A0A087YR01_POEFO Loading...

G protein-coupled receptor 85

Orphan receptor.

AlphaFold DB , UniProt , Accession A0A087YR01, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 377 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.8Very low33.8Very low246 Ų246148.8 Ų148.8100%1.21284%0.84SS**  0103.60-86.1167.2177.300107.5
2I33.8Very low33.8Very low162 Ų162148.5 Ų148.583%0.83183%0.826SS**  trans-123.9126.6-178.8-63.4168.6000104.5
3P43Very low33.7Very low109 Ų109143.9 Ų143.971%0.70882%0.819SS**PPolyproline II helixtrans-72.2153.3-178.830.3-32.8000110.9
4P39.9Very low33.4Very low118 Ų118137.4 Ų137.477%0.76680%0.799SS**PPolyproline II helixtrans-74146.6-179.130.6-33.2000111.3
5P36.4Very low33.6Very low129 Ų129135 Ų13584%0.83878%0.782SS**PPolyproline II helixtrans-74.4139.8172.229.1-28.6000110.8
6S31.3Very low33.7Very low113 Ų113136.8 Ų136.879%0.7978%0.78SS**PPolyproline II helixtrans-56.1142-179.840.80000113.9A8S6-A8 PolarHBondContact O-N 3.38Å
7M31Very low33.8Very low190 Ų190135.9 Ų135.994%0.93678%0.778SS**  trans-59.9105.1166.2-72.9-167.6-84.100109.8N9M7-N9 PolarHBondContact O-N 2.95Å
8A30.8Very low34.1Very low85 Ų85136.2 Ų136.270%0.70278%0.775SS**  trans-74.4114.6165.900000108.8S6 Y10S6-A8 PolarHBondContact O-N 3.38Å; A8-Y10 PolarHBondContact O-N 3.14Å
9N28.1Very low34.5Very low160 Ų160136.8 Ų136.886%0.85678%0.775SS**  trans-49.6103.1167-88.9-25.8000110.5M7 S11M7-N9 PolarHBondContact O-N 2.95Å; N9-S11 PolarHBondContact O-N 3.38Å
10Y27.1Very low34.9Very low219 Ų219138.3 Ų138.386%0.85978%0.775SS**  trans-78.299.1155.1-98.6-91.8000107.4A8 H12A8-Y10 PolarHBondContact O-N 3.14Å; Y10-H12 PolarHBondContact O-N 3.25Å
11S29.8Very low35.3Very low106 Ų106139.5 Ų139.574%0.74178%0.78SS**  trans-55.598.117030.80000110.8N9 A13N9-S11 PolarHBondContact O-N 3.38Å; S11-A13 PolarHBondContact O-N 3Å
12H33.8Very low36.1Very low145 Ų145132.5 Ų132.567%0.67175%0.751SS**  trans-66.971.7159.1-99.2-83.3000109.3Y10 D15Y10-H12 PolarHBondContact O-N 3.25Å; H12-D15 IonicContact CE1-OD2 3.11Å; H12-D15 PolarHBondContact CE1-OD2 2.82Å; H12-D15 IonicContact ND1-OD2 3.02Å; H12-D15 PolarHBondContact ND1-OD2 3.02Å
13A32.4Very low37.9Very low89 Ų89127.7 Ų127.774%0.73673%0.732SS**  trans-103.72.2171.800000112.5S11S11-A13 PolarHBondContact O-N 3Å
14G29.4Very low39.8Very low52 Ų52127.9 Ų127.954%0.53673%0.733SS.*SBendtrans-106.6-13.6-174.700000116.8
15D35.7Very low42Very low102 Ų102127.6 Ų127.655%0.54572%0.724SS.*SBendtrans-98-9.3-172.5-80.5-32.8000114.7H12 T17H12-D15 IonicContact CE1-OD2 3.11Å; H12-D15 PolarHBondContact CE1-OD2 2.82Å; H12-D15 IonicContact ND1-OD2 3.02Å; H12-D15 PolarHBondContact ND1-OD2 3.02Å; D15-T17 VanDerWaalsContact C-N 3.31Å; D15-T17 PolarHBondContact O-N 3.32Å
16H35.2Very low44.3Very low163 Ų163123.1 Ų123.176%0.75570%0.698SS**THydrogen-bonded Turntrans-78.5-10.9-178.9-84.2-67.3000114.4
17T35.1Very low47Very low122 Ų122119.7 Ų119.775%0.74867%0.673SS**THydrogen-bonded Turntrans-102.3-5.9-175.442.50000114.9D15D15-T17 VanDerWaalsContact C-N 3.31Å; D15-T17 PolarHBondContact O-N 3.32Å
18I39.8Very low49.9Very low141 Ų141116.7 Ų116.772%0.72366%0.655SS**SBendtrans-99.8-12.1178.1-60.2-169.7000112.7
19L42.6Very low52.8Low149 Ų149117.2 Ų117.278%0.7865%0.645SS**SBendtrans-98.727.2-176.5-151.287.7000115
20Q41.4Very low55.8Low166 Ų166111.4 Ų111.478%0.77661%0.612SS**SBendtrans-132.52.5179-88.4-171.8-19.700116.7
21N44.3Very low59Low163 Ų163102.7 Ų102.787%0.87258%0.58SS**  trans-10352.5173.5-79.1-12.8000112.4S23N21-S23 PolarHBondContact O-N 3.44Å
22V57.3Low62.1Low100 Ų100100.7 Ų100.761%0.60656%0.564SS**  trans-72.9108.5151.4-178.60000105.1T27V22-T27 WeakPolarHBondContact CG1-OG1 3.41Å
23S71.7Confident65Low60 Ų6096 Ų9642%0.4255%0.547SS..  trans-56.3130.7-177.860.50000108.9N21 L25 A26 T27N21-S23 PolarHBondContact O-N 3.44Å; S23-L25 PolarHBondContact O-N 3.31Å; S23-A26 WeakPolarHBondContact O-CB 3.19Å; S23-A26 PolarHBondContact O-N 3.48Å; S23-A26 VanDerWaalsContact OG-CB 3.32Å; S23-A26 WeakPolarHBondContact OG-CB 3.11Å; S23-A26 PolarHBondContact OG-N 3.46Å; S23-T27 PolarHBondContact O-N 3.22Å
24P81.7Confident67.9Low114 Ų11491.7 Ų91.774%0.7451%0.512SS*.Hα-helixtrans-55.5-28.1-179.920.7-32.5000111.5F28P24-F28 WeakPolarHBondContact O-CB 3.47Å; P24-F28 PolarHBondContact O-N 3.48Å
25L86.1Confident71.1Confident111 Ų11190.8 Ų90.858%0.58150%0.503SS*.Hα-helixtrans-60-45.8170.4-176.862000113.2S23 F28 L29S23-L25 PolarHBondContact O-N 3.31Å; L25-F28 PolarHBondContact O-N 3.04Å; L25-L29 HydrophobicContact CD1-CD1 4.38Å; L25-L29 HydrophobicContact CD1-CG 4.37Å; L25-L29 HydrophobicContact CG-CD1 4.13Å; L25-L29 WeakPolarHBondContact O-CB 3.45Å; L25-L29 VanDerWaalsContact O-CG 3.25Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 3.42Å
26A85.3Confident74Confident35 Ų3592.5 Ų92.529%0.28951%0.505SS..Hα-helixtrans-64.5-42179.600000111.9S23 L29 K30S23-A26 WeakPolarHBondContact O-CB 3.19Å; S23-A26 PolarHBondContact O-N 3.48Å; S23-A26 VanDerWaalsContact OG-CB 3.32Å; S23-A26 WeakPolarHBondContact OG-CB 3.11Å; S23-A26 PolarHBondContact OG-N 3.46Å; A26-L29 PolarHBondContact O-N 3.37Å; A26-K30 WeakPolarHBondContact O-CG 3.39Å; A26-K30 PolarHBondContact O-N 2.92Å
27T88Confident76.9Confident41 Ų4185.7 Ų85.725%0.25247%0.474SS..Hα-helixtrans-63.6-43.9175.3-54.10000111.2V22 S23 L29 K30 L31 V88V22-T27 WeakPolarHBondContact CG1-OG1 3.41Å; S23-T27 PolarHBondContact O-N 3.22Å; T27-L29 PolarHBondContact O-N 3.39Å; T27-K30 PolarHBondContact O-N 3.02Å; T27-L31 HydrophobicContact CG2-CD1 4.21Å; T27-L31 WeakPolarHBondContact O-CG 3.19Å; T27-L31 PolarHBondContact O-N 2.86Å; T27-V88 HydrophobicContact CG2-CG1 4.12Å
28F91.3Very high79.8Confident127 Ų12781.4 Ų81.456%0.55745%0.446SS*.Hα-helixtrans-59.5-44.3174.9177.7-98.8000112.2P24 L25 L31 T32P24-F28 WeakPolarHBondContact O-CB 3.47Å; P24-F28 PolarHBondContact O-N 3.48Å; L25-F28 PolarHBondContact O-N 3.04Å; F28-L31 PolarHBondContact O-N 2.9Å; F28-T32 HydrophobicContact CD1-CG2 4.31Å; F28-T32 HydrophobicContact CD2-CG2 4.24Å; F28-T32 HydrophobicContact CE1-CG2 3.9Å; F28-T32 HydrophobicContact CE2-CG2 3.83Å; F28-T32 HydrophobicContact CG-CG2 4.47Å; F28-T32 HydrophobicContact CZ-CG2 3.65Å; F28-T32 WeakPolarHBondContact O-CB 3.33Å; F28-T32 WeakPolarHBondContact O-CG2 3.48Å; F28-T32 PolarHBondContact O-N 3.05Å; F28-T32 PolarHBondContact O-OG1 3.22Å
29L91.9Very high82.5Confident97 Ų9776.3 Ų76.351%0.50843%0.428SS..Hα-helixtrans-63.5-41.7176.3-71.4172.7000112.2L25 A26 T27 T32 S33L25-L29 HydrophobicContact CD1-CD1 4.38Å; L25-L29 HydrophobicContact CD1-CG 4.37Å; L25-L29 HydrophobicContact CG-CD1 4.13Å; L25-L29 WeakPolarHBondContact O-CB 3.45Å; L25-L29 VanDerWaalsContact O-CG 3.25Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 3.42Å; A26-L29 PolarHBondContact O-N 3.37Å; T27-L29 PolarHBondContact O-N 3.39Å; L29-T32 WeakPolarHBondContact CA-OG1 3.42Å; L29-T32 PolarHBondContact O-OG1 2.84Å; L29-T32 VanDerWaalsContact O-OG1 3.12Å; L29-S33 VanDerWaalsContact O-CB 3.27Å; L29-S33 WeakPolarHBondContact O-CB 3.46Å; L29-S33 PolarHBondContact O-N 3.41Å; L29-S33 PolarHBondContact O-OG 3.17Å
30K91.5Very high85Confident38 Ų3870.4 Ų70.417%0.16540%0.399CS..Hα-helixtrans-61.1-47.5174.8-74.7-175.9176.7-168.30111.6A26 T27 S33 L34 V88 D177 W333A26-K30 WeakPolarHBondContact O-CG 3.39Å; A26-K30 PolarHBondContact O-N 2.92Å; T27-K30 PolarHBondContact O-N 3.02Å; K30-S33 PolarHBondContact O-OG 3.04Å; K30-S33 VanDerWaalsContact O-OG 3.1Å; K30-L34 WeakPolarHBondContact O-CB 3.36Å; K30-L34 PolarHBondContact O-N 2.99Å; K30-V88 HydrophobicContact CB-CG1 3.83Å; K30-V88 HydrophobicContact CD-CG1 4.19Å; K30-D177 IonicContact NZ-OD2 2.69Å; K30-D177 PolarHBondContact NZ-OD2 3.2Å; K30-W333 HydrophobicContact CB-CZ2 3.83Å; K30-W333 HydrophobicContact CD-CZ2 4.25Å; K30-W333 HydrophobicContact CG-CZ2 3.83Å
31L93.9Very high87.5Confident36 Ų3662.5 Ų62.519%0.18836%0.362CS..Hα-helixtrans-66-44.2-178.9-70173.8000112.4T27 F28 G35 F85 V88 K89T27-L31 HydrophobicContact CG2-CD1 4.21Å; T27-L31 WeakPolarHBondContact O-CG 3.19Å; T27-L31 PolarHBondContact O-N 2.86Å; F28-L31 PolarHBondContact O-N 2.9Å; L31-G35 PolarHBondContact O-N 3.15Å; L31-F85 HydrophobicContact CB-CE2 4.21Å; L31-F85 HydrophobicContact CD2-CD1 4.38Å; L31-F85 HydrophobicContact CD2-CD2 3.99Å; L31-F85 HydrophobicContact CD2-CE1 4.22Å; L31-F85 HydrophobicContact CD2-CE2 3.81Å; L31-F85 HydrophobicContact CD2-CG 4.26Å; L31-F85 HydrophobicContact CD2-CZ 3.93Å; L31-V88 HydrophobicContact CD2-CB 3.93Å; L31-V88 HydrophobicContact CD2-CG1 3.7Å; L31-V88 HydrophobicContact CG-CG1 3.86Å; L31-K89 HydrophobicContact CD2-CB 4.27Å
32T94.8Very high90Very high64 Ų6456.3 Ų56.339%0.39333%0.329SS..Hα-helixtrans-66.8-45179.549.30000111.9F28 L29 G35 F36F28-T32 HydrophobicContact CD1-CG2 4.31Å; F28-T32 HydrophobicContact CD2-CG2 4.24Å; F28-T32 HydrophobicContact CE1-CG2 3.9Å; F28-T32 HydrophobicContact CE2-CG2 3.83Å; F28-T32 HydrophobicContact CG-CG2 4.47Å; F28-T32 HydrophobicContact CZ-CG2 3.65Å; F28-T32 WeakPolarHBondContact O-CB 3.33Å; F28-T32 WeakPolarHBondContact O-CG2 3.48Å; F28-T32 PolarHBondContact O-N 3.05Å; F28-T32 PolarHBondContact O-OG1 3.22Å; L29-T32 WeakPolarHBondContact CA-OG1 3.42Å; L29-T32 PolarHBondContact O-OG1 2.84Å; L29-T32 VanDerWaalsContact O-OG1 3.12Å; T32-G35 PolarHBondContact O-N 3.43Å; T32-F36 WeakPolarHBondContact O-CB 3.45Å; T32-F36 PolarHBondContact O-N 3.02Å
