Å
136T43.6Very low42.6Very low129 Ų129156 Ų15679%0.79179%0.793SS**  trans-76.878.1173.752.80000109.4
137D39.2Very low44.3Very low142 Ų142158.1 Ų158.176%0.75980%0.796SS**  trans-77.8140.5163.6-112-42.5000109.8F135F135-D137 PolarHBondContact O-N 3.46Å
138D40.6Very low46.4Very low142 Ų142154 Ų15476%0.75978%0.779SS**  trans-61.5146.9-177.3-115.2-36.4000111.1Q140D138-Q140 VanDerWaalsContact C-N 3.26Å; D138-Q140 PolarHBondContact O-N 2.95Å
139P46Very low48.6Very low121 Ų121152 Ų15279%0.78676%0.762SS**  trans-69.581.4176.4-14.429.5000111.4D141P139-D141 PolarHBondContact O-N 3.46Å
140Q47.5Very low51.1Low167 Ų167145 Ų14578%0.7874%0.742SS**  trans-63.5119.1167.5-122.3173.9-2.500108.2D138 I142D138-Q140 VanDerWaalsContact C-N 3.26Å; D138-Q140 PolarHBondContact O-N 2.95Å; Q140-I142 HydrophobicContact CB-CG1 4.38Å; Q140-I142 PolarHBondContact O-N 2.87Å
141D56.7Low53.6Low160 Ų160142.1 Ų142.186%0.85673%0.726SS**  trans-74.165.8-176.2-165.515.7000110.8P139 P143P139-D141 PolarHBondContact O-N 3.46Å; D141-P143 VanDerWaalsContact O-CD 3.29Å; D141-P143 WeakPolarHBondContact O-CD 3.41Å
142I50.7Low56.2Low126 Ų126138 Ų13865%0.64671%0.71SS**  trans-72.4115.7173.8-58173.8000106.7Q140 R144Q140-I142 HydrophobicContact CB-CG1 4.38Å; Q140-I142 PolarHBondContact O-N 2.87Å; I142-R144 PolarHBondContact O-N 3.05Å
143P54.7Low59.1Low110 Ų110138.2 Ų138.271%0.71470%0.703SS**  trans-58.8115.1178.9-23.234.6000109.3D141 T145D141-P143 VanDerWaalsContact O-CD 3.29Å; D141-P143 WeakPolarHBondContact O-CD 3.41Å; P143-T145 PolarHBondContact O-N 3.29Å
144R60.3Low62Low243 Ų243133.4 Ų133.492%0.91769%0.687SS**  trans-57112.4176.7-71.3-176.9176.9-171.1-1.9108.2I142I142-R144 PolarHBondContact O-N 3.05Å
145T54.9Low64.9Low115 Ų115132.7 Ų132.771%0.70668%0.677SS**PPolyproline II helixtrans-53.2135.5174.344.30000108.8P143 K147P143-T145 PolarHBondContact O-N 3.29Å; T145-K147 PolarHBondContact O-N 2.65Å
146P66.7Low67.9Low124 Ų124127.9 Ų127.981%0.80567%0.669SS**PPolyproline II helixtrans-60116.6177.224.9-32.4000107.5N148P146-N148 PolarHBondContact O-N 2.62Å; P146-N148 VanDerWaalsContact O-N 3.08Å
147K70.2Confident70.3Confident200 Ų200125 Ų12587%0.8765%0.654SS**PPolyproline II helixtrans-54.1121.1-177.5-70.2-171.7175-171.50108.8T145 D149T145-K147 PolarHBondContact O-N 2.65Å; K147-D149 VanDerWaalsContact C-N 3.33Å; K147-D149 PolarHBondContact O-N 3.27Å
148N77.9Confident73Confident79 Ų79119.8 Ų119.842%0.42263%0.627SS.*  trans-66.694.9177.5-175.9-0.7000109.1Q48 P146 A150 P151Q48-N148 PolarHBondContact NE2-ND2 3.46Å; P146-N148 PolarHBondContact O-N 2.62Å; P146-N148 VanDerWaalsContact O-N 3.08Å; N148-A150 VanDerWaalsContact C-N 3.29Å; N148-A150 WeakPolarHBondContact OD1-CB 3.36Å; N148-A150 PolarHBondContact OD1-N 3.01Å; N148-A150 VanDerWaalsContact OD1-N 3.13Å; N148-P151 WeakPolarHBondContact O-CD 3.49Å
149D83.6Confident75.6Confident77 Ų77119.1 Ų119.141%0.41262%0.62SS.*  trans-870.7-179.7-162.651.4000112.2K147 P151 N152 R153K147-D149 VanDerWaalsContact C-N 3.33Å; K147-D149 PolarHBondContact O-N 3.27Å; D149-P151 VanDerWaalsContact C-CD 3.49Å; D149-N152 PolarHBondContact O-N 3.26Å; D149-N152 VanDerWaalsContact O-N 3.12Å; D149-N152 WeakPolarHBondContact OD1-CB 3.34Å; D149-N152 PolarHBondContact OD1-ND2 3.16Å; D149-R153 WeakPolarHBondContact O-CG 3.48Å; D149-R153 PolarHBondContact O-N 3.25Å; D149-R153 WeakPolarHBondContact OD2-CG 3.37Å
150A86.3Confident77.8Confident59 Ų59117.6 Ų117.649%0.48861%0.61SS.*Hα-helixtrans-56.4-40.2-179.100000113.4N148 N152 R153 F154N148-A150 VanDerWaalsContact C-N 3.29Å; N148-A150 WeakPolarHBondContact OD1-CB 3.36Å; N148-A150 PolarHBondContact OD1-N 3.01Å; N148-A150 VanDerWaalsContact OD1-N 3.13Å; A150-N152 PolarHBondContact O-N 2.74Å; A150-R153 PolarHBondContact O-N 3.31Å; A150-F154 WeakPolarHBondContact O-CB 3.4Å; A150-F154 PolarHBondContact O-N 2.66Å
151P88.4Confident79.9Confident65 Ų65119.3 Ų119.342%0.42261%0.61SS.*Hα-helixtrans-62-42.1174.8-23.735.4000112.9N148 D149 F154 W155N148-P151 WeakPolarHBondContact O-CD 3.49Å; D149-P151 VanDerWaalsContact C-CD 3.49Å; P151-F154 PolarHBondContact O-N 2.98Å; P151-W155 PolarHBondContact O-N 2.7Å
152N88.8Confident81.5Confident103 Ų103116.2 Ų116.255%0.55160%0.6SS**Hα-helixtrans-67.5-40.2179.1-60.9-34000111.2D149 A150 W155 A156D149-N152 PolarHBondContact O-N 3.26Å; D149-N152 VanDerWaalsContact O-N 3.12Å; D149-N152 WeakPolarHBondContact OD1-CB 3.34Å; D149-N152 PolarHBondContact OD1-ND2 3.16Å; A150-N152 PolarHBondContact O-N 2.74Å; N152-W155 PolarHBondContact O-N 3.49Å; N152-A156 VanDerWaalsContact O-CB 3.26Å; N152-A156 WeakPolarHBondContact O-CB 3.42Å; N152-A156 PolarHBondContact O-N 3.22Å
153R91.6Very high83.5Confident182 Ų182113 Ų11369%0.68759%0.592SS**Hα-helixtrans-67.5-37.6177.7-65.8173.5100.9-179.67.1111.6D149 A150 S157D149-R153 WeakPolarHBondContact O-CG 3.48Å; D149-R153 PolarHBondContact O-N 3.25Å; D149-R153 WeakPolarHBondContact OD2-CG 3.37Å; A150-R153 PolarHBondContact O-N 3.31Å; R153-S157 WeakPolarHBondContact O-CB 3.46Å; R153-S157 PolarHBondContact O-N 2.92Å; R153-S157 VanDerWaalsContact O-N 3.1Å; R153-S157 PolarHBondContact O-OG 2.88Å
154F92.1Very high85.5Confident112 Ų112111.5 Ų111.549%0.49158%0.578SS.*Hα-helixtrans-59.7-57.2170.8173.5-98.1000110.7A150 P151 A156 S157 V158A150-F154 WeakPolarHBondContact O-CB 3.4Å; A150-F154 PolarHBondContact O-N 2.66Å; P151-F154 PolarHBondContact O-N 2.98Å; F154-A156 VanDerWaalsContact C-N 3.33Å; F154-A156 PolarHBondContact O-N 3.36Å; F154-S157 WeakPolarHBondContact O-CA 3.43Å; F154-S157 WeakPolarHBondContact O-CB 3.4Å; F154-S157 PolarHBondContact O-N 3.41Å; F154-S157 PolarHBondContact O-OG 3.3Å; F154-V158 HydrophobicContact CD1-CG2 4.4Å; F154-V158 HydrophobicContact CD2-CG2 4.35Å; F154-V158 HydrophobicContact CE1-CG2 4Å; F154-V158 HydrophobicContact CE2-CG2 3.95Å; F154-V158 HydrophobicContact CZ-CG2 3.76Å; F154-V158 WeakPolarHBondContact O-CG2 3.35Å; F154-V158 PolarHBondContact O-N 3.43Å
155W93.6Very high87.1Confident159 Ų159102.4 Ų102.460%0.60255%0.547SS*.Hα-helixtrans-60.4-40.4-179.5-70.7118.8000112.8P151 N152 S157 V158 E159P151-W155 PolarHBondContact O-N 2.7Å; N152-W155 PolarHBondContact O-N 3.49Å; W155-S157 PolarHBondContact O-N 3.25Å; W155-V158 HydrophobicContact CE3-CB 4.41Å; W155-V158 HydrophobicContact CE3-CG1 4.37Å; W155-V158 HydrophobicContact CZ3-CG1 4.37Å; W155-V158 PolarHBondContact O-N 2.98Å; W155-V158 VanDerWaalsContact O-N 3.07Å; W155-E159 PolarHBondContact O-N 3.42Å
156A92.7Very high89Confident70 Ų7099.4 Ų99.458%0.57953%0.529SS*.Hα-helixtrans-62.4-27.7174.300000113.8N152 F154N152-A156 VanDerWaalsContact O-CB 3.26Å; N152-A156 WeakPolarHBondContact O-CB 3.42Å; N152-A156 PolarHBondContact O-N 3.22Å; F154-A156 VanDerWaalsContact C-N 3.33Å; F154-A156 PolarHBondContact O-N 3.36Å
157S94.5Very high90.4Very high68 Ų6897.8 Ų97.848%0.47651%0.514SS..Hα-helixtrans-81.4-24.2173.873.10000113.5R153 F154 W155 Y161R153-S157 WeakPolarHBondContact O-CB 3.46Å; R153-S157 PolarHBondContact O-N 2.92Å; R153-S157 VanDerWaalsContact O-N 3.1Å; R153-S157 PolarHBondContact O-OG 2.88Å; F154-S157 WeakPolarHBondContact O-CA 3.43Å; F154-S157 WeakPolarHBondContact O-CB 3.4Å; F154-S157 PolarHBondContact O-N 3.41Å; F154-S157 PolarHBondContact O-OG 3.3Å; W155-S157 PolarHBondContact O-N 3.25Å; S157-Y161 WeakPolarHBondContact O-CD2 3.3Å; S157-Y161 WeakPolarHBondContact O-CE2 3.4Å
158V96.1Very high91.6Very high33 Ų3393.6 Ų93.620%0.250%0.497CS..Hα-helixtrans-87.3-32.4178.7172.70000111.9F154 W155 P160 Y161 C162F154-V158 HydrophobicContact CD1-CG2 4.4Å; F154-V158 HydrophobicContact CD2-CG2 4.35Å; F154-V158 HydrophobicContact CE1-CG2 4Å; F154-V158 HydrophobicContact CE2-CG2 3.95Å; F154-V158 HydrophobicContact CZ-CG2 3.76Å; F154-V158 WeakPolarHBondContact O-CG2 3.35Å; F154-V158 PolarHBondContact O-N 3.43Å; W155-V158 HydrophobicContact CE3-CB 4.41Å; W155-V158 HydrophobicContact CE3-CG1 4.37Å; W155-V158 HydrophobicContact CZ3-CG1 4.37Å; W155-V158 PolarHBondContact O-N 2.98Å; W155-V158 VanDerWaalsContact O-N 3.07Å; V158-P160 VanDerWaalsContact C-N 3.35Å; V158-P160 VanDerWaalsContact O-N 3.17Å; V158-Y161 PolarHBondContact O-N 3.22Å; V158-C162 VanDerWaalsContact CG1-SG 3.56Å; V158-C162 PolarHBondContact O-N 2.96Å
159E93.7Very high92.4Very high129 Ų12994.4 Ų94.460%0.60350%0.498SS*.Hα-helixtrans-44.8-46.5-178.3-167.979.5-175.500113.8W155 Y161 C162 A163W155-E159 PolarHBondContact O-N 3.42Å; E159-Y161 PolarHBondContact O-N 3.47Å; E159-C162 CarbonylContact O-C 3.55Å; E159-C162 PolarHBondContact O-N 3.44Å; E159-C162 VanDerWaalsContact O-N 3.11Å; E159-A163 PolarHBondContact O-N 3.34Å
160P92.7Very high93Very high89 Ų8991.2 Ų91.258%0.57848%0.482SS*.Hα-helixtrans-65.1-26.3-178.6-20.134.4000113.9V158V158-P160 VanDerWaalsContact C-N 3.35Å; V158-P160 VanDerWaalsContact O-N 3.17Å
161Y92Very high93.5Very high202 Ų20295.5 Ų95.579%0.79249%0.485SS*.Hα-helixtrans-86.7-14.7178.6-56.1-83.1000112.8S157 V158 E159S157-Y161 WeakPolarHBondContact O-CD2 3.3Å; S157-Y161 WeakPolarHBondContact O-CE2 3.4Å; V158-Y161 PolarHBondContact O-N 3.22Å; E159-Y161 PolarHBondContact O-N 3.47Å
162C90.9Very high93.9Very high96 Ų9696.8 Ų96.865%0.64949%0.488SS*.Hα-helixtrans-110.22178.8-61.20000113.1V158 E159V158-C162 VanDerWaalsContact CG1-SG 3.56Å; V158-C162 PolarHBondContact O-N 2.96Å; E159-C162 CarbonylContact O-C 3.55Å; E159-C162 PolarHBondContact O-N 3.44Å; E159-C162 VanDerWaalsContact O-N 3.11Å
163A92.4Very high94.2Very high57 Ų5793.7 Ų93.747%0.47147%0.471SS..SBendtrans-68.2151.6-179.200000112.5E159 I165E159-A163 PolarHBondContact O-N 3.34Å; A163-I165 PolarHBondContact O-N 3.45Å
164D95.2Very high94.4Very high79 Ų7988.9 Ų88.942%0.42246%0.456SS..  trans-67.9120.4170.6-79.9-37.1000109.5T166 Q377 R380D164-T166 PolarHBondContact O-N 2.94Å; D164-Q377 HydrophobicContact CB-CG 4.36Å; D164-Q377 WeakPolarHBondContact OD1-CG 3.32Å; D164-R380 IonicContact OD1-NH2 3.95Å; D164-R380 PolarHBondContact OD1-NH2 3.26Å
165I95.5Very high94.6Very high52 Ų5289.1 Ų89.127%0.26746%0.459SS..  trans-46131.4172.5-57176.4000112.2A163 E169 A370 E373 M374 Q377A163-I165 PolarHBondContact O-N 3.45Å; I165-E169 HydrophobicContact CG2-CB 4.49Å; I165-A370 HydrophobicContact CD1-CB 4.26Å; I165-A370 HydrophobicContact CG2-CB 4.36Å; I165-E373 HydrophobicContact CD1-CB 4.07Å; I165-E373 HydrophobicContact CD1-CG 4.04Å; I165-M374 HydrophobicContact CG2-CG 4.26Å; I165-Q377 PolarHBondContact O-OE1 3.41Å; I165-Q377 VanDerWaalsContact O-OE1 3.05Å
166T95.2Very high94.7Very high53 Ų5385.4 Ų85.433%0.32545%0.451SS..  trans-96.7166.7-177.264.60000113.4D164 E168 E169 T170D164-T166 PolarHBondContact O-N 2.94Å; T166-E168 PolarHBondContact O-N 3.33Å; T166-E169 WeakPolarHBondContact CB-OE2 3.38Å; T166-E169 PolarHBondContact N-OE2 2.94Å; T166-E169 VanDerWaalsContact OG1-CD 3.22Å; T166-E169 WeakPolarHBondContact OG1-CG 3.42Å; T166-E169 PolarHBondContact OG1-N 3.41Å; T166-E169 VanDerWaalsContact OG1-N 3.15Å; T166-E169 PolarHBondContact OG1-OE2 2.87Å; T166-T170 PolarHBondContact O-N 2.94Å; T166-T170 PolarHBondContact O-OG1 2.75Å; T166-T170 VanDerWaalsContact O-OG1 3.13Å
167N95.3Very high94.7Very high90 Ų9083.6 Ų83.648%0.48143%0.431SS..Hα-helixtrans-65.8-33.6171.4-74.5-88.4000111T170 R171N167-T170 PolarHBondContact O-N 3.39Å; N167-R171 WeakPolarHBondContact O-CB 3.42Å; N167-R171 VanDerWaalsContact O-CG 3.28Å; N167-R171 WeakPolarHBondContact O-CG 3.4Å; N167-R171 PolarHBondContact O-N 3.46Å
168E95.8Very high94.7Very high112 Ų11286.9 Ų86.952%0.52344%0.437SS..Hα-helixtrans-65.2-44.7-179.6-70.956.8-133.100111.1T166 R171 L172T166-E168 PolarHBondContact O-N 3.33Å; E168-R171 PolarHBondContact O-N 3.2Å; E168-R171 IonicContact OE1-NH1 3.71Å; E168-R171 PolarHBondContact OE1-NH1 3.24Å; E168-L172 WeakPolarHBondContact O-CB 3.36Å; E168-L172 PolarHBondContact O-N 3.33Å
169E94.5Very high94.2Very high95 Ų9589 Ų8944%0.44445%0.452SS..Hα-helixtrans-66.8-37175.2-70.2155.6143.900112.1I165 T166 L172 L173I165-E169 HydrophobicContact CG2-CB 4.49Å; T166-E169 WeakPolarHBondContact CB-OE2 3.38Å; T166-E169 PolarHBondContact N-OE2 2.94Å; T166-E169 VanDerWaalsContact OG1-CD 3.22Å; T166-E169 WeakPolarHBondContact OG1-CG 3.42Å; T166-E169 PolarHBondContact OG1-N 3.41Å; T166-E169 VanDerWaalsContact OG1-N 3.15Å; T166-E169 PolarHBondContact OG1-OE2 2.87Å; E169-L172 PolarHBondContact O-N 2.9Å; E169-L173 PolarHBondContact O-N 3.34Å
170T96Very high93.8Very high10 Ų1086.3 Ų86.36%0.06145%0.445CS..Hα-helixtrans-64.8-42.2174.1-60.30000111.5T166 N167 L173 E174 L367 K371 M374T166-T170 PolarHBondContact O-N 2.94Å; T166-T170 PolarHBondContact O-OG1 2.75Å; T166-T170 VanDerWaalsContact O-OG1 3.13Å; N167-T170 PolarHBondContact O-N 3.39Å; T170-L173 PolarHBondContact O-N 2.88Å; T170-E174 WeakPolarHBondContact O-CG 3.5Å; T170-E174 PolarHBondContact O-N 3.47Å; T170-L367 HydrophobicContact CG2-CD1 3.74Å; T170-K371 HydrophobicContact CG2-CG 4.1Å; T170-M374 HydrophobicContact CG2-SD 4.48Å; T170-M374 PolarHBondContact OG1-SD 3.37Å
171R96.9Very high93.4Very high150 Ų15091.8 Ų91.857%0.56646%0.463SS*.Hα-helixtrans-64.7-39173.7-75.2170179.6161.41.5112.4N167 E168 L173 E174 E175N167-R171 WeakPolarHBondContact O-CB 3.42Å; N167-R171 VanDerWaalsContact O-CG 3.28Å; N167-R171 WeakPolarHBondContact O-CG 3.4Å; N167-R171 PolarHBondContact O-N 3.46Å; E168-R171 PolarHBondContact O-N 3.2Å; E168-R171 IonicContact OE1-NH1 3.71Å; E168-R171 PolarHBondContact OE1-NH1 3.24Å; R171-L173 VanDerWaalsContact C-N 3.33Å; R171-L173 PolarHBondContact O-N 3.4Å; R171-E174 WeakPolarHBondContact O-CB 3.32Å; R171-E174 PolarHBondContact O-N 3.2Å; R171-E175 WeakPolarHBondContact O-CB 3.37Å; R171-E175 PolarHBondContact O-N 3.07Å
172L96.2Very high93.1Very high92 Ų9285.4 Ų85.448%0.48244%0.442SS..Hα-helixtrans-60.9-42.4174.9178.364.2000111.1E168 E169 E175 L176E168-L172 WeakPolarHBondContact O-CB 3.36Å; E168-L172 PolarHBondContact O-N 3.33Å; E169-L172 PolarHBondContact O-N 2.9Å; L172-E175 PolarHBondContact O-N 3.13Å; L172-L176 HydrophobicContact CD1-CD1 4.24Å; L172-L176 HydrophobicContact CD1-CG 4.26Å; L172-L176 HydrophobicContact CG-CD1 4.02Å; L172-L176 HydrophobicContact CG-CG 4.46Å; L172-L176 WeakPolarHBondContact O-CB 3.25Å; L172-L176 VanDerWaalsContact O-CG 3.23Å; L172-L176 WeakPolarHBondContact O-CG 3.41Å; L172-L176 PolarHBondContact O-N 3.14Å
173L95.8Very high92.9Very high38 Ų3883.1 Ų83.120%0.19942%0.422CS..Hα-helixtrans-63.9-38.5173.8-73.5171.9000112.6E169 T170 R171 L177 L366 L367 A370E169-L173 PolarHBondContact O-N 3.34Å; T170-L173 PolarHBondContact O-N 2.88Å; R171-L173 VanDerWaalsContact C-N 3.33Å; R171-L173 PolarHBondContact O-N 3.4Å; L173-L177 WeakPolarHBondContact O-CD1 3.49Å; L173-L177 WeakPolarHBondContact O-CG 3.43Å; L173-L177 PolarHBondContact O-N 3.27Å; L173-L366 HydrophobicContact CD1-CB 4.47Å; L173-L366 HydrophobicContact CD2-CB 4.44Å; L173-L367 HydrophobicContact CB-CB 4.43Å; L173-L367 HydrophobicContact CB-CD1 4.04Å; L173-A370 HydrophobicContact CD1-CB 4.2Å
174E96.1Very high92.6Very high80 Ų8083.7 Ų83.737%0.37443%0.427SS..Hα-helixtrans-66.3-36.4173.8-71.2177.7160.600112.8T170 R171 L177 L367 K371T170-E174 WeakPolarHBondContact O-CG 3.5Å; T170-E174 PolarHBondContact O-N 3.47Å; R171-E174 WeakPolarHBondContact O-CB 3.32Å; R171-E174 PolarHBondContact O-N 3.2Å; E174-L177 PolarHBondContact O-N 3.2Å; E174-L367 HydrophobicContact CG-CD1 3.79Å; E174-L367 HydrophobicContact CG-CD2 3.67Å; E174-L367 HydrophobicContact CG-CG 4.41Å; E174-K371 WeakPolarHBondContact OE1-CE 3.24Å; E174-K371 IonicContact OE1-NZ 3.45Å; E174-K371 PolarHBondContact OE1-NZ 2.97Å
175E95.8Very high92.4Very high117 Ų11785.9 Ų85.955%0.54744%0.435SS..Hα-helixtrans-69.4-46.2175-176.2166.7-153.900111.8R171 L172 L177 K178R171-E175 WeakPolarHBondContact O-CB 3.37Å; R171-E175 PolarHBondContact O-N 3.07Å; L172-E175 PolarHBondContact O-N 3.13Å; E175-L177 PolarHBondContact O-N 3.26Å; E175-L177 VanDerWaalsContact O-N 3.07Å; E175-K178 WeakPolarHBondContact O-CB 3.47Å; E175-K178 WeakPolarHBondContact O-CG 3.32Å; E175-K178 PolarHBondContact O-N 2.9Å