33S94.8Very high91.8Very high45 Ų4556.3 Ų56.332%0.31533%0.329SS..Hα-helixtrans-65.7-43.2176.558.80000112.5L29 K30 F36 I37L29-S33 VanDerWaalsContact O-CB 3.27Å; L29-S33 WeakPolarHBondContact O-CB 3.46Å; L29-S33 PolarHBondContact O-N 3.41Å; L29-S33 PolarHBondContact O-OG 3.17Å; K30-S33 PolarHBondContact O-OG 3.04Å; K30-S33 VanDerWaalsContact O-OG 3.1Å; S33-F36 WeakPolarHBondContact O-CB 3.44Å; S33-F36 PolarHBondContact O-N 3.18Å; S33-I37 VanDerWaalsContact O-CG1 3.29Å; S33-I37 WeakPolarHBondContact O-CG1 3.48Å; S33-I37 PolarHBondContact O-N 3.3Å
34L95.1Very high92.9Very high0 Ų054 Ų540%032%0.315CS..Hα-helixtrans-63.7-43.7175.5-17659.3000112K30 F36 I37 I38 F81 V84 F85 W333 F336K30-L34 WeakPolarHBondContact O-CB 3.36Å; K30-L34 PolarHBondContact O-N 2.99Å; L34-F36 VanDerWaalsContact C-N 3.27Å; L34-F36 PolarHBondContact O-N 3.36Å; L34-I37 PolarHBondContact O-N 3.44Å; L34-I37 VanDerWaalsContact O-N 3.16Å; L34-I38 HydrophobicContact CD1-CD1 4.29Å; L34-I38 HydrophobicContact CD1-CG1 4.34Å; L34-I38 HydrophobicContact CG-CD1 3.97Å; L34-I38 HydrophobicContact CG-CG1 4.45Å; L34-I38 VanDerWaalsContact O-CG1 3.29Å; L34-I38 WeakPolarHBondContact O-CG1 3.11Å; L34-I38 PolarHBondContact O-N 2.97Å; L34-F81 HydrophobicContact CD1-CB 4.13Å; L34-F81 HydrophobicContact CD1-CG 4.26Å; L34-V84 HydrophobicContact CD2-CB 4.12Å; L34-V84 HydrophobicContact CD2-CG1 3.95Å; L34-F85 HydrophobicContact CB-CD2 4.45Å; L34-F85 HydrophobicContact CD2-CB 3.56Å; L34-F85 HydrophobicContact CD2-CD2 3.96Å; L34-F85 HydrophobicContact CD2-CG 4.24Å; L34-F85 HydrophobicContact CG-CB 4.44Å; L34-F85 HydrophobicContact CG-CD2 4.26Å; L34-W333 HydrophobicContact CB-CH2 3.55Å; L34-W333 HydrophobicContact CB-CZ3 3.54Å; L34-W333 HydrophobicContact CD1-CH2 3.95Å; L34-W333 HydrophobicContact CD1-CZ3 3.53Å; L34-W333 HydrophobicContact CD2-CH2 3.95Å; L34-W333 HydrophobicContact CD2-CZ3 4.37Å; L34-W333 HydrophobicContact CG-CH2 3.99Å; L34-W333 HydrophobicContact CG-CZ3 3.94Å; L34-F336 HydrophobicContact CD1-CD2 4.4Å
35G96.1Very high93.5Very high33 Ų3348.6 Ų48.634%0.3428%0.28SS..Hα-helixtrans-58.7-41.4175.700000111.8L31 T32 I38 G39L31-G35 PolarHBondContact O-N 3.15Å; T32-G35 PolarHBondContact O-N 3.43Å; G35-I38 PolarHBondContact O-N 3.2Å; G35-G39 PolarHBondContact O-N 3.49Å
36F95.8Very high93.9Very high138 Ų13847 Ų4761%0.60527%0.272SS*.Hα-helixtrans-63.6-45.5173.3-179.5-101.7000112.3T32 S33 L34 I38 G39 V40T32-F36 WeakPolarHBondContact O-CB 3.45Å; T32-F36 PolarHBondContact O-N 3.02Å; S33-F36 WeakPolarHBondContact O-CB 3.44Å; S33-F36 PolarHBondContact O-N 3.18Å; L34-F36 VanDerWaalsContact C-N 3.27Å; L34-F36 PolarHBondContact O-N 3.36Å; F36-I38 VanDerWaalsContact C-N 3.35Å; F36-I38 PolarHBondContact O-N 2.88Å; F36-G39 PolarHBondContact O-N 3.38Å; F36-V40 HydrophobicContact CD1-CG2 4.27Å; F36-V40 HydrophobicContact CD2-CG2 4.28Å; F36-V40 HydrophobicContact CE1-CG2 3.85Å; F36-V40 HydrophobicContact CE2-CG2 3.85Å; F36-V40 HydrophobicContact CG-CG2 4.48Å; F36-V40 HydrophobicContact CZ-CG2 3.62Å; F36-V40 WeakPolarHBondContact O-CG2 3.35Å; F36-V40 PolarHBondContact O-N 3.49Å
37I95.9Very high94.3Very high19 Ų1947.7 Ų47.710%0.09727%0.27CS..Hα-helixtrans-59.5-44.8176.8-69.7165.4000111S33 L34 G41 F81 W333 F336 A337S33-I37 VanDerWaalsContact O-CG1 3.29Å; S33-I37 WeakPolarHBondContact O-CG1 3.48Å; S33-I37 PolarHBondContact O-N 3.3Å; L34-I37 PolarHBondContact O-N 3.44Å; L34-I37 VanDerWaalsContact O-N 3.16Å; I37-G41 WeakPolarHBondContact O-CA 3.34Å; I37-G41 PolarHBondContact O-N 3.11Å; I37-F81 HydrophobicContact CG2-CD2 4.1Å; I37-F81 HydrophobicContact CG2-CE2 3.64Å; I37-F81 HydrophobicContact CG2-CZ 4.4Å; I37-W333 HydrophobicContact CD1-CE3 4.01Å; I37-W333 HydrophobicContact CD1-CZ3 4.36Å; I37-F336 HydrophobicContact CD1-CB 4.27Å; I37-F336 HydrophobicContact CG2-CB 4.43Å; I37-F336 WeakPolarHBondContact CG2-O 3.44Å; I37-A337 HydrophobicContact CD1-CB 4.35Å
38I96.7Very high94.5Very high33 Ų3345.8 Ų45.817%0.16926%0.259CS..Hα-helixtrans-60.6-48.5176.3-68.3166.7000110.2L34 G35 F36 V40 G41 V42 F81 F85L34-I38 HydrophobicContact CD1-CD1 4.29Å; L34-I38 HydrophobicContact CD1-CG1 4.34Å; L34-I38 HydrophobicContact CG-CD1 3.97Å; L34-I38 HydrophobicContact CG-CG1 4.45Å; L34-I38 VanDerWaalsContact O-CG1 3.29Å; L34-I38 WeakPolarHBondContact O-CG1 3.11Å; L34-I38 PolarHBondContact O-N 2.97Å; G35-I38 PolarHBondContact O-N 3.2Å; F36-I38 VanDerWaalsContact C-N 3.35Å; F36-I38 PolarHBondContact O-N 2.88Å; I38-V40 PolarHBondContact O-N 3.17Å; I38-G41 PolarHBondContact O-N 3.37Å; I38-V42 HydrophobicContact CG2-CG2 4.33Å; I38-V42 WeakPolarHBondContact O-CB 3.28Å; I38-V42 WeakPolarHBondContact O-CG2 3.27Å; I38-V42 PolarHBondContact O-N 3.19Å; I38-F81 HydrophobicContact CD1-CB 3.84Å; I38-F81 HydrophobicContact CG1-CB 3.53Å; I38-F81 HydrophobicContact CG1-CD2 3.99Å; I38-F81 HydrophobicContact CG1-CG 4.27Å; I38-F85 HydrophobicContact CD1-CB 4.42Å
39G95.8Very high94.6Very high33 Ų3340.6 Ų40.634%0.3424%0.238SC..Hα-helixtrans-58.5-50.6-18000000112.3G35 F36 V43G35-G39 PolarHBondContact O-N 3.49Å; F36-G39 PolarHBondContact O-N 3.38Å; G39-V43 VanDerWaalsContact O-CB 3.22Å; G39-V43 WeakPolarHBondContact O-CB 3.32Å; G39-V43 WeakPolarHBondContact O-CG2 3.34Å; G39-V43 PolarHBondContact O-N 3.12Å
40V94.9Very high94.6Very high26 Ų2640.2 Ų40.216%0.15824%0.236CC..Iπ-helixtrans-65.8-42.9177.7176.20000111.3F36 I38 G44 F344F36-V40 HydrophobicContact CD1-CG2 4.27Å; F36-V40 HydrophobicContact CD2-CG2 4.28Å; F36-V40 HydrophobicContact CE1-CG2 3.85Å; F36-V40 HydrophobicContact CE2-CG2 3.85Å; F36-V40 HydrophobicContact CG-CG2 4.48Å; F36-V40 HydrophobicContact CZ-CG2 3.62Å; F36-V40 WeakPolarHBondContact O-CG2 3.35Å; F36-V40 PolarHBondContact O-N 3.49Å; I38-V40 PolarHBondContact O-N 3.17Å; V40-G44 VanDerWaalsContact O-CA 3.22Å; V40-G44 WeakPolarHBondContact O-CA 3.46Å; V40-G44 PolarHBondContact O-N 3.25Å; V40-F344 HydrophobicContact CG1-CE2 3.62Å; V40-F344 HydrophobicContact CG1-CZ 3.88Å
41G95.6Very high94.5Very high0 Ų038.6 Ų38.60%023%0.229CC..Iπ-helixtrans-63-41.8-179.600000112.7I37 I38 N45I37-G41 WeakPolarHBondContact O-CA 3.34Å; I37-G41 PolarHBondContact O-N 3.11Å; I38-G41 PolarHBondContact O-N 3.37Å; G41-N45 VanDerWaalsContact O-CB 3.27Å; G41-N45 WeakPolarHBondContact O-CB 3.3Å; G41-N45 PolarHBondContact O-ND2 2.87Å
42V96.5Very high94.3Very high32 Ų3237.2 Ų37.219%0.19422%0.221CC..Iπ-helixtrans-79.9-58.8178.5176.60000110.9I38 G44 L46 A78I38-V42 HydrophobicContact CG2-CG2 4.33Å; I38-V42 WeakPolarHBondContact O-CB 3.28Å; I38-V42 WeakPolarHBondContact O-CG2 3.27Å; I38-V42 PolarHBondContact O-N 3.19Å; V42-G44 PolarHBondContact O-N 3.46Å; V42-L46 HydrophobicContact CG1-CD1 3.66Å; V42-L46 HydrophobicContact CG1-CG 4.48Å; V42-L46 VanDerWaalsContact O-CB 3.25Å; V42-L46 WeakPolarHBondContact O-CB 3.42Å; V42-L46 WeakPolarHBondContact O-CD1 3.33Å; V42-L46 WeakPolarHBondContact O-CG 3.49Å; V42-L46 PolarHBondContact O-N 3.06Å; V42-A78 HydrophobicContact CG2-CB 4.02Å
43V95.3Very high94.1Very high100 Ų10038.4 Ų38.461%0.60623%0.228SC*.Iπ-helixtrans-66.7-43.4-172.9179.70000111.1G39 L47G39-V43 VanDerWaalsContact O-CB 3.22Å; G39-V43 WeakPolarHBondContact O-CB 3.32Å; G39-V43 WeakPolarHBondContact O-CG2 3.34Å; G39-V43 PolarHBondContact O-N 3.12Å; V43-L47 VanDerWaalsContact O-CB 3.25Å; V43-L47 WeakPolarHBondContact O-CB 3.31Å; V43-L47 PolarHBondContact O-N 2.97Å
44G93.6Very high93.8Very high12 Ų1243.7 Ų43.712%0.12425%0.246CC..Iπ-helixtrans-65.3-48.1-178.600000112.2V40 V42 L47 I48V40-G44 VanDerWaalsContact O-CA 3.22Å; V40-G44 WeakPolarHBondContact O-CA 3.46Å; V40-G44 PolarHBondContact O-N 3.25Å; V42-G44 PolarHBondContact O-N 3.46Å; G44-L47 PolarHBondContact O-N 3.41Å; G44-I48 WeakPolarHBondContact O-CG1 3.49Å; G44-I48 PolarHBondContact O-N 3.23Å; G44-I48 VanDerWaalsContact O-N 3.11Å
45N95.4Very high93.3Very high0 Ų045.7 Ų45.70%026%0.257CS..Hα-helixtrans-70.2-36.4179.2-71.6-64.7000111.9G41 L47 I48 S49 C70 I74 A339G41-N45 VanDerWaalsContact O-CB 3.27Å; G41-N45 WeakPolarHBondContact O-CB 3.3Å; G41-N45 PolarHBondContact O-ND2 2.87Å; N45-L47 VanDerWaalsContact C-N 3.34Å; N45-L47 PolarHBondContact O-N 3.44Å; N45-I48 PolarHBondContact O-N 2.83Å; N45-S49 WeakPolarHBondContact O-CB 3.4Å; N45-S49 PolarHBondContact O-N 2.98Å; N45-S49 PolarHBondContact O-OG 3.38Å; N45-C70 HydrophobicContact CB-CB 4.02Å; N45-C70 PolarHBondContact OD1-SG 3.41Å; N45-I74 HydrophobicContact CB-CD1 3.97Å; N45-I74 HydrophobicContact CB-CG1 3.6Å; N45-A339 PolarHBondContact ND2-O 3.15Å
46L95Very high92.7Very high77 Ų7752.5 Ų52.540%0.40328%0.277SS..Hα-helixtrans-60.4-44.5173.6-79.2170.9000111.8V42 I48 S49 I50 I74V42-L46 HydrophobicContact CG1-CD1 3.66Å; V42-L46 HydrophobicContact CG1-CG 4.48Å; V42-L46 VanDerWaalsContact O-CB 3.25Å; V42-L46 WeakPolarHBondContact O-CB 3.42Å; V42-L46 WeakPolarHBondContact O-CD1 3.33Å; V42-L46 WeakPolarHBondContact O-CG 3.49Å; V42-L46 PolarHBondContact O-N 3.06Å; L46-I48 PolarHBondContact O-N 3.03Å; L46-S49 PolarHBondContact O-N 3.5Å; L46-I50 VanDerWaalsContact O-CG1 3.27Å; L46-I50 WeakPolarHBondContact O-CG1 3.29Å; L46-I50 PolarHBondContact O-N 3.06Å; L46-I74 HydrophobicContact CB-CD1 4.5Å; L46-I74 HydrophobicContact CD2-CD1 3.72Å; L46-I74 HydrophobicContact CG-CD1 3.83Å; L46-I74 HydrophobicContact CG-CG1 4.28Å
47L92.3Very high91.9Very high50 Ų5049.4 Ų49.426%0.26227%0.272SS..Hα-helixtrans-59.1-46.917717266.3000111.6V43 G44 N45 I50 L51 F357V43-L47 VanDerWaalsContact O-CB 3.25Å; V43-L47 WeakPolarHBondContact O-CB 3.31Å; V43-L47 PolarHBondContact O-N 2.97Å; G44-L47 PolarHBondContact O-N 3.41Å; N45-L47 VanDerWaalsContact C-N 3.34Å; N45-L47 PolarHBondContact O-N 3.44Å; L47-I50 PolarHBondContact O-N 2.93Å; L47-L51 HydrophobicContact CD1-CD1 4.44Å; L47-L51 HydrophobicContact CG-CD1 4.38Å; L47-L51 VanDerWaalsContact O-CG 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.32Å; L47-L51 PolarHBondContact O-N 2.86Å; L47-F357 HydrophobicContact CD1-CD2 3.99Å; L47-F357 HydrophobicContact CD1-CE2 3.83Å; L47-F357 HydrophobicContact CD2-CD2 3.85Å; L47-F357 HydrophobicContact CD2-CE2 3.26Å; L47-F357 HydrophobicContact CD2-CZ 4.05Å; L47-F357 HydrophobicContact CG-CD2 4.21Å; L47-F357 HydrophobicContact CG-CE2 4Å
48I92.1Very high91.2Very high1 Ų148.6 Ų48.61%0.00527%0.268CS..Hα-helixtrans-61-47.3175.8-65-59.4000110.5G44 N45 L46 I50 L51 L52 L66 P343 C346 I347G44-I48 WeakPolarHBondContact O-CG1 3.49Å; G44-I48 PolarHBondContact O-N 3.23Å; G44-I48 VanDerWaalsContact O-N 3.11Å; N45-I48 PolarHBondContact O-N 2.83Å; L46-I48 PolarHBondContact O-N 3.03Å; I48-I50 VanDerWaalsContact C-N 3.32Å; I48-I50 PolarHBondContact O-N 3.36Å; I48-L51 PolarHBondContact O-N 2.95Å; I48-L51 VanDerWaalsContact O-N 3.13Å; I48-L52 HydrophobicContact CG2-CD1 3.84Å; I48-L52 HydrophobicContact CG2-CG 4.15Å; I48-L52 VanDerWaalsContact O-CG 3.3Å; I48-L52 WeakPolarHBondContact O-CG 3.29Å; I48-L52 PolarHBondContact O-N 2.96Å; I48-L66 HydrophobicContact CG2-CD2 4.39Å; I48-P343 HydrophobicContact CG1-CB 4Å; I48-P343 HydrophobicContact CG1-CG 4.34Å; I48-C346 HydrophobicContact CD1-CB 3.83Å; I48-C346 HydrophobicContact CG1-CB 4.47Å; I48-I347 HydrophobicContact CD1-CG1 4.47Å
49S93.7Very high90.7Very high18 Ų1851 Ų5113%0.12628%0.278CS..Hα-helixtrans-56.4-44.6177.7-640000112.4N45 L46 L51 L52 V53 C70N45-S49 WeakPolarHBondContact O-CB 3.4Å; N45-S49 PolarHBondContact O-N 2.98Å; N45-S49 PolarHBondContact O-OG 3.38Å; L46-S49 PolarHBondContact O-N 3.5Å; S49-L51 PolarHBondContact O-N 3.29Å; S49-L52 PolarHBondContact O-N 3.47Å; S49-V53 WeakPolarHBondContact O-CG2 3.4Å; S49-V53 PolarHBondContact O-N 3.15Å; S49-C70 WeakPolarHBondContact OG-CB 3.38Å
50I91.2Very high90.3Very high89 Ų8953.5 Ų53.546%0.45628%0.278SS..Hα-helixtrans-62.2-43177.2-69.4164.3000111.3L46 L47 I48 V53 K54L46-I50 VanDerWaalsContact O-CG1 3.27Å; L46-I50 WeakPolarHBondContact O-CG1 3.29Å; L46-I50 PolarHBondContact O-N 3.06Å; L47-I50 PolarHBondContact O-N 2.93Å; I48-I50 VanDerWaalsContact C-N 3.32Å; I48-I50 PolarHBondContact O-N 3.36Å; I50-V53 PolarHBondContact O-N 2.99Å; I50-K54 HydrophobicContact CG2-CD 4.19Å; I50-K54 HydrophobicContact CG2-CG 4.46Å; I50-K54 WeakPolarHBondContact O-CB 3.32Å; I50-K54 PolarHBondContact O-N 3.41Å
51L89.3Confident90Very high5 Ų552.7 Ų52.73%0.02627%0.274CS..Hα-helixtrans-63.5-43178.3-69.9171.4000111.8L47 I48 S49 D55 C356 F357 T360L47-L51 HydrophobicContact CD1-CD1 4.44Å; L47-L51 HydrophobicContact CG-CD1 4.38Å; L47-L51 VanDerWaalsContact O-CG 3.3Å; L47-L51 WeakPolarHBondContact O-CG 3.32Å; L47-L51 PolarHBondContact O-N 2.86Å; I48-L51 PolarHBondContact O-N 2.95Å; I48-L51 VanDerWaalsContact O-N 3.13Å; S49-L51 PolarHBondContact O-N 3.29Å; L51-D55 PolarHBondContact O-N 3.42Å; L51-D55 VanDerWaalsContact O-N 3.15Å; L51-C356 HydrophobicContact CD2-CB 4.39Å; L51-F357 HydrophobicContact CD1-CB 3.96Å; L51-F357 HydrophobicContact CD1-CD2 4.07Å; L51-F357 HydrophobicContact CD1-CG 4.48Å; L51-T360 HydrophobicContact CD2-CG2 4.4Å; L51-T360 WeakPolarHBondContact CD2-OG1 3.27Å
52L90.7Very high89.7Confident6 Ų652.7 Ų52.73%0.03127%0.274CS..Hα-helixtrans-65.9-36.8-179.9-67.6178.4000112.5I48 S49 L58 H59 Y63 L66 L67 L353I48-L52 HydrophobicContact CG2-CD1 3.84Å; I48-L52 HydrophobicContact CG2-CG 4.15Å; I48-L52 VanDerWaalsContact O-CG 3.3Å; I48-L52 WeakPolarHBondContact O-CG 3.29Å; I48-L52 PolarHBondContact O-N 2.96Å; S49-L52 PolarHBondContact O-N 3.47Å; L52-L58 HydrophobicContact CD2-CB 4.39Å; L52-L58 HydrophobicContact CD2-CD1 4.14Å; L52-H59 PolarHBondContact O-CD2 3Å; L52-H59 PolarHBondContact O-NE2 3.28Å; L52-Y63 HydrophobicContact CD2-CD1 3.75Å; L52-Y63 HydrophobicContact CD2-CG 4.17Å; L52-L66 HydrophobicContact CD1-CB 4.23Å; L52-L66 HydrophobicContact CD1-CD2 3.89Å; L52-L66 HydrophobicContact CD1-CG 3.93Å; L52-L66 HydrophobicContact CD2-CD2 4.45Å; L52-L67 HydrophobicContact CB-CD1 4.44Å; L52-L67 HydrophobicContact CD1-CB 4.14Å; L52-L67 HydrophobicContact CD1-CD1 4.45Å; L52-L353 HydrophobicContact CD2-CD2 3.82Å
53V91Very high89.5Confident89 Ų8951.3 Ų51.354%0.53927%0.265SS..Hα-helixtrans-78.8-34.9179.71730000112.1S49 I50 L67S49-V53 WeakPolarHBondContact O-CG2 3.4Å; S49-V53 PolarHBondContact O-N 3.15Å; I50-V53 PolarHBondContact O-N 2.99Å; V53-L67 HydrophobicContact CG2-CD1 4.11Å; V53-L67 HydrophobicContact CG2-CD2 4.02Å
54K87.5Confident89.4Confident157 Ų15749 Ų4968%0.68325%0.246SC*.Hα-helixtrans-74-37.7-179.5-83.9-167.4166.2-178.80113I50 K56I50-K54 HydrophobicContact CG2-CD 4.19Å; I50-K54 HydrophobicContact CG2-CG 4.46Å; I50-K54 WeakPolarHBondContact O-CB 3.32Å; I50-K54 PolarHBondContact O-N 3.41Å; K54-K56 PolarHBondContact O-N 3.05Å
55D85Confident89.5Confident42 Ų4248.5 Ų48.523%0.22524%0.24CC..  trans-93.1104.9-174-166.6-17.9000112.2L51 S57 L58 C356L51-D55 PolarHBondContact O-N 3.42Å; L51-D55 VanDerWaalsContact O-N 3.15Å; D55-S57 PolarHBondContact O-N 3.4Å; D55-S57 VanDerWaalsContact O-N 3.15Å; D55-S57 VanDerWaalsContact OD1-CB 3.24Å; D55-S57 WeakPolarHBondContact OD1-CB 3.46Å; D55-S57 PolarHBondContact OD1-N 3.15Å; D55-S57 PolarHBondContact OD1-OG 3.46Å; D55-S57 PolarHBondContact OD2-OG 3.29Å; D55-L58 HydrophobicContact CB-CD1 3.95Å; D55-L58 HydrophobicContact CB-CG 4.17Å; D55-L58 PolarHBondContact O-N 3.22Å; D55-C356 PolarHBondContact OD2-SG 3.48Å
56K83.3Confident89.5Confident176 Ų17648.5 Ų48.577%0.76524%0.24SC*.G310 helixtrans-60.2-24.1176.8-62-175.7-178.4-178.20113.2K54 L58 H59K54-K56 PolarHBondContact O-N 3.05Å; K56-L58 PolarHBondContact O-N 3.02Å; K56-H59 WeakPolarHBondContact O-CB 3.31Å; K56-H59 PolarHBondContact O-N 3.01Å
57S79.1Confident89.5Confident73 Ų7347.1 Ų47.151%0.5123%0.233SC..G310 helixtrans-68.2-22.9177.773.70000112.8D55D55-S57 PolarHBondContact O-N 3.4Å; D55-S57 VanDerWaalsContact O-N 3.15Å; D55-S57 VanDerWaalsContact OD1-CB 3.24Å; D55-S57 WeakPolarHBondContact OD1-CB 3.46Å; D55-S57 PolarHBondContact OD1-N 3.15Å; D55-S57 PolarHBondContact OD1-OG 3.46Å; D55-S57 PolarHBondContact OD2-OG 3.29Å
58L81.9Confident89.7Confident2 Ų245.6 Ų45.61%0.0123%0.225CC..G310 helixtrans-92.32.3177.9-60.8174.8000112.9L52 D55 K56 R60 Y63 E352 L353L52-L58 HydrophobicContact CD2-CB 4.39Å; L52-L58 HydrophobicContact CD2-CD1 4.14Å; D55-L58 HydrophobicContact CB-CD1 3.95Å; D55-L58 HydrophobicContact CB-CG 4.17Å; D55-L58 PolarHBondContact O-N 3.22Å; K56-L58 PolarHBondContact O-N 3.02Å; L58-R60 PolarHBondContact O-N 3.01Å; L58-Y63 HydrophobicContact CB-CD2 4.27Å; L58-Y63 HydrophobicContact CB-CE2 4.46Å; L58-Y63 HydrophobicContact CB-CG 4.49Å; L58-Y63 HydrophobicContact CD2-CD2 4.47Å; L58-Y63 HydrophobicContact CD2-CE1 4.27Å; L58-Y63 HydrophobicContact CD2-CE2 3.86Å; L58-Y63 WeakPolarHBondContact O-CB 3.48Å; L58-Y63 WeakPolarHBondContact O-CD2 3.37Å; L58-E352 HydrophobicContact CD2-CB 4.33Å; L58-L353 HydrophobicContact CD1-CD2 3.57Å
59H85.4Confident89.9Confident83 Ų8345.7 Ų45.738%0.38423%0.226SC..  trans-74.668.9176.2-73.5-173.9000111.7L52 K56L52-H59 PolarHBondContact O-CD2 3Å; L52-H59 PolarHBondContact O-NE2 3.28Å; K56-H59 WeakPolarHBondContact O-CB 3.31Å; K56-H59 PolarHBondContact O-N 3.01Å
60R87.1Confident90.1Very high85 Ų8544.9 Ų44.932%0.32122%0.22SC..SBendtrans-122.1152.5173.1-50.2-174.1-174.6-176.11.9109.2L58 P62 Y63 Y64L58-R60 PolarHBondContact O-N 3.01Å; R60-P62 VanDerWaalsContact C-CD 3.42Å; R60-P62 HydrophobicContact CB-CG 4.24Å; R60-P62 VanDerWaalsContact O-N 3.15Å; R60-Y63 HydrophobicContact CB-CD2 3.97Å; R60-Y63 HydrophobicContact CG-CD2 4.39Å; R60-Y63 WeakPolarHBondContact O-CB 3.44Å; R60-Y63 PolarHBondContact O-N 3.42Å; R60-Y64 PolarHBondContact O-N 3.33Å
61A88.9Confident90.3Very high9 Ų942.9 Ų42.97%0.07422%0.216CC..Hα-helixtrans-41.5-49178.300000116.7Y63 Y64 F65 L140 C145A61-Y63 PolarHBondContact O-N 2.92Å; A61-Y64 PolarHBondContact O-N 2.82Å; A61-F65 PolarHBondContact O-N 3.18Å; A61-L140 HydrophobicContact CB-CD2 3.16Å; A61-L140 HydrophobicContact CB-CG 3.58Å; A61-C145 WeakPolarHBondContact CB-SG 3.41Å
62P89.6Confident90.6Very high0 Ų042.7 Ų42.70%022%0.216CC..Hα-helixtrans-58.6-35.6178.617-28.9000113.3R60 F65 L66 Y136 I290 F294R60-P62 VanDerWaalsContact C-CD 3.42Å; R60-P62 HydrophobicContact CB-CG 4.24Å; R60-P62 VanDerWaalsContact O-N 3.15Å; P62-F65 PolarHBondContact O-N 2.96Å; P62-L66 PolarHBondContact O-N 2.83Å; P62-L66 VanDerWaalsContact O-N 3.08Å; P62-Y136 WeakPolarHBondContact CD-OH 3.33Å; P62-I290 HydrophobicContact CB-CG2 3.8Å; P62-I290 HydrophobicContact CG-CD1 4.49Å; P62-I290 HydrophobicContact CG-CG2 3.98Å; P62-F294 HydrophobicContact CB-CE2 3.6Å; P62-F294 HydrophobicContact CB-CZ 4.07Å; P62-F294 VanDerWaalsContact O-CZ 3.23Å; P62-F294 WeakPolarHBondContact O-CZ 3.37Å
63Y91.8Very high90.9Very high3 Ų342.5 Ų42.51%0.01222%0.215CC..Hα-helixtrans-76.4-24.7-177.9-65.1-64.2000112.4L52 L58 R60 A61 L66 L67 I290 N350 E352 L353L52-Y63 HydrophobicContact CD2-CD1 3.75Å; L52-Y63 HydrophobicContact CD2-CG 4.17Å; L58-Y63 HydrophobicContact CB-CD2 4.27Å; L58-Y63 HydrophobicContact CB-CE2 4.46Å; L58-Y63 HydrophobicContact CB-CG 4.49Å; L58-Y63 HydrophobicContact CD2-CD2 4.47Å; L58-Y63 HydrophobicContact CD2-CE1 4.27Å; L58-Y63 HydrophobicContact CD2-CE2 3.86Å; L58-Y63 WeakPolarHBondContact O-CB 3.48Å; L58-Y63 WeakPolarHBondContact O-CD2 3.37Å; R60-Y63 HydrophobicContact CB-CD2 3.97Å; R60-Y63 HydrophobicContact CG-CD2 4.39Å; R60-Y63 WeakPolarHBondContact O-CB 3.44Å; R60-Y63 PolarHBondContact O-N 3.42Å; A61-Y63 PolarHBondContact O-N 2.92Å; Y63-L66 HydrophobicContact CD1-CD2 4.21Å; Y63-L66 PolarHBondContact O-N 3.08Å; Y63-L67 WeakPolarHBondContact O-CB 3.46Å; Y63-L67 PolarHBondContact O-N 3.26Å; Y63-I290 HydrophobicContact CE2-CD1 4.14Å; Y63-N350 PolarHBondContact OH-ND2 3.36Å; Y63-E352 PolarHBondContact OH-OE2 3.1Å; Y63-L353 HydrophobicContact CE1-CD1 4.37Å