176L94.5Very high91.9Very high82 Ų8289.5 Ų89.543%0.42945%0.446SS..THydrogen-bonded Turntrans-63.9-10.9175.5-71.5173.1000113.8L172 K363L172-L176 HydrophobicContact CD1-CD1 4.24Å; L172-L176 HydrophobicContact CD1-CG 4.26Å; L172-L176 HydrophobicContact CG-CD1 4.02Å; L172-L176 HydrophobicContact CG-CG 4.46Å; L172-L176 WeakPolarHBondContact O-CB 3.25Å; L172-L176 VanDerWaalsContact O-CG 3.23Å; L172-L176 WeakPolarHBondContact O-CG 3.41Å; L172-L176 PolarHBondContact O-N 3.14Å; L176-K363 HydrophobicContact CB-CD 4.29Å; L176-K363 WeakPolarHBondContact O-CD 3.23Å; L176-K363 WeakPolarHBondContact O-CE 3.33Å; L176-K363 PolarHBondContact O-NZ 2.97Å
177L94.2Very high91.7Very high32 Ų3289.2 Ų89.217%0.16844%0.441CS..THydrogen-bonded Turntrans-92-9.9174.3-83.7168.5000114.1L173 E174 E175 R360 K363 Q364 L367L173-L177 WeakPolarHBondContact O-CD1 3.49Å; L173-L177 WeakPolarHBondContact O-CG 3.43Å; L173-L177 PolarHBondContact O-N 3.27Å; E174-L177 PolarHBondContact O-N 3.2Å; E175-L177 PolarHBondContact O-N 3.26Å; E175-L177 VanDerWaalsContact O-N 3.07Å; L177-R360 HydrophobicContact CD2-CG 4.13Å; L177-K363 HydrophobicContact CD1-CB 4.48Å; L177-K363 HydrophobicContact CD2-CB 3.53Å; L177-K363 HydrophobicContact CD2-CD 4.39Å; L177-K363 HydrophobicContact CG-CB 3.87Å; L177-Q364 HydrophobicContact CD1-CG 4.18Å; L177-Q364 HydrophobicContact CD2-CG 3.59Å; L177-L367 HydrophobicContact CD1-CB 4.25Å; L177-L367 HydrophobicContact CD1-CD2 3.65Å
178K92.9Very high91.5Very high136 Ų13691.3 Ų91.359%0.59145%0.445SS*.SBendtrans-68.8134.4170.2-61.1172.1-174.1167.60108.7E175E175-K178 WeakPolarHBondContact O-CB 3.47Å; E175-K178 WeakPolarHBondContact O-CG 3.32Å; E175-K178 PolarHBondContact O-N 2.9Å
179P86.3Confident91.2Very high79 Ų7989.3 Ų89.351%0.51344%0.437SS..PPolyproline II helixtrans-64138.517228.1-33.3000109.6E183P179-E183 WeakPolarHBondContact CB-OE2 3.47Å
180P85.6Confident90.8Very high71 Ų7190.2 Ų90.246%0.46145%0.451SS..PPolyproline II helixtrans-57.9141.5169.7-21.432.8000111.3D182 E183P180-D182 WeakPolarHBondContact CB-OD1 3.45Å; P180-D182 PolarHBondContact O-N 3.47Å; P180-E183 HydrophobicContact CB-CB 4.35Å; P180-E183 WeakPolarHBondContact CD-OE2 3.31Å; P180-E183 WeakPolarHBondContact O-CB 3.28Å; P180-E183 PolarHBondContact O-N 2.83Å; P180-E183 VanDerWaalsContact O-N 3.15Å
181E84.8Confident90.1Very high204 Ų20494.4 Ų94.495%0.95349%0.487SS*.THydrogen-bonded Turntrans-65.6-24.8-179.4-61-165153.700112.5
182D85.6Confident89.4Confident68 Ų6894.4 Ų94.436%0.36450%0.498SS..THydrogen-bonded Turntrans-90.7-0.3177.862.8-37.4000113.8P180 A184 E185 Y186P180-D182 WeakPolarHBondContact CB-OD1 3.45Å; P180-D182 PolarHBondContact O-N 3.47Å; D182-A184 PolarHBondContact O-N 3.43Å; D182-E185 VanDerWaalsContact O-CB 3.3Å; D182-E185 WeakPolarHBondContact O-CB 3.35Å; D182-E185 PolarHBondContact O-N 3.39Å; D182-Y186 WeakPolarHBondContact OD2-CE2 3.46Å; D182-Y186 VanDerWaalsContact OD2-CZ 3.29Å; D182-Y186 PolarHBondContact OD2-OH 2.91Å
183E85.8Confident88.8Confident48 Ų4893.3 Ų93.322%0.22451%0.509CS..THydrogen-bonded Turntrans-54.9-35.2-175.8-170.5-178.114800112.3P179 P180 E185 F187 I356P179-E183 WeakPolarHBondContact CB-OE2 3.47Å; P180-E183 HydrophobicContact CB-CB 4.35Å; P180-E183 WeakPolarHBondContact CD-OE2 3.31Å; P180-E183 WeakPolarHBondContact O-CB 3.28Å; P180-E183 PolarHBondContact O-N 2.83Å; P180-E183 VanDerWaalsContact O-N 3.15Å; E183-E185 VanDerWaalsContact C-N 3.28Å; E183-E185 PolarHBondContact O-N 3.31Å; E183-F187 HydrophobicContact CG-CE2 4.24Å; E183-F187 WeakPolarHBondContact O-CD2 3.28Å; E183-F187 VanDerWaalsContact O-CE2 3.29Å; E183-F187 WeakPolarHBondContact O-CE2 3.43Å; E183-I356 HydrophobicContact CG-CD1 4.3Å
184A87.6Confident88.3Confident70 Ų7096.6 Ų96.658%0.57952%0.521SS*.THydrogen-bonded Turntrans-72.1-14.9178.100000114.4D182D182-A184 PolarHBondContact O-N 3.43Å
185E89.2Confident87.9Confident124 Ų12497.5 Ų97.558%0.57953%0.525SS*.THydrogen-bonded Turntrans-77.4-37.2-179.9-167.2154.716900112.3D182 E183 F187 K188D182-E185 VanDerWaalsContact O-CB 3.3Å; D182-E185 WeakPolarHBondContact O-CB 3.35Å; D182-E185 PolarHBondContact O-N 3.39Å; E183-E185 VanDerWaalsContact C-N 3.28Å; E183-E185 PolarHBondContact O-N 3.31Å; E185-F187 PolarHBondContact O-N 3.31Å; E185-K188 HydrophobicContact CG-CD 4.39Å; E185-K188 PolarHBondContact O-N 3.49Å
186Y86.7Confident87.3Confident129 Ų12998.5 Ų98.551%0.50653%0.525SS..THydrogen-bonded Turntrans-60.3-14.6176.6-56-64.6000114.5D182 Q349D182-Y186 WeakPolarHBondContact OD2-CE2 3.46Å; D182-Y186 VanDerWaalsContact OD2-CZ 3.29Å; D182-Y186 PolarHBondContact OD2-OH 2.91Å; Y186-Q349 PolarHBondContact O-NE2 3.01Å
187F90.9Very high86.9Confident47 Ų4797.3 Ų97.321%0.20652%0.523CS..THydrogen-bonded Turntrans-106.53.1-179.4-55.5-58.9000114.1E183 E185 Q349 L352 K353 I356E183-F187 HydrophobicContact CG-CE2 4.24Å; E183-F187 WeakPolarHBondContact O-CD2 3.28Å; E183-F187 VanDerWaalsContact O-CE2 3.29Å; E183-F187 WeakPolarHBondContact O-CE2 3.43Å; E185-F187 PolarHBondContact O-N 3.31Å; F187-Q349 HydrophobicContact CD1-CB 3.99Å; F187-Q349 HydrophobicContact CD1-CG 3.96Å; F187-Q349 HydrophobicContact CE1-CB 4.32Å; F187-L352 HydrophobicContact CE1-CB 4.37Å; F187-L352 HydrophobicContact CE1-CD2 3.94Å; F187-L352 HydrophobicContact CE1-CG 4.21Å; F187-L352 HydrophobicContact CZ-CD2 4.06Å; F187-L352 HydrophobicContact CZ-CG 4.17Å; F187-K353 HydrophobicContact CD1-CD 4.49Å; F187-K353 VanDerWaalsContact CD1-CE 3.45Å; F187-K353 HydrophobicContact CD1-CG 4.37Å; F187-K353 HydrophobicContact CE1-CD 4.16Å; F187-K353 HydrophobicContact CE1-CG 3.59Å; F187-K353 HydrophobicContact CE2-CG 4.48Å; F187-K353 HydrophobicContact CZ-CG 3.65Å; F187-I356 HydrophobicContact CE2-CD1 4.5Å; F187-I356 HydrophobicContact CZ-CD1 4.01Å
188K91.4Very high86.5Confident134 Ų134100.5 Ų100.558%0.58354%0.537SS*.PPolyproline II helixtrans-82.3123.2175.4-64.3173.1-168.1160.90109.8E185E185-K188 HydrophobicContact CG-CD 4.39Å; E185-K188 PolarHBondContact O-N 3.49Å
189I88.1Confident86.2Confident70 Ų70100.1 Ų100.136%0.35953%0.532SS..PPolyproline II helixtrans-101.2116.6170.1-48.7-173.3000107.2L342 L345 Q346I189-L342 HydrophobicContact CD1-CD1 3.83Å; I189-L342 HydrophobicContact CG2-CD1 3.85Å; I189-L345 HydrophobicContact CB-CD2 4.38Å; I189-L345 HydrophobicContact CD1-CD2 3.63Å; I189-L345 HydrophobicContact CG1-CD2 3.59Å; I189-L345 HydrophobicContact CG2-CD2 4.11Å; I189-Q346 HydrophobicContact CD1-CG 4Å
190P85.8Confident86.4Confident113 Ų113103.4 Ų103.473%0.73454%0.535SS*.PPolyproline II helixtrans-62.1149.2173-21.734000111.5
191A83.1Confident86.6Confident99 Ų99102.1 Ų102.182%0.81853%0.53SS*.PPolyproline II helixtrans-67.2145.6170.900000110.8G193A191-G193 PolarHBondContact O-N 3.39Å
192L82.3Confident86.7Confident150 Ų15094.8 Ų94.879%0.78550%0.496SS*.PPolyproline II helixtrans-59.7132.6170.8-65.3173.5000109.9
193G82.7Confident86.8Confident69 Ų6995.6 Ų95.671%0.71150%0.497SS*.  trans-76-177177.800000113A191 H195A191-G193 PolarHBondContact O-N 3.39Å; G193-H195 PolarHBondContact O-N 3.1Å
194K85.8Confident87Confident107 Ų10797.8 Ų97.847%0.46551%0.51SS..SBendtrans-56.7136.7168.5-70-164.1179.4-163.90110.2R199K194-R199 HydrophobicContact CB-CG 3.85Å
195H86.3Confident86.9Confident98 Ų9897.5 Ų97.545%0.45450%0.499SS..  trans-59145.4176.5-168.7-102.6000111.3G193 S197 Q198 R199G193-H195 PolarHBondContact O-N 3.1Å; H195-S197 VanDerWaalsContact C-N 3.28Å; H195-S197 PolarHBondContact ND1-N 3.11Å; H195-S197 PolarHBondContact ND1-OG 3.23Å; H195-S197 PolarHBondContact O-N 2.84Å; H195-Q198 PolarHBondContact O-N 2.95Å; H195-Q198 VanDerWaalsContact O-N 3.09Å; H195-R199 PolarHBondContact O-N 3.43Å
196Y84.8Confident86.8Confident139 Ų13994.5 Ų94.555%0.54549%0.486SS..Hα-helixtrans-60-36-172.663.7-93.9000112.6Q198 R199 W200Y196-Q198 PolarHBondContact O-N 2.99Å; Y196-R199 WeakPolarHBondContact O-CB 3.36Å; Y196-R199 PolarHBondContact O-N 3.07Å; Y196-R199 VanDerWaalsContact O-N 3.16Å; Y196-W200 HydrophobicContact CD2-CD2 4.33Å; Y196-W200 AromaticContact CD2-CE3 3.81Å; Y196-W200 HydrophobicContact CD2-CE3 3.81Å; Y196-W200 AromaticContact CD2-CH2 3.77Å; Y196-W200 HydrophobicContact CD2-CH2 3.77Å; Y196-W200 HydrophobicContact CD2-CZ2 4.29Å; Y196-W200 AromaticContact CD2-CZ3 3.51Å; Y196-W200 HydrophobicContact CD2-CZ3 3.51Å; Y196-W200 HydrophobicContact CE2-CE3 4.36Å; Y196-W200 HydrophobicContact CE2-CH2 4.24Å; Y196-W200 AromaticContact CE2-CZ3 3.81Å; Y196-W200 HydrophobicContact CE2-CZ3 3.81Å; Y196-W200 PolarHBondContact O-N 3.27Å
197S85.3Confident86.8Confident56 Ų5693.7 Ų93.739%0.39249%0.487SS..Hα-helixtrans-64.6-38.2176.861.30000113.1H195 R199 A201H195-S197 VanDerWaalsContact C-N 3.28Å; H195-S197 PolarHBondContact ND1-N 3.11Å; H195-S197 PolarHBondContact ND1-OG 3.23Å; H195-S197 PolarHBondContact O-N 2.84Å; S197-R199 VanDerWaalsContact C-N 3.32Å; S197-A201 WeakPolarHBondContact O-CB 3.42Å; S197-A201 PolarHBondContact O-N 3.3Å
198Q85Confident86.5Confident99 Ų9998.1 Ų98.146%0.46351%0.509SS..Hα-helixtrans-69.8-32.4174.2-68.3-178.8-9.400111.6H195 Y196 Q202H195-Q198 PolarHBondContact O-N 2.95Å; H195-Q198 VanDerWaalsContact O-N 3.09Å; Y196-Q198 PolarHBondContact O-N 2.99Å; Q198-Q202 VanDerWaalsContact O-CB 3.24Å; Q198-Q202 WeakPolarHBondContact O-CB 3.45Å; Q198-Q202 PolarHBondContact O-N 3.22Å; Q198-Q202 VanDerWaalsContact O-N 3.08Å
199R86.9Confident85.9Confident128 Ų12895.9 Ų95.948%0.48350%0.5SS..Hα-helixtrans-68.3-47.6173.9-72.8-163.858-167.4-12.6111.8K194 H195 Y196 S197 Q202 E203K194-R199 HydrophobicContact CB-CG 3.85Å; H195-R199 PolarHBondContact O-N 3.43Å; Y196-R199 WeakPolarHBondContact O-CB 3.36Å; Y196-R199 PolarHBondContact O-N 3.07Å; Y196-R199 VanDerWaalsContact O-N 3.16Å; S197-R199 VanDerWaalsContact C-N 3.32Å; R199-Q202 PolarHBondContact O-N 2.91Å; R199-E203 IonicContact CZ-OE1 3.62Å; R199-E203 IonicContact NE-OE1 3.93Å; R199-E203 PolarHBondContact NE-OE1 3.47Å; R199-E203 IonicContact NH2-OE1 2.75Å; R199-E203 PolarHBondContact NH2-OE1 3.3Å; R199-E203 VanDerWaalsContact O-CB 3.3Å; R199-E203 WeakPolarHBondContact O-CB 3.39Å; R199-E203 VanDerWaalsContact O-CG 3.22Å; R199-E203 WeakPolarHBondContact O-CG 3.33Å; R199-E203 PolarHBondContact O-N 3.19Å
200W90.9Very high85.6Confident149 Ų14999 Ų9956%0.56451%0.507SS*.Hα-helixtrans-62-49.9175.3-65.7-24000111.5Y196 Q202 E203 D204Y196-W200 HydrophobicContact CD2-CD2 4.33Å; Y196-W200 AromaticContact CD2-CE3 3.81Å; Y196-W200 HydrophobicContact CD2-CE3 3.81Å; Y196-W200 AromaticContact CD2-CH2 3.77Å; Y196-W200 HydrophobicContact CD2-CH2 3.77Å; Y196-W200 HydrophobicContact CD2-CZ2 4.29Å; Y196-W200 AromaticContact CD2-CZ3 3.51Å; Y196-W200 HydrophobicContact CD2-CZ3 3.51Å; Y196-W200 HydrophobicContact CE2-CE3 4.36Å; Y196-W200 HydrophobicContact CE2-CH2 4.24Å; Y196-W200 AromaticContact CE2-CZ3 3.81Å; Y196-W200 HydrophobicContact CE2-CZ3 3.81Å; Y196-W200 PolarHBondContact O-N 3.27Å; W200-Q202 PolarHBondContact O-N 3.3Å; W200-Q202 VanDerWaalsContact O-N 3.12Å; W200-E203 CarbonylContact O-C 3.52Å; W200-E203 PolarHBondContact O-N 2.95Å; W200-D204 WeakPolarHBondContact O-CB 3.3Å; W200-D204 PolarHBondContact O-N 2.93Å
201A89Confident85.2Confident44 Ų4499.2 Ų99.236%0.36450%0.499SS..Hα-helixtrans-57.3-33175.700000113.5S197 L205S197-A201 WeakPolarHBondContact O-CB 3.42Å; S197-A201 PolarHBondContact O-N 3.3Å; A201-L205 VanDerWaalsContact O-CB 3.3Å; A201-L205 WeakPolarHBondContact O-CB 3.5Å; A201-L205 PolarHBondContact O-N 3.47Å
202Q87.1Confident84.6Confident49 Ų4996.3 Ų96.323%0.22948%0.479CS..Hα-helixtrans-75.2-39173.1-175.7175.20.500112.6Q198 R199 W200 L206Q198-Q202 VanDerWaalsContact O-CB 3.24Å; Q198-Q202 WeakPolarHBondContact O-CB 3.45Å; Q198-Q202 PolarHBondContact O-N 3.22Å; Q198-Q202 VanDerWaalsContact O-N 3.08Å; R199-Q202 PolarHBondContact O-N 2.91Å; W200-Q202 PolarHBondContact O-N 3.3Å; W200-Q202 VanDerWaalsContact O-N 3.12Å; Q202-L206 HydrophobicContact CG-CD1 4.16Å; Q202-L206 WeakPolarHBondContact O-CB 3.26Å; Q202-L206 WeakPolarHBondContact O-CD1 3.47Å; Q202-L206 WeakPolarHBondContact O-CG 3.26Å; Q202-L206 PolarHBondContact O-N 3.25Å
203E87.8Confident83.9Confident85 Ų8591.7 Ų91.740%0.39746%0.462SS..Hα-helixtrans-70.5-44.6179.6-74.6164.1-163.600111R199 W200 L206 E207R199-E203 IonicContact CZ-OE1 3.62Å; R199-E203 IonicContact NE-OE1 3.93Å; R199-E203 PolarHBondContact NE-OE1 3.47Å; R199-E203 IonicContact NH2-OE1 2.75Å; R199-E203 PolarHBondContact NH2-OE1 3.3Å; R199-E203 VanDerWaalsContact O-CB 3.3Å; R199-E203 WeakPolarHBondContact O-CB 3.39Å; R199-E203 VanDerWaalsContact O-CG 3.22Å; R199-E203 WeakPolarHBondContact O-CG 3.33Å; R199-E203 PolarHBondContact O-N 3.19Å; W200-E203 CarbonylContact O-C 3.52Å; W200-E203 PolarHBondContact O-N 2.95Å; E203-L206 CarbonylContact O-C 3.53Å; E203-L206 PolarHBondContact O-N 3.03Å; E203-E207 PolarHBondContact O-N 3.45Å
204D90.1Very high83Confident94 Ų9495.8 Ų95.850%0.50346%0.456SS..Hα-helixtrans-60.1-48.5174.9-62.2-15.4000111.2W200 L206 E207 E208W200-D204 WeakPolarHBondContact O-CB 3.3Å; W200-D204 PolarHBondContact O-N 2.93Å; D204-L206 VanDerWaalsContact C-N 3.29Å; D204-L206 PolarHBondContact O-N 3.06Å; D204-E207 CarbonylContact O-C 3.59Å; D204-E207 WeakPolarHBondContact O-CA 3.36Å; D204-E207 WeakPolarHBondContact O-CB 3.32Å; D204-E207 PolarHBondContact O-N 3.48Å; D204-E208 PolarHBondContact O-N 3.46Å
205L86.8Confident81.7Confident65 Ų6593.5 Ų93.534%0.3446%0.457SS..Hα-helixtrans-63.6-34.7177.5-174.570.6000112.2A201 E207 Q209 V235A201-L205 VanDerWaalsContact O-CB 3.3Å; A201-L205 WeakPolarHBondContact O-CB 3.5Å; A201-L205 PolarHBondContact O-N 3.47Å; L205-E207 VanDerWaalsContact C-N 3.32Å; L205-Q209 VanDerWaalsContact O-CB 3.31Å; L205-Q209 WeakPolarHBondContact O-CB 3.47Å; L205-Q209 PolarHBondContact O-N 2.88Å; L205-V235 HydrophobicContact CD2-CB 4.45Å; L205-V235 HydrophobicContact CD2-CG1 3.7Å; L205-V235 HydrophobicContact CD2-CG2 4.14Å
206L86.6Confident80.2Confident60 Ų6091.9 Ų91.931%0.31445%0.452SS..Hα-helixtrans-74.2-22.3173-73.1170000112.7Q202 E203 D204 R210Q202-L206 HydrophobicContact CG-CD1 4.16Å; Q202-L206 WeakPolarHBondContact O-CB 3.26Å; Q202-L206 WeakPolarHBondContact O-CD1 3.47Å; Q202-L206 WeakPolarHBondContact O-CG 3.26Å; Q202-L206 PolarHBondContact O-N 3.25Å; E203-L206 CarbonylContact O-C 3.53Å; E203-L206 PolarHBondContact O-N 3.03Å; D204-L206 VanDerWaalsContact C-N 3.29Å; D204-L206 PolarHBondContact O-N 3.06Å; L206-R210 VanDerWaalsContact O-CB 3.29Å; L206-R210 WeakPolarHBondContact O-CB 3.49Å; L206-R210 PolarHBondContact O-N 2.88Å
207E86.6Confident78.6Confident112 Ų11290.3 Ų90.352%0.52345%0.453SS..Hα-helixtrans-76.7-49.8170.3-173.6143.6-114.600110.5E203 D204 L205 Q209 R210 E211E203-E207 PolarHBondContact O-N 3.45Å; D204-E207 CarbonylContact O-C 3.59Å; D204-E207 WeakPolarHBondContact O-CA 3.36Å; D204-E207 WeakPolarHBondContact O-CB 3.32Å; D204-E207 PolarHBondContact O-N 3.48Å; L205-E207 VanDerWaalsContact C-N 3.32Å; E207-Q209 VanDerWaalsContact C-N 3.31Å; E207-Q209 PolarHBondContact O-N 3.07Å; E207-R210 CarbonylContact O-C 3.56Å; E207-R210 WeakPolarHBondContact O-CA 3.46Å; E207-R210 WeakPolarHBondContact O-CB 3.47Å; E207-R210 PolarHBondContact O-N 3.48Å; E207-E211 HydrophobicContact CG-CG 4.37Å; E207-E211 WeakPolarHBondContact O-CG 3.47Å; E207-E211 PolarHBondContact O-N 2.75Å
208E83.6Confident77.1Confident140 Ų14096.6 Ų96.665%0.65447%0.473SS*.Hα-helixtrans-56.2-42.2172.9-71.5-163.2143.600112.4D204 R210 E211 G212D204-E208 PolarHBondContact O-N 3.46Å; E208-R210 VanDerWaalsContact C-N 3.28Å; E208-R210 PolarHBondContact O-N 2.65Å; E208-E211 PolarHBondContact O-N 3.15Å; E208-G212 WeakPolarHBondContact O-CA 3.36Å; E208-G212 PolarHBondContact O-N 3.35Å
209Q79.8Confident75.5Confident88 Ų8899.8 Ų99.841%0.41149%0.486SS..Hα-helixtrans-62.3-37175.3-168.9-172.548.100111.7L205 E207 A213L205-Q209 VanDerWaalsContact O-CB 3.31Å; L205-Q209 WeakPolarHBondContact O-CB 3.47Å; L205-Q209 PolarHBondContact O-N 2.88Å; E207-Q209 VanDerWaalsContact C-N 3.31Å; E207-Q209 PolarHBondContact O-N 3.07Å; Q209-A213 VanDerWaalsContact O-CB 3.3Å; Q209-A213 WeakPolarHBondContact O-CB 3.23Å; Q209-A213 PolarHBondContact O-N 3.45Å
210R80.8Confident73.7Confident134 Ų13499.2 Ų99.251%0.50649%0.487SS..Hα-helixtrans-75-38.8179.4-170.8-167.2-43.1-115.3-0.9112.1L206 E207 E208 R214L206-R210 VanDerWaalsContact O-CB 3.29Å; L206-R210 WeakPolarHBondContact O-CB 3.49Å; L206-R210 PolarHBondContact O-N 2.88Å; E207-R210 CarbonylContact O-C 3.56Å; E207-R210 WeakPolarHBondContact O-CA 3.46Å; E207-R210 WeakPolarHBondContact O-CB 3.47Å; E207-R210 PolarHBondContact O-N 3.48Å; E208-R210 VanDerWaalsContact C-N 3.28Å; E208-R210 PolarHBondContact O-N 2.65Å; R210-R214 VanDerWaalsContact O-CG 3.26Å; R210-R214 WeakPolarHBondContact O-CG 3.46Å; R210-R214 PolarHBondContact O-N 3.03Å