64Y94.6Very high91.2Very high53 Ų5339.8 Ų39.821%0.20820%0.197CC..Hα-helixtrans-66.7-40.2169.5-61.6-45.5000112R60 A61 L66 L67 D68 F142 C145R60-Y64 PolarHBondContact O-N 3.33Å; A61-Y64 PolarHBondContact O-N 2.82Å; Y64-L66 VanDerWaalsContact C-N 3.34Å; Y64-L67 WeakPolarHBondContact O-CB 3.44Å; Y64-L67 PolarHBondContact O-N 2.87Å; Y64-D68 PolarHBondContact O-N 3.37Å; Y64-D68 VanDerWaalsContact O-N 3.1Å; Y64-F142 HydrophobicContact CD2-CD2 4.38Å; Y64-F142 HydrophobicContact CE1-CD2 4.36Å; Y64-F142 HydrophobicContact CE1-CE2 4.48Å; Y64-F142 AromaticContact CE2-CD2 3.86Å; Y64-F142 HydrophobicContact CE2-CD2 3.86Å; Y64-F142 AromaticContact CZ-CD2 3.84Å; Y64-C145 HydrophobicContact CD2-CB 4.17Å
65F95.8Very high91.5Very high1 Ų134.4 Ų34.40%0.00418%0.175CC..Hα-helixtrans-68-35.3174-58-32.5000112.3A61 P62 D68 L69 M118 V122 T125 C145 V148 I149A61-F65 PolarHBondContact O-N 3.18Å; P62-F65 PolarHBondContact O-N 2.96Å; F65-D68 PolarHBondContact O-N 3.42Å; F65-L69 WeakPolarHBondContact O-CG 3.39Å; F65-L69 PolarHBondContact O-N 2.95Å; F65-M118 HydrophobicContact CB-CE 3.82Å; F65-M118 HydrophobicContact CD1-CE 3.64Å; F65-M118 HydrophobicContact CE1-CE 4.49Å; F65-M118 HydrophobicContact CG-CE 3.96Å; F65-V122 HydrophobicContact CB-CG2 3.61Å; F65-V122 HydrophobicContact CD2-CG2 3.86Å; F65-V122 HydrophobicContact CG-CG2 4.06Å; F65-T125 HydrophobicContact CE2-CG2 3.97Å; F65-T125 WeakPolarHBondContact CE2-OG1 3.33Å; F65-C145 HydrophobicContact CE1-CB 3.97Å; F65-C145 HydrophobicContact CZ-CB 4.29Å; F65-V148 HydrophobicContact CE1-CB 4.16Å; F65-V148 HydrophobicContact CE1-CG1 3.96Å; F65-V148 HydrophobicContact CZ-CB 4.3Å; F65-V148 HydrophobicContact CZ-CG1 4.04Å; F65-I149 HydrophobicContact CD1-CD1 4.19Å; F65-I149 HydrophobicContact CD1-CG1 4Å; F65-I149 HydrophobicContact CE1-CD1 4.49Å; F65-I149 HydrophobicContact CE1-CG1 4.18Å
66L94.7Very high92Very high0 Ų033.1 Ų33.10%017%0.167CC..Hα-helixtrans-64.1-41.5172.3-17962.2000112.1I48 L52 P62 Y63 Y64 D68 L69 C70 M293 F294 M297I48-L66 HydrophobicContact CG2-CD2 4.39Å; L52-L66 HydrophobicContact CD1-CB 4.23Å; L52-L66 HydrophobicContact CD1-CD2 3.89Å; L52-L66 HydrophobicContact CD1-CG 3.93Å; L52-L66 HydrophobicContact CD2-CD2 4.45Å; P62-L66 PolarHBondContact O-N 2.83Å; P62-L66 VanDerWaalsContact O-N 3.08Å; Y63-L66 HydrophobicContact CD1-CD2 4.21Å; Y63-L66 PolarHBondContact O-N 3.08Å; Y64-L66 VanDerWaalsContact C-N 3.34Å; L66-D68 VanDerWaalsContact C-N 3.32Å; L66-D68 PolarHBondContact O-N 3.35Å; L66-L69 PolarHBondContact O-N 3.27Å; L66-C70 PolarHBondContact O-N 3.42Å; L66-C70 PolarHBondContact O-SG 2.89Å; L66-M293 HydrophobicContact CD2-CE 4.06Å; L66-F294 HydrophobicContact CB-CE1 4.23Å; L66-F294 HydrophobicContact CB-CZ 4.04Å; L66-F294 HydrophobicContact CD1-CE1 4.47Å; L66-M297 HydrophobicContact CD1-CE 3.58Å; L66-M297 HydrophobicContact CD1-SD 4.04Å
67L95.3Very high92.7Very high48 Ų4824.7 Ų24.725%0.25113%0.131SC..Hα-helixtrans-60.5-43.3177-177.966.3000111.3L52 V53 Y63 Y64 C70 A71L52-L67 HydrophobicContact CB-CD1 4.44Å; L52-L67 HydrophobicContact CD1-CB 4.14Å; L52-L67 HydrophobicContact CD1-CD1 4.45Å; V53-L67 HydrophobicContact CG2-CD1 4.11Å; V53-L67 HydrophobicContact CG2-CD2 4.02Å; Y63-L67 WeakPolarHBondContact O-CB 3.46Å; Y63-L67 PolarHBondContact O-N 3.26Å; Y64-L67 WeakPolarHBondContact O-CB 3.44Å; Y64-L67 PolarHBondContact O-N 2.87Å; L67-C70 PolarHBondContact O-N 2.86Å; L67-A71 PolarHBondContact O-N 3.46Å
68D96.9Very high93.5Very high17 Ų1723.6 Ų23.69%0.09113%0.126CC..Hα-helixtrans-66.6-40.6175.9176.182.2000112.6Y64 F65 L66 C70 A71 S72 H114 M118 I149 W153Y64-D68 PolarHBondContact O-N 3.37Å; Y64-D68 VanDerWaalsContact O-N 3.1Å; F65-D68 PolarHBondContact O-N 3.42Å; L66-D68 VanDerWaalsContact C-N 3.32Å; L66-D68 PolarHBondContact O-N 3.35Å; D68-C70 VanDerWaalsContact C-N 3.35Å; D68-C70 PolarHBondContact O-N 3.32Å; D68-A71 WeakPolarHBondContact O-CB 3.5Å; D68-A71 PolarHBondContact O-N 3Å; D68-S72 PolarHBondContact O-N 3.46Å; D68-H114 IonicContact OD1-CE1 3.87Å; D68-H114 IonicContact OD1-NE2 3.69Å; D68-H114 IonicContact OD2-CD2 3.91Å; D68-H114 IonicContact OD2-CE1 3.23Å; D68-H114 PolarHBondContact OD2-CE1 3.32Å; D68-H114 VanDerWaalsContact OD2-CE1 3.23Å; D68-H114 IonicContact OD2-NE2 2.68Å; D68-H114 PolarHBondContact OD2-NE2 2.75Å; D68-M118 HydrophobicContact CB-CE 4.44Å; D68-M118 WeakPolarHBondContact OD2-CG 3.4Å; D68-I149 HydrophobicContact CB-CD1 4.13Å; D68-I149 HydrophobicContact CB-CG1 4.31Å; D68-I149 HydrophobicContact CB-CG2 4.47Å; D68-I149 WeakPolarHBondContact OD1-CG2 3.35Å; D68-W153 PolarHBondContact OD1-NE1 3.46Å
69L95.9Very high94Very high4 Ų426.8 Ų26.82%0.02114%0.142CC..Hα-helixtrans-57.8-46.2171.1-76.2169.5000111.6F65 L66 A71 S72 D73 T115 M118 L119 M297F65-L69 WeakPolarHBondContact O-CG 3.39Å; F65-L69 PolarHBondContact O-N 2.95Å; L66-L69 PolarHBondContact O-N 3.27Å; L69-A71 VanDerWaalsContact C-N 3.34Å; L69-A71 PolarHBondContact O-N 3.43Å; L69-S72 PolarHBondContact O-N 3.01Å; L69-D73 PolarHBondContact O-N 2.72Å; L69-T115 HydrophobicContact CD2-CG2 4.06Å; L69-M118 HydrophobicContact CD2-CB 3.86Å; L69-M118 HydrophobicContact CG-CB 4.4Å; L69-L119 HydrophobicContact CD1-CD2 4.25Å; L69-M297 HydrophobicContact CD1-CE 4.29Å
70C96.4Very high94.4Very high0 Ų023.2 Ų23.20%013%0.126CC..Hα-helixtrans-61.6-40.5175.5-73.90000112N45 S49 L66 L67 D68 D73 I74N45-C70 HydrophobicContact CB-CB 4.02Å; N45-C70 PolarHBondContact OD1-SG 3.41Å; S49-C70 WeakPolarHBondContact OG-CB 3.38Å; L66-C70 PolarHBondContact O-N 3.42Å; L66-C70 PolarHBondContact O-SG 2.89Å; L67-C70 PolarHBondContact O-N 2.86Å; D68-C70 VanDerWaalsContact C-N 3.35Å; D68-C70 PolarHBondContact O-N 3.32Å; C70-D73 PolarHBondContact O-N 3.17Å; C70-I74 WeakPolarHBondContact O-CD1 3.41Å; C70-I74 WeakPolarHBondContact O-CG1 3.43Å; C70-I74 PolarHBondContact O-N 3.48Å
71A96.1Very high94.8Very high47 Ų4719.3 Ų19.339%0.38811%0.112SC..Hα-helixtrans-62.7-43.4176.700000112.1L67 D68 L69 I74 L75L67-A71 PolarHBondContact O-N 3.46Å; D68-A71 WeakPolarHBondContact O-CB 3.5Å; D68-A71 PolarHBondContact O-N 3Å; L69-A71 VanDerWaalsContact C-N 3.34Å; L69-A71 PolarHBondContact O-N 3.43Å; A71-I74 PolarHBondContact O-N 3.48Å; A71-L75 WeakPolarHBondContact O-CB 3.49Å; A71-L75 PolarHBondContact O-N 3.05Å
72S96.4Very high95.1Very high1 Ų121 Ų211%0.00712%0.122CC..Hα-helixtrans-65.2-39.3176.6-164.30000112.4D68 L69 L75 R76 H114D68-S72 PolarHBondContact O-N 3.46Å; L69-S72 PolarHBondContact O-N 3.01Å; S72-L75 WeakPolarHBondContact O-CB 3.45Å; S72-L75 PolarHBondContact O-N 3.29Å; S72-R76 PolarHBondContact O-N 3.44Å; S72-H114 PolarHBondContact OG-CD2 3.43Å
73D96.2Very high95.2Very high3 Ų323.6 Ų23.62%0.01613%0.134CC..Hα-helixtrans-70.5-34.3175.8-81.9-42.5000113L69 C70 R76 S77 N342L69-D73 PolarHBondContact O-N 2.72Å; C70-D73 PolarHBondContact O-N 3.17Å; D73-R76 PolarHBondContact O-N 3.09Å; D73-R76 IonicContact OD1-CZ 3.69Å; D73-R76 IonicContact OD1-NE 3.7Å; D73-R76 IonicContact OD1-NH2 2.79Å; D73-R76 PolarHBondContact OD1-NH2 2.91Å; D73-S77 VanDerWaalsContact O-CB 3.24Å; D73-S77 WeakPolarHBondContact O-CB 3.49Å; D73-S77 PolarHBondContact O-N 3.32Å; D73-S77 PolarHBondContact O-OG 3.06Å; D73-N342 PolarHBondContact OD2-ND2 2.94Å
74I96.8Very high95.2Very high31 Ų3123.8 Ų23.816%0.15914%0.135CC..Hα-helixtrans-63.3-46.6170.8-68.5159.1000109.8N45 L46 C70 A71 R76 S77 A78N45-I74 HydrophobicContact CB-CD1 3.97Å; N45-I74 HydrophobicContact CB-CG1 3.6Å; L46-I74 HydrophobicContact CB-CD1 4.5Å; L46-I74 HydrophobicContact CD2-CD1 3.72Å; L46-I74 HydrophobicContact CG-CD1 3.83Å; L46-I74 HydrophobicContact CG-CG1 4.28Å; C70-I74 WeakPolarHBondContact O-CD1 3.41Å; C70-I74 WeakPolarHBondContact O-CG1 3.43Å; C70-I74 PolarHBondContact O-N 3.48Å; A71-I74 PolarHBondContact O-N 3.48Å; I74-R76 VanDerWaalsContact C-N 3.32Å; I74-R76 PolarHBondContact O-N 2.81Å; I74-S77 PolarHBondContact O-N 2.92Å; I74-A78 HydrophobicContact CG2-CB 4.49Å; I74-A78 WeakPolarHBondContact O-CB 3.35Å; I74-A78 PolarHBondContact O-N 3.01Å
75L95.4Very high95.1Very high45 Ų4524.5 Ų24.524%0.23614%0.139CC..Hα-helixtrans-53.8-50.1177173.867.3000110.8A71 S72 I79 W153A71-L75 WeakPolarHBondContact O-CB 3.49Å; A71-L75 PolarHBondContact O-N 3.05Å; S72-L75 WeakPolarHBondContact O-CB 3.45Å; S72-L75 PolarHBondContact O-N 3.29Å; L75-I79 HydrophobicContact CD1-CD1 3.46Å; L75-I79 VanDerWaalsContact CD1-CD1 3.46Å; L75-I79 HydrophobicContact CD1-CG1 4.12Å; L75-I79 VanDerWaalsContact O-CB 3.25Å; L75-I79 WeakPolarHBondContact O-CB 3.33Å; L75-I79 WeakPolarHBondContact O-CG1 3.34Å; L75-I79 PolarHBondContact O-N 3.25Å; L75-W153 HydrophobicContact CD2-CH2 4.17Å
76R95.3Very high94.8Very high14 Ų1426.1 Ų26.15%0.05315%0.149CC..Iπ-helixtrans-65.1-43.1178.4-173.9170.857.8111.5-1.8112.7S72 D73 I74 C80 F81 S335 A339S72-R76 PolarHBondContact O-N 3.44Å; D73-R76 PolarHBondContact O-N 3.09Å; D73-R76 IonicContact OD1-CZ 3.69Å; D73-R76 IonicContact OD1-NE 3.7Å; D73-R76 IonicContact OD1-NH2 2.79Å; D73-R76 PolarHBondContact OD1-NH2 2.91Å; I74-R76 VanDerWaalsContact C-N 3.32Å; I74-R76 PolarHBondContact O-N 2.81Å; R76-C80 HydrophobicContact CG-CB 4.23Å; R76-C80 WeakPolarHBondContact O-CA 3.35Å; R76-C80 VanDerWaalsContact O-CB 3.3Å; R76-C80 WeakPolarHBondContact O-CB 3.39Å; R76-C80 PolarHBondContact O-N 2.94Å; R76-F81 HydrophobicContact CG-CD1 4.46Å; R76-F81 HydrophobicContact CG-CE1 3.95Å; R76-F81 HydrophobicContact CG-CZ 4.12Å; R76-F81 VanDerWaalsContact NH1-CZ 3.28Å; R76-F81 PolarHBondContact O-N 2.93Å; R76-F81 VanDerWaalsContact O-N 3.14Å; R76-S335 PolarHBondContact NH1-O 3.01Å; R76-S335 VanDerWaalsContact NH1-O 3.08Å; R76-A339 VanDerWaalsContact NH2-N 3.13Å