211E77.4Confident71.6Confident118 Ų11897.3 Ų97.355%0.55150%0.496SS*.Hα-helixtrans-68.5-43.1172.9-63.9-138.4130.500111.1E207 E208 A213 R214 A215E207-E211 HydrophobicContact CG-CG 4.37Å; E207-E211 WeakPolarHBondContact O-CG 3.47Å; E207-E211 PolarHBondContact O-N 2.75Å; E208-E211 PolarHBondContact O-N 3.15Å; E211-A213 VanDerWaalsContact C-N 3.34Å; E211-A213 PolarHBondContact O-N 3.31Å; E211-R214 CarbonylContact O-C 3.02Å; E211-R214 PolarHBondContact O-N 2.84Å; E211-A215 WeakPolarHBondContact O-CB 3.34Å; E211-A215 PolarHBondContact O-N 3.35Å
212G71.3Confident69.8Low39 Ų39102.4 Ų102.440%0.40252%0.516SS..Hα-helixtrans-59-41.5171.900000112.5E208 A215 N216E208-G212 WeakPolarHBondContact O-CA 3.36Å; E208-G212 PolarHBondContact O-N 3.35Å; G212-A215 PolarHBondContact O-N 2.89Å; G212-N216 VanDerWaalsContact O-CB 3.27Å; G212-N216 WeakPolarHBondContact O-CB 3.39Å; G212-N216 PolarHBondContact O-N 3Å
213A66.9Low67.6Low52 Ų52107.8 Ų107.843%0.4354%0.543SS..Hα-helixtrans-62.4-47.4172.800000111.9Q209 E211 A215 N216 D217Q209-A213 VanDerWaalsContact O-CB 3.3Å; Q209-A213 WeakPolarHBondContact O-CB 3.23Å; Q209-A213 PolarHBondContact O-N 3.45Å; E211-A213 VanDerWaalsContact C-N 3.34Å; E211-A213 PolarHBondContact O-N 3.31Å; A213-A215 VanDerWaalsContact C-N 3.31Å; A213-A215 PolarHBondContact O-N 3.42Å; A213-N216 CarbonylContact O-C 3.56Å; A213-N216 PolarHBondContact O-N 3.43Å; A213-N216 VanDerWaalsContact O-N 3.12Å; A213-D217 PolarHBondContact O-N 3.22Å
214R63.4Low65.5Low155 Ų155107.7 Ų107.759%0.58557%0.565SS**Hα-helixtrans-62.9-33.8175.7-72.4167172.6177.6-2.1113.1R210 E211R210-R214 VanDerWaalsContact O-CG 3.26Å; R210-R214 WeakPolarHBondContact O-CG 3.46Å; R210-R214 PolarHBondContact O-N 3.03Å; E211-R214 CarbonylContact O-C 3.02Å; E211-R214 PolarHBondContact O-N 2.84Å
215A59.9Low63.2Low60 Ų60105.8 Ų105.850%0.49657%0.567SS.*Hα-helixtrans-72.3-36.4173.400000111.6E211 G212 A213 K218E211-A215 WeakPolarHBondContact O-CB 3.34Å; E211-A215 PolarHBondContact O-N 3.35Å; G212-A215 PolarHBondContact O-N 2.89Å; A213-A215 VanDerWaalsContact C-N 3.31Å; A213-A215 PolarHBondContact O-N 3.42Å; A215-K218 PolarHBondContact O-N 2.88Å
216N53.2Low61.3Low63 Ų63109.2 Ų109.234%0.33759%0.593SS.*Hα-helixtrans-72.3-31177.1-159.612.3000112.2G212 A213 K218 K219 K220G212-N216 VanDerWaalsContact O-CB 3.27Å; G212-N216 WeakPolarHBondContact O-CB 3.39Å; G212-N216 PolarHBondContact O-N 3Å; A213-N216 CarbonylContact O-C 3.56Å; A213-N216 PolarHBondContact O-N 3.43Å; A213-N216 VanDerWaalsContact O-N 3.12Å; N216-K218 VanDerWaalsContact C-N 3.26Å; N216-K218 PolarHBondContact O-N 2.89Å; N216-K219 CarbonylContact O-C 3.55Å; N216-K219 WeakPolarHBondContact O-CA 3.24Å; N216-K219 PolarHBondContact O-N 3.5Å; N216-K220 WeakPolarHBondContact O-CB 3.44Å; N216-K220 WeakPolarHBondContact O-CG 3.43Å; N216-K220 PolarHBondContact O-N 2.94Å
217D51.5Low59.2Low107 Ų107113.9 Ų113.957%0.57262%0.618SS**Hα-helixtrans-61.2-33.2172-80.5-32.1000112.7A213 K219A213-D217 PolarHBondContact O-N 3.22Å; D217-K219 PolarHBondContact O-N 3.02Å
218K55Low57.4Low188 Ų188113.6 Ų113.682%0.81763%0.628SS**THydrogen-bonded Turntrans-68.7-17.8170.8-66.7179.1-179.5173.80113.4A215 N216A215-K218 PolarHBondContact O-N 2.88Å; N216-K218 VanDerWaalsContact C-N 3.26Å; N216-K218 PolarHBondContact O-N 2.89Å
219K51.4Low55.8Low165 Ų165116.2 Ų116.272%0.71764%0.641SS**THydrogen-bonded Turntrans-104.8-27.3-177.6-128.7175.5-177178.30113.4N216 D217 S221 I222N216-K219 CarbonylContact O-C 3.55Å; N216-K219 WeakPolarHBondContact O-CA 3.24Å; N216-K219 PolarHBondContact O-N 3.5Å; D217-K219 PolarHBondContact O-N 3.02Å; K219-S221 PolarHBondContact O-N 2.78Å; K219-I222 PolarHBondContact O-N 3.48Å
220K47.7Very low54.6Low117 Ų117116.4 Ų116.451%0.50964%0.644SS.*THydrogen-bonded Turntrans-64.8-12.8177.2-85.7-179.4175.8174.80114.4N216 I222N216-K220 WeakPolarHBondContact O-CB 3.44Å; N216-K220 WeakPolarHBondContact O-CG 3.43Å; N216-K220 PolarHBondContact O-N 2.94Å; K220-I222 PolarHBondContact O-N 2.99Å
221S48Very low53.4Low109 Ų109114.6 Ų114.676%0.76264%0.644SS**THydrogen-bonded Turntrans-67.7-8.5170.7-169.50000114.1K219K219-S221 PolarHBondContact O-N 2.78Å
222I51.3Low52.3Low151 Ų151111.9 Ų111.977%0.77464%0.642SS**THydrogen-bonded Turntrans-125.6-24.6-171.6-70.1-179.2000115.1K219 K220K219-I222 PolarHBondContact O-N 3.48Å; K220-I222 PolarHBondContact O-N 2.99Å
223M40.3Very low51.7Low161 Ų161117.5 Ų117.579%0.79366%0.655SS**  trans-148.8119.7176.6-157.9168.1-75.900112.6
224G43.6Very low51.5Low84 Ų84118.3 Ų118.387%0.86665%0.652SS**  trans-86.3131.9-176.100000113.3
225G40.9Very low51.2Low53 Ų53111.5 Ų111.555%0.54663%0.628SS.*  trans-173.6140.9170.400000110.3L227G225-L227 PolarHBondContact O-N 2.76Å
226P47Very low51.3Low138 Ų138112 Ų11290%0.89662%0.622SS**  trans-79.6120.717831.5-31.5000110.2
227L43.4Very low51.9Low157 Ų157111.7 Ų111.782%0.82263%0.625SS**  trans-117.2124.5163.4-91.8159.5000107G225G225-L227 PolarHBondContact O-N 2.76Å
228S48.3Very low52.5Low107 Ų107111 Ų11175%0.74862%0.621SS**PPolyproline II helixtrans-63.3147.8-162.8-54.70000114.5L230S228-L230 PolarHBondContact O-N 2.92Å
229E51.5Low52.6Low195 Ų195104.6 Ų104.691%0.91160%0.596SS**PPolyproline II helixtrans-60.3125146.6-69.8172124.700108.1
230L53.8Low53.1Low92 Ų92102.7 Ų102.748%0.48259%0.587SS.*PPolyproline II helixtrans-87.2132.1168.1-80.2154.8000108.1S228 D234S228-L230 PolarHBondContact O-N 2.92Å; L230-D234 HydrophobicContact CB-CB 4.46Å; L230-D234 HydrophobicContact CD2-CB 3.82Å
231D54.6Low53.6Low95 Ų95103.6 Ų103.651%0.50859%0.591SS.*PPolyproline II helixtrans-75156.5-178.8-169-2.3000109.7K233 D234 V235D231-K233 PolarHBondContact O-N 2.95Å; D231-D234 PolarHBondContact N-OD2 2.93Å; D231-D234 WeakPolarHBondContact O-CB 3.44Å; D231-D234 PolarHBondContact O-N 3.47Å; D231-V235 PolarHBondContact O-N 3.4Å
232A55.9Low53.5Low61 Ų61100.7 Ų100.750%0.50457%0.571SS.*Hα-helixtrans-59.4-17179.600000113.4D236A232-D236 PolarHBondContact O-N 3.32Å
233K57.4Low53.3Low158 Ų158100 Ų10069%0.68757%0.565SS**Hα-helixtrans-76.4-33.5172.5-66.6174-177.6166.30113.1D231 V235 D236 S237D231-K233 PolarHBondContact O-N 2.95Å; K233-V235 VanDerWaalsContact C-N 3.31Å; K233-D236 PolarHBondContact O-N 3.2Å; K233-S237 PolarHBondContact O-N 2.78Å; K233-S237 VanDerWaalsContact O-N 3.17Å
234D62.4Low53.7Low68 Ų6896.8 Ų96.836%0.36456%0.557SS.*Hα-helixtrans-69.4-36177.7-60.9-42.3000110L230 D231 S237 L238L230-D234 HydrophobicContact CB-CB 4.46Å; L230-D234 HydrophobicContact CD2-CB 3.82Å; D231-D234 PolarHBondContact N-OD2 2.93Å; D231-D234 WeakPolarHBondContact O-CB 3.44Å; D231-D234 PolarHBondContact O-N 3.47Å; D234-S237 PolarHBondContact O-N 3.34Å; D234-S237 PolarHBondContact O-OG 2.97Å; D234-L238 WeakPolarHBondContact O-CB 3.08Å; D234-L238 WeakPolarHBondContact O-CG 3.47Å; D234-L238 PolarHBondContact O-N 3.42Å
235V58.6Low53.7Low13 Ų1399.9 Ų99.98%0.07955%0.55CS..Hα-helixtrans-58-48.7171.2169.20000112.3L205 D231 K233 S237 L238 L239L205-V235 HydrophobicContact CD2-CB 4.45Å; L205-V235 HydrophobicContact CD2-CG1 3.7Å; L205-V235 HydrophobicContact CD2-CG2 4.14Å; D231-V235 PolarHBondContact O-N 3.4Å; K233-V235 VanDerWaalsContact C-N 3.31Å; V235-S237 PolarHBondContact O-N 3.12Å; V235-L238 PolarHBondContact O-N 3.38Å; V235-L239 HydrophobicContact CG1-CD1 3.99Å; V235-L239 WeakPolarHBondContact O-CG 3.25Å; V235-L239 PolarHBondContact O-N 3.42Å
236D61.3Low53.8Low70 Ų70104.9 Ų104.937%0.37456%0.558SS.*Hα-helixtrans-61.5-34176.9-164.188.4000111.7A232 K233 K240A232-D236 PolarHBondContact O-N 3.32Å; K233-D236 PolarHBondContact O-N 3.2Å; D236-K240 PolarHBondContact O-N 2.88Å; D236-K240 IonicContact OD2-NZ 3.31Å; D236-K240 PolarHBondContact OD2-NZ 3.48Å
237S66.6Low53.6Low57 Ų57104.6 Ų104.640%0.39955%0.545SS..Hα-helixtrans-74.2-32.5176.186.90000113.7K233 D234 V235 K241K233-S237 PolarHBondContact O-N 2.78Å; K233-S237 VanDerWaalsContact O-N 3.17Å; D234-S237 PolarHBondContact O-N 3.34Å; D234-S237 PolarHBondContact O-OG 2.97Å; V235-S237 PolarHBondContact O-N 3.12Å; S237-K241 PolarHBondContact O-N 3.12Å; S237-K241 VanDerWaalsContact O-N 3.15Å
238L62.3Low53.5Low91 Ų91100.7 Ų100.748%0.47654%0.536SS..Hα-helixtrans-72.8-41.7176.6-83.8162.3000111.2D234 V235 K241 S242D234-L238 WeakPolarHBondContact O-CB 3.08Å; D234-L238 WeakPolarHBondContact O-CG 3.47Å; D234-L238 PolarHBondContact O-N 3.42Å; V235-L238 PolarHBondContact O-N 3.38Å; L238-K241 CarbonylContact O-C 3.48Å; L238-K241 WeakPolarHBondContact O-CA 3.42Å; L238-K241 WeakPolarHBondContact O-CB 3.49Å; L238-K241 PolarHBondContact O-N 3Å; L238-K241 VanDerWaalsContact O-N 3.1Å; L238-S242 PolarHBondContact O-N 3.05Å; L238-S242 PolarHBondContact O-OG 3.46Å
239L58.9Low53.4Low55 Ų5599.6 Ų99.629%0.28853%0.526SS..Hα-helixtrans-62.8-42.9175.1-72166.6000111.9V235 K241 S242 E243V235-L239 HydrophobicContact CG1-CD1 3.99Å; V235-L239 WeakPolarHBondContact O-CG 3.25Å; V235-L239 PolarHBondContact O-N 3.42Å; L239-K241 VanDerWaalsContact C-N 3.25Å; L239-K241 PolarHBondContact O-N 3.37Å; L239-S242 PolarHBondContact O-N 2.67Å; L239-S242 PolarHBondContact O-OG 2.97Å; L239-E243 PolarHBondContact O-N 3.1Å
240K60.6Low53.3Low125 Ų125100.2 Ų100.254%0.54353%0.529SS..Hα-helixtrans-63.7-29.4172-79.7170.6178.81420113.5D236 S244D236-K240 PolarHBondContact O-N 2.88Å; D236-K240 IonicContact OD2-NZ 3.31Å; D236-K240 PolarHBondContact OD2-NZ 3.48Å; K240-S244 PolarHBondContact O-N 3.33Å; K240-S244 PolarHBondContact O-OG 2.78Å
241K58Low53.1Low135 Ų135101.9 Ų101.959%0.58754%0.538SS*.Hα-helixtrans-75.1-40.5173.8-92.8178.8172.1177.30112.3S237 L238 L239 S244 Q245S237-K241 PolarHBondContact O-N 3.12Å; S237-K241 VanDerWaalsContact O-N 3.15Å; L238-K241 CarbonylContact O-C 3.48Å; L238-K241 WeakPolarHBondContact O-CA 3.42Å; L238-K241 WeakPolarHBondContact O-CB 3.49Å; L238-K241 PolarHBondContact O-N 3Å; L238-K241 VanDerWaalsContact O-N 3.1Å; L239-K241 VanDerWaalsContact C-N 3.25Å; L239-K241 PolarHBondContact O-N 3.37Å; K241-S244 WeakPolarHBondContact CA-OG 3.37Å; K241-S244 CarbonylContact O-C 3.59Å; K241-S244 PolarHBondContact O-N 2.88Å; K241-S244 PolarHBondContact O-OG 2.92Å; K241-Q245 PolarHBondContact O-N 2.73Å; K241-Q245 VanDerWaalsContact O-N 3.14Å
242S46.7Very low53.2Low48 Ų48101.1 Ų101.134%0.33655%0.552SS.*Hα-helixtrans-68-38.9176.8620000111.8L238 L239 S244 Q245 H246L238-S242 PolarHBondContact O-N 3.05Å; L238-S242 PolarHBondContact O-OG 3.46Å; L239-S242 PolarHBondContact O-N 2.67Å; L239-S242 PolarHBondContact O-OG 2.97Å; S242-S244 PolarHBondContact O-N 3.45Å; S242-Q245 CarbonylContact O-C 3.58Å; S242-Q245 PolarHBondContact O-N 2.98Å; S242-H246 WeakPolarHBondContact O-CB 3.46Å; S242-H246 PolarHBondContact O-N 3.3Å
243E47.7Very low53.6Low138 Ų138100.3 Ų100.365%0.64554%0.543SS*.Hα-helixtrans-54.9-36.2169.8-77.4-179.6153.400112.2L239L239-E243 PolarHBondContact O-N 3.1Å
244S47.4Very low54.3Low92 Ų9295.2 Ų95.264%0.64353%0.526SS*.THydrogen-bonded Turntrans-84.6-2.2175.664.10000115.6K240 K241 S242K240-S244 PolarHBondContact O-N 3.33Å; K240-S244 PolarHBondContact O-OG 2.78Å; K241-S244 WeakPolarHBondContact CA-OG 3.37Å; K241-S244 CarbonylContact O-C 3.59Å; K241-S244 PolarHBondContact O-N 2.88Å; K241-S244 PolarHBondContact O-OG 2.92Å; S242-S244 PolarHBondContact O-N 3.45Å
245Q44.4Very low55Low150 Ų15094 Ų9470%0.70152%0.518SS*.THydrogen-bonded Turntrans-120.6-1.6176.9-67.9-163.3-65.700114.2K241 S242 E247K241-Q245 PolarHBondContact O-N 2.73Å; K241-Q245 VanDerWaalsContact O-N 3.14Å; S242-Q245 CarbonylContact O-C 3.58Å; S242-Q245 PolarHBondContact O-N 2.98Å; Q245-E247 PolarHBondContact O-N 3.49Å
246H42.2Very low55.9Low158 Ų15893.9 Ų93.973%0.73152%0.519SS*.THydrogen-bonded Turntrans-74.335.7-177.4-125-66.7000114.9S242S242-H246 WeakPolarHBondContact O-CB 3.46Å; S242-H246 PolarHBondContact O-N 3.3Å
247E42.5Very low56.7Low131 Ų13195 Ų9561%0.61253%0.529SS*.THydrogen-bonded Turntrans-112.89.2-176.7-96.2-78.5150.200112.8Q245 R309Q245-E247 PolarHBondContact O-N 3.49Å; E247-R309 PolarHBondContact O-NH2 2.94Å; E247-R309 IonicContact OE2-CZ 2.74Å; E247-R309 IonicContact OE2-NH1 2.66Å; E247-R309 PolarHBondContact OE2-NH1 2.81Å; E247-R309 IonicContact OE2-NH2 3.68Å; E247-R309 PolarHBondContact OE2-NH2 3.36Å
248A41.9Very low57.4Low76 Ų7694.2 Ų94.263%0.62852%0.521SS*.SBendtrans-130.7116.8174.300000109.8
249P47.6Very low58.4Low83 Ų8390.2 Ų90.254%0.53950%0.5SS..  trans-74.9126.3171.3-9.225.4000110.2D251P249-D251 PolarHBondContact O-N 3.48Å
250E48.6Very low59.5Low209 Ų20990.5 Ų90.598%0.97750%0.5SS*.SBendtrans-82.332.9161.4-73.4-143.9134.200111.9
251D50.3Low60.6Low126 Ų12693.9 Ų93.967%0.67451%0.51SS*.SBendtrans-124.8140.7171.9-151.5-16.4000108.9P249 C253P249-D251 PolarHBondContact O-N 3.48Å; D251-C253 PolarHBondContact O-N 3.38Å
252G56.3Low61.8Low79 Ų7990.8 Ų90.881%0.81450%0.499SS*.SBendtrans-68.19.2-158.300000116.8
253C64.4Low63.4Low45 Ų4591.6 Ų91.630%0.30450%0.499SS..  trans-92.4123-176.1-1670000111.4D251 F255 Q260D251-C253 PolarHBondContact O-N 3.38Å; C253-F255 PolarHBondContact O-N 2.86Å; C253-Q260 HydrophobicContact CB-CG 4.39Å
254P71.2Confident64.9Low51 Ų5190 Ų9033%0.33149%0.491SS..SBendtrans-75.1-9.8-176.732.8-38.4000114T308P254-T308 HydrophobicContact CB-CG2 4.03Å; P254-T308 WeakPolarHBondContact O-CB 3.29Å; P254-T308 WeakPolarHBondContact O-CG2 3.28Å; P254-T308 PolarHBondContact O-OG1 3.14Å
255F77.1Confident66.3Low43 Ų4387.7 Ų87.719%0.18948%0.479CS..SBendtrans-87.4150.1-179.5-56-63.6000111C253 T259 Q260 L263 V305 T308 L311C253-F255 PolarHBondContact O-N 2.86Å; F255-T259 HydrophobicContact CB-CG2 3.84Å; F255-T259 HydrophobicContact CD1-CG2 3.89Å; F255-T259 HydrophobicContact CG-CG2 3.9Å; F255-Q260 HydrophobicContact CB-CG 4.18Å; F255-Q260 WeakPolarHBondContact O-CG 3.4Å; F255-Q260 PolarHBondContact O-NE2 3.36Å; F255-L263 HydrophobicContact CD2-CD1 3.53Å; F255-L263 HydrophobicContact CE2-CD1 3.74Å; F255-L263 HydrophobicContact CG-CD1 4.19Å; F255-V305 HydrophobicContact CE1-CB 4.3Å; F255-V305 HydrophobicContact CE1-CG2 4.21Å; F255-V305 HydrophobicContact CZ-CG2 4Å; F255-T308 HydrophobicContact CD1-CG2 3.82Å; F255-T308 HydrophobicContact CE1-CG2 4.07Å; F255-L311 HydrophobicContact CD1-CD2 4.17Å; F255-L311 HydrophobicContact CE1-CD2 3.93Å
256G77.6Confident68Low10 Ų1083.7 Ų83.710%0.10346%0.461CS..  trans-81.8172.7173.300000113.8L258 T259 Q260 E312G256-L258 VanDerWaalsContact C-N 3.31Å; G256-L258 PolarHBondContact O-N 3.4Å; G256-L258 VanDerWaalsContact O-N 3.17Å; G256-T259 PolarHBondContact O-N 2.72Å; G256-Q260 WeakPolarHBondContact O-CG 3.5Å; G256-Q260 PolarHBondContact O-N 2.91Å; G256-E312 VanDerWaalsContact CA-OE1 3.23Å; G256-E312 WeakPolarHBondContact CA-OE1 3.34Å; G256-E312 WeakPolarHBondContact CA-OE2 3.21Å
257P78.3Confident69.5Low92 Ų9278.4 Ų78.460%0.59744%0.44SS*.Hα-helixtrans-57.3-35-164.7-26.335.2000115.3R261 E312P257-R261 WeakPolarHBondContact O-CB 3.5Å; P257-R261 PolarHBondContact O-N 2.88Å; P257-E312 WeakPolarHBondContact CD-OE1 3.03Å; P257-E312 VanDerWaalsContact N-OE1 3.12Å
258L80.6Confident70.9Confident41 Ų4178.3 Ų78.322%0.21544%0.44CS..Hα-helixtrans-67.1-46.2178.4172.962000110.3G256 R261 L262 E312 I315 K316 L319G256-L258 VanDerWaalsContact C-N 3.31Å; G256-L258 PolarHBondContact O-N 3.4Å; G256-L258 VanDerWaalsContact O-N 3.17Å; L258-R261 PolarHBondContact O-N 3.08Å; L258-L262 HydrophobicContact CD1-CD1 4.18Å; L258-L262 HydrophobicContact CG-CD1 4.19Å; L258-L262 WeakPolarHBondContact O-CG 3.48Å; L258-L262 PolarHBondContact O-N 2.72Å; L258-L262 VanDerWaalsContact O-N 3.12Å; L258-E312 HydrophobicContact CB-CG 4.29Å; L258-E312 PolarHBondContact N-OE1 2.66Å; L258-E312 VanDerWaalsContact N-OE1 3.08Å; L258-I315 HydrophobicContact CD2-CG2 4.2Å; L258-I315 HydrophobicContact CG-CG2 4.45Å; L258-K316 HydrophobicContact CD2-CB 3.76Å; L258-K316 HydrophobicContact CD2-CG 4.23Å; L258-L319 HydrophobicContact CD1-CD1 4.41Å
259T84Confident72.1Confident8 Ų881.6 Ų81.65%0.04944%0.442CS..Hα-helixtrans-70.1-37.3-178.5-54.70000110.9F255 G256 L262 L263 I315F255-T259 HydrophobicContact CB-CG2 3.84Å; F255-T259 HydrophobicContact CD1-CG2 3.89Å; F255-T259 HydrophobicContact CG-CG2 3.9Å; G256-T259 PolarHBondContact O-N 2.72Å; T259-L262 PolarHBondContact O-N 2.88Å; T259-L263 HydrophobicContact CG2-CD1 4.18Å; T259-L263 WeakPolarHBondContact O-CG 3.26Å; T259-L263 PolarHBondContact O-N 3.32Å; T259-I315 HydrophobicContact CG2-CD1 3.99Å
260Q83.3Confident73Confident61 Ų6183.9 Ų83.929%0.28545%0.45SS..Hα-helixtrans-59.7-48.3172.4-69.7-176.512.100112C253 F255 G256 L262 L263 Q264C253-Q260 HydrophobicContact CB-CG 4.39Å; F255-Q260 HydrophobicContact CB-CG 4.18Å; F255-Q260 WeakPolarHBondContact O-CG 3.4Å; F255-Q260 PolarHBondContact O-NE2 3.36Å; G256-Q260 WeakPolarHBondContact O-CG 3.5Å; G256-Q260 PolarHBondContact O-N 2.91Å; Q260-L262 VanDerWaalsContact C-N 3.33Å; Q260-L262 PolarHBondContact O-N 3.47Å; Q260-L263 PolarHBondContact O-N 3Å; Q260-Q264 WeakPolarHBondContact O-CB 3.34Å; Q260-Q264 PolarHBondContact O-N 3.38Å
261R81.8Confident73.8Confident196 Ų19679.5 Ų79.574%0.7443%0.432SS*.Hα-helixtrans-61.9-39.4179.3-176.2177.2-69.7150.7-0.3112.4P257 L258 Q264 A265P257-R261 WeakPolarHBondContact O-CB 3.5Å; P257-R261 PolarHBondContact O-N 2.88Å; L258-R261 PolarHBondContact O-N 3.08Å; R261-Q264 PolarHBondContact O-N 3.06Å; R261-A265 PolarHBondContact O-N 3.15Å
262L83.1Confident74.4Confident69 Ų6977 Ų7736%0.36142%0.418SS..Hα-helixtrans-65.6-43.7175.6-69.4166.1000111.9L258 T259 Q260 A265 L266 I315 L319L258-L262 HydrophobicContact CD1-CD1 4.18Å; L258-L262 HydrophobicContact CG-CD1 4.19Å; L258-L262 WeakPolarHBondContact O-CG 3.48Å; L258-L262 PolarHBondContact O-N 2.72Å; L258-L262 VanDerWaalsContact O-N 3.12Å; T259-L262 PolarHBondContact O-N 2.88Å; Q260-L262 VanDerWaalsContact C-N 3.33Å; Q260-L262 PolarHBondContact O-N 3.47Å; L262-A265 PolarHBondContact O-N 3.26Å; L262-L266 VanDerWaalsContact O-CG 3.32Å; L262-L266 WeakPolarHBondContact O-CG 3.46Å; L262-L266 PolarHBondContact O-N 3.13Å; L262-L266 VanDerWaalsContact O-N 3.12Å; L262-I315 HydrophobicContact CD1-CG2 3.51Å; L262-L319 HydrophobicContact CD1-CD1 4.08Å
263L80.4Confident74.2Confident66 Ų6677.6 Ų77.635%0.34641%0.41SS..Hα-helixtrans-63.3-41.9175.5-72.9168000111.8F255 T259 Q260 L266 V267F255-L263 HydrophobicContact CD2-CD1 3.53Å; F255-L263 HydrophobicContact CE2-CD1 3.74Å; F255-L263 HydrophobicContact CG-CD1 4.19Å; T259-L263 HydrophobicContact CG2-CD1 4.18Å; T259-L263 WeakPolarHBondContact O-CG 3.26Å; T259-L263 PolarHBondContact O-N 3.32Å; Q260-L263 PolarHBondContact O-N 3Å; L263-L266 PolarHBondContact O-N 2.92Å; L263-V267 WeakPolarHBondContact O-CG2 3.42Å; L263-V267 PolarHBondContact O-N 3.46Å; L263-V267 VanDerWaalsContact O-N 3.08Å
264Q79.3Confident73.6Confident103 Ų10379.4 Ų79.448%0.48142%0.42SS..Hα-helixtrans-59.6-47.7176.4-178.362.422.300111.6Q260 R261 L266 V267 E268Q260-Q264 WeakPolarHBondContact O-CB 3.34Å; Q260-Q264 PolarHBondContact O-N 3.38Å; R261-Q264 PolarHBondContact O-N 3.06Å; Q264-L266 VanDerWaalsContact C-N 3.31Å; Q264-L266 PolarHBondContact O-N 2.78Å; Q264-V267 PolarHBondContact O-N 2.92Å; Q264-V267 VanDerWaalsContact O-N 3.11Å; Q264-E268 WeakPolarHBondContact CG-OE1 3.47Å; Q264-E268 PolarHBondContact NE2-OE1 2.85Å; Q264-E268 WeakPolarHBondContact O-CG 3.39Å; Q264-E268 PolarHBondContact O-N 2.81Å
265A78.1Confident72.7Confident45 Ų4585.9 Ų85.937%0.37245%0.449SS..Hα-helixtrans-60.6-38.5176.800000112.6R261 L262 V267 E268 E269R261-A265 PolarHBondContact O-N 3.15Å; L262-A265 PolarHBondContact O-N 3.26Å; A265-V267 VanDerWaalsContact C-N 3.3Å; A265-V267 PolarHBondContact O-N 3.13Å; A265-E268 PolarHBondContact O-N 2.83Å; A265-E269 WeakPolarHBondContact O-CB 3.18Å; A265-E269 WeakPolarHBondContact O-CG 3.43Å; A265-E269 PolarHBondContact O-N 3.31Å
266L78.9Confident71.1Confident65 Ų6591.7 Ų91.734%0.3448%0.476SS..Hα-helixtrans-68.1-27.2176.2-68.6169.9000113.4L262 L263 Q264 I271 I272L262-L266 VanDerWaalsContact O-CG 3.32Å; L262-L266 WeakPolarHBondContact O-CG 3.46Å; L262-L266 PolarHBondContact O-N 3.13Å; L262-L266 VanDerWaalsContact O-N 3.12Å; L263-L266 PolarHBondContact O-N 2.92Å; Q264-L266 VanDerWaalsContact C-N 3.31Å; Q264-L266 PolarHBondContact O-N 2.78Å; L266-I271 HydrophobicContact CD2-CB 4.2Å; L266-I271 HydrophobicContact CD2-CD1 3.87Å; L266-I271 HydrophobicContact CD2-CG2 4.08Å; L266-I271 WeakPolarHBondContact O-CB 3.47Å; L266-I271 PolarHBondContact O-N 3.16Å; L266-I272 HydrophobicContact CB-CD1 4Å; L266-I272 HydrophobicContact CB-CG1 4.28Å; L266-I272 HydrophobicContact CD1-CD1 4.06Å; L266-I272 PolarHBondContact O-N 3.06Å; L266-I272 VanDerWaalsContact O-N 3.15Å
267V75.3Confident69.6Low48 Ų4899.2 Ų99.229%0.29151%0.514SS..Hα-helixtrans-78.4-43.1173.1172.10000110.9L263 Q264 A265 E269 N270 P274L263-V267 WeakPolarHBondContact O-CG2 3.42Å; L263-V267 PolarHBondContact O-N 3.46Å; L263-V267 VanDerWaalsContact O-N 3.08Å; Q264-V267 PolarHBondContact O-N 2.92Å; Q264-V267 VanDerWaalsContact O-N 3.11Å; A265-V267 VanDerWaalsContact C-N 3.3Å; A265-V267 PolarHBondContact O-N 3.13Å; V267-E269 VanDerWaalsContact C-N 3.33Å; V267-E269 PolarHBondContact O-N 3.41Å; V267-N270 PolarHBondContact O-N 3.23Å; V267-P274 HydrophobicContact CG1-CG 3.94Å
268E70.6Confident67.4Low128 Ų12898.6 Ų98.660%0.59851%0.512SS*.Hα-helixtrans-60.7-39.8176.9-73.6173.7-174.100112.2Q264 A265 N270Q264-E268 WeakPolarHBondContact CG-OE1 3.47Å; Q264-E268 PolarHBondContact NE2-OE1 2.85Å; Q264-E268 WeakPolarHBondContact O-CG 3.39Å; Q264-E268 PolarHBondContact O-N 2.81Å; A265-E268 PolarHBondContact O-N 2.83Å; E268-N270 PolarHBondContact O-N 3.01Å
269E67.4Low65.5Low146 Ų146102.3 Ų102.368%0.68254%0.539SS*.THydrogen-bonded Turntrans-78.78175.1-66.7-66.9149.700113.9A265 V267 I271A265-E269 WeakPolarHBondContact O-CB 3.18Å; A265-E269 WeakPolarHBondContact O-CG 3.43Å; A265-E269 PolarHBondContact O-N 3.31Å; V267-E269 VanDerWaalsContact C-N 3.33Å; V267-E269 PolarHBondContact O-N 3.41Å; E269-I271 HydrophobicContact CB-CD1 3.83Å; E269-I271 HydrophobicContact CB-CG1 4.01Å; E269-I271 PolarHBondContact O-N 2.89Å; E269-I271 VanDerWaalsContact O-N 3.08Å
270N65.6Low63.4Low130 Ų130109.6 Ų109.670%0.69558%0.576SS**THydrogen-bonded Turntrans55.518.2-176.2-82-75.5000115.5V267 E268 I272V267-N270 PolarHBondContact O-N 3.23Å; E268-N270 PolarHBondContact O-N 3.01Å; N270-I272 VanDerWaalsContact C-N 3.3Å
271I67.1Low61.1Low118 Ų118111.9 Ų111.961%0.60560%0.596SS**SBendtrans-72.5-29179.2-62.9167.6000110.7L266 E269L266-I271 HydrophobicContact CD2-CB 4.2Å; L266-I271 HydrophobicContact CD2-CD1 3.87Å; L266-I271 HydrophobicContact CD2-CG2 4.08Å; L266-I271 WeakPolarHBondContact O-CB 3.47Å; L266-I271 PolarHBondContact O-N 3.16Å; E269-I271 HydrophobicContact CB-CD1 3.83Å; E269-I271 HydrophobicContact CB-CG1 4.01Å; E269-I271 PolarHBondContact O-N 2.89Å; E269-I271 VanDerWaalsContact O-N 3.08Å
272I61.7Low58.9Low74 Ų74110.6 Ų110.638%0.37960%0.603SS.*SBendtrans-126.7118.6171.6-53.9174.9000107.8L266 N270L266-I272 HydrophobicContact CB-CD1 4Å; L266-I272 HydrophobicContact CB-CG1 4.28Å; L266-I272 HydrophobicContact CD1-CD1 4.06Å; L266-I272 PolarHBondContact O-N 3.06Å; L266-I272 VanDerWaalsContact O-N 3.15Å; N270-I272 VanDerWaalsContact C-N 3.3Å
273S52.9Low56.6Low91 Ų91115.5 Ų115.564%0.63663%0.627SS**  trans-61.2135.5172.5-54.10000110M275S273-M275 PolarHBondContact O-N 3.13Å
274P52.1Low54.6Low82 Ų82118.4 Ų118.453%0.53265%0.653SS.*  trans-52.5133.3168.8-20.829.9000109.3V267 E276V267-P274 HydrophobicContact CG1-CG 3.94Å; P274-E276 PolarHBondContact O-N 2.94Å
275M51.8Low52.4Low187 Ų187117.1 Ų117.192%0.92167%0.667SS**  trans-67100.6172.3-70.4168.3175.400107.5S273 D277S273-M275 PolarHBondContact O-N 3.13Å; M275-D277 PolarHBondContact O-N 2.95Å; M275-D277 VanDerWaalsContact O-N 3.17Å
276E43Very low50.4Low165 Ų165123.7 Ų123.777%0.77169%0.687SS**  trans-59.6119.5-179.8-70-169.314400110P274 S278P274-E276 PolarHBondContact O-N 2.94Å; E276-S278 PolarHBondContact O-N 3.08Å
277D45.4Very low48.2Very low168 Ų168127.2 Ų127.290%0.89871%0.706SS**  trans-73.771.1169.4-158.518.1000108.4M275 P279M275-D277 PolarHBondContact O-N 2.95Å; M275-D277 VanDerWaalsContact O-N 3.17Å; D277-P279 WeakPolarHBondContact O-CD 3.3Å
278S33.1Very low46.3Very low80 Ų80129.5 Ų129.556%0.55973%0.73SS**PPolyproline II helixtrans-71.2117.2-173.9-1010000110.6E276 I280E276-S278 PolarHBondContact O-N 3.08Å; S278-I280 PolarHBondContact O-N 2.86Å
279P39.9Very low44.5Very low118 Ų118130 Ų13077%0.76674%0.737SS**PPolyproline II helixtrans-67.3120.2171.628.1-32.8000109.5D277 P281D277-P279 WeakPolarHBondContact O-CD 3.3Å; P279-P281 VanDerWaalsContact O-CD 3.31Å; P279-P281 WeakPolarHBondContact O-CD 3.48Å
280I39.8Very low43Very low162 Ų162130 Ų13083%0.83174%0.742SS**PPolyproline II helixtrans-58.4121.6-178.9-58.2170000109.8S278S278-I280 PolarHBondContact O-N 2.86Å
281P35.3Very low41.3Very low109 Ų109127.3 Ų127.371%0.70874%0.744SS**PPolyproline II helixtrans-75.9127.6168.9-9.426.2000109.9P279 M283P279-P281 VanDerWaalsContact O-CD 3.31Å; P279-P281 WeakPolarHBondContact O-CD 3.48Å; P281-M283 PolarHBondContact O-N 3.48Å
282D36.9Very low40.1Very low168 Ų168127.4 Ų127.490%0.89876%0.763SS**  trans-60.8115.9171.3-112.7-36.9000110.4
283M34.8Very low38.7Very low173 Ų173127 Ų12785%0.85278%0.777SS**  trans-136.6114.5170.4-89.4-65.8-159.900110.8P281P281-M283 PolarHBondContact O-N 3.48Å
284S37Very low38.1Very low127 Ų127130 Ų13089%0.88879%0.791SS**  trans-75.812817550.50000111
285G34Very low37.1Very low75 Ų75130.9 Ų130.977%0.77380%0.8SS**  trans-174.262-171.400000117.5
286K35Very low36.6Very low184 Ų184127.5 Ų127.580%0.879%0.792SS**  trans5.4118.9151.1-165.7175.3-177.2177.20120.5
287D33.6Very low36.5Very low138 Ų138131.7 Ų131.774%0.73880%0.8SS**  trans57.6138.6144.7-54-32.5000124
288A35.6Very low36.1Very low96 Ų96128.5 Ų128.579%0.79379%0.791SS**  trans92.687.9145.200000122.1
289N31.8Very low36.5Very low138 Ų138133.6 Ų133.674%0.73881%0.807SS**  96.6137114.3-156.753.9000122.4
290D35.6Very low36.7Very low148 Ų148132.3 Ų132.379%0.79181%0.814SS**  trans52.4112.2164-75-34000122.1
291G30.6Very low36.8Very low73 Ų73133.9 Ų133.975%0.75382%0.815SS**  trans-176.5113.1163.400000110.6G293G291-G293 PolarHBondContact O-N 2.94Å
292A41.9Very low37.2Very low120 Ų120133 Ų13399%0.99282%0.817SS**  trans-67.3118.6-172.200000112.6
293G33.3Very low37.8Very low66 Ų66133.8 Ų133.868%0.6881%0.813SS**  trans-145.9115.9174.800000111.7G291 S295G291-G293 PolarHBondContact O-N 2.94Å; G293-S295 VanDerWaalsContact C-N 3.29Å; G293-S295 PolarHBondContact O-N 3.33Å
294T39.9Very low38.8Very low152 Ų152130.3 Ų130.393%0.93381%0.805SS**  trans-76.379174.151.70000110.3
295S31.4Very low40.1Very low102 Ų102126.4 Ų126.471%0.71378%0.776SS**  trans-105.5118.7174.1-174.80000110.7G293 R297G293-S295 VanDerWaalsContact C-N 3.29Å; G293-S295 PolarHBondContact O-N 3.33Å; S295-R297 PolarHBondContact O-N 2.7Å; S295-R297 VanDerWaalsContact O-N 3.15Å
296P41.3Very low41.4Very low116 Ų116127.3 Ų127.375%0.75377%0.769SS**  trans-77.1102.2178.529.3-30.7000110.8S298P296-S298 PolarHBondContact O-N 2.73Å
297R40.8Very low43Very low252 Ų252125.2 Ų125.295%0.95176%0.761SS**  trans-71.692.4173.2-176-178.2-174.5166.92.7110.8S295S295-R297 PolarHBondContact O-N 2.7Å; S295-R297 VanDerWaalsContact O-N 3.15Å
298S37Very low45Very low101 Ų101119.9 Ų119.971%0.70673%0.734SS**  trans-143.6102.6168.160.80000113.8P296P296-S298 PolarHBondContact O-N 2.73Å
299Q40.9Very low46.6Very low188 Ų188122.7 Ų122.788%0.87972%0.724SS**  trans-16.3129.1160.8-63.9160.8-2900117.6K301Q299-K301 PolarHBondContact O-N 2.9Å
300G44.4Very low48.8Very low90 Ų90119 Ų11993%0.92871%0.708SS**SBendtrans63.734.613400000118.4
301K41.1Very low51Low195 Ų195114.6 Ų114.685%0.84869%0.685SS**  trans-124.3137.7168.3-71.3-173.9176.9-177.70110.5Q299Q299-K301 PolarHBondContact O-N 2.9Å
302A44.6Very low53.5Low90 Ų90113.1 Ų113.174%0.74466%0.658SS**  trans-54.4146.3171.300000110.6S304A302-S304 VanDerWaalsContact C-N 3.3Å; A302-S304 PolarHBondContact O-N 2.79Å
303F50.2Low55.5Low185 Ų185110.2 Ų110.281%0.81163%0.634SS**  trans-69.483.2-174.6-160.9-91.1000110.8V305F303-V305 HydrophobicContact CD1-CG2 4.08Å; F303-V305 HydrophobicContact CE1-CG2 3.99Å; F303-V305 PolarHBondContact O-N 3.32Å
304S55.1Low58Low100 Ų100114.1 Ų114.170%0.69963%0.628SS**  trans-88.3103.3-176.8-174.20000110.4A302 P306A302-S304 VanDerWaalsContact C-N 3.3Å; A302-S304 PolarHBondContact O-N 2.79Å; S304-P306 WeakPolarHBondContact O-CD 3.49Å
305V63.9Low60.1Low45 Ų45108.9 Ų108.927%0.27359%0.594SS.*  trans-76.6118.3168.4-179.60000108.2F255 F303 T308F255-V305 HydrophobicContact CE1-CB 4.3Å; F255-V305 HydrophobicContact CE1-CG2 4.21Å; F255-V305 HydrophobicContact CZ-CG2 4Å; F303-V305 HydrophobicContact CD1-CG2 4.08Å; F303-V305 HydrophobicContact CE1-CG2 3.99Å; F303-V305 PolarHBondContact O-N 3.32Å; V305-T308 HydrophobicContact CB-CG2 3.99Å; V305-T308 HydrophobicContact CG1-CG2 4.42Å; V305-T308 WeakPolarHBondContact O-CG2 3.34Å
306P61.1Low62.6Low95 Ų95107.4 Ų107.462%0.61758%0.575SS**THydrogen-bonded Turntrans-69.7143.8178.229-34.4000110.8S304S304-P306 WeakPolarHBondContact O-CD 3.49Å
307H68.9Low64.8Low140 Ų140108.5 Ų108.565%0.64857%0.57SS**THydrogen-bonded Turntrans68.933.7-179.3-42.487.6000116.1R309 S310 L311H307-R309 VanDerWaalsContact C-N 3.31Å; H307-R309 PolarHBondContact O-N 3.13Å; H307-S310 CarbonylContact O-C 3.54Å; H307-S310 WeakPolarHBondContact O-CA 3.29Å; H307-S310 PolarHBondContact O-N 3.15Å; H307-L311 PolarHBondContact O-N 2.9Å
308T74.6Confident66.9Low26 Ų26101.7 Ų101.716%0.1655%0.549CS..Hα-helixtrans-55.8-38.9177.154.70000114.2P254 F255 V305 S310 L311 E312P254-T308 HydrophobicContact CB-CG2 4.03Å; P254-T308 WeakPolarHBondContact O-CB 3.29Å; P254-T308 WeakPolarHBondContact O-CG2 3.28Å; P254-T308 PolarHBondContact O-OG1 3.14Å; F255-T308 HydrophobicContact CD1-CG2 3.82Å; F255-T308 HydrophobicContact CE1-CG2 4.07Å; V305-T308 HydrophobicContact CB-CG2 3.99Å; V305-T308 HydrophobicContact CG1-CG2 4.42Å; V305-T308 WeakPolarHBondContact O-CG2 3.34Å; T308-S310 VanDerWaalsContact C-N 3.31Å; T308-S310 PolarHBondContact O-N 2.92Å; T308-L311 WeakPolarHBondContact O-CB 3.22Å; T308-L311 PolarHBondContact O-N 2.99Å; T308-L311 VanDerWaalsContact O-N 3.12Å; T308-E312 PolarHBondContact O-N 2.84Å
309R69.5Low69.4Low155 Ų15598.6 Ų98.659%0.58552%0.524SS*.Hα-helixtrans-58.2-39.9171.8-70.2174.5173.4-104.2-5.2112.8E247 H307 A313E247-R309 PolarHBondContact O-NH2 2.94Å; E247-R309 IonicContact OE2-CZ 2.74Å; E247-R309 IonicContact OE2-NH1 2.66Å; E247-R309 PolarHBondContact OE2-NH1 2.81Å; E247-R309 IonicContact OE2-NH2 3.68Å; E247-R309 PolarHBondContact OE2-NH2 3.36Å; H307-R309 VanDerWaalsContact C-N 3.31Å; H307-R309 PolarHBondContact O-N 3.13Å; R309-A313 WeakPolarHBondContact O-CB 3.27Å; R309-A313 PolarHBondContact O-N 3.37Å
310S79.4Confident71.5Confident59 Ų5991.7 Ų91.741%0.41349%0.493SS..Hα-helixtrans-78.1-20177.1-46.30000113H307 T308 R314H307-S310 CarbonylContact O-C 3.54Å; H307-S310 WeakPolarHBondContact O-CA 3.29Å; H307-S310 PolarHBondContact O-N 3.15Å; T308-S310 VanDerWaalsContact C-N 3.31Å; T308-S310 PolarHBondContact O-N 2.92Å; S310-R314 WeakPolarHBondContact O-CG 3.21Å; S310-R314 PolarHBondContact O-NE 3.41Å; S310-R314 PolarHBondContact O-NH2 2.87Å
311L81.8Confident73.4Confident56 Ų5691.1 Ų91.129%0.29348%0.48SS..Hα-helixtrans-72.6-49.5168.3175.663.6000109.9F255 H307 T308 A313 R314 I315F255-L311 HydrophobicContact CD1-CD2 4.17Å; F255-L311 HydrophobicContact CE1-CD2 3.93Å; H307-L311 PolarHBondContact O-N 2.9Å; T308-L311 WeakPolarHBondContact O-CB 3.22Å; T308-L311 PolarHBondContact O-N 2.99Å; T308-L311 VanDerWaalsContact O-N 3.12Å; L311-A313 PolarHBondContact O-N 2.56Å; L311-R314 PolarHBondContact O-N 3.07Å; L311-I315 HydrophobicContact CD1-CD1 3.96Å; L311-I315 HydrophobicContact CD1-CG1 4.29Å; L311-I315 HydrophobicContact CG-CD1 3.82Å; L311-I315 WeakPolarHBondContact O-CG1 3.31Å; L311-I315 PolarHBondContact O-N 2.83Å
312E82.8Confident75.6Confident43 Ų4388 Ų8820%0.20147%0.468CS..Hα-helixtrans-59.5-43.6178.6-178.6167.2-133.500112.6G256 P257 L258 T308 R314 I315 K316G256-E312 VanDerWaalsContact CA-OE1 3.23Å; G256-E312 WeakPolarHBondContact CA-OE1 3.34Å; G256-E312 WeakPolarHBondContact CA-OE2 3.21Å; P257-E312 WeakPolarHBondContact CD-OE1 3.03Å; P257-E312 VanDerWaalsContact N-OE1 3.12Å; L258-E312 HydrophobicContact CB-CG 4.29Å; L258-E312 PolarHBondContact N-OE1 2.66Å; L258-E312 VanDerWaalsContact N-OE1 3.08Å; T308-E312 PolarHBondContact O-N 2.84Å; E312-R314 PolarHBondContact O-N 3.46Å; E312-I315 PolarHBondContact O-N 3.39Å; E312-K316 PolarHBondContact O-N 3.49Å