77S96.3Very high94.5Very high0 Ų026.4 Ų26.40%015%0.151CC..Iπ-helixtrans-73.5-34.8-176.1-53.90000113.6D73 I74 P82 A339D73-S77 VanDerWaalsContact O-CB 3.24Å; D73-S77 WeakPolarHBondContact O-CB 3.49Å; D73-S77 PolarHBondContact O-N 3.32Å; D73-S77 PolarHBondContact O-OG 3.06Å; I74-S77 PolarHBondContact O-N 2.92Å; S77-P82 WeakPolarHBondContact O-CD 3.45Å; S77-A339 WeakPolarHBondContact OG-CB 3.3Å
78A95.9Very high94.2Very high49 Ų4924.3 Ų24.341%0.40514%0.141SC..Iπ-helixtrans-88.1-26.3-178.100000112.7V42 I74 P82V42-A78 HydrophobicContact CG2-CB 4.02Å; I74-A78 HydrophobicContact CG2-CB 4.49Å; I74-A78 WeakPolarHBondContact O-CB 3.35Å; I74-A78 PolarHBondContact O-N 3.01Å; A78-P82 WeakPolarHBondContact O-CG 3.43Å
79I94.3Very high93.8Very high69 Ų6930.4 Ų30.435%0.35417%0.166SC..Iπ-helixtrans-107.4-56.6-178.2-51.8-167000111.6L75 P82 F83 I104 L107L75-I79 HydrophobicContact CD1-CD1 3.46Å; L75-I79 VanDerWaalsContact CD1-CD1 3.46Å; L75-I79 HydrophobicContact CD1-CG1 4.12Å; L75-I79 VanDerWaalsContact O-CB 3.25Å; L75-I79 WeakPolarHBondContact O-CB 3.33Å; L75-I79 WeakPolarHBondContact O-CG1 3.34Å; L75-I79 PolarHBondContact O-N 3.25Å; I79-P82 WeakPolarHBondContact O-CD 3.31Å; I79-F83 WeakPolarHBondContact O-CD2 3.46Å; I79-F83 WeakPolarHBondContact O-CE2 3.43Å; I79-I104 HydrophobicContact CG2-CD1 3.85Å; I79-L107 HydrophobicContact CG2-CD1 4.08Å
80C93.7Very high93.3Very high8 Ų833.8 Ų33.85%0.05418%0.184CC..Iπ-helixtrans-74.9-46-170.3-58.70000112.8R76 F83 V84 I104R76-C80 HydrophobicContact CG-CB 4.23Å; R76-C80 WeakPolarHBondContact O-CA 3.35Å; R76-C80 VanDerWaalsContact O-CB 3.3Å; R76-C80 WeakPolarHBondContact O-CB 3.39Å; R76-C80 PolarHBondContact O-N 2.94Å; C80-F83 PolarHBondContact O-N 3.38Å; C80-F83 VanDerWaalsContact O-N 3.16Å; C80-V84 PolarHBondContact O-N 3.15Å; C80-I104 HydrophobicContact CB-CG2 4.31Å
81F94.6Very high92.6Very high3 Ų336.4 Ų36.41%0.01321%0.211CC..Hα-helixtrans-64.3-33.9-175.9-67.9-13.1000115.2L34 I37 I38 R76 F83 V84 F85 F336 A339L34-F81 HydrophobicContact CD1-CB 4.13Å; L34-F81 HydrophobicContact CD1-CG 4.26Å; I37-F81 HydrophobicContact CG2-CD2 4.1Å; I37-F81 HydrophobicContact CG2-CE2 3.64Å; I37-F81 HydrophobicContact CG2-CZ 4.4Å; I38-F81 HydrophobicContact CD1-CB 3.84Å; I38-F81 HydrophobicContact CG1-CB 3.53Å; I38-F81 HydrophobicContact CG1-CD2 3.99Å; I38-F81 HydrophobicContact CG1-CG 4.27Å; R76-F81 HydrophobicContact CG-CD1 4.46Å; R76-F81 HydrophobicContact CG-CE1 3.95Å; R76-F81 HydrophobicContact CG-CZ 4.12Å; R76-F81 VanDerWaalsContact NH1-CZ 3.28Å; R76-F81 PolarHBondContact O-N 2.93Å; R76-F81 VanDerWaalsContact O-N 3.14Å; F81-F83 VanDerWaalsContact C-N 3.26Å; F81-F83 PolarHBondContact O-N 3.18Å; F81-V84 WeakPolarHBondContact O-CB 3.42Å; F81-V84 PolarHBondContact O-N 3.32Å; F81-V84 VanDerWaalsContact O-N 3.15Å; F81-F85 PolarHBondContact O-N 3.47Å; F81-F336 HydrophobicContact CD1-CD1 4.35Å; F81-F336 HydrophobicContact CD1-CG 4.47Å; F81-F336 HydrophobicContact CE1-CB 4.02Å; F81-F336 AromaticContact CE1-CD1 3.51Å; F81-F336 HydrophobicContact CE1-CD1 3.51Å; F81-F336 HydrophobicContact CE1-CE1 4.1Å; F81-F336 AromaticContact CE1-CG 3.8Å; F81-F336 HydrophobicContact CE1-CG 3.8Å; F81-F336 HydrophobicContact CZ-CB 3.83Å; F81-F336 HydrophobicContact CZ-CD1 4.1Å; F81-F336 HydrophobicContact CZ-CG 4.14Å; F81-A339 HydrophobicContact CE2-CB 3.7Å; F81-A339 HydrophobicContact CZ-CB 4.07Å
82P94.3Very high91.8Very high46 Ų4635.9 Ų35.930%0.29921%0.205SC..Hα-helixtrans-58.9-32.7171.6-3138.6000114.3S77 A78 I79 F85 T86S77-P82 WeakPolarHBondContact O-CD 3.45Å; A78-P82 WeakPolarHBondContact O-CG 3.43Å; I79-P82 WeakPolarHBondContact O-CD 3.31Å; P82-F85 WeakPolarHBondContact O-CB 3.27Å; P82-F85 PolarHBondContact O-N 3.33Å; P82-T86 PolarHBondContact O-N 3.31Å; P82-T86 PolarHBondContact O-OG1 3.39Å
83F91.8Very high90.9Very high54 Ų5440.2 Ų40.224%0.23723%0.231CC..Hα-helixtrans-69.7-36.9174.5-72.8-93000112I79 C80 F81 F85 T86 S87 Y96 T100 I104I79-F83 WeakPolarHBondContact O-CD2 3.46Å; I79-F83 WeakPolarHBondContact O-CE2 3.43Å; C80-F83 PolarHBondContact O-N 3.38Å; C80-F83 VanDerWaalsContact O-N 3.16Å; F81-F83 VanDerWaalsContact C-N 3.26Å; F81-F83 PolarHBondContact O-N 3.18Å; F83-F85 VanDerWaalsContact C-N 3.31Å; F83-T86 PolarHBondContact O-OG1 3.07Å; F83-T86 VanDerWaalsContact O-OG1 3.07Å; F83-S87 WeakPolarHBondContact O-CB 3.08Å; F83-S87 PolarHBondContact O-N 3.21Å; F83-Y96 HydrophobicContact CD1-CD1 4.27Å; F83-Y96 AromaticContact CD1-CD2 3.61Å; F83-Y96 HydrophobicContact CD1-CD2 3.61Å; F83-Y96 HydrophobicContact CD1-CE1 4.15Å; F83-Y96 AromaticContact CD1-CE2 3.47Å; F83-Y96 HydrophobicContact CD1-CE2 3.47Å; F83-Y96 VanDerWaalsContact CD1-CE2 3.47Å; F83-Y96 HydrophobicContact CD1-CG 4.01Å; F83-Y96 AromaticContact CD1-CZ 3.75Å; F83-Y96 AromaticContact CE1-CD1 3.88Å; F83-Y96 HydrophobicContact CE1-CD1 3.88Å; F83-Y96 HydrophobicContact CE1-CD2 4.07Å; F83-Y96 AromaticContact CE1-CE1 3.8Å; F83-Y96 HydrophobicContact CE1-CE1 3.8Å; F83-Y96 AromaticContact CE1-CE2 3.99Å; F83-Y96 HydrophobicContact CE1-CE2 3.99Å; F83-Y96 HydrophobicContact CE1-CG 4.01Å; F83-Y96 AromaticContact CE1-CZ 3.84Å; F83-Y96 HydrophobicContact CG-CE2 4.4Å; F83-T100 HydrophobicContact CD1-CG2 4.13Å; F83-T100 HydrophobicContact CE1-CG2 3.33Å; F83-T100 HydrophobicContact CZ-CG2 3.83Å; F83-I104 HydrophobicContact CB-CG2 4.32Å; F83-I104 HydrophobicContact CD1-CG1 4.11Å; F83-I104 HydrophobicContact CD2-CD1 3.39Å; F83-I104 HydrophobicContact CD2-CG1 3.71Å; F83-I104 HydrophobicContact CE1-CG1 4.28Å; F83-I104 HydrophobicContact CE2-CD1 3.34Å; F83-I104 HydrophobicContact CE2-CG1 3.89Å; F83-I104 HydrophobicContact CG-CD1 4.06Å; F83-I104 HydrophobicContact CG-CG1 3.84Å; F83-I104 HydrophobicContact CZ-CD1 3.98Å; F83-I104 HydrophobicContact CZ-CG1 4.17Å
84V91.7Very high89.9Confident6 Ų643.4 Ų43.44%0.03625%0.248CC..Hα-helixtrans-63.9-41.8171.7-177.70000109.7L34 C80 F81 T86 S87 V88 D177 Q178 F336L34-V84 HydrophobicContact CD2-CB 4.12Å; L34-V84 HydrophobicContact CD2-CG1 3.95Å; C80-V84 PolarHBondContact O-N 3.15Å; F81-V84 WeakPolarHBondContact O-CB 3.42Å; F81-V84 PolarHBondContact O-N 3.32Å; F81-V84 VanDerWaalsContact O-N 3.15Å; V84-T86 PolarHBondContact O-N 2.94Å; V84-S87 WeakPolarHBondContact O-CB 3.09Å; V84-S87 PolarHBondContact O-N 3.41Å; V84-V88 HydrophobicContact CG1-CG2 4.44Å; V84-V88 WeakPolarHBondContact O-CG2 3.47Å; V84-V88 PolarHBondContact O-N 2.88Å; V84-D177 HydrophobicContact CG1-CB 4.29Å; V84-Q178 HydrophobicContact CG2-CB 3.85Å; V84-F336 HydrophobicContact CG1-CE2 3.89Å; V84-F336 HydrophobicContact CG1-CZ 4.3Å; V84-F336 HydrophobicContact CG2-CZ 4.27Å
85F92.6Very high88.7Confident68 Ų6845.4 Ų45.430%0.29826%0.261SS..Hα-helixtrans-61.1-46.4179.7-174.1-83.7000112.2L31 L34 I38 F81 P82 F83 S87 V88 K89L31-F85 HydrophobicContact CB-CE2 4.21Å; L31-F85 HydrophobicContact CD2-CD1 4.38Å; L31-F85 HydrophobicContact CD2-CD2 3.99Å; L31-F85 HydrophobicContact CD2-CE1 4.22Å; L31-F85 HydrophobicContact CD2-CE2 3.81Å; L31-F85 HydrophobicContact CD2-CG 4.26Å; L31-F85 HydrophobicContact CD2-CZ 3.93Å; L34-F85 HydrophobicContact CB-CD2 4.45Å; L34-F85 HydrophobicContact CD2-CB 3.56Å; L34-F85 HydrophobicContact CD2-CD2 3.96Å; L34-F85 HydrophobicContact CD2-CG 4.24Å; L34-F85 HydrophobicContact CG-CB 4.44Å; L34-F85 HydrophobicContact CG-CD2 4.26Å; I38-F85 HydrophobicContact CD1-CB 4.42Å; F81-F85 PolarHBondContact O-N 3.47Å; P82-F85 WeakPolarHBondContact O-CB 3.27Å; P82-F85 PolarHBondContact O-N 3.33Å; F83-F85 VanDerWaalsContact C-N 3.31Å; F85-S87 VanDerWaalsContact C-N 3.34Å; F85-V88 PolarHBondContact O-N 3.38Å; F85-K89 WeakPolarHBondContact O-CB 3.5Å; F85-K89 PolarHBondContact O-N 3.47Å
86T90.7Very high87.9Confident35 Ų3547.7 Ų47.722%0.21527%0.267CS..Hα-helixtrans-69.4-33.8177.451.10000112P82 F83 V84 K89 N90 Y96P82-T86 PolarHBondContact O-N 3.31Å; P82-T86 PolarHBondContact O-OG1 3.39Å; F83-T86 PolarHBondContact O-OG1 3.07Å; F83-T86 VanDerWaalsContact O-OG1 3.07Å; V84-T86 PolarHBondContact O-N 2.94Å; T86-K89 PolarHBondContact O-N 2.91Å; T86-N90 WeakPolarHBondContact O-CB 3.42Å; T86-N90 PolarHBondContact O-N 2.98Å; T86-Y96 WeakPolarHBondContact CB-OH 3.32Å; T86-Y96 WeakPolarHBondContact CG2-OH 3.34Å; T86-Y96 VanDerWaalsContact OG1-CE2 3.23Å; T86-Y96 WeakPolarHBondContact OG1-CE2 3.35Å; T86-Y96 PolarHBondContact OG1-OH 3.43Å
87S88.8Confident87.4Confident6 Ų650.7 Ų50.74%0.04229%0.291CS..Hα-helixtrans-61.9-48.4172.9-172.70000112.2F83 V84 F85 K89 N90 G91 S92 F172F83-S87 WeakPolarHBondContact O-CB 3.08Å; F83-S87 PolarHBondContact O-N 3.21Å; V84-S87 WeakPolarHBondContact O-CB 3.09Å; V84-S87 PolarHBondContact O-N 3.41Å; F85-S87 VanDerWaalsContact C-N 3.34Å; S87-K89 VanDerWaalsContact C-N 3.32Å; S87-K89 PolarHBondContact O-N 3.39Å; S87-N90 PolarHBondContact O-N 2.92Å; S87-G91 PolarHBondContact O-N 3.38Å; S87-S92 WeakPolarHBondContact O-CA 3.38Å; S87-S92 PolarHBondContact O-N 2.84Å; S87-F172 WeakPolarHBondContact OG-CE2 3.27Å; S87-F172 WeakPolarHBondContact OG-CZ 3.45Å
88V88.8Confident86.8Confident5 Ų556.1 Ų56.13%0.0332%0.319CS..Hα-helixtrans-61-41.5176.2175.20000111.1T27 K30 L31 V84 F85 N90 G91 D177T27-V88 HydrophobicContact CG2-CG1 4.12Å; K30-V88 HydrophobicContact CB-CG1 3.83Å; K30-V88 HydrophobicContact CD-CG1 4.19Å; L31-V88 HydrophobicContact CD2-CB 3.93Å; L31-V88 HydrophobicContact CD2-CG1 3.7Å; L31-V88 HydrophobicContact CG-CG1 3.86Å; V84-V88 HydrophobicContact CG1-CG2 4.44Å; V84-V88 WeakPolarHBondContact O-CG2 3.47Å; V84-V88 PolarHBondContact O-N 2.88Å; F85-V88 PolarHBondContact O-N 3.38Å; V88-N90 VanDerWaalsContact C-N 3.28Å; V88-N90 PolarHBondContact O-N 3.04Å; V88-G91 PolarHBondContact O-N 3.03Å; V88-D177 HydrophobicContact CG2-CB 3.64Å
89K88.1Confident86.4Confident145 Ų14559.5 Ų59.563%0.6333%0.329SS*.Hα-helixtrans-61.3-36.9179-174.9-176175.7-174.50112.3L31 F85 T86 S87 G91L31-K89 HydrophobicContact CD2-CB 4.27Å; F85-K89 WeakPolarHBondContact O-CB 3.5Å; F85-K89 PolarHBondContact O-N 3.47Å; T86-K89 PolarHBondContact O-N 2.91Å; S87-K89 VanDerWaalsContact C-N 3.32Å; S87-K89 PolarHBondContact O-N 3.39Å; K89-G91 VanDerWaalsContact C-N 3.31Å; K89-G91 PolarHBondContact O-N 3.36Å
90N86.1Confident86.1Confident75 Ų7558.5 Ų58.540%0.40133%0.326SS..THydrogen-bonded Turntrans-92.316.8-177-65.9-13.6000113.4T86 S87 V88 T95T86-N90 WeakPolarHBondContact O-CB 3.42Å; T86-N90 PolarHBondContact O-N 2.98Å; S87-N90 PolarHBondContact O-N 2.92Å; V88-N90 VanDerWaalsContact C-N 3.28Å; V88-N90 PolarHBondContact O-N 3.04Å; N90-T95 WeakPolarHBondContact ND2-CG2 3.46Å; N90-T95 PolarHBondContact ND2-OG1 2.93Å
91G80.8Confident85.8Confident55 Ų5558.4 Ų58.457%0.56733%0.326SS*.THydrogen-bonded Turntrans75.435.7176.700000113.9S87 V88 K89 V93S87-G91 PolarHBondContact O-N 3.38Å; V88-G91 PolarHBondContact O-N 3.03Å; K89-G91 VanDerWaalsContact C-N 3.31Å; K89-G91 PolarHBondContact O-N 3.36Å; G91-V93 VanDerWaalsContact C-N 3.25Å; G91-V93 PolarHBondContact O-N 3.5Å
92S79.8Confident85.5Confident35 Ų3561.5 Ų61.525%0.24534%0.339CS..SBendtrans62.631.2175.8-43.80000113.1S87 F172 D177S87-S92 WeakPolarHBondContact O-CA 3.38Å; S87-S92 PolarHBondContact O-N 2.84Å; S92-F172 WeakPolarHBondContact O-CE1 3.45Å; S92-F172 WeakPolarHBondContact O-CZ 3.42Å; S92-D177 VanDerWaalsContact CB-OD1 3.26Å; S92-D177 WeakPolarHBondContact CB-OD1 3.42Å; S92-D177 PolarHBondContact OG-OD1 3.01Å
93V76.5Confident85.4Confident92 Ų9262.7 Ų62.756%0.55835%0.346SS*.  trans-99.6141.1174.3-176.70000109.8G91 T95G91-V93 VanDerWaalsContact C-N 3.25Å; G91-V93 PolarHBondContact O-N 3.5Å; V93-T95 PolarHBondContact O-N 3.46Å; V93-T95 PolarHBondContact O-OG1 3.46Å
94L75.3Confident85.4Confident71 Ų7160.8 Ų60.837%0.37234%0.337SS..  trans-61.5102.9172.617962.6000109.6Y96 C101 F172L94-Y96 WeakPolarHBondContact CG-O 3.33Å; L94-C101 HydrophobicContact CD1-CB 4.13Å; L94-F172 HydrophobicContact CB-CB 4.47Å; L94-F172 HydrophobicContact CB-CD1 4.1Å; L94-F172 HydrophobicContact CB-CG 4.23Å; L94-F172 HydrophobicContact CD1-CB 4.1Å; L94-F172 HydrophobicContact CD1-CD2 4.44Å; L94-F172 HydrophobicContact CD1-CG 4.23Å
95T71.6Confident85.3Confident72 Ų7260.5 Ų60.544%0.44234%0.336SS..  trans-88.1-23.1-178.3-52.10000112.2N90 V93N90-T95 WeakPolarHBondContact ND2-CG2 3.46Å; N90-T95 PolarHBondContact ND2-OG1 2.93Å; V93-T95 PolarHBondContact O-N 3.46Å; V93-T95 PolarHBondContact O-OG1 3.46Å
96Y79.2Confident85.2Confident93 Ų9359.4 Ų59.437%0.36533%0.331SS..SBendtrans-106.2166.1-173.3-60.8-84.5000112.7F83 T86 L94 T100F83-Y96 HydrophobicContact CD1-CD1 4.27Å; F83-Y96 AromaticContact CD1-CD2 3.61Å; F83-Y96 HydrophobicContact CD1-CD2 3.61Å; F83-Y96 HydrophobicContact CD1-CE1 4.15Å; F83-Y96 AromaticContact CD1-CE2 3.47Å; F83-Y96 HydrophobicContact CD1-CE2 3.47Å; F83-Y96 VanDerWaalsContact CD1-CE2 3.47Å; F83-Y96 HydrophobicContact CD1-CG 4.01Å; F83-Y96 AromaticContact CD1-CZ 3.75Å; F83-Y96 AromaticContact CE1-CD1 3.88Å; F83-Y96 HydrophobicContact CE1-CD1 3.88Å; F83-Y96 HydrophobicContact CE1-CD2 4.07Å; F83-Y96 AromaticContact CE1-CE1 3.8Å; F83-Y96 HydrophobicContact CE1-CE1 3.8Å; F83-Y96 AromaticContact CE1-CE2 3.99Å; F83-Y96 HydrophobicContact CE1-CE2 3.99Å; F83-Y96 HydrophobicContact CE1-CG 4.01Å; F83-Y96 AromaticContact CE1-CZ 3.84Å; F83-Y96 HydrophobicContact CG-CE2 4.4Å; T86-Y96 WeakPolarHBondContact CB-OH 3.32Å; T86-Y96 WeakPolarHBondContact CG2-OH 3.34Å; T86-Y96 VanDerWaalsContact OG1-CE2 3.23Å; T86-Y96 WeakPolarHBondContact OG1-CE2 3.35Å; T86-Y96 PolarHBondContact OG1-OH 3.43Å; L94-Y96 WeakPolarHBondContact CG-O 3.33Å; Y96-T100 HydrophobicContact CG-CG2 4.47Å
97S85.2Confident85.4Confident77 Ų7759.3 Ų59.354%0.53833%0.329SS..  trans-56.4148.3171.5178.70000111.8L99 T100 C101S97-L99 PolarHBondContact O-N 3.48Å; S97-L99 PolarHBondContact OG-N 3.15Å; S97-T100 WeakPolarHBondContact O-CB 3.25Å; S97-T100 PolarHBondContact O-N 3.27Å; S97-C101 PolarHBondContact O-N 3.48Å; S97-C101 VanDerWaalsContact O-N 3.1Å
98I83.8Confident85.5Confident115 Ų11560.2 Ų60.259%0.5934%0.34SS*.Hα-helixtrans-54.2-37.4174.9-65161.4000110.9C101 K102I98-C101 WeakPolarHBondContact O-CB 3.39Å; I98-C101 PolarHBondContact O-N 2.91Å; I98-K102 WeakPolarHBondContact O-CG 3.46Å; I98-K102 PolarHBondContact O-N 3.2Å
99L86.3Confident85.6Confident120 Ų12061.1 Ų61.163%0.62835%0.345SS*.Hα-helixtrans-61.6-46.2177.5179.662.6000111.5S97 C101 K102 V103S97-L99 PolarHBondContact O-N 3.48Å; S97-L99 PolarHBondContact OG-N 3.15Å; L99-C101 VanDerWaalsContact C-N 3.31Å; L99-C101 PolarHBondContact O-N 3Å; L99-K102 PolarHBondContact O-N 3.02Å; L99-V103 WeakPolarHBondContact O-CG2 3.49Å; L99-V103 PolarHBondContact O-N 2.89Å
100T88.3Confident85.9Confident47 Ų4754.7 Ų54.729%0.28832%0.318SS..Hα-helixtrans-62.1-42178.2-49.90000111F83 Y96 S97 K102 V103 I104F83-T100 HydrophobicContact CD1-CG2 4.13Å; F83-T100 HydrophobicContact CE1-CG2 3.33Å; F83-T100 HydrophobicContact CZ-CG2 3.83Å; Y96-T100 HydrophobicContact CG-CG2 4.47Å; S97-T100 WeakPolarHBondContact O-CB 3.25Å; S97-T100 PolarHBondContact O-N 3.27Å; T100-K102 PolarHBondContact O-N 3.34Å; T100-V103 PolarHBondContact O-N 3.44Å; T100-I104 HydrophobicContact CG2-CG1 4.45Å; T100-I104 VanDerWaalsContact O-CG1 3.3Å; T100-I104 WeakPolarHBondContact O-CG1 3.44Å; T100-I104 PolarHBondContact O-N 3.4Å
101C88.4Confident86.3Confident7 Ų751.2 Ų51.25%0.04730%0.299CS..Hα-helixtrans-59.6-44.3175.5-174.80000112.2L94 S97 I98 L99 I104 A105 C179L94-C101 HydrophobicContact CD1-CB 4.13Å; S97-C101 PolarHBondContact O-N 3.48Å; S97-C101 VanDerWaalsContact O-N 3.1Å; I98-C101 WeakPolarHBondContact O-CB 3.39Å; I98-C101 PolarHBondContact O-N 2.91Å; L99-C101 VanDerWaalsContact C-N 3.31Å; L99-C101 PolarHBondContact O-N 3Å; C101-I104 PolarHBondContact O-N 3Å; C101-A105 WeakPolarHBondContact O-CB 3.45Å; C101-A105 PolarHBondContact O-N 2.95Å; C101-C179 WeakPolarHBondContact CA-SG 3.41Å; C101-C179 HydrophobicContact CB-CB 4.09Å; C101-C179 WeakPolarHBondContact CB-SG 3.3Å; C101-C179 VanDerWaalsContact O-CB 3.29Å; C101-C179 WeakPolarHBondContact O-CB 3.38Å; C101-C179 WeakPolarHBondContact SG-CB 3.48Å; C101-C179 CovalentContact SG-SG 2.03Å; C101-C179 PolarHBondContact SG-SG 3.43Å
102K88.1Confident86.8Confident68 Ų6849.1 Ų49.130%0.29628%0.276SS..Hα-helixtrans-61.9-43.5176.1-71.9-177.3176.5-171.80112.5I98 L99 T100 A105 F106I98-K102 WeakPolarHBondContact O-CG 3.46Å; I98-K102 PolarHBondContact O-N 3.2Å; L99-K102 PolarHBondContact O-N 3.02Å; T100-K102 PolarHBondContact O-N 3.34Å; K102-A105 PolarHBondContact O-N 3.48Å; K102-F106 WeakPolarHBondContact O-CB 3.47Å; K102-F106 PolarHBondContact O-N 3.06Å
103V90.5Very high87.5Confident71 Ų7148 Ų4843%0.4327%0.266SS..Hα-helixtrans-63.8-43.6178.1172.30000111.1L99 T100 F106 L107L99-V103 WeakPolarHBondContact O-CG2 3.49Å; L99-V103 PolarHBondContact O-N 2.89Å; T100-V103 PolarHBondContact O-N 3.44Å; V103-F106 PolarHBondContact O-N 3.08Å; V103-L107 HydrophobicContact CG1-CD1 4.11Å; V103-L107 HydrophobicContact CG1-CG 4.46Å; V103-L107 WeakPolarHBondContact O-CG 3.42Å; V103-L107 PolarHBondContact O-N 2.66Å
104I92Very high88.4Confident13 Ų1343.6 Ų43.67%0.06724%0.24CC..Hα-helixtrans-67.6-40.7178.8-64.7-61.7000111.6I79 C80 F83 T100 C101 L107 G108I79-I104 HydrophobicContact CG2-CD1 3.85Å; C80-I104 HydrophobicContact CB-CG2 4.31Å; F83-I104 HydrophobicContact CB-CG2 4.32Å; F83-I104 HydrophobicContact CD1-CG1 4.11Å; F83-I104 HydrophobicContact CD2-CD1 3.39Å; F83-I104 HydrophobicContact CD2-CG1 3.71Å; F83-I104 HydrophobicContact CE1-CG1 4.28Å; F83-I104 HydrophobicContact CE2-CD1 3.34Å; F83-I104 HydrophobicContact CE2-CG1 3.89Å; F83-I104 HydrophobicContact CG-CD1 4.06Å; F83-I104 HydrophobicContact CG-CG1 3.84Å; F83-I104 HydrophobicContact CZ-CD1 3.98Å; F83-I104 HydrophobicContact CZ-CG1 4.17Å; T100-I104 HydrophobicContact CG2-CG1 4.45Å; T100-I104 VanDerWaalsContact O-CG1 3.3Å; T100-I104 WeakPolarHBondContact O-CG1 3.44Å; T100-I104 PolarHBondContact O-N 3.4Å; C101-I104 PolarHBondContact O-N 3Å; I104-L107 HydrophobicContact CD1-CD1 4.47Å; I104-L107 PolarHBondContact O-N 3.04Å; I104-G108 PolarHBondContact O-N 2.87Å
105A90.1Very high89.3Confident1 Ų140.7 Ų40.71%0.00823%0.225CC..Hα-helixtrans-60.9-45.5173.700000111.4C101 K102 G108 V109 Y170 C179C101-A105 WeakPolarHBondContact O-CB 3.45Å; C101-A105 PolarHBondContact O-N 2.95Å; K102-A105 PolarHBondContact O-N 3.48Å; A105-G108 PolarHBondContact O-N 3.1Å; A105-V109 WeakPolarHBondContact O-CG2 3.35Å; A105-V109 PolarHBondContact O-N 2.93Å; A105-Y170 HydrophobicContact CB-CD1 3.42Å; A105-Y170 VanDerWaalsContact CB-CD1 3.42Å; A105-Y170 HydrophobicContact CB-CE1 4.03Å; A105-Y170 HydrophobicContact CB-CG 3.75Å; A105-C179 WeakPolarHBondContact CA-O 3.27Å; A105-C179 HydrophobicContact CB-CB 4.06Å; A105-C179 WeakPolarHBondContact CB-O 3.43Å