313A82.6Confident77.2Confident58 Ų5886.8 Ų86.848%0.47947%0.465SS..Hα-helixtrans-58.2-44.4174.600000112.5R309 L311 K316 E317R309-A313 WeakPolarHBondContact O-CB 3.27Å; R309-A313 PolarHBondContact O-N 3.37Å; L311-A313 PolarHBondContact O-N 2.56Å; A313-K316 PolarHBondContact O-N 2.76Å; A313-E317 WeakPolarHBondContact O-CB 3.28Å; A313-E317 PolarHBondContact O-N 3.24Å
314R85.9Confident78.7Confident148 Ų14883.9 Ų83.956%0.55846%0.457SS*.Hα-helixtrans-69.3-35.3177.6-78.5178.5-69.9165.50.4112.9S310 L311 E312 E317 E318S310-R314 WeakPolarHBondContact O-CG 3.21Å; S310-R314 PolarHBondContact O-NE 3.41Å; S310-R314 PolarHBondContact O-NH2 2.87Å; L311-R314 PolarHBondContact O-N 3.07Å; E312-R314 PolarHBondContact O-N 3.46Å; R314-E317 PolarHBondContact O-N 3.12Å; R314-E318 WeakPolarHBondContact O-CB 3.38Å; R314-E318 PolarHBondContact O-N 2.96Å
315I85.6Confident79.8Confident42 Ų4282.3 Ų82.322%0.21544%0.44CS..Hα-helixtrans-64.2-43.7173.2-70.6168.8000109.9L258 T259 L262 L311 E312 L319L258-I315 HydrophobicContact CD2-CG2 4.2Å; L258-I315 HydrophobicContact CG-CG2 4.45Å; T259-I315 HydrophobicContact CG2-CD1 3.99Å; L262-I315 HydrophobicContact CD1-CG2 3.51Å; L311-I315 HydrophobicContact CD1-CD1 3.96Å; L311-I315 HydrophobicContact CD1-CG1 4.29Å; L311-I315 HydrophobicContact CG-CD1 3.82Å; L311-I315 WeakPolarHBondContact O-CG1 3.31Å; L311-I315 PolarHBondContact O-N 2.83Å; E312-I315 PolarHBondContact O-N 3.39Å; I315-L319 HydrophobicContact CG2-CD1 3.88Å; I315-L319 HydrophobicContact CG2-CG 4.44Å; I315-L319 WeakPolarHBondContact O-CB 3.49Å; I315-L319 VanDerWaalsContact O-CG 3.23Å; I315-L319 WeakPolarHBondContact O-CG 3.32Å; I315-L319 PolarHBondContact O-N 3.01Å
316K83.4Confident80.6Confident72 Ų7287.2 Ų87.231%0.31347%0.465SS..Hα-helixtrans-62.3-46.7175.5-168.3171.1-173.2168.30111.4L258 E312 A313 L319 I320 L325 E329L258-K316 HydrophobicContact CD2-CB 3.76Å; L258-K316 HydrophobicContact CD2-CG 4.23Å; E312-K316 PolarHBondContact O-N 3.49Å; A313-K316 PolarHBondContact O-N 2.76Å; K316-L319 PolarHBondContact O-N 2.78Å; K316-I320 HydrophobicContact CG-CD1 3.91Å; K316-I320 WeakPolarHBondContact O-CD1 3.42Å; K316-I320 VanDerWaalsContact O-CG1 3.23Å; K316-I320 WeakPolarHBondContact O-CG1 3.36Å; K316-I320 PolarHBondContact O-N 2.91Å; K316-L325 HydrophobicContact CG-CD1 4.34Å; K316-E329 IonicContact NZ-OE2 3.63Å; K316-E329 PolarHBondContact NZ-OE2 2.91Å
317E86.3Confident80.8Confident139 Ų13986.9 Ų86.965%0.6547%0.465SS*.Hα-helixtrans-61-45.1178.7-172.7175-16200112.5A313 R314 I320 A321A313-E317 WeakPolarHBondContact O-CB 3.28Å; A313-E317 PolarHBondContact O-N 3.24Å; R314-E317 PolarHBondContact O-N 3.12Å; E317-I320 PolarHBondContact O-N 2.74Å; E317-A321 WeakPolarHBondContact O-CB 3.23Å; E317-A321 PolarHBondContact O-N 2.9Å
318E86.7Confident80Confident108 Ų10885.9 Ų85.951%0.50546%0.461SS..Hα-helixtrans-65.5-44.2176.5-173.766.7-14100111.6R314 I320 A321 Q322R314-E318 WeakPolarHBondContact O-CB 3.38Å; R314-E318 PolarHBondContact O-N 2.96Å; E318-I320 VanDerWaalsContact C-N 3.27Å; E318-I320 PolarHBondContact O-N 2.99Å; E318-A321 PolarHBondContact O-N 2.77Å; E318-A321 VanDerWaalsContact O-N 3.12Å; E318-Q322 HydrophobicContact CG-CG 4.46Å; E318-Q322 VanDerWaalsContact O-CG 3.27Å; E318-Q322 WeakPolarHBondContact O-CG 3.35Å; E318-Q322 PolarHBondContact O-N 2.74Å; E318-Q322 PolarHBondContact OE1-NE2 3.39Å
319L87.8Confident78.8Confident36 Ų3692 Ų9219%0.18849%0.487CS..Hα-helixtrans-63-34176.8-72.1173.4000112.4L258 L262 I315 K316 G323 L324 L325L258-L319 HydrophobicContact CD1-CD1 4.41Å; L262-L319 HydrophobicContact CD1-CD1 4.08Å; I315-L319 HydrophobicContact CG2-CD1 3.88Å; I315-L319 HydrophobicContact CG2-CG 4.44Å; I315-L319 WeakPolarHBondContact O-CB 3.49Å; I315-L319 VanDerWaalsContact O-CG 3.23Å; I315-L319 WeakPolarHBondContact O-CG 3.32Å; I315-L319 PolarHBondContact O-N 3.01Å; K316-L319 PolarHBondContact O-N 2.78Å; L319-G323 PolarHBondContact O-N 2.99Å; L319-L324 HydrophobicContact CD2-CB 4.23Å; L319-L324 HydrophobicContact CD2-CD1 3.76Å; L319-L324 WeakPolarHBondContact O-CA 3.47Å; L319-L324 WeakPolarHBondContact O-CB 3.18Å; L319-L324 PolarHBondContact O-N 3.43Å; L319-L325 HydrophobicContact CB-CB 4.42Å; L319-L325 HydrophobicContact CB-CD1 3.69Å; L319-L325 HydrophobicContact CB-CG 3.93Å; L319-L325 HydrophobicContact CD1-CD1 3.9Å; L319-L325 HydrophobicContact CG-CD1 4.47Å; L319-L325 PolarHBondContact O-N 3.35Å
320I85Confident77.4Confident43 Ų4392.7 Ų92.722%0.22149%0.49CS..Hα-helixtrans-67.1-46171-69.4163000110.7K316 E317 E318 Q322 G323 L325K316-I320 HydrophobicContact CG-CD1 3.91Å; K316-I320 WeakPolarHBondContact O-CD1 3.42Å; K316-I320 VanDerWaalsContact O-CG1 3.23Å; K316-I320 WeakPolarHBondContact O-CG1 3.36Å; K316-I320 PolarHBondContact O-N 2.91Å; E317-I320 PolarHBondContact O-N 2.74Å; E318-I320 VanDerWaalsContact C-N 3.27Å; E318-I320 PolarHBondContact O-N 2.99Å; I320-Q322 VanDerWaalsContact C-N 3.27Å; I320-Q322 PolarHBondContact O-N 3.12Å; I320-G323 PolarHBondContact O-N 3.42Å; I320-L325 WeakPolarHBondContact CA-O 3.43Å; I320-L325 HydrophobicContact CG1-CB 3.82Å
321A85.9Confident75.8Confident79 Ų7996.7 Ų96.765%0.65352%0.515SS*.Hα-helixtrans-62.8-32.3179.800000113.2E317 E318 G323E317-A321 WeakPolarHBondContact O-CB 3.23Å; E317-A321 PolarHBondContact O-N 2.9Å; E318-A321 PolarHBondContact O-N 2.77Å; E318-A321 VanDerWaalsContact O-N 3.12Å; A321-G323 VanDerWaalsContact C-N 3.26Å; A321-G323 PolarHBondContact O-N 3.2Å
322Q87.2Confident73.8Confident128 Ų12896.5 Ų96.560%0.59853%0.526SS*.THydrogen-bonded Turntrans-80.3-1.2173.4-60.4-65.7-19.600113.3E318 I320 L324E318-Q322 HydrophobicContact CG-CG 4.46Å; E318-Q322 VanDerWaalsContact O-CG 3.27Å; E318-Q322 WeakPolarHBondContact O-CG 3.35Å; E318-Q322 PolarHBondContact O-N 2.74Å; E318-Q322 PolarHBondContact OE1-NE2 3.39Å; I320-Q322 VanDerWaalsContact C-N 3.27Å; I320-Q322 PolarHBondContact O-N 3.12Å; Q322-L324 VanDerWaalsContact C-N 3.29Å; Q322-L324 HydrophobicContact CB-CD1 4.12Å; Q322-L324 HydrophobicContact CB-CG 4.14Å; Q322-L324 PolarHBondContact O-N 2.88Å
323G77.5Confident71.8Confident66 Ų66103.9 Ų103.968%0.6856%0.56SS**THydrogen-bonded Turntrans70.321.1-178.600000114.5L319 I320 A321L319-G323 PolarHBondContact O-N 2.99Å; I320-G323 PolarHBondContact O-N 3.42Å; A321-G323 VanDerWaalsContact C-N 3.26Å; A321-G323 PolarHBondContact O-N 3.2Å
324L81.3Confident70.1Confident124 Ų124105.7 Ų105.765%0.64958%0.584SS**SBendtrans-92.4-16.4178.6-61.8173.7000112.8L319 Q322L319-L324 HydrophobicContact CD2-CB 4.23Å; L319-L324 HydrophobicContact CD2-CD1 3.76Å; L319-L324 WeakPolarHBondContact O-CA 3.47Å; L319-L324 WeakPolarHBondContact O-CB 3.18Å; L319-L324 PolarHBondContact O-N 3.43Å; Q322-L324 VanDerWaalsContact C-N 3.29Å; Q322-L324 HydrophobicContact CB-CD1 4.12Å; Q322-L324 HydrophobicContact CB-CG 4.14Å; Q322-L324 PolarHBondContact O-N 2.88Å
325L79.1Confident68.2Low67 Ų67101.5 Ų101.535%0.35159%0.587SS.*SBendtrans-134.2144.4171.4-68.5178.4000109.4K316 L319 I320K316-L325 HydrophobicContact CG-CD1 4.34Å; L319-L325 HydrophobicContact CB-CB 4.42Å; L319-L325 HydrophobicContact CB-CD1 3.69Å; L319-L325 HydrophobicContact CB-CG 3.93Å; L319-L325 HydrophobicContact CD1-CD1 3.9Å; L319-L325 HydrophobicContact CG-CD1 4.47Å; L319-L325 PolarHBondContact O-N 3.35Å; I320-L325 WeakPolarHBondContact CA-O 3.43Å; I320-L325 HydrophobicContact CG1-CB 3.82Å
326D79.4Confident66.3Low148 Ų148106.7 Ų106.779%0.79162%0.615SS**  trans-73141173.6-68.8-53.2000111.2E328D326-E328 PolarHBondContact O-N 2.92Å; D326-E328 VanDerWaalsContact O-N 3.1Å
327S65.4Low64.6Low87 Ų87111.4 Ų111.461%0.60864%0.643SS**SBendtrans-70.8-6.7-171.8-167.80000115
328E53.3Low63.1Low120 Ų120112.7 Ų112.756%0.56165%0.649SS**  trans-136.463.9-168.2-75.3-83.791.400112D326 R330D326-E328 PolarHBondContact O-N 2.92Å; D326-E328 VanDerWaalsContact O-N 3.1Å; E328-R330 HydrophobicContact CB-CG 4.5Å; E328-R330 PolarHBondContact O-N 3.36Å; E328-R330 IonicContact OE2-CZ 2.64Å; E328-R330 IonicContact OE2-NE 2.7Å; E328-R330 PolarHBondContact OE2-NE 2.93Å; E328-R330 IonicContact OE2-NH2 2.79Å; E328-R330 PolarHBondContact OE2-NH2 2.97Å
329E48.9Very low62.4Low154 Ų154110.6 Ų110.672%0.7264%0.641SS**  trans-67.480.6149.1-97.6-174.7148.300108.3K316 P331K316-E329 IonicContact NZ-OE2 3.63Å; K316-E329 PolarHBondContact NZ-OE2 2.91Å; E329-P331 WeakPolarHBondContact O-CD 3.4Å
330R40.3Very low62.3Low170 Ų170116.7 Ų116.764%0.64267%0.669SS**  trans-66.8123.8171.6-74.2-174.1-175.4144.414109.1E328 G332E328-R330 HydrophobicContact CB-CG 4.5Å; E328-R330 PolarHBondContact O-N 3.36Å; E328-R330 IonicContact OE2-CZ 2.64Å; E328-R330 IonicContact OE2-NE 2.7Å; E328-R330 PolarHBondContact OE2-NE 2.93Å; E328-R330 IonicContact OE2-NH2 2.79Å; E328-R330 PolarHBondContact OE2-NH2 2.97Å; R330-G332 PolarHBondContact O-N 3.47Å
331P46.3Very low62.3Low143 Ų143119.9 Ų119.993%0.92969%0.69SS**SBendtrans-74.973.2168.332.4-33.6000108.8E329E329-P331 WeakPolarHBondContact O-CD 3.4Å
332G39.2Very low62.4Low51 Ų51119.1 Ų119.153%0.52668%0.675SS.*SBendtrans-164.290.6-169.900000112.2R330R330-G332 PolarHBondContact O-N 3.47Å
333Q41.6Very low62.4Low199 Ų199114.8 Ų114.893%0.9366%0.661SS**  trans42.790.6146.2-159161.381.800115.5G335Q333-G335 PolarHBondContact O-N 3.1Å; Q333-G335 VanDerWaalsContact O-N 3.14Å
334G46.2Very low63.1Low95 Ų95114.7 Ų114.798%0.97964%0.643SS**SBendtrans-37.4109-16900000116.3
335G46.3Very low63.6Low61 Ų61112.2 Ų112.263%0.62963%0.63SS**  trans-170.3100.5174.800000110.5Q333Q333-G335 PolarHBondContact O-N 3.1Å; Q333-G335 VanDerWaalsContact O-N 3.14Å
336D44.3Very low64.2Low150 Ų150114 Ų11480%0.80264%0.637SS**SBendtrans171.2-1148.3-103-0.4000113
337L48.4Very low64.9Low171 Ų171111.6 Ų111.690%0.89562%0.619SS**SBendtrans-78.2113.8133.5-64.9176.1000105.6D339L337-D339 PolarHBondContact O-N 2.69Å
338E54.2Low66.3Low166 Ų166114.2 Ų114.278%0.77662%0.616SS**  trans-51.4132.2167.8-67.7-176.3142.900107.7E340E338-E340 VanDerWaalsContact C-N 3.3Å; E338-E340 PolarHBondContact O-N 2.8Å
339D73.4Confident68.3Low64 Ų64109.5 Ų109.534%0.34259%0.594SS.*  trans-60.998.7170.7172.7-9.1000107L337 V341 L342 A343L337-D339 PolarHBondContact O-N 2.69Å; D339-V341 PolarHBondContact O-N 3.18Å; D339-V341 VanDerWaalsContact O-N 3.15Å; D339-V341 WeakPolarHBondContact OD1-CB 3.43Å; D339-V341 PolarHBondContact OD1-N 3.37Å; D339-V341 VanDerWaalsContact OD1-N 3.13Å; D339-L342 HydrophobicContact CB-CB 3.72Å; D339-L342 HydrophobicContact CB-CD2 4.49Å; D339-L342 VanDerWaalsContact CG-CB 3.43Å; D339-L342 CarbonylContact O-C 3.18Å; D339-L342 WeakPolarHBondContact O-CA 3.49Å; D339-L342 WeakPolarHBondContact O-CB 3.1Å; D339-L342 PolarHBondContact O-N 3.43Å; D339-L342 PolarHBondContact OD1-N 3.21Å; D339-L342 WeakPolarHBondContact OD2-CB 3.47Å; D339-A343 PolarHBondContact O-N 2.87Å
340E85.2Confident70.5Confident164 Ų164104.9 Ų104.977%0.76658%0.582SS**Hα-helixtrans-56.5-34-173.3-172.7-174167.400110.7E338 E344E338-E340 VanDerWaalsContact C-N 3.3Å; E338-E340 PolarHBondContact O-N 2.8Å; E340-E344 VanDerWaalsContact O-CB 3.23Å; E340-E344 WeakPolarHBondContact O-CB 3.3Å; E340-E344 PolarHBondContact O-N 3.1Å
341V85.8Confident73.1Confident110 Ų110101 Ų10167%0.66757%0.571SS**Hα-helixtrans-69.7-44.2176.4-175.70000110.3D339 L345D339-V341 PolarHBondContact O-N 3.18Å; D339-V341 VanDerWaalsContact O-N 3.15Å; D339-V341 WeakPolarHBondContact OD1-CB 3.43Å; D339-V341 PolarHBondContact OD1-N 3.37Å; D339-V341 VanDerWaalsContact OD1-N 3.13Å; V341-L345 WeakPolarHBondContact O-CB 3.25Å; V341-L345 PolarHBondContact O-N 2.91Å
342L87.1Confident75.5Confident63 Ų6397.1 Ų97.133%0.3354%0.542SS..Hα-helixtrans-64.1-44.8174.8179.761.9000112.2I189 D339 L345 Q346I189-L342 HydrophobicContact CD1-CD1 3.83Å; I189-L342 HydrophobicContact CG2-CD1 3.85Å; D339-L342 HydrophobicContact CB-CB 3.72Å; D339-L342 HydrophobicContact CB-CD2 4.49Å; D339-L342 VanDerWaalsContact CG-CB 3.43Å; D339-L342 CarbonylContact O-C 3.18Å; D339-L342 WeakPolarHBondContact O-CA 3.49Å; D339-L342 WeakPolarHBondContact O-CB 3.1Å; D339-L342 PolarHBondContact O-N 3.43Å; D339-L342 PolarHBondContact OD1-N 3.21Å; D339-L342 WeakPolarHBondContact OD2-CB 3.47Å; L342-L345 PolarHBondContact O-N 3.34Å; L342-Q346 HydrophobicContact CD1-CG 4.36Å; L342-Q346 WeakPolarHBondContact O-CB 3.21Å; L342-Q346 VanDerWaalsContact O-CG 3.3Å; L342-Q346 WeakPolarHBondContact O-CG 3.27Å; L342-Q346 PolarHBondContact O-N 3.28Å
343A87.6Confident78.1Confident38 Ų38100 Ų10031%0.31454%0.54SS..Hα-helixtrans-63.6-47.8179.700000111.3D339 L345 Q346 K347D339-A343 PolarHBondContact O-N 2.87Å; A343-L345 VanDerWaalsContact C-N 3.35Å; A343-L345 PolarHBondContact O-N 3.14Å; A343-Q346 PolarHBondContact O-N 3.43Å; A343-K347 WeakPolarHBondContact O-CB 3.35Å; A343-K347 PolarHBondContact O-N 2.9Å
344E91.4Very high80.7Confident63 Ų6393.5 Ų93.529%0.29452%0.52SS..Hα-helixtrans-66.5-36.9176.5-168.763.7-16200111.1E340 K347 R348E340-E344 VanDerWaalsContact O-CB 3.23Å; E340-E344 WeakPolarHBondContact O-CB 3.3Å; E340-E344 PolarHBondContact O-N 3.1Å; E344-K347 VanDerWaalsContact CD-NZ 3.26Å; E344-K347 WeakPolarHBondContact O-CB 3.46Å; E344-K347 PolarHBondContact O-N 3.48Å; E344-K347 IonicContact OE1-NZ 2.81Å; E344-K347 PolarHBondContact OE1-NZ 3.12Å; E344-K347 WeakPolarHBondContact OE2-CD 3.21Å; E344-K347 IonicContact OE2-NZ 3.84Å; E344-K347 PolarHBondContact OE2-NZ 2.93Å; E344-R348 WeakPolarHBondContact O-CG 3.41Å; E344-R348 PolarHBondContact O-N 3.43Å; E344-R348 IonicContact OE1-CZ 3.46Å; E344-R348 IonicContact OE1-NE 3.46Å; E344-R348 PolarHBondContact OE1-NE 3.21Å; E344-R348 IonicContact OE1-NH2 2.65Å; E344-R348 PolarHBondContact OE1-NH2 2.9Å
345L91.4Very high83.1Confident73 Ų7393.8 Ų93.838%0.38250%0.499SS..Hα-helixtrans-64.8-42.8175.4-171.6123.6000112.2I189 V341 L342 A343 K347 R348 Q349I189-L345 HydrophobicContact CB-CD2 4.38Å; I189-L345 HydrophobicContact CD1-CD2 3.63Å; I189-L345 HydrophobicContact CG1-CD2 3.59Å; I189-L345 HydrophobicContact CG2-CD2 4.11Å; V341-L345 WeakPolarHBondContact O-CB 3.25Å; V341-L345 PolarHBondContact O-N 2.91Å; L342-L345 PolarHBondContact O-N 3.34Å; A343-L345 VanDerWaalsContact C-N 3.35Å; A343-L345 PolarHBondContact O-N 3.14Å; L345-K347 VanDerWaalsContact C-N 3.34Å; L345-K347 PolarHBondContact O-N 2.81Å; L345-R348 PolarHBondContact O-N 3.04Å; L345-Q349 WeakPolarHBondContact O-CG 3.32Å; L345-Q349 PolarHBondContact O-N 3.44Å
346Q91.9Very high85.4Confident104 Ų10493 Ų9349%0.48648%0.48SS..Hα-helixtrans-61.4-41.9173.2-73.6178.819.400111.7I189 L342 A343 Q349 A350I189-Q346 HydrophobicContact CD1-CG 4Å; L342-Q346 HydrophobicContact CD1-CG 4.36Å; L342-Q346 WeakPolarHBondContact O-CB 3.21Å; L342-Q346 VanDerWaalsContact O-CG 3.3Å; L342-Q346 WeakPolarHBondContact O-CG 3.27Å; L342-Q346 PolarHBondContact O-N 3.28Å; A343-Q346 PolarHBondContact O-N 3.43Å; Q346-Q349 WeakPolarHBondContact O-CB 3.23Å; Q346-Q349 PolarHBondContact O-N 2.71Å; Q346-A350 PolarHBondContact O-N 3.12Å
347K94.2Very high87.8Confident98 Ų9888.7 Ų88.743%0.42647%0.465SS..Hα-helixtrans-61.6-47.1174.5172.6179.1153.8-145.60112A343 E344 L345 Q349 A350 E351A343-K347 WeakPolarHBondContact O-CB 3.35Å; A343-K347 PolarHBondContact O-N 2.9Å; E344-K347 VanDerWaalsContact CD-NZ 3.26Å; E344-K347 WeakPolarHBondContact O-CB 3.46Å; E344-K347 PolarHBondContact O-N 3.48Å; E344-K347 IonicContact OE1-NZ 2.81Å; E344-K347 PolarHBondContact OE1-NZ 3.12Å; E344-K347 WeakPolarHBondContact OE2-CD 3.21Å; E344-K347 IonicContact OE2-NZ 3.84Å; E344-K347 PolarHBondContact OE2-NZ 2.93Å; L345-K347 VanDerWaalsContact C-N 3.34Å; L345-K347 PolarHBondContact O-N 2.81Å; K347-Q349 VanDerWaalsContact C-N 3.32Å; K347-Q349 PolarHBondContact O-N 3.17Å; K347-A350 WeakPolarHBondContact O-CB 3.48Å; K347-A350 PolarHBondContact O-N 3.43Å; K347-A350 VanDerWaalsContact O-N 3.08Å; K347-E351 WeakPolarHBondContact CE-OE1 3.48Å; K347-E351 WeakPolarHBondContact O-CG 3.48Å; K347-E351 PolarHBondContact O-N 3.33Å