106F91.8Very high90.4Very high45 Ų4537.2 Ų37.220%0.19720%0.204CC..Hα-helixtrans-58.5-48.4175.2171.3-96.6000111.9K102 V103 G108 V109 L110 A160 V164 Y170K102-F106 WeakPolarHBondContact O-CB 3.47Å; K102-F106 PolarHBondContact O-N 3.06Å; V103-F106 PolarHBondContact O-N 3.08Å; F106-G108 VanDerWaalsContact C-N 3.34Å; F106-G108 PolarHBondContact O-N 3.5Å; F106-V109 PolarHBondContact O-N 3.01Å; F106-L110 HydrophobicContact CE1-CD2 3.95Å; F106-L110 HydrophobicContact CZ-CD2 4.28Å; F106-L110 WeakPolarHBondContact O-CB 3.26Å; F106-L110 PolarHBondContact O-N 3.43Å; F106-A160 HydrophobicContact CD2-CB 3.84Å; F106-A160 WeakPolarHBondContact CD2-O 3.28Å; F106-A160 HydrophobicContact CE2-CB 3.58Å; F106-A160 HydrophobicContact CZ-CB 4.36Å; F106-V164 HydrophobicContact CB-CG2 4.4Å; F106-V164 HydrophobicContact CD2-CG2 3.55Å; F106-V164 HydrophobicContact CE2-CG2 4.22Å; F106-V164 HydrophobicContact CG-CG2 4.28Å; F106-Y170 HydrophobicContact CB-CE2 4.36Å
107L93.8Very high91.3Very high32 Ų3233.9 Ų33.917%0.16819%0.191CC..Hα-helixtrans-62.2-40.5178-72.6174.7000112I79 V103 I104 L110 S111I79-L107 HydrophobicContact CG2-CD1 4.08Å; V103-L107 HydrophobicContact CG1-CD1 4.11Å; V103-L107 HydrophobicContact CG1-CG 4.46Å; V103-L107 WeakPolarHBondContact O-CG 3.42Å; V103-L107 PolarHBondContact O-N 2.66Å; I104-L107 HydrophobicContact CD1-CD1 4.47Å; I104-L107 PolarHBondContact O-N 3.04Å; L107-L110 HydrophobicContact CD2-CD2 4.4Å; L107-L110 PolarHBondContact O-N 3.04Å; L107-S111 WeakPolarHBondContact O-CB 3.36Å; L107-S111 PolarHBondContact O-N 3.19Å; L107-S111 PolarHBondContact O-OG 2.83Å
108G92.1Very high91.8Very high26 Ų2630.2 Ų30.227%0.26817%0.165SC..Hα-helixtrans-61.7-47.9176.400000112.6I104 A105 F106 C112I104-G108 PolarHBondContact O-N 2.87Å; A105-G108 PolarHBondContact O-N 3.1Å; F106-G108 VanDerWaalsContact C-N 3.34Å; F106-G108 PolarHBondContact O-N 3.5Å; G108-C112 PolarHBondContact O-N 2.92Å; G108-C112 VanDerWaalsContact O-N 3.08Å
109V90.3Very high92.4Very high24 Ų2425 Ų2515%0.14514%0.139CC..Hα-helixtrans-66.7-42.9177.4173.80000111.4A105 F106 S111 C112 F113 A160 Y170A105-V109 WeakPolarHBondContact O-CG2 3.35Å; A105-V109 PolarHBondContact O-N 2.93Å; F106-V109 PolarHBondContact O-N 3.01Å; V109-S111 PolarHBondContact O-N 3.35Å; V109-C112 WeakPolarHBondContact O-CB 3.48Å; V109-C112 PolarHBondContact O-N 3.02Å; V109-C112 VanDerWaalsContact O-N 3.17Å; V109-F113 HydrophobicContact CG1-CD2 3.62Å; V109-F113 HydrophobicContact CG1-CE2 3.59Å; V109-F113 WeakPolarHBondContact O-CD2 3.35Å; V109-F113 PolarHBondContact O-N 3.05Å; V109-A160 HydrophobicContact CG1-CB 4.12Å; V109-Y170 HydrophobicContact CG2-CE1 3.9Å
110L93.8Very high92.8Very high10 Ų1022.7 Ų22.75%0.05212%0.124CC..Hα-helixtrans-55.7-51.2175.117666.3000111.3F106 L107 C112 F113 H114 W153 S156 V157 A160F106-L110 HydrophobicContact CE1-CD2 3.95Å; F106-L110 HydrophobicContact CZ-CD2 4.28Å; F106-L110 WeakPolarHBondContact O-CB 3.26Å; F106-L110 PolarHBondContact O-N 3.43Å; L107-L110 HydrophobicContact CD2-CD2 4.4Å; L107-L110 PolarHBondContact O-N 3.04Å; L110-C112 VanDerWaalsContact C-N 3.29Å; L110-C112 PolarHBondContact O-N 3.11Å; L110-F113 PolarHBondContact O-N 3.37Å; L110-H114 WeakPolarHBondContact O-CB 3.45Å; L110-H114 PolarHBondContact O-N 3.38Å; L110-W153 HydrophobicContact CD2-CZ3 4.01Å; L110-W153 HydrophobicContact CG-CZ3 4.26Å; L110-S156 VanDerWaalsContact CD1-C 3.43Å; L110-V157 HydrophobicContact CD1-CB 4.32Å; L110-V157 HydrophobicContact CD1-CG2 3.63Å; L110-A160 HydrophobicContact CB-CB 4.04Å; L110-A160 HydrophobicContact CD1-CB 4.39Å
111S94.2Very high93.2Very high1 Ų121.3 Ų21.31%0.00712%0.116CC..Hα-helixtrans-61.2-36.3177.5-74.30000112.5L107 V109 T115L107-S111 WeakPolarHBondContact O-CB 3.36Å; L107-S111 PolarHBondContact O-N 3.19Å; L107-S111 PolarHBondContact O-OG 2.83Å; V109-S111 PolarHBondContact O-N 3.35Å; S111-T115 WeakPolarHBondContact O-CB 3.44Å; S111-T115 WeakPolarHBondContact O-CG2 3.24Å; S111-T115 PolarHBondContact O-N 2.92Å; S111-T115 PolarHBondContact O-OG1 3.48Å
112C92.3Very high93.6Very high11 Ų1121 Ų217%0.07411%0.114CC..Hα-helixtrans-65.7-49176.7-176.10000112.2G108 V109 L110 H114 T115 A116 W305G108-C112 PolarHBondContact O-N 2.92Å; G108-C112 VanDerWaalsContact O-N 3.08Å; V109-C112 WeakPolarHBondContact O-CB 3.48Å; V109-C112 PolarHBondContact O-N 3.02Å; V109-C112 VanDerWaalsContact O-N 3.17Å; L110-C112 VanDerWaalsContact C-N 3.29Å; L110-C112 PolarHBondContact O-N 3.11Å; C112-H114 VanDerWaalsContact C-N 3.35Å; C112-T115 PolarHBondContact O-OG1 3.47Å; C112-A116 PolarHBondContact O-N 2.65Å; C112-A116 VanDerWaalsContact O-N 3.09Å; C112-W305 HydrophobicContact CB-CH2 3.81Å; C112-W305 HydrophobicContact CB-CZ2 4.32Å; C112-W305 HydrophobicContact CB-CZ3 4.32Å; C112-W305 WeakPolarHBondContact SG-CH2 3.4Å; C112-W305 WeakPolarHBondContact SG-CZ3 3.15Å
113F93Very high93.9Very high11 Ų1117.8 Ų17.85%0.04810%0.1CC..Hα-helixtrans-66.5-39.9177.8-81.3-71000111.6V109 L110 T115 A116 F117 M159 F194 L198V109-F113 HydrophobicContact CG1-CD2 3.62Å; V109-F113 HydrophobicContact CG1-CE2 3.59Å; V109-F113 WeakPolarHBondContact O-CD2 3.35Å; V109-F113 PolarHBondContact O-N 3.05Å; L110-F113 PolarHBondContact O-N 3.37Å; F113-T115 PolarHBondContact O-N 2.81Å; F113-A116 PolarHBondContact O-N 2.88Å; F113-F117 HydrophobicContact CB-CD2 4.3Å; F113-F117 HydrophobicContact CB-CE2 4.22Å; F113-F117 HydrophobicContact CD1-CE2 4.27Å; F113-F117 WeakPolarHBondContact O-CD2 3.47Å; F113-F117 PolarHBondContact O-N 3.16Å; F113-M159 HydrophobicContact CD1-CB 4.2Å; F113-M159 HydrophobicContact CD2-CB 4.07Å; F113-M159 HydrophobicContact CE1-CB 4.42Å; F113-M159 HydrophobicContact CE2-CB 4.28Å; F113-M159 HydrophobicContact CG-CB 4.03Å; F113-M159 HydrophobicContact CZ-CB 4.46Å; F113-F194 HydrophobicContact CZ-CB 4.44Å; F113-F194 HydrophobicContact CZ-CD1 4.32Å; F113-L198 HydrophobicContact CD1-CD1 4.28Å; F113-L198 HydrophobicContact CE1-CB 3.95Å; F113-L198 HydrophobicContact CE1-CD1 4.21Å; F113-L198 HydrophobicContact CZ-CB 4.4Å
114H95.9Very high94.1Very high0 Ų016.7 Ų16.70%09%0.093CC..Hα-helixtrans-56.6-51.3176.1-177.978.9000111.9D68 S72 L110 C112 A116 F117 M118 W153 S156D68-H114 IonicContact OD1-CE1 3.87Å; D68-H114 IonicContact OD1-NE2 3.69Å; D68-H114 IonicContact OD2-CD2 3.91Å; D68-H114 IonicContact OD2-CE1 3.23Å; D68-H114 PolarHBondContact OD2-CE1 3.32Å; D68-H114 VanDerWaalsContact OD2-CE1 3.23Å; D68-H114 IonicContact OD2-NE2 2.68Å; D68-H114 PolarHBondContact OD2-NE2 2.75Å; S72-H114 PolarHBondContact OG-CD2 3.43Å; L110-H114 WeakPolarHBondContact O-CB 3.45Å; L110-H114 PolarHBondContact O-N 3.38Å; C112-H114 VanDerWaalsContact C-N 3.35Å; H114-A116 VanDerWaalsContact C-N 3.35Å; H114-A116 PolarHBondContact O-N 3.06Å; H114-F117 PolarHBondContact O-N 2.75Å; H114-M118 WeakPolarHBondContact NE2-CG 3.5Å; H114-M118 VanDerWaalsContact O-CB 3.28Å; H114-M118 WeakPolarHBondContact O-CB 3.19Å; H114-M118 VanDerWaalsContact O-CG 3.3Å; H114-M118 WeakPolarHBondContact O-CG 3.44Å; H114-M118 PolarHBondContact O-N 2.91Å; H114-W153 AromaticContact CE1-CD1 3.52Å; H114-W153 AromaticContact CE1-CD2 3.73Å; H114-W153 AromaticContact CE1-CE2 3.36Å; H114-W153 AromaticContact CE1-CG 3.84Å; H114-W153 AromaticContact CE1-CZ2 3.91Å; H114-W153 AromaticContact CE1-NE1 3.2Å; H114-W153 PolarHBondContact CE1-NE1 3.07Å; H114-W153 AromaticContact ND1-CD2 3.64Å; H114-W153 AromaticContact ND1-CE2 3.7Å; H114-W153 AromaticContact ND1-CG 3.88Å; H114-W153 AromaticContact ND1-NE1 3.9Å; H114-W153 AromaticContact NE2-CE2 3.9Å; H114-W153 AromaticContact NE2-NE1 3.85Å; H114-S156 WeakPolarHBondContact CA-OG 3.21Å; H114-S156 PolarHBondContact N-OG 2.89Å
115T95.6Very high94.2Very high10 Ų1016.6 Ų16.66%0.0619%0.093CC..Hα-helixtrans-62.1-41.1177.645.60000112L69 S111 C112 F113 M118 L119L69-T115 HydrophobicContact CD2-CG2 4.06Å; S111-T115 WeakPolarHBondContact O-CB 3.44Å; S111-T115 WeakPolarHBondContact O-CG2 3.24Å; S111-T115 PolarHBondContact O-N 2.92Å; S111-T115 PolarHBondContact O-OG1 3.48Å; C112-T115 PolarHBondContact O-OG1 3.47Å; F113-T115 PolarHBondContact O-N 2.81Å; T115-M118 PolarHBondContact O-N 3.07Å; T115-L119 WeakPolarHBondContact O-CB 3.36Å; T115-L119 WeakPolarHBondContact O-CG 3.45Å; T115-L119 PolarHBondContact O-N 3.42Å
116A94.8Very high94.4Very high0 Ų016.6 Ų16.60%09%0.093CC..Hα-helixtrans-62.4-49176.800000112.8C112 F113 H114 L119 F120 L198 I201 L202C112-A116 PolarHBondContact O-N 2.65Å; C112-A116 VanDerWaalsContact O-N 3.09Å; F113-A116 PolarHBondContact O-N 2.88Å; H114-A116 VanDerWaalsContact C-N 3.35Å; H114-A116 PolarHBondContact O-N 3.06Å; A116-L119 PolarHBondContact O-N 3.33Å; A116-F120 PolarHBondContact O-N 2.92Å; A116-L198 HydrophobicContact CB-CD1 3.73Å; A116-I201 HydrophobicContact CB-CG2 4.28Å; A116-L202 HydrophobicContact CB-CD2 4.29Å
117F96.3Very high94.5Very high22 Ų2216.2 Ų16.210%0.0969%0.091CC..Hα-helixtrans-65.1-40.9177.1-75.4-54.6000112.2F113 H114 L119 F120 C121 V152 L155 M159 I201F113-F117 HydrophobicContact CB-CD2 4.3Å; F113-F117 HydrophobicContact CB-CE2 4.22Å; F113-F117 HydrophobicContact CD1-CE2 4.27Å; F113-F117 WeakPolarHBondContact O-CD2 3.47Å; F113-F117 PolarHBondContact O-N 3.16Å; H114-F117 PolarHBondContact O-N 2.75Å; F117-L119 PolarHBondContact O-N 2.92Å; F117-F120 WeakPolarHBondContact O-CB 3.23Å; F117-F120 PolarHBondContact O-N 3.42Å; F117-C121 PolarHBondContact O-N 3.05Å; F117-C121 PolarHBondContact O-SG 2.8Å; F117-V152 HydrophobicContact CB-CB 4.43Å; F117-V152 HydrophobicContact CB-CG1 3.48Å; F117-V152 VanDerWaalsContact CB-CG1 3.48Å; F117-V152 HydrophobicContact CB-CG2 4.24Å; F117-L155 HydrophobicContact CD2-CB 4.22Å; F117-L155 HydrophobicContact CE2-CB 4.03Å; F117-L155 HydrophobicContact CZ-CB 4.39Å; F117-M159 HydrophobicContact CE2-CG 4.06Å; F117-M159 HydrophobicContact CZ-CG 4.19Å; F117-I201 HydrophobicContact CD1-CD1 3.87Å; F117-I201 HydrophobicContact CD1-CG1 4.41Å; F117-I201 HydrophobicContact CD1-CG2 4.34Å; F117-I201 HydrophobicContact CE1-CD1 3.19Å; F117-I201 HydrophobicContact CE1-CG1 3.93Å; F117-I201 HydrophobicContact CE2-CD1 4.39Å; F117-I201 HydrophobicContact CZ-CD1 3.49Å; F117-I201 VanDerWaalsContact CZ-CD1 3.49Å