348R95.2Very high90.1Very high141 Ų14186.3 Ų86.353%0.53245%0.449SS..Hα-helixtrans-63.9-34.9175.2-62.2-44.9171.3102.35112.6E344 L345 A350 E351 L352E344-R348 WeakPolarHBondContact O-CG 3.41Å; E344-R348 PolarHBondContact O-N 3.43Å; E344-R348 IonicContact OE1-CZ 3.46Å; E344-R348 IonicContact OE1-NE 3.46Å; E344-R348 PolarHBondContact OE1-NE 3.21Å; E344-R348 IonicContact OE1-NH2 2.65Å; E344-R348 PolarHBondContact OE1-NH2 2.9Å; L345-R348 PolarHBondContact O-N 3.04Å; R348-A350 VanDerWaalsContact C-N 3.34Å; R348-E351 WeakPolarHBondContact CD-OE2 3.43Å; R348-E351 IonicContact NE-OE2 2.71Å; R348-E351 PolarHBondContact O-N 3.17Å; R348-L352 VanDerWaalsContact O-CB 3.29Å; R348-L352 WeakPolarHBondContact O-CB 3.29Å; R348-L352 PolarHBondContact O-N 3.12Å
349Q94.8Very high92.1Very high22 Ų2282.3 Ų82.310%0.10343%0.433CS..Hα-helixtrans-64.6-36.4171.5-74.9-178.1-1.500112.4Y186 F187 L345 Q346 K347 K353Y186-Q349 PolarHBondContact O-NE2 3.01Å; F187-Q349 HydrophobicContact CD1-CB 3.99Å; F187-Q349 HydrophobicContact CD1-CG 3.96Å; F187-Q349 HydrophobicContact CE1-CB 4.32Å; L345-Q349 WeakPolarHBondContact O-CG 3.32Å; L345-Q349 PolarHBondContact O-N 3.44Å; Q346-Q349 WeakPolarHBondContact O-CB 3.23Å; Q346-Q349 PolarHBondContact O-N 2.71Å; K347-Q349 VanDerWaalsContact C-N 3.32Å; K347-Q349 PolarHBondContact O-N 3.17Å; Q349-K353 VanDerWaalsContact O-CG 3.28Å; Q349-K353 WeakPolarHBondContact O-CG 3.4Å; Q349-K353 PolarHBondContact O-N 3.4Å
350A94.9Very high93.2Very high57 Ų5785.1 Ų85.147%0.47144%0.439SS..Hα-helixtrans-69-44.3174.900000112.1Q346 K347 R348 L352 K353 A354Q346-A350 PolarHBondContact O-N 3.12Å; K347-A350 WeakPolarHBondContact O-CB 3.48Å; K347-A350 PolarHBondContact O-N 3.43Å; K347-A350 VanDerWaalsContact O-N 3.08Å; R348-A350 VanDerWaalsContact C-N 3.34Å; A350-L352 PolarHBondContact O-N 3.01Å; A350-K353 PolarHBondContact O-N 3.38Å; A350-A354 PolarHBondContact O-N 3.29Å
351E96.6Very high93.7Very high87 Ų8779.8 Ų79.841%0.40742%0.423SS..Hα-helixtrans-58.3-45.4172.9-70.5171.2-170.200111.4K347 R348 K353 A354 L355K347-E351 WeakPolarHBondContact CE-OE1 3.48Å; K347-E351 WeakPolarHBondContact O-CG 3.48Å; K347-E351 PolarHBondContact O-N 3.33Å; R348-E351 WeakPolarHBondContact CD-OE2 3.43Å; R348-E351 IonicContact NE-OE2 2.71Å; R348-E351 PolarHBondContact O-N 3.17Å; E351-K353 PolarHBondContact O-N 2.86Å; E351-A354 PolarHBondContact O-N 3.06Å; E351-L355 WeakPolarHBondContact O-CG 3.38Å; E351-L355 PolarHBondContact O-N 3.28Å
352L95.3Very high94.3Very high63 Ų6381 Ų8133%0.3342%0.415SS..Hα-helixtrans-61.1-43.5176.8-179.559.9000112.1F187 R348 A350 A354 L355 I356F187-L352 HydrophobicContact CE1-CB 4.37Å; F187-L352 HydrophobicContact CE1-CD2 3.94Å; F187-L352 HydrophobicContact CE1-CG 4.21Å; F187-L352 HydrophobicContact CZ-CD2 4.06Å; F187-L352 HydrophobicContact CZ-CG 4.17Å; R348-L352 VanDerWaalsContact O-CB 3.29Å; R348-L352 WeakPolarHBondContact O-CB 3.29Å; R348-L352 PolarHBondContact O-N 3.12Å; A350-L352 PolarHBondContact O-N 3.01Å; L352-A354 VanDerWaalsContact C-N 3.34Å; L352-A354 PolarHBondContact O-N 2.97Å; L352-L355 PolarHBondContact O-N 3.17Å; L352-I356 HydrophobicContact CD1-CD1 4.03Å; L352-I356 HydrophobicContact CD1-CG1 4.23Å; L352-I356 HydrophobicContact CG-CD1 3.88Å; L352-I356 HydrophobicContact CG-CG1 4.5Å; L352-I356 WeakPolarHBondContact O-CB 3.37Å; L352-I356 VanDerWaalsContact O-CG1 3.3Å; L352-I356 WeakPolarHBondContact O-CG1 3.48Å; L352-I356 PolarHBondContact O-N 2.76Å
353K94.8Very high94.7Very high111 Ų11181.2 Ų81.248%0.48341%0.414SS..Hα-helixtrans-59.7-43174.4-74.4165.9-173.8168.60111.9F187 Q349 A350 E351 I356 A357F187-K353 HydrophobicContact CD1-CD 4.49Å; F187-K353 VanDerWaalsContact CD1-CE 3.45Å; F187-K353 HydrophobicContact CD1-CG 4.37Å; F187-K353 HydrophobicContact CE1-CD 4.16Å; F187-K353 HydrophobicContact CE1-CG 3.59Å; F187-K353 HydrophobicContact CE2-CG 4.48Å; F187-K353 HydrophobicContact CZ-CG 3.65Å; Q349-K353 VanDerWaalsContact O-CG 3.28Å; Q349-K353 WeakPolarHBondContact O-CG 3.4Å; Q349-K353 PolarHBondContact O-N 3.4Å; A350-K353 PolarHBondContact O-N 3.38Å; E351-K353 PolarHBondContact O-N 2.86Å; K353-I356 PolarHBondContact O-N 2.71Å; K353-A357 WeakPolarHBondContact O-CB 3.48Å; K353-A357 PolarHBondContact O-N 2.93Å
354A96.6Very high95.2Very high62 Ų6284.5 Ų84.551%0.51242%0.423SS..Hα-helixtrans-64-43177.100000112A350 E351 L352 A357 H358A350-A354 PolarHBondContact O-N 3.29Å; E351-A354 PolarHBondContact O-N 3.06Å; L352-A354 VanDerWaalsContact C-N 3.34Å; L352-A354 PolarHBondContact O-N 2.97Å; A354-A357 PolarHBondContact O-N 3.08Å; A354-H358 WeakPolarHBondContact O-CB 2.84Å; A354-H358 PolarHBondContact O-N 3.05Å
355L96.1Very high95.5Very high101 Ų10184.6 Ų84.653%0.52942%0.423SS..Hα-helixtrans-64.4-43.1176-72171.5000112.5E351 L352 H358 N359E351-L355 WeakPolarHBondContact O-CG 3.38Å; E351-L355 PolarHBondContact O-N 3.28Å; L352-L355 PolarHBondContact O-N 3.17Å; L355-H358 PolarHBondContact O-N 2.64Å; L355-N359 VanDerWaalsContact O-CB 3.26Å; L355-N359 WeakPolarHBondContact O-CB 3.23Å; L355-N359 PolarHBondContact O-N 2.85Å; L355-N359 PolarHBondContact O-ND2 2.84Å
356I94.1Very high95.8Very high45 Ų4584.5 Ų84.523%0.23142%0.423CS..Hα-helixtrans-61-47.5175.1-70.4166.5000110.2E183 F187 L352 K353 N359 R360E183-I356 HydrophobicContact CG-CD1 4.3Å; F187-I356 HydrophobicContact CE2-CD1 4.5Å; F187-I356 HydrophobicContact CZ-CD1 4.01Å; L352-I356 HydrophobicContact CD1-CD1 4.03Å; L352-I356 HydrophobicContact CD1-CG1 4.23Å; L352-I356 HydrophobicContact CG-CD1 3.88Å; L352-I356 HydrophobicContact CG-CG1 4.5Å; L352-I356 WeakPolarHBondContact O-CB 3.37Å; L352-I356 VanDerWaalsContact O-CG1 3.3Å; L352-I356 WeakPolarHBondContact O-CG1 3.48Å; L352-I356 PolarHBondContact O-N 2.76Å; K353-I356 PolarHBondContact O-N 2.71Å; I356-N359 PolarHBondContact O-N 3.47Å; I356-R360 VanDerWaalsContact O-CB 3.26Å; I356-R360 WeakPolarHBondContact O-CB 3.38Å; I356-R360 PolarHBondContact O-N 3.16Å
357A95.1Very high96.1Very high60 Ų6080.6 Ų80.650%0.49641%0.405SS..Hα-helixtrans-60.4-47.3178.300000112.1K353 A354 R360 A361K353-A357 WeakPolarHBondContact O-CB 3.48Å; K353-A357 PolarHBondContact O-N 2.93Å; A354-A357 PolarHBondContact O-N 3.08Å; A357-R360 PolarHBondContact O-N 3.06Å; A357-A361 WeakPolarHBondContact O-CB 3.37Å; A357-A361 PolarHBondContact O-N 2.95Å
358H97.3Very high96.2Very high121 Ų12181.4 Ų81.456%0.5641%0.406SS*.Hα-helixtrans-60.5-48.5176.2175.5-93.6000112.2A354 L355 R360 A361 R362A354-H358 WeakPolarHBondContact O-CB 2.84Å; A354-H358 PolarHBondContact O-N 3.05Å; L355-H358 PolarHBondContact O-N 2.64Å; H358-R360 VanDerWaalsContact C-N 3.33Å; H358-R360 PolarHBondContact O-N 2.82Å; H358-A361 PolarHBondContact O-N 3.47Å; H358-R362 WeakPolarHBondContact O-CB 3.44Å; H358-R362 PolarHBondContact O-N 3.09Å
359N95.6Very high96.3Very high82 Ų8278 Ų7844%0.43940%0.397SS..Hα-helixtrans-64.3-38.3-180-71.1-19.1000111.8L355 I356 R362 K363L355-N359 VanDerWaalsContact O-CB 3.26Å; L355-N359 WeakPolarHBondContact O-CB 3.23Å; L355-N359 PolarHBondContact O-N 2.85Å; L355-N359 PolarHBondContact O-ND2 2.84Å; I356-N359 PolarHBondContact O-N 3.47Å; N359-R362 PolarHBondContact O-N 3.19Å; N359-K363 WeakPolarHBondContact O-CB 3.35Å; N359-K363 VanDerWaalsContact O-CG 3.25Å; N359-K363 WeakPolarHBondContact O-CG 3.44Å; N359-K363 PolarHBondContact O-N 3.23Å
360R95.6Very high96.4Very high122 Ų12277.3 Ų77.346%0.4640%0.395SS..Hα-helixtrans-63.9-47.8174.3-173.5174.9-176.5168.21.2111.4L177 I356 A357 H358 R362 K363 Q364L177-R360 HydrophobicContact CD2-CG 4.13Å; I356-R360 VanDerWaalsContact O-CB 3.26Å; I356-R360 WeakPolarHBondContact O-CB 3.38Å; I356-R360 PolarHBondContact O-N 3.16Å; A357-R360 PolarHBondContact O-N 3.06Å; H358-R360 VanDerWaalsContact C-N 3.33Å; H358-R360 PolarHBondContact O-N 2.82Å; R360-R362 VanDerWaalsContact C-N 3.33Å; R360-R362 PolarHBondContact O-N 3.46Å; R360-K363 PolarHBondContact O-N 2.91Å; R360-Q364 WeakPolarHBondContact O-CG 3.32Å; R360-Q364 PolarHBondContact O-N 3.14Å
361A97.2Very high96.5Very high52 Ų5279.2 Ų79.243%0.4339%0.393SS..Hα-helixtrans-60-42.5176.200000111.9A357 H358 Q364 E365A357-A361 WeakPolarHBondContact O-CB 3.37Å; A357-A361 PolarHBondContact O-N 2.95Å; H358-A361 PolarHBondContact O-N 3.47Å; A361-Q364 PolarHBondContact O-N 3.23Å; A361-E365 PolarHBondContact O-N 2.76Å
362R97.6Very high96.4Very high135 Ų13578 Ų7851%0.50939%0.388SS..Hα-helixtrans-66.8-41.1177.9-168.966.4-168.9159.74112.6H358 N359 R360 Q364 E365 L366H358-R362 WeakPolarHBondContact O-CB 3.44Å; H358-R362 PolarHBondContact O-N 3.09Å; N359-R362 PolarHBondContact O-N 3.19Å; R360-R362 VanDerWaalsContact C-N 3.33Å; R360-R362 PolarHBondContact O-N 3.46Å; R362-Q364 VanDerWaalsContact C-N 3.34Å; R362-E365 PolarHBondContact O-N 3.3Å; R362-L366 HydrophobicContact CG-CD1 4.41Å; R362-L366 WeakPolarHBondContact O-CB 3.06Å; R362-L366 VanDerWaalsContact O-CG 3.32Å; R362-L366 WeakPolarHBondContact O-CG 3.42Å; R362-L366 PolarHBondContact O-N 3.15Å
363K96.4Very high96.5Very high69 Ų6977.6 Ų77.630%0.338%0.384SS..Hα-helixtrans-61.8-39.3173-74.1170.6177.8-179.50112L176 L177 N359 R360 L366 L367L176-K363 HydrophobicContact CB-CD 4.29Å; L176-K363 WeakPolarHBondContact O-CD 3.23Å; L176-K363 WeakPolarHBondContact O-CE 3.33Å; L176-K363 PolarHBondContact O-NZ 2.97Å; L177-K363 HydrophobicContact CD1-CB 4.48Å; L177-K363 HydrophobicContact CD2-CB 3.53Å; L177-K363 HydrophobicContact CD2-CD 4.39Å; L177-K363 HydrophobicContact CG-CB 3.87Å; N359-K363 WeakPolarHBondContact O-CB 3.35Å; N359-K363 VanDerWaalsContact O-CG 3.25Å; N359-K363 WeakPolarHBondContact O-CG 3.44Å; N359-K363 PolarHBondContact O-N 3.23Å; R360-K363 PolarHBondContact O-N 2.91Å; K363-L366 PolarHBondContact O-N 3.34Å; K363-L367 WeakPolarHBondContact O-CB 3.46Å; K363-L367 PolarHBondContact O-N 2.98Å
364Q97.4Very high96.5Very high106 Ų10673.7 Ų73.750%0.49537%0.368SS..Hα-helixtrans-63.3-44.7175.8-74.8176.3-31.300112L177 R360 A361 R362 L367 R368L177-Q364 HydrophobicContact CD1-CG 4.18Å; L177-Q364 HydrophobicContact CD2-CG 3.59Å; R360-Q364 WeakPolarHBondContact O-CG 3.32Å; R360-Q364 PolarHBondContact O-N 3.14Å; A361-Q364 PolarHBondContact O-N 3.23Å; R362-Q364 VanDerWaalsContact C-N 3.34Å; Q364-L367 PolarHBondContact O-N 3.08Å; Q364-R368 PolarHBondContact O-N 3.31Å
365E98Very high96.5Very high65 Ų6577.2 Ų77.230%0.30437%0.368SS..Hα-helixtrans-67.6-39.3177.2178.256.6-167.800112.2A361 R362 L367 R368 L369A361-E365 PolarHBondContact O-N 2.76Å; R362-E365 PolarHBondContact O-N 3.3Å; E365-L367 VanDerWaalsContact C-N 3.34Å; E365-L367 PolarHBondContact O-N 2.87Å; E365-R368 WeakPolarHBondContact O-CB 3.46Å; E365-R368 PolarHBondContact O-N 3.21Å; E365-R368 IonicContact OE1-CZ 3.14Å; E365-R368 IonicContact OE1-NE 2.7Å; E365-R368 PolarHBondContact OE1-NE 2.84Å; E365-R368 IonicContact OE1-NH2 2.73Å; E365-R368 PolarHBondContact OE1-NH2 3.28Å; E365-R368 IonicContact OE2-CZ 2.66Å; E365-R368 IonicContact OE2-NE 2.69Å; E365-R368 PolarHBondContact OE2-NE 3.1Å; E365-R368 IonicContact OE2-NH2 2.67Å; E365-L369 HydrophobicContact CG-CD1 4.11Å; E365-L369 WeakPolarHBondContact O-CG 3.43Å; E365-L369 PolarHBondContact O-N 3.35Å
366L97.2Very high96.5Very high72 Ų7275.5 Ų75.538%0.37736%0.356SS..Hα-helixtrans-60.4-42.1172.3-73.2171.9000111.9L173 R362 K363 R368 L369 A370L173-L366 HydrophobicContact CD1-CB 4.47Å; L173-L366 HydrophobicContact CD2-CB 4.44Å; R362-L366 HydrophobicContact CG-CD1 4.41Å; R362-L366 WeakPolarHBondContact O-CB 3.06Å; R362-L366 VanDerWaalsContact O-CG 3.32Å; R362-L366 WeakPolarHBondContact O-CG 3.42Å; R362-L366 PolarHBondContact O-N 3.15Å; K363-L366 PolarHBondContact O-N 3.34Å; L366-R368 VanDerWaalsContact C-N 3.34Å; L366-R368 PolarHBondContact O-N 3.17Å; L366-L369 PolarHBondContact O-N 3.05Å; L366-A370 VanDerWaalsContact O-CB 3.3Å; L366-A370 WeakPolarHBondContact O-CB 3.44Å; L366-A370 PolarHBondContact O-N 3.24Å
367L97.4Very high96.5Very high22 Ų2274.5 Ų74.512%0.11535%0.35CS..Hα-helixtrans-63.9-38.4175.4-179.663.1000112.2T170 L173 E174 L177 K363 Q364 E365 K371T170-L367 HydrophobicContact CG2-CD1 3.74Å; L173-L367 HydrophobicContact CB-CB 4.43Å; L173-L367 HydrophobicContact CB-CD1 4.04Å; E174-L367 HydrophobicContact CG-CD1 3.79Å; E174-L367 HydrophobicContact CG-CD2 3.67Å; E174-L367 HydrophobicContact CG-CG 4.41Å; L177-L367 HydrophobicContact CD1-CB 4.25Å; L177-L367 HydrophobicContact CD1-CD2 3.65Å; K363-L367 WeakPolarHBondContact O-CB 3.46Å; K363-L367 PolarHBondContact O-N 2.98Å; Q364-L367 PolarHBondContact O-N 3.08Å; E365-L367 VanDerWaalsContact C-N 3.34Å; E365-L367 PolarHBondContact O-N 2.87Å; L367-K371 HydrophobicContact CD1-CD 4.3Å; L367-K371 HydrophobicContact CD1-CG 4.47Å; L367-K371 HydrophobicContact CG-CD 4.35Å; L367-K371 WeakPolarHBondContact O-CG 3.24Å; L367-K371 PolarHBondContact O-N 2.72Å; L367-K371 VanDerWaalsContact O-N 3.09Å
368R97.6Very high96.6Very high115 Ų11577.7 Ų77.743%0.43436%0.355SS..Hα-helixtrans-62.7-49.1175.4-168.6-162.866.970.7-0.9111Q364 E365 L366 K371 E372Q364-R368 PolarHBondContact O-N 3.31Å; E365-R368 WeakPolarHBondContact O-CB 3.46Å; E365-R368 PolarHBondContact O-N 3.21Å; E365-R368 IonicContact OE1-CZ 3.14Å; E365-R368 IonicContact OE1-NE 2.7Å; E365-R368 PolarHBondContact OE1-NE 2.84Å; E365-R368 IonicContact OE1-NH2 2.73Å; E365-R368 PolarHBondContact OE1-NH2 3.28Å; E365-R368 IonicContact OE2-CZ 2.66Å; E365-R368 IonicContact OE2-NE 2.69Å; E365-R368 PolarHBondContact OE2-NE 3.1Å; E365-R368 IonicContact OE2-NH2 2.67Å; L366-R368 VanDerWaalsContact C-N 3.34Å; L366-R368 PolarHBondContact O-N 3.17Å; R368-K371 PolarHBondContact O-N 3.39Å; R368-E372 IonicContact CZ-OE2 3.7Å; R368-E372 IonicContact NH1-OE2 2.68Å; R368-E372 PolarHBondContact NH1-OE2 2.97Å; R368-E372 PolarHBondContact O-N 3.48Å
369L97.2Very high96.6Very high69 Ų6972.8 Ų72.836%0.36133%0.333SS..Hα-helixtrans-63.1-43.2178.1-71.3167.6000112E365 L366 K371 E372 E373E365-L369 HydrophobicContact CG-CD1 4.11Å; E365-L369 WeakPolarHBondContact O-CG 3.43Å; E365-L369 PolarHBondContact O-N 3.35Å; L366-L369 PolarHBondContact O-N 3.05Å; L369-K371 PolarHBondContact O-N 3.49Å; L369-E372 PolarHBondContact O-N 2.9Å; L369-E373 WeakPolarHBondContact O-CB 3.43Å; L369-E373 PolarHBondContact O-N 3.34Å
370A96.8Very high96.6Very high7 Ų772.9 Ų72.96%0.05833%0.327CS..Hα-helixtrans-59.1-45.6176.400000112I165 L173 L366 E373 M374I165-A370 HydrophobicContact CD1-CB 4.26Å; I165-A370 HydrophobicContact CG2-CB 4.36Å; L173-A370 HydrophobicContact CD1-CB 4.2Å; L366-A370 VanDerWaalsContact O-CB 3.3Å; L366-A370 WeakPolarHBondContact O-CB 3.44Å; L366-A370 PolarHBondContact O-N 3.24Å; A370-E373 PolarHBondContact O-N 3.36Å; A370-M374 WeakPolarHBondContact O-CG 3.48Å; A370-M374 PolarHBondContact O-N 3.17Å
371K96.4Very high96.6Very high98 Ų9871.4 Ų71.443%0.42633%0.325SS..Hα-helixtrans-66.1-37.2176.7-74.1177.1174.7175.90113T170 E174 L367 R368 L369 R375T170-K371 HydrophobicContact CG2-CG 4.1Å; E174-K371 WeakPolarHBondContact OE1-CE 3.24Å; E174-K371 IonicContact OE1-NZ 3.45Å; E174-K371 PolarHBondContact OE1-NZ 2.97Å; L367-K371 HydrophobicContact CD1-CD 4.3Å; L367-K371 HydrophobicContact CD1-CG 4.47Å; L367-K371 HydrophobicContact CG-CD 4.35Å; L367-K371 WeakPolarHBondContact O-CG 3.24Å; L367-K371 PolarHBondContact O-N 2.72Å; L367-K371 VanDerWaalsContact O-N 3.09Å; R368-K371 PolarHBondContact O-N 3.39Å; L369-K371 PolarHBondContact O-N 3.49Å; K371-R375 PolarHBondContact O-N 3.26Å
372E95.8Very high96.6Very high62 Ų6274.8 Ų74.829%0.2933%0.327SS..Hα-helixtrans-64.5-41.7173.9-165.5-167.8131.600111.5R368 L369 R375 K376R368-E372 IonicContact CZ-OE2 3.7Å; R368-E372 IonicContact NH1-OE2 2.68Å; R368-E372 PolarHBondContact NH1-OE2 2.97Å; R368-E372 PolarHBondContact O-N 3.48Å; L369-E372 PolarHBondContact O-N 2.9Å; E372-R375 WeakPolarHBondContact O-CB 3.32Å; E372-R375 PolarHBondContact O-N 3.26Å; E372-K376 PolarHBondContact O-N 3.05Å; E372-K376 VanDerWaalsContact O-N 3.15Å; E372-K376 VanDerWaalsContact OE1-CE 3.31Å; E372-K376 WeakPolarHBondContact OE1-CE 3.44Å; E372-K376 IonicContact OE1-NZ 3.87Å; E372-K376 PolarHBondContact OE1-NZ 3.48Å
373E95.6Very high96.6Very high54 Ų5469 Ų6925%0.25231%0.307SS..Hα-helixtrans-72-38.9179.6-173.252.5-142.600112.3I165 L369 A370 R375 K376 Q377 R380I165-E373 HydrophobicContact CD1-CB 4.07Å; I165-E373 HydrophobicContact CD1-CG 4.04Å; L369-E373 WeakPolarHBondContact O-CB 3.43Å; L369-E373 PolarHBondContact O-N 3.34Å; A370-E373 PolarHBondContact O-N 3.36Å; E373-R375 VanDerWaalsContact C-N 3.29Å; E373-R375 PolarHBondContact O-N 3.43Å; E373-K376 CarbonylContact O-C 3.56Å; E373-K376 WeakPolarHBondContact O-CA 3.32Å; E373-K376 WeakPolarHBondContact O-CB 3.42Å; E373-K376 PolarHBondContact O-N 3Å; E373-K376 WeakPolarHBondContact OE2-CD 3.45Å; E373-Q377 WeakPolarHBondContact O-CG 3.48Å; E373-Q377 PolarHBondContact O-N 2.87Å; E373-R380 IonicContact OE1-CZ 2.7Å; E373-R380 IonicContact OE1-NH1 3.58Å; E373-R380 PolarHBondContact OE1-NH1 3.12Å; E373-R380 IonicContact OE1-NH2 2.71Å; E373-R380 PolarHBondContact OE1-NH2 2.84Å
374M96.3Very high96.6Very high29 Ų2971.5 Ų71.514%0.14331%0.314CS..Hα-helixtrans-55.5-43.5169.7-76.7-17176.200111.8I165 T170 A370 K376 Q377 E378I165-M374 HydrophobicContact CG2-CG 4.26Å; T170-M374 HydrophobicContact CG2-SD 4.48Å; T170-M374 PolarHBondContact OG1-SD 3.37Å; A370-M374 WeakPolarHBondContact O-CG 3.48Å; A370-M374 PolarHBondContact O-N 3.17Å; M374-K376 VanDerWaalsContact C-N 3.29Å; M374-K376 PolarHBondContact O-N 3.45Å; M374-Q377 WeakPolarHBondContact O-CB 3.42Å; M374-Q377 PolarHBondContact O-N 3.28Å; M374-E378 WeakPolarHBondContact O-CG 3.39Å; M374-E378 PolarHBondContact O-N 3.12Å
375R95.5Very high96.6Very high135 Ų13570 Ų7051%0.50931%0.312SS..Hα-helixtrans-60.6-38.6174.2-169.9-168.971145.47.1111.8K371 E372 E373 L379K371-R375 PolarHBondContact O-N 3.26Å; E372-R375 WeakPolarHBondContact O-CB 3.32Å; E372-R375 PolarHBondContact O-N 3.26Å; E373-R375 VanDerWaalsContact C-N 3.29Å; E373-R375 PolarHBondContact O-N 3.43Å; R375-L379 WeakPolarHBondContact O-CG 3.14Å; R375-L379 PolarHBondContact O-N 3.04Å
376K95.6Very high96.6Very high65 Ų6567.1 Ų67.128%0.28330%0.299SS..Hα-helixtrans-68.3-39.6175.3-68.5170.6-173.8166.90111.6E372 E373 M374 L379 R380 L429E372-K376 PolarHBondContact O-N 3.05Å; E372-K376 VanDerWaalsContact O-N 3.15Å; E372-K376 VanDerWaalsContact OE1-CE 3.31Å; E372-K376 WeakPolarHBondContact OE1-CE 3.44Å; E372-K376 IonicContact OE1-NZ 3.87Å; E372-K376 PolarHBondContact OE1-NZ 3.48Å; E373-K376 CarbonylContact O-C 3.56Å; E373-K376 WeakPolarHBondContact O-CA 3.32Å; E373-K376 WeakPolarHBondContact O-CB 3.42Å; E373-K376 PolarHBondContact O-N 3Å; E373-K376 WeakPolarHBondContact OE2-CD 3.45Å; M374-K376 VanDerWaalsContact C-N 3.29Å; M374-K376 PolarHBondContact O-N 3.45Å; K376-L379 PolarHBondContact O-N 3.41Å; K376-R380 WeakPolarHBondContact O-CG 3.43Å; K376-R380 PolarHBondContact O-N 2.91Å; K376-L429 HydrophobicContact CB-CD2 4.49Å
377Q95.9Very high96.6Very high24 Ų2466.2 Ų66.211%0.11230%0.295CS..Hα-helixtrans-60.5-44.3173.9-68.2167.9700112.3D164 I165 E373 M374 L379 R380 Q381D164-Q377 HydrophobicContact CB-CG 4.36Å; D164-Q377 WeakPolarHBondContact OD1-CG 3.32Å; I165-Q377 PolarHBondContact O-OE1 3.41Å; I165-Q377 VanDerWaalsContact O-OE1 3.05Å; E373-Q377 WeakPolarHBondContact O-CG 3.48Å; E373-Q377 PolarHBondContact O-N 2.87Å; M374-Q377 WeakPolarHBondContact O-CB 3.42Å; M374-Q377 PolarHBondContact O-N 3.28Å; Q377-L379 VanDerWaalsContact C-N 3.33Å; Q377-L379 PolarHBondContact O-N 3.26Å; Q377-R380 PolarHBondContact O-N 3.48Å; Q377-Q381 WeakPolarHBondContact O-CB 3.42Å; Q377-Q381 PolarHBondContact O-N 3.25Å
378E96.1Very high96.6Very high128 Ų12869.8 Ų69.860%0.59831%0.314SS*.Hα-helixtrans-58.2-44.9174.6-72.7-179.3170.600111.5M374 Q381 R382M374-E378 WeakPolarHBondContact O-CG 3.39Å; M374-E378 PolarHBondContact O-N 3.12Å; E378-Q381 PolarHBondContact O-N 3.29Å; E378-R382 WeakPolarHBondContact O-CG 3.18Å; E378-R382 PolarHBondContact O-N 2.74Å
379L96.6Very high96.6Very high17 Ų1768 Ų689%0.08931%0.311CS..Hα-helixtrans-64-45.5175.4-68.5172.3000111.8R375 K376 Q377 Q381 R382 V383 I425 L428 L429R375-L379 WeakPolarHBondContact O-CG 3.14Å; R375-L379 PolarHBondContact O-N 3.04Å; K376-L379 PolarHBondContact O-N 3.41Å; Q377-L379 VanDerWaalsContact C-N 3.33Å; Q377-L379 PolarHBondContact O-N 3.26Å; L379-Q381 VanDerWaalsContact C-N 3.28Å; L379-Q381 PolarHBondContact O-N 2.93Å; L379-R382 CarbonylContact O-C 3.57Å; L379-R382 WeakPolarHBondContact O-CB 3.33Å; L379-R382 PolarHBondContact O-N 2.77Å; L379-R382 VanDerWaalsContact O-N 3.1Å; L379-V383 WeakPolarHBondContact O-CG2 3.22Å; L379-V383 PolarHBondContact O-N 3.18Å; L379-I425 HydrophobicContact CB-CG2 4.28Å; L379-I425 HydrophobicContact CD2-CG2 4.09Å; L379-I425 WeakPolarHBondContact O-CG2 3.26Å; L379-L428 HydrophobicContact CD1-CB 4.17Å; L379-L428 WeakPolarHBondContact CD1-O 3.41Å; L379-L428 HydrophobicContact CD2-CB 4.34Å; L379-L428 HydrophobicContact CD2-CD1 4.46Å; L379-L429 HydrophobicContact CB-CD1 4.2Å; L379-L429 HydrophobicContact CB-CD2 3.63Å; L379-L429 HydrophobicContact CB-CG 3.8Å; L379-L429 HydrophobicContact CD1-CD2 4.21Å; L379-L429 HydrophobicContact CD1-CG 4.36Å
380R96.1Very high96.6Very high84 Ų8466.1 Ų66.132%0.31730%0.302SS..Hα-helixtrans-58.6-40.2174.1-70.2-169.1-59.4-101.411.1111.5D164 E373 K376 Q377 V383 R384 L429D164-R380 IonicContact OD1-NH2 3.95Å; D164-R380 PolarHBondContact OD1-NH2 3.26Å; E373-R380 IonicContact OE1-CZ 2.7Å; E373-R380 IonicContact OE1-NH1 3.58Å; E373-R380 PolarHBondContact OE1-NH1 3.12Å; E373-R380 IonicContact OE1-NH2 2.71Å; E373-R380 PolarHBondContact OE1-NH2 2.84Å; K376-R380 WeakPolarHBondContact O-CG 3.43Å; K376-R380 PolarHBondContact O-N 2.91Å; Q377-R380 PolarHBondContact O-N 3.48Å; R380-V383 PolarHBondContact O-N 3.32Å; R380-R384 WeakPolarHBondContact O-CG 3.34Å; R380-R384 PolarHBondContact O-N 2.98Å; R380-L429 HydrophobicContact CG-CD1 4.26Å; R380-L429 HydrophobicContact CG-CD2 4.01Å
381Q96.4Very high96.6Very high91 Ų9170.3 Ų70.343%0.42532%0.321SS..Hα-helixtrans-66-38.4175.5-178.2562300112Q377 E378 L379 R384 V385Q377-Q381 WeakPolarHBondContact O-CB 3.42Å; Q377-Q381 PolarHBondContact O-N 3.25Å; E378-Q381 PolarHBondContact O-N 3.29Å; L379-Q381 VanDerWaalsContact C-N 3.28Å; L379-Q381 PolarHBondContact O-N 2.93Å; Q381-R384 PolarHBondContact O-N 2.95Å; Q381-R384 VanDerWaalsContact OE1-CZ 3.28Å; Q381-V385 WeakPolarHBondContact O-CG2 3.49Å; Q381-V385 PolarHBondContact O-N 2.79Å; Q381-V385 VanDerWaalsContact O-N 3.1Å
382R97.2Very high96.6Very high124 Ų12469.8 Ų69.847%0.46832%0.32SS..Hα-helixtrans-66.1-38172.6-71.7176.863.9-165.5-2.7112.5E378 L379 V385 A386 I425E378-R382 WeakPolarHBondContact O-CG 3.18Å; E378-R382 PolarHBondContact O-N 2.74Å; L379-R382 CarbonylContact O-C 3.57Å; L379-R382 WeakPolarHBondContact O-CB 3.33Å; L379-R382 PolarHBondContact O-N 2.77Å; L379-R382 VanDerWaalsContact O-N 3.1Å; R382-V385 PolarHBondContact O-N 2.75Å; R382-A386 PolarHBondContact O-N 3.19Å; R382-I425 HydrophobicContact CB-CD1 3.94Å; R382-I425 HydrophobicContact CB-CG2 4.24Å
383V97Very high96.6Very high14 Ų1467 Ų679%0.08531%0.308CS..Hα-helixtrans-59.1-48170.5176.90000110.3L379 R380 V385 A386 D387 I425 L426 L429L379-V383 WeakPolarHBondContact O-CG2 3.22Å; L379-V383 PolarHBondContact O-N 3.18Å; R380-V383 PolarHBondContact O-N 3.32Å; V383-V385 PolarHBondContact O-N 3.18Å; V383-A386 PolarHBondContact O-N 2.89Å; V383-A386 VanDerWaalsContact O-N 3.09Å; V383-D387 WeakPolarHBondContact CG1-OD2 3.3Å; V383-D387 WeakPolarHBondContact O-CB 3.48Å; V383-D387 PolarHBondContact O-N 3.45Å; V383-I425 HydrophobicContact CG2-CB 4Å; V383-I425 HydrophobicContact CG2-CG2 3.43Å; V383-I425 VanDerWaalsContact CG2-CG2 3.43Å; V383-L426 HydrophobicContact CG1-CD2 4.21Å; V383-L426 HydrophobicContact CG2-CD2 4.09Å; V383-L426 HydrophobicContact CG2-CG 4.43Å; V383-L429 HydrophobicContact CG2-CD1 3.58Å
384R97Very high96.6Very high120 Ų12069.9 Ų69.945%0.45332%0.32SS..Hα-helixtrans-57.1-34.2176.7-69.5-169.9-72-134.92.6112.6R380 Q381 N388R380-R384 WeakPolarHBondContact O-CG 3.34Å; R380-R384 PolarHBondContact O-N 2.98Å; Q381-R384 PolarHBondContact O-N 2.95Å; Q381-R384 VanDerWaalsContact OE1-CZ 3.28Å; R384-N388 PolarHBondContact O-N 3.38Å; R384-N388 PolarHBondContact O-ND2 3.46Å
385V97.4Very high96.6Very high75 Ų7575 Ų7546%0.45534%0.338SS..Hα-helixtrans-71.4-49.2173.5174.90000111.2Q381 R382 V383 D387 N388 E389Q381-V385 WeakPolarHBondContact O-CG2 3.49Å; Q381-V385 PolarHBondContact O-N 2.79Å; Q381-V385 VanDerWaalsContact O-N 3.1Å; R382-V385 PolarHBondContact O-N 2.75Å; V383-V385 PolarHBondContact O-N 3.18Å; V385-D387 VanDerWaalsContact C-N 3.34Å; V385-D387 PolarHBondContact O-N 3.04Å; V385-N388 WeakPolarHBondContact O-CB 3.3Å; V385-N388 PolarHBondContact O-N 3.03Å; V385-N388 VanDerWaalsContact O-N 3.13Å; V385-E389 PolarHBondContact O-N 2.77Å
386A97Very high96.6Very high4 Ų472.7 Ų72.73%0.03333%0.329CS..Hα-helixtrans-61.5-38.7179.600000112.7R382 V383 N388 E389 V390 R422 I425R382-A386 PolarHBondContact O-N 3.19Å; V383-A386 PolarHBondContact O-N 2.89Å; V383-A386 VanDerWaalsContact O-N 3.09Å; A386-N388 VanDerWaalsContact C-N 3.34Å; A386-N388 PolarHBondContact O-N 3.34Å; A386-E389 PolarHBondContact O-N 3.15Å; A386-V390 WeakPolarHBondContact O-CG2 3.18Å; A386-V390 PolarHBondContact O-N 3.08Å; A386-R422 HydrophobicContact CB-CB 3.98Å; A386-I425 HydrophobicContact CB-CD1 4.19Å
387D97.3Very high96.6Very high54 Ų5471.1 Ų71.129%0.28932%0.324SS..Hα-helixtrans-59.7-42.6173.3-79.7-27.5000112V383 V385 V390 M391 R422V383-D387 WeakPolarHBondContact CG1-OD2 3.3Å; V383-D387 WeakPolarHBondContact O-CB 3.48Å; V383-D387 PolarHBondContact O-N 3.45Å; V385-D387 VanDerWaalsContact C-N 3.34Å; V385-D387 PolarHBondContact O-N 3.04Å; D387-V390 PolarHBondContact O-N 3.24Å; D387-M391 WeakPolarHBondContact O-CB 3.37Å; D387-M391 VanDerWaalsContact O-CG 3.32Å; D387-M391 WeakPolarHBondContact O-CG 3.48Å; D387-M391 PolarHBondContact O-N 3.19Å; D387-R422 WeakPolarHBondContact OD1-CD 3.41Å; D387-R422 IonicContact OD1-CZ 3.77Å; D387-R422 IonicContact OD1-NE 2.67Å; D387-R422 PolarHBondContact OD1-NE 2.85Å; D387-R422 IonicContact OD1-NH2 3.91Å
388N97.8Very high96.6Very high96 Ų9673.1 Ų73.151%0.51333%0.334SS..Hα-helixtrans-64.5-41175.1-79.8-57.3000111.6R384 V385 A386 M391 E392R384-N388 PolarHBondContact O-N 3.38Å; R384-N388 PolarHBondContact O-ND2 3.46Å; V385-N388 WeakPolarHBondContact O-CB 3.3Å; V385-N388 PolarHBondContact O-N 3.03Å; V385-N388 VanDerWaalsContact O-N 3.13Å; A386-N388 VanDerWaalsContact C-N 3.34Å; A386-N388 PolarHBondContact O-N 3.34Å; N388-M391 PolarHBondContact O-N 3.27Å; N388-E392 PolarHBondContact O-N 3.12Å
389E97Very high96.6Very high78 Ų7868.9 Ų68.936%0.36432%0.32SS..Hα-helixtrans-64.6-39.6174.7-68.3-162.5-178.500112.9V385 A386 E392 G393 A418V385-E389 PolarHBondContact O-N 2.77Å; A386-E389 PolarHBondContact O-N 3.15Å; E389-E392 PolarHBondContact O-N 3Å; E389-G393 PolarHBondContact O-N 3.4Å; E389-A418 HydrophobicContact CB-CB 3.78Å
390V97.1Very high96.5Very high29 Ų2968.2 Ų68.218%0.17632%0.318CS..Hα-helixtrans-61-46.5173.3168.90000110.4A386 D387 E392 G393 F394 A418 L419A386-V390 WeakPolarHBondContact O-CG2 3.18Å; A386-V390 PolarHBondContact O-N 3.08Å; D387-V390 PolarHBondContact O-N 3.24Å; V390-E392 PolarHBondContact O-N 2.96Å; V390-G393 PolarHBondContact O-N 3.04Å; V390-F394 WeakPolarHBondContact O-CB 3.48Å; V390-F394 PolarHBondContact O-N 3.43Å; V390-A418 HydrophobicContact CG2-CB 3.74Å; V390-L419 HydrophobicContact CG1-CD2 3.78Å; V390-L419 HydrophobicContact CG1-CG 4.4Å; V390-L419 HydrophobicContact CG2-CD2 3.87Å; V390-L419 HydrophobicContact CG2-CG 4.07Å
391M97.4Very high96.4Very high95 Ų9571.8 Ų71.847%0.46833%0.331SS..Hα-helixtrans-64.7-37.9177.7-72.3-62.5-73.900112.4D387 N388 R395D387-M391 WeakPolarHBondContact O-CB 3.37Å; D387-M391 VanDerWaalsContact O-CG 3.32Å; D387-M391 WeakPolarHBondContact O-CG 3.48Å; D387-M391 PolarHBondContact O-N 3.19Å; N388-M391 PolarHBondContact O-N 3.27Å; M391-R395 VanDerWaalsContact O-CG 3.27Å; M391-R395 WeakPolarHBondContact O-CG 3.4Å; M391-R395 PolarHBondContact O-N 3.43Å
392E96.6Very high96.3Very high87 Ų8774.8 Ų74.841%0.40735%0.345SS..Hα-helixtrans-65.6-44.6171.4-77.5-163.7-171.100112.7N388 E389 V390 F394 R395 R396N388-E392 PolarHBondContact O-N 3.12Å; E389-E392 PolarHBondContact O-N 3Å; V390-E392 PolarHBondContact O-N 2.96Å; E392-F394 VanDerWaalsContact C-N 3.29Å; E392-F394 PolarHBondContact O-N 3.11Å; E392-R395 PolarHBondContact O-N 2.79Å; E392-R396 VanDerWaalsContact O-CG 3.28Å; E392-R396 WeakPolarHBondContact O-CG 3.45Å; E392-R396 PolarHBondContact O-N 2.78Å; E392-R396 IonicContact OE2-CZ 2.8Å; E392-R396 IonicContact OE2-NE 3.13Å; E392-R396 IonicContact OE2-NH2 3.57Å; E392-R396 PolarHBondContact OE2-NH2 3.25Å
393G95.7Very high96.3Very high3 Ų377.1 Ų77.13%0.03136%0.359CS..Hα-helixtrans-56-45.817500000111.5E389 V390 R396 I397E389-G393 PolarHBondContact O-N 3.4Å; V390-G393 PolarHBondContact O-N 3.04Å; G393-R396 PolarHBondContact O-N 2.9Å; G393-I397 WeakPolarHBondContact O-CB 3.34Å; G393-I397 WeakPolarHBondContact O-CG1 3.48Å; G393-I397 PolarHBondContact O-N 2.81Å
394F95.4Very high96.2Very high115 Ų11586.2 Ų86.250%0.50440%0.397SS..Hα-helixtrans-59.8-50.5173.4178.7-102000112.3V390 E392 R396 I397 M398V390-F394 WeakPolarHBondContact O-CB 3.48Å; V390-F394 PolarHBondContact O-N 3.43Å; E392-F394 VanDerWaalsContact C-N 3.29Å; E392-F394 PolarHBondContact O-N 3.11Å; F394-R396 VanDerWaalsContact C-N 3.33Å; F394-R396 PolarHBondContact O-N 3.08Å; F394-I397 PolarHBondContact O-N 2.76Å; F394-M398 HydrophobicContact CD1-CG 4.23Å; F394-M398 HydrophobicContact CD2-CG 4.21Å; F394-M398 HydrophobicContact CE1-CG 3.82Å; F394-M398 HydrophobicContact CE2-CG 3.79Å; F394-M398 HydrophobicContact CE2-SD 4.14Å; F394-M398 HydrophobicContact CG-CG 4.42Å; F394-M398 HydrophobicContact CZ-CG 3.59Å; F394-M398 HydrophobicContact CZ-SD 4.12Å; F394-M398 WeakPolarHBondContact O-CB 3.44Å; F394-M398 WeakPolarHBondContact O-CG 3.44Å; F394-M398 PolarHBondContact O-N 3Å
395R96.8Very high96.1Very high138 Ų13886 Ų8652%0.52140%0.396SS..Hα-helixtrans-56.9-43.3177.1-72.1174.1-156.2141.94.1112M391 E392 M398 A399M391-R395 VanDerWaalsContact O-CG 3.27Å; M391-R395 WeakPolarHBondContact O-CG 3.4Å; M391-R395 PolarHBondContact O-N 3.43Å; E392-R395 PolarHBondContact O-N 2.79Å; R395-M398 PolarHBondContact O-N 2.87Å; R395-A399 VanDerWaalsContact O-CB 3.32Å; R395-A399 WeakPolarHBondContact O-CB 3.46Å; R395-A399 PolarHBondContact O-N 3.44Å
396R95.6Very high95.9Very high86 Ų8687.7 Ų87.733%0.32541%0.407SS..Hα-helixtrans-64.6-44.1177.9-67174.8-147.5163.85.9111.8E392 G393 F394 A399 A400E392-R396 VanDerWaalsContact O-CG 3.28Å; E392-R396 WeakPolarHBondContact O-CG 3.45Å; E392-R396 PolarHBondContact O-N 2.78Å; E392-R396 IonicContact OE2-CZ 2.8Å; E392-R396 IonicContact OE2-NE 3.13Å; E392-R396 IonicContact OE2-NH2 3.57Å; E392-R396 PolarHBondContact OE2-NH2 3.25Å; G393-R396 PolarHBondContact O-N 2.9Å; F394-R396 VanDerWaalsContact C-N 3.33Å; F394-R396 PolarHBondContact O-N 3.08Å; R396-A399 PolarHBondContact O-N 2.8Å; R396-A400 PolarHBondContact O-N 3.2Å
397I95.1Very high95.7Very high32 Ų3288.2 Ų88.216%0.16441%0.41CS..Hα-helixtrans-61.3-44175.2-74.5168.1000111.1G393 F394 A400 R401 P407 A415G393-I397 WeakPolarHBondContact O-CB 3.34Å; G393-I397 WeakPolarHBondContact O-CG1 3.48Å; G393-I397 PolarHBondContact O-N 2.81Å; F394-I397 PolarHBondContact O-N 2.76Å; I397-A400 PolarHBondContact O-N 3.35Å; I397-R401 WeakPolarHBondContact O-CG 3.41Å; I397-R401 PolarHBondContact O-N 3.35Å; I397-R401 VanDerWaalsContact O-N 3.07Å; I397-P407 HydrophobicContact CB-CG 4.48Å; I397-P407 HydrophobicContact CG1-CB 4.22Å; I397-P407 HydrophobicContact CG2-CG 3.95Å; I397-A415 HydrophobicContact CD1-CB 3.72Å
398M95.4Very high95.6Very high65 Ų6588.4 Ų88.432%0.3241%0.413SS..Hα-helixtrans-68.1-40178.1-69.7-58.9-71.900112.2F394 R395 A400 R401 Q402F394-M398 HydrophobicContact CD1-CG 4.23Å; F394-M398 HydrophobicContact CD2-CG 4.21Å; F394-M398 HydrophobicContact CE1-CG 3.82Å; F394-M398 HydrophobicContact CE2-CG 3.79Å; F394-M398 HydrophobicContact CE2-SD 4.14Å; F394-M398 HydrophobicContact CG-CG 4.42Å; F394-M398 HydrophobicContact CZ-CG 3.59Å; F394-M398 HydrophobicContact CZ-SD 4.12Å; F394-M398 WeakPolarHBondContact O-CB 3.44Å; F394-M398 WeakPolarHBondContact O-CG 3.44Å; F394-M398 PolarHBondContact O-N 3Å; R395-M398 PolarHBondContact O-N 2.87Å; M398-A400 VanDerWaalsContact C-N 3.34Å; M398-A400 PolarHBondContact O-N 3.25Å; M398-R401 PolarHBondContact O-N 3.31Å; M398-Q402 WeakPolarHBondContact O-CG 3.43Å; M398-Q402 PolarHBondContact O-N 2.95Å
399A95.8Very high95.5Very high39 Ų3991.3 Ų91.332%0.32242%0.421SS..Hα-helixtrans-64-36.5174.600000112.5R395 R396 K403R395-A399 VanDerWaalsContact O-CB 3.32Å; R395-A399 WeakPolarHBondContact O-CB 3.46Å; R395-A399 PolarHBondContact O-N 3.44Å; R396-A399 PolarHBondContact O-N 2.8Å; A399-K403 WeakPolarHBondContact O-CG 3.39Å; A399-K403 PolarHBondContact O-N 2.99Å