118M96.8Very high94.4Very high0 Ų017 Ų170%010%0.095CC..Hα-helixtrans-62.4-42.9176-78.2-51.7-66.900111.6F65 D68 L69 H114 T115 F120 C121 V122 I149 V152F65-M118 HydrophobicContact CB-CE 3.82Å; F65-M118 HydrophobicContact CD1-CE 3.64Å; F65-M118 HydrophobicContact CE1-CE 4.49Å; F65-M118 HydrophobicContact CG-CE 3.96Å; D68-M118 HydrophobicContact CB-CE 4.44Å; D68-M118 WeakPolarHBondContact OD2-CG 3.4Å; L69-M118 HydrophobicContact CD2-CB 3.86Å; L69-M118 HydrophobicContact CG-CB 4.4Å; H114-M118 WeakPolarHBondContact NE2-CG 3.5Å; H114-M118 VanDerWaalsContact O-CB 3.28Å; H114-M118 WeakPolarHBondContact O-CB 3.19Å; H114-M118 VanDerWaalsContact O-CG 3.3Å; H114-M118 WeakPolarHBondContact O-CG 3.44Å; H114-M118 PolarHBondContact O-N 2.91Å; T115-M118 PolarHBondContact O-N 3.07Å; M118-F120 VanDerWaalsContact C-N 3.3Å; M118-F120 PolarHBondContact O-N 3.46Å; M118-C121 PolarHBondContact O-N 3.22Å; M118-V122 WeakPolarHBondContact O-CB 3.5Å; M118-V122 WeakPolarHBondContact O-CG2 3.17Å; M118-V122 PolarHBondContact O-N 3.46Å; M118-I149 HydrophobicContact CE-CG1 4.07Å; M118-V152 HydrophobicContact CB-CG1 4.48Å; M118-V152 HydrophobicContact CG-CB 4.3Å; M118-V152 HydrophobicContact CG-CG1 3.59Å; M118-V152 HydrophobicContact SD-CB 3.59Å; M118-V152 VanDerWaalsContact SD-CB 3.59Å; M118-V152 HydrophobicContact SD-CG1 3.59Å; M118-V152 VanDerWaalsContact SD-CG1 3.59Å; M118-V152 HydrophobicContact SD-CG2 3.64Å
119L95.3Very high94.4Very high7 Ų715.8 Ų15.84%0.0378%0.082CC..Hα-helixtrans-63.1-37175.8-71.1174.6000112L69 T115 A116 F117 V122 S123 F301L69-L119 HydrophobicContact CD1-CD2 4.25Å; T115-L119 WeakPolarHBondContact O-CB 3.36Å; T115-L119 WeakPolarHBondContact O-CG 3.45Å; T115-L119 PolarHBondContact O-N 3.42Å; A116-L119 PolarHBondContact O-N 3.33Å; F117-L119 PolarHBondContact O-N 2.92Å; L119-V122 PolarHBondContact O-N 3.1Å; L119-S123 WeakPolarHBondContact O-CB 3Å; L119-S123 PolarHBondContact O-N 3.44Å; L119-F301 HydrophobicContact CD1-CB 3.68Å; L119-F301 HydrophobicContact CD1-CD1 3.96Å; L119-F301 HydrophobicContact CD1-CD2 3.68Å; L119-F301 HydrophobicContact CD1-CE2 4.31Å; L119-F301 HydrophobicContact CD1-CG 3.47Å; L119-F301 VanDerWaalsContact CD1-CG 3.47Å
120F96.4Very high94.4Very high70 Ų7015.4 Ų15.431%0.3078%0.079SC..Hα-helixtrans-62-52.4172177.8-105.9000111.7A116 F117 M118 V122 S123 V124 I201 A204 T205 V208A116-F120 PolarHBondContact O-N 2.92Å; F117-F120 WeakPolarHBondContact O-CB 3.23Å; F117-F120 PolarHBondContact O-N 3.42Å; M118-F120 VanDerWaalsContact C-N 3.3Å; M118-F120 PolarHBondContact O-N 3.46Å; F120-V122 VanDerWaalsContact C-N 3.29Å; F120-V122 PolarHBondContact O-N 3.27Å; F120-S123 WeakPolarHBondContact O-CB 2.93Å; F120-S123 PolarHBondContact O-N 3.29Å; F120-S123 PolarHBondContact O-OG 3.05Å; F120-V124 HydrophobicContact CE1-CG2 4.18Å; F120-V124 HydrophobicContact CE2-CG2 4.23Å; F120-V124 HydrophobicContact CZ-CG2 3.97Å; F120-V124 PolarHBondContact O-N 2.92Å; F120-I201 HydrophobicContact CB-CG2 4.27Å; F120-A204 HydrophobicContact CD2-CB 4.37Å; F120-A204 HydrophobicContact CE2-CB 4.05Å; F120-T205 WeakPolarHBondContact CA-OG1 3.44Å; F120-T205 WeakPolarHBondContact CB-OG1 3.49Å; F120-V208 HydrophobicContact CE2-CG2 4.15Å
121C96.4Very high94.1Very high18 Ų1815.9 Ų15.912%0.1228%0.084CC..Hα-helixtrans-59.8-38.6178-70.90000112.3F117 M118 V124 T125 V148F117-C121 PolarHBondContact O-N 3.05Å; F117-C121 PolarHBondContact O-SG 2.8Å; M118-C121 PolarHBondContact O-N 3.22Å; C121-V124 PolarHBondContact O-N 3.49Å; C121-T125 WeakPolarHBondContact O-CB 3.43Å; C121-T125 PolarHBondContact O-N 3.41Å; C121-T125 PolarHBondContact O-OG1 3.34Å; C121-V148 HydrophobicContact CB-CG1 3.95Å
122V95.6Very high93.9Very high1 Ų120.6 Ų20.61%0.00611%0.106CC..Hα-helixtrans-61.3-46.5173.1166.60000110.5F65 M118 L119 F120 V124 T125 R126 F294F65-V122 HydrophobicContact CB-CG2 3.61Å; F65-V122 HydrophobicContact CD2-CG2 3.86Å; F65-V122 HydrophobicContact CG-CG2 4.06Å; M118-V122 WeakPolarHBondContact O-CB 3.5Å; M118-V122 WeakPolarHBondContact O-CG2 3.17Å; M118-V122 PolarHBondContact O-N 3.46Å; L119-V122 PolarHBondContact O-N 3.1Å; F120-V122 VanDerWaalsContact C-N 3.29Å; F120-V122 PolarHBondContact O-N 3.27Å; V122-V124 PolarHBondContact O-N 2.82Å; V122-T125 WeakPolarHBondContact O-CB 3.25Å; V122-T125 PolarHBondContact O-N 2.91Å; V122-T125 VanDerWaalsContact O-N 3.16Å; V122-R126 HydrophobicContact CG1-CG 4.24Å; V122-R126 VanDerWaalsContact O-CG 3.31Å; V122-R126 WeakPolarHBondContact O-CG 3.24Å; V122-R126 PolarHBondContact O-N 3.48Å; V122-F294 HydrophobicContact CG1-CB 3.78Å; V122-F294 HydrophobicContact CG1-CD1 3.41Å; V122-F294 VanDerWaalsContact CG1-CD1 3.41Å; V122-F294 HydrophobicContact CG1-CD2 4.24Å; V122-F294 HydrophobicContact CG1-CE1 3.99Å; V122-F294 HydrophobicContact CG1-CG 3.53Å; V122-F294 HydrophobicContact CG2-CE1 4.49Å
123S95.6Very high93.6Very high0 Ų022.8 Ų22.80%012%0.115CC..Hα-helixtrans-58.7-45.2179.579.30000112.2L119 F120 R126 Y127 V208L119-S123 WeakPolarHBondContact O-CB 3Å; L119-S123 PolarHBondContact O-N 3.44Å; F120-S123 WeakPolarHBondContact O-CB 2.93Å; F120-S123 PolarHBondContact O-N 3.29Å; F120-S123 PolarHBondContact O-OG 3.05Å; S123-R126 PolarHBondContact O-N 3.23Å; S123-Y127 PolarHBondContact O-N 3.39Å; S123-V208 WeakPolarHBondContact OG-CG1 3.43Å
124V95.2Very high93.3Very high49 Ų4931.8 Ų31.830%0.29715%0.149SC..Hα-helixtrans-62.9-44.9175.6174.90000110.4F120 C121 V122 R126 Y127 L128 V208F120-V124 HydrophobicContact CE1-CG2 4.18Å; F120-V124 HydrophobicContact CE2-CG2 4.23Å; F120-V124 HydrophobicContact CZ-CG2 3.97Å; F120-V124 PolarHBondContact O-N 2.92Å; C121-V124 PolarHBondContact O-N 3.49Å; V122-V124 PolarHBondContact O-N 2.82Å; V124-R126 VanDerWaalsContact C-N 3.34Å; V124-R126 PolarHBondContact O-N 2.96Å; V124-Y127 WeakPolarHBondContact O-CB 3.28Å; V124-Y127 PolarHBondContact O-N 2.9Å; V124-L128 HydrophobicContact CG1-CD1 4.14Å; V124-L128 HydrophobicContact CG1-CG 4.42Å; V124-L128 WeakPolarHBondContact O-CG 3.47Å; V124-L128 PolarHBondContact O-N 3.37Å; V124-V208 HydrophobicContact CG2-CG1 4.41Å; V124-V208 HydrophobicContact CG2-CG2 4.44Å
125T94.1Very high93Very high11 Ų1137.1 Ų37.17%0.06717%0.172CC..Hα-helixtrans-60.3-43.2177.7-58.80000111.9F65 C121 V122 L128 A129 Y136 L140F65-T125 HydrophobicContact CE2-CG2 3.97Å; F65-T125 WeakPolarHBondContact CE2-OG1 3.33Å; C121-T125 WeakPolarHBondContact O-CB 3.43Å; C121-T125 PolarHBondContact O-N 3.41Å; C121-T125 PolarHBondContact O-OG1 3.34Å; V122-T125 WeakPolarHBondContact O-CB 3.25Å; V122-T125 PolarHBondContact O-N 2.91Å; V122-T125 VanDerWaalsContact O-N 3.16Å; T125-L128 PolarHBondContact O-N 3.06Å; T125-A129 WeakPolarHBondContact O-CB 3.49Å; T125-A129 PolarHBondContact O-N 3.11Å; T125-Y136 HydrophobicContact CG2-CD2 4.44Å; T125-Y136 HydrophobicContact CG2-CE2 3.86Å; T125-L140 HydrophobicContact CG2-CD1 4.49Å; T125-L140 HydrophobicContact CG2-CD2 3.46Å; T125-L140 VanDerWaalsContact CG2-CD2 3.46Å
126R94.1Very high92.7Very high1 Ų137.6 Ų37.60%0.00417%0.173CC..Hα-helixtrans-66.1-39177.3-65.9-55.584.5-157.3-1.5111.5V122 S123 V124 A129 I130 Y136 L212 E287 F294V122-R126 HydrophobicContact CG1-CG 4.24Å; V122-R126 VanDerWaalsContact O-CG 3.31Å; V122-R126 WeakPolarHBondContact O-CG 3.24Å; V122-R126 PolarHBondContact O-N 3.48Å; S123-R126 PolarHBondContact O-N 3.23Å; V124-R126 VanDerWaalsContact C-N 3.34Å; V124-R126 PolarHBondContact O-N 2.96Å; R126-A129 PolarHBondContact O-N 3.44Å; R126-I130 PolarHBondContact O-N 2.88Å; R126-Y136 PolarHBondContact NH2-OH 3.39Å; R126-L212 HydrophobicContact CB-CD2 4.4Å; R126-E287 IonicContact CZ-OE2 3.65Å; R126-E287 IonicContact NH1-OE2 2.66Å; R126-E287 PolarHBondContact NH1-OE2 3.23Å; R126-E287 IonicContact NH2-OE2 3.87Å; R126-F294 HydrophobicContact CG-CB 4.4Å; R126-F294 HydrophobicContact CG-CD2 4.43Å
127Y93Very high92.3Very high36 Ų3641 Ų4114%0.14119%0.194CC..Hα-helixtrans-59.6-48.2172175.1-95.5000111.6S123 V124 A129 I130 A131 K211 L212S123-Y127 PolarHBondContact O-N 3.39Å; V124-Y127 WeakPolarHBondContact O-CB 3.28Å; V124-Y127 PolarHBondContact O-N 2.9Å; Y127-A129 VanDerWaalsContact C-N 3.34Å; Y127-A129 PolarHBondContact O-N 2.99Å; Y127-I130 PolarHBondContact O-N 3.43Å; Y127-A131 HydrophobicContact CD2-CB 4.32Å; Y127-A131 HydrophobicContact CE1-CB 4.1Å; Y127-A131 HydrophobicContact CE2-CB 3.92Å; Y127-A131 VanDerWaalsContact O-CB 3.27Å; Y127-A131 WeakPolarHBondContact O-CB 3.34Å; Y127-A131 PolarHBondContact O-N 3.34Å; Y127-K211 HydrophobicContact CE2-CD 3.88Å; Y127-K211 HydrophobicContact CE2-CG 4.03Å; Y127-K211 VanDerWaalsContact OH-CE 3.29Å; Y127-K211 WeakPolarHBondContact OH-CE 3.36Å; Y127-K211 PolarHBondContact OH-NZ 2.76Å; Y127-L212 HydrophobicContact CD2-CB 4.24Å
128L92.7Very high91.9Very high49 Ų4947.2 Ų47.226%0.25722%0.221SC..Hα-helixtrans-62.6-39.2177.8-68.1174.4000112.4V124 T125 I130 H132 H133 F135V124-L128 HydrophobicContact CG1-CD1 4.14Å; V124-L128 HydrophobicContact CG1-CG 4.42Å; V124-L128 WeakPolarHBondContact O-CG 3.47Å; V124-L128 PolarHBondContact O-N 3.37Å; T125-L128 PolarHBondContact O-N 3.06Å; L128-I130 VanDerWaalsContact C-N 3.3Å; L128-I130 PolarHBondContact O-N 3.24Å; L128-H132 CarbonylContact O-C 3.01Å; L128-H132 WeakPolarHBondContact