400A95.1Very high95.4Very high4 Ų495.4 Ų95.43%0.03344%0.438CS..Hα-helixtrans-63.1-47.6171.900000111.3R396 I397 M398 Q402 K403 K404 R405 P407R396-A400 PolarHBondContact O-N 3.2Å; I397-A400 PolarHBondContact O-N 3.35Å; M398-A400 VanDerWaalsContact C-N 3.34Å; M398-A400 PolarHBondContact O-N 3.25Å; A400-Q402 PolarHBondContact O-N 2.87Å; A400-K403 CarbonylContact O-C 3.54Å; A400-K403 PolarHBondContact O-N 3.27Å; A400-K403 VanDerWaalsContact O-N 3.16Å; A400-K404 PolarHBondContact O-N 2.95Å; A400-R405 CarbonylContact C-O 3.51Å; A400-R405 PolarHBondContact O-N 2.89Å; A400-P407 HydrophobicContact CB-CB 4.47Å; A400-P407 HydrophobicContact CB-CG 4.26Å
401R93.8Very high95.2Very high158 Ų15896 Ų9660%0.59644%0.439SS*.Hα-helixtrans-60-42.8176.6-73.5174.5169.5-173.7-4.1112.8I397 M398 K403 K404 P407I397-R401 WeakPolarHBondContact O-CG 3.41Å; I397-R401 PolarHBondContact O-N 3.35Å; I397-R401 VanDerWaalsContact O-N 3.07Å; M398-R401 PolarHBondContact O-N 3.31Å; R401-K403 VanDerWaalsContact C-N 3.29Å; R401-K403 PolarHBondContact O-N 3.05Å; R401-K404 WeakPolarHBondContact O-CA 3.42Å; R401-K404 PolarHBondContact O-N 3.3Å; R401-P407 HydrophobicContact CG-CG 4.34Å
402Q95.9Very high95Very high154 Ų15496.5 Ų96.572%0.7244%0.438SS*.Hα-helixtrans-59.7-38.2175-76.7174.4-14.600112.2M398 A400 K404M398-Q402 WeakPolarHBondContact O-CG 3.43Å; M398-Q402 PolarHBondContact O-N 2.95Å; A400-Q402 PolarHBondContact O-N 2.87Å; Q402-K404 PolarHBondContact O-N 2.92Å; Q402-K404 VanDerWaalsContact O-N 3.13Å
403K96.3Very high95Very high173 Ų17396.4 Ų96.475%0.75244%0.44SS*.THydrogen-bonded Turntrans-7613.7173.1-66.2177.6-178.2-175.10113.6A399 A400 R401 R405A399-K403 WeakPolarHBondContact O-CG 3.39Å; A399-K403 PolarHBondContact O-N 2.99Å; A400-K403 CarbonylContact O-C 3.54Å; A400-K403 PolarHBondContact O-N 3.27Å; A400-K403 VanDerWaalsContact O-N 3.16Å; R401-K403 VanDerWaalsContact C-N 3.29Å; R401-K403 PolarHBondContact O-N 3.05Å; K403-R405 PolarHBondContact O-N 3.15Å
404K95Very high94.9Very high205 Ų205100.2 Ų100.289%0.89146%0.457SS*.THydrogen-bonded Turntrans52.224.5-174.1-58.7-176.8179.9-179.70113.7A400 R401 Q402A400-K404 PolarHBondContact O-N 2.95Å; R401-K404 WeakPolarHBondContact O-CA 3.42Å; R401-K404 PolarHBondContact O-N 3.3Å; Q402-K404 PolarHBondContact O-N 2.92Å; Q402-K404 VanDerWaalsContact O-N 3.13Å
405R95.1Very high94.9Very high117 Ų11795.3 Ų95.344%0.44244%0.438SS..  trans-104.2132.9-179.6-165.2-164.872.4-177-3.5109.9A400 K403 E411A400-R405 CarbonylContact C-O 3.51Å; A400-R405 PolarHBondContact O-N 2.89Å; K403-R405 PolarHBondContact O-N 3.15Å; R405-E411 IonicContact CZ-OE1 2.72Å; R405-E411 IonicContact CZ-OE2 2.73Å; R405-E411 IonicContact NH2-OE1 2.72Å; R405-E411 PolarHBondContact NH2-OE1 3.38Å; R405-E411 IonicContact NH2-OE2 3.89Å; R405-E411 PolarHBondContact NH2-OE2 2.97Å
406T92.4Very high94.8Very high109 Ų10996.7 Ų96.767%0.66944%0.444SS*.PPolyproline II helixtrans-57.7132168.1-530000109.8T408T406-T408 PolarHBondContact O-N 3.06Å
407P93.4Very high94.9Very high16 Ų1698.8 Ų98.810%0.10446%0.455CS..PPolyproline II helixtrans-57.6131.9171.8-23.132.2000110.5I397 A400 R401 K412I397-P407 HydrophobicContact CB-CG 4.48Å; I397-P407 HydrophobicContact CG1-CB 4.22Å; I397-P407 HydrophobicContact CG2-CG 3.95Å; A400-P407 HydrophobicContact CB-CB 4.47Å; A400-P407 HydrophobicContact CB-CG 4.26Å; R401-P407 HydrophobicContact CG-CG 4.34Å; P407-K412 HydrophobicContact CB-CG 4.23Å; P407-K412 WeakPolarHBondContact O-CE 3.49Å
408T94.8Very high94.9Very high57 Ų5797.4 Ų97.435%0.3545%0.448SS..PPolyproline II helixtrans-64.8158.7-178.962.20000110.9T406 K410 E411 K412T406-T408 PolarHBondContact O-N 3.06Å; T408-K410 VanDerWaalsContact C-N 3.28Å; T408-K410 PolarHBondContact O-N 2.72Å; T408-E411 WeakPolarHBondContact CB-OE2 3.42Å; T408-E411 PolarHBondContact N-OE2 3.35Å; T408-E411 PolarHBondContact O-N 3.33Å; T408-E411 WeakPolarHBondContact OG1-CB 3.16Å; T408-E411 VanDerWaalsContact OG1-CG 3.24Å; T408-E411 WeakPolarHBondContact OG1-CG 3.31Å; T408-E411 PolarHBondContact OG1-N 3.33Å; T408-E411 PolarHBondContact OG1-OE2 3.21Å; T408-K412 PolarHBondContact O-N 2.8Å; T408-K412 VanDerWaalsContact O-N 3.09Å
409K95.4Very high95Very high157 Ų15798.3 Ų98.368%0.68345%0.454SS*.Hα-helixtrans-53.6-47174.1-176179.4175.6-1760111.1E411 K412 D413K409-E411 VanDerWaalsContact C-N 3.35Å; K409-E411 PolarHBondContact O-N 2.77Å; K409-K412 PolarHBondContact O-N 2.88Å; K409-K412 VanDerWaalsContact O-N 3.13Å; K409-D413 VanDerWaalsContact CE-OD2 3.24Å; K409-D413 WeakPolarHBondContact CE-OD2 3.34Å; K409-D413 WeakPolarHBondContact CG-OD2 3.48Å; K409-D413 WeakPolarHBondContact O-CB 3.36Å; K409-D413 PolarHBondContact O-N 2.97Å
410K94.6Very high95.1Very high165 Ų165101 Ų10172%0.71746%0.458SS*.Hα-helixtrans-57.4-41.1177.9-171.6176.5-179.4178.70113.5T408 Q414T408-K410 VanDerWaalsContact C-N 3.28Å; T408-K410 PolarHBondContact O-N 2.72Å; K410-Q414 WeakPolarHBondContact O-CB 3.4Å; K410-Q414 PolarHBondContact O-N 3.43Å
411E93.8Very high95.2Very high41 Ų41104.1 Ų104.119%0.19247%0.472CS..Hα-helixtrans-67.7-39.3177-73157.9159.900112.1R405 T408 K409 A415R405-E411 IonicContact CZ-OE1 2.72Å; R405-E411 IonicContact CZ-OE2 2.73Å; R405-E411 IonicContact NH2-OE1 2.72Å; R405-E411 PolarHBondContact NH2-OE1 3.38Å; R405-E411 IonicContact NH2-OE2 3.89Å; R405-E411 PolarHBondContact NH2-OE2 2.97Å; T408-E411 WeakPolarHBondContact CB-OE2 3.42Å; T408-E411 PolarHBondContact N-OE2 3.35Å; T408-E411 PolarHBondContact O-N 3.33Å; T408-E411 WeakPolarHBondContact OG1-CB 3.16Å; T408-E411 VanDerWaalsContact OG1-CG 3.24Å; T408-E411 WeakPolarHBondContact OG1-CG 3.31Å; T408-E411 PolarHBondContact OG1-N 3.33Å; T408-E411 PolarHBondContact OG1-OE2 3.21Å; K409-E411 VanDerWaalsContact C-N 3.35Å; K409-E411 PolarHBondContact O-N 2.77Å; E411-A415 PolarHBondContact O-N 3.42Å
412K93.8Very high95.3Very high106 Ų106101 Ų10146%0.46146%0.46SS..Hα-helixtrans-67.5-48.5175.4-67.2176.4179.4178.30111.7P407 T408 K409 Q414 A415 W416P407-K412 HydrophobicContact CB-CG 4.23Å; P407-K412 WeakPolarHBondContact O-CE 3.49Å; T408-K412 PolarHBondContact O-N 2.8Å; T408-K412 VanDerWaalsContact O-N 3.09Å; K409-K412 PolarHBondContact O-N 2.88Å; K409-K412 VanDerWaalsContact O-N 3.13Å; K412-Q414 VanDerWaalsContact C-N 3.3Å; K412-Q414 PolarHBondContact O-N 3.49Å; K412-A415 PolarHBondContact O-N 3.1Å; K412-W416 WeakPolarHBondContact O-CB 3.29Å; K412-W416 PolarHBondContact O-N 3.21Å
413D95.4Very high95.4Very high85 Ų8597 Ų9746%0.45544%0.442SS..Hα-helixtrans-61-39.3-179.7-65.8-3.9000110.9K409 W416 K417K409-D413 VanDerWaalsContact CE-OD2 3.24Å; K409-D413 WeakPolarHBondContact CE-OD2 3.34Å; K409-D413 WeakPolarHBondContact CG-OD2 3.48Å; K409-D413 WeakPolarHBondContact O-CB 3.36Å; K409-D413 PolarHBondContact O-N 2.97Å; D413-W416 PolarHBondContact O-N 3.5Å; D413-K417 WeakPolarHBondContact O-CB 3.43Å; D413-K417 PolarHBondContact O-N 3.47Å
414Q94.4Very high95.4Very high83 Ų8392 Ų9239%0.38843%0.429SS..Hα-helixtrans-69.4-41.9177.1-170.9167.410.600112.7K410 K412 W416 K417 A418K410-Q414 WeakPolarHBondContact O-CB 3.4Å; K410-Q414 PolarHBondContact O-N 3.43Å; K412-Q414 VanDerWaalsContact C-N 3.3Å; K412-Q414 PolarHBondContact O-N 3.49Å; Q414-W416 VanDerWaalsContact C-N 3.33Å; Q414-K417 PolarHBondContact O-N 3.08Å; Q414-A418 PolarHBondContact O-N 3.19Å; Q414-A418 VanDerWaalsContact O-N 3.07Å
415A94.8Very high95.5Very high12 Ų1282.4 Ų82.410%0.09939%0.387CS..Hα-helixtrans-64.7-38.6174.300000111.9I397 E411 K412 A418 L419I397-A415 HydrophobicContact CD1-CB 3.72Å; E411-A415 PolarHBondContact O-N 3.42Å; K412-A415 PolarHBondContact O-N 3.1Å; A415-A418 PolarHBondContact O-N 3.11Å; A415-L419 WeakPolarHBondContact O-CG 3.3Å; A415-L419 PolarHBondContact O-N 2.81Å; A415-L419 VanDerWaalsContact O-N 3.09Å
416W96.1Very high95.5Very high167 Ų16779 Ų7963%0.63338%0.377SS*.Hα-helixtrans-66.2-41175.7-171.7-96.9000112.4K412 D413 Q414 L419 K420K412-W416 WeakPolarHBondContact O-CB 3.29Å; K412-W416 PolarHBondContact O-N 3.21Å; D413-W416 PolarHBondContact O-N 3.5Å; Q414-W416 VanDerWaalsContact C-N 3.33Å; W416-L419 PolarHBondContact O-N 3.18Å; W416-K420 PolarHBondContact O-N 3.17Å
417K96.8Very high95.6Very high130 Ų13080.1 Ų80.157%0.56537%0.373SS*.Hα-helixtrans-58.4-50.5173.2-176.7-171.8169.5-165.80110.9D413 Q414 L419 K420 E421D413-K417 WeakPolarHBondContact O-CB 3.43Å; D413-K417 PolarHBondContact O-N 3.47Å; Q414-K417 PolarHBondContact O-N 3.08Å; K417-L419 VanDerWaalsContact C-N 3.3Å; K417-L419 PolarHBondContact O-N 3.32Å; K417-K420 PolarHBondContact O-N 2.79Å; K417-K420 VanDerWaalsContact O-N 3.11Å; K417-E421 WeakPolarHBondContact O-CB 3.38Å; K417-E421 PolarHBondContact O-N 3.21Å
418A96.1Very high95.6Very high2 Ų283.6 Ų83.62%0.01739%0.39CS..Hα-helixtrans-59.7-40.4-179.500000112.1E389 V390 Q414 A415 E421 R422E389-A418 HydrophobicContact CB-CB 3.78Å; V390-A418 HydrophobicContact CG2-CB 3.74Å; Q414-A418 PolarHBondContact O-N 3.19Å; Q414-A418 VanDerWaalsContact O-N 3.07Å; A415-A418 PolarHBondContact O-N 3.11Å; A418-E421 PolarHBondContact O-N 3.03Å; A418-R422 WeakPolarHBondContact O-CB 3.23Å; A418-R422 PolarHBondContact O-N 2.91Å
419L96.9Very high95.4Very high84 Ų8483.3 Ų83.344%0.4439%0.386SS..Hα-helixtrans-62.3-42.9173.6-75.1169.6000112.7V390 A415 W416 K417 E423V390-L419 HydrophobicContact CG1-CD2 3.78Å; V390-L419 HydrophobicContact CG1-CG 4.4Å; V390-L419 HydrophobicContact CG2-CD2 3.87Å; V390-L419 HydrophobicContact CG2-CG 4.07Å; A415-L419 WeakPolarHBondContact O-CG 3.3Å; A415-L419 PolarHBondContact O-N 2.81Å; A415-L419 VanDerWaalsContact O-N 3.09Å; W416-L419 PolarHBondContact O-N 3.18Å; K417-L419 VanDerWaalsContact C-N 3.3Å; K417-L419 PolarHBondContact O-N 3.32Å; L419-E423 WeakPolarHBondContact O-CB 3.36Å; L419-E423 PolarHBondContact O-N 3.39Å
420K97.6Very high95Very high95 Ų9582.4 Ų82.441%0.41339%0.389SS..Hα-helixtrans-70.8-35.4178.7-77.2-72.7162.7-160.40113W416 K417 E423 S424W416-K420 PolarHBondContact O-N 3.17Å; K417-K420 PolarHBondContact O-N 2.79Å; K417-K420 VanDerWaalsContact O-N 3.11Å; K420-E423 IonicContact NZ-OE1 3.42Å; K420-E423 IonicContact NZ-OE2 2.92Å; K420-E423 PolarHBondContact NZ-OE2 3.02Å; K420-S424 WeakPolarHBondContact O-CB 3.16Å; K420-S424 PolarHBondContact O-N 3.45Å
421E96.6Very high93.7Very high70 Ų7079.3 Ų79.333%0.32740%0.404SS..Hα-helixtrans-66.1-46.7173.8-177.5153.9-17400110.9K417 A418 E423 S424 I425K417-E421 WeakPolarHBondContact O-CB 3.38Å; K417-E421 PolarHBondContact O-N 3.21Å; A418-E421 PolarHBondContact O-N 3.03Å; E421-E423 PolarHBondContact O-N 3.27Å; E421-S424 PolarHBondContact O-N 3.22Å; E421-I425 HydrophobicContact CG-CD1 3.87Å; E421-I425 WeakPolarHBondContact O-CD1 3.35Å; E421-I425 VanDerWaalsContact O-CG1 3.27Å; E421-I425 WeakPolarHBondContact O-CG1 3.49Å; E421-I425 PolarHBondContact O-N 3.37Å
422R97.1Very high93.7Very high92 Ų9281.3 Ų81.335%0.34742%0.415SS..Hα-helixtrans-54.1-50.8171.5-176.1-165.1-173.4-90.7-9.5112.2A386 D387 A418 S424 I425 L426A386-R422 HydrophobicContact CB-CB 3.98Å; D387-R422 WeakPolarHBondContact OD1-CD 3.41Å; D387-R422 IonicContact OD1-CZ 3.77Å; D387-R422 IonicContact OD1-NE 2.67Å; D387-R422 PolarHBondContact OD1-NE 2.85Å; D387-R422 IonicContact OD1-NH2 3.91Å; A418-R422 WeakPolarHBondContact O-CB 3.23Å; A418-R422 PolarHBondContact O-N 2.91Å; R422-S424 VanDerWaalsContact C-N 3.29Å; R422-S424 PolarHBondContact O-N 3.12Å; R422-I425 PolarHBondContact O-N 3.4Å; R422-L426 HydrophobicContact CG-CD1 4.12Å; R422-L426 WeakPolarHBondContact O-CG 3.32Å; R422-L426 PolarHBondContact O-N 3.33Å
423E96.8Very high93.6Very high72 Ų7279.9 Ų79.934%0.33641%0.412SS..Hα-helixtrans-58.9-40.5178-169.1-162.8141.600111.8L419 K420 E421 K427L419-E423 WeakPolarHBondContact O-CB 3.36Å; L419-E423 PolarHBondContact O-N 3.39Å; K420-E423 IonicContact NZ-OE1 3.42Å; K420-E423 IonicContact NZ-OE2 2.92Å; K420-E423 PolarHBondContact NZ-OE2 3.02Å; E421-E423 PolarHBondContact O-N 3.27Å; E423-K427 WeakPolarHBondContact O-CG 3.5Å; E423-K427 PolarHBondContact O-N 2.83Å; E423-K427 IonicContact OE1-NZ 2.68Å; E423-K427 PolarHBondContact OE1-NZ 3.33Å
424S97Very high93.6Very high68 Ų6879.7 Ų79.748%0.47641%0.41SS..Hα-helixtrans-68.3-34177.8-172.20000113.3K420 E421 R422 L428K420-S424 WeakPolarHBondContact O-CB 3.16Å; K420-S424 PolarHBondContact O-N 3.45Å; E421-S424 PolarHBondContact O-N 3.22Å; R422-S424 VanDerWaalsContact C-N 3.29Å; R422-S424 PolarHBondContact O-N 3.12Å; S424-L428 WeakPolarHBondContact O-CG 3.31Å
425I95.9Very high93.5Very high2 Ų279.5 Ų79.51%0.0141%0.411CS..Hα-helixtrans-77.7-38.5179.5-58.5154.8000110.4L379 R382 V383 A386 E421 R422 K427 L428 L429L379-I425 HydrophobicContact CB-CG2 4.28Å; L379-I425 HydrophobicContact CD2-CG2 4.09Å; L379-I425 WeakPolarHBondContact O-CG2 3.26Å; R382-I425 HydrophobicContact CB-CD1 3.94Å; R382-I425 HydrophobicContact CB-CG2 4.24Å; V383-I425 HydrophobicContact CG2-CB 4Å; V383-I425 HydrophobicContact CG2-CG2 3.43Å; V383-I425 VanDerWaalsContact CG2-CG2 3.43Å; A386-I425 HydrophobicContact CB-CD1 4.19Å; E421-I425 HydrophobicContact CG-CD1 3.87Å; E421-I425 WeakPolarHBondContact O-CD1 3.35Å; E421-I425 VanDerWaalsContact O-CG1 3.27Å; E421-I425 WeakPolarHBondContact O-CG1 3.49Å; E421-I425 PolarHBondContact O-N 3.37Å; R422-I425 PolarHBondContact O-N 3.4Å; I425-K427 VanDerWaalsContact C-N 3.34Å; I425-K427 PolarHBondContact O-N 3.19Å; I425-L428 WeakPolarHBondContact O-CB 3.48Å; I425-L428 PolarHBondContact O-N 2.88Å; I425-L429 PolarHBondContact O-N 3.2Å
426L95.2Very high93.4Very high46 Ų4683.7 Ų83.724%0.24143%0.431CS..Hα-helixtrans-60.4-42.9174.6-70.8170.3000111.7V383 R422 L428 L429 D430V383-L426 HydrophobicContact CG1-CD2 4.21Å; V383-L426 HydrophobicContact CG2-CD2 4.09Å; V383-L426 HydrophobicContact CG2-CG 4.43Å; R422-L426 HydrophobicContact CG-CD1 4.12Å; R422-L426 WeakPolarHBondContact O-CG 3.32Å; R422-L426 PolarHBondContact O-N 3.33Å; L426-L428 PolarHBondContact O-N 2.76Å; L426-L429 WeakPolarHBondContact O-CA 3.27Å; L426-L429 WeakPolarHBondContact O-CB 3.45Å; L426-L429 PolarHBondContact O-N 3.17Å; L426-D430 VanDerWaalsContact O-CG 3.28Å; L426-D430 PolarHBondContact O-N 3.23Å
427K95.6Very high93.2Very high133 Ų13378.1 Ų78.158%0.57842%0.417SS*.THydrogen-bonded Turntrans-59.6-18.4172.7-76.6170.9170.8172.10115.1E423 I425E423-K427 WeakPolarHBondContact O-CG 3.5Å; E423-K427 PolarHBondContact O-N 2.83Å; E423-K427 IonicContact OE1-NZ 2.68Å; E423-K427 PolarHBondContact OE1-NZ 3.33Å; I425-K427 VanDerWaalsContact C-N 3.34Å; I425-K427 PolarHBondContact O-N 3.19Å
428L93.6Very high93Very high89 Ų8974.4 Ų74.447%0.46641%0.407SS..THydrogen-bonded Turntrans-96.7-5.6174.5-65.9170.5000113.1L379 S424 I425 L426L379-L428 HydrophobicContact CD1-CB 4.17Å; L379-L428 WeakPolarHBondContact CD1-O 3.41Å; L379-L428 HydrophobicContact CD2-CB 4.34Å; L379-L428 HydrophobicContact CD2-CD1 4.46Å; S424-L428 WeakPolarHBondContact O-CG 3.31Å; I425-L428 WeakPolarHBondContact O-CB 3.48Å; I425-L428 PolarHBondContact O-N 2.88Å; L426-L428 PolarHBondContact O-N 2.76Å
429L90.8Very high92.8Very high51 Ų5180 Ų8027%0.26744%0.437SS..THydrogen-bonded Turntrans-100.5-32.3172.5-79.4166.2000111.8K376 L379 R380 V383 I425 L426 G431K376-L429 HydrophobicContact CB-CD2 4.49Å; L379-L429 HydrophobicContact CB-CD1 4.2Å; L379-L429 HydrophobicContact CB-CD2 3.63Å; L379-L429 HydrophobicContact CB-CG 3.8Å; L379-L429 HydrophobicContact CD1-CD2 4.21Å; L379-L429 HydrophobicContact CD1-CG 4.36Å; R380-L429 HydrophobicContact CG-CD1 4.26Å; R380-L429 HydrophobicContact CG-CD2 4.01Å; V383-L429 HydrophobicContact CG2-CD1 3.58Å; I425-L429 PolarHBondContact O-N 3.2Å; L426-L429 WeakPolarHBondContact O-CA 3.27Å; L426-L429 WeakPolarHBondContact O-CB 3.45Å; L426-L429 PolarHBondContact O-N 3.17Å; L429-G431 VanDerWaalsContact C-N 3.27Å; L429-G431 PolarHBondContact O-N 3.35Å
430D86.6Confident92.4Very high137 Ų13779.7 Ų79.773%0.73344%0.436SS*.  trans-80.6-3179.8-59.8-28.3000113.4L426L426-D430 VanDerWaalsContact O-CG 3.28Å; L426-D430 PolarHBondContact O-N 3.23Å
431G66.4Low91.9Very high101 Ų10178.3 Ų78.3100%1.04144%0.438SS*.  trans-137.70-178.900000113.4L429L429-G431 VanDerWaalsContact C-N 3.27Å; L429-G431 PolarHBondContact O-N 3.35Å

Retrieved 431 of 431 residues in 78.4 ms (Link to these results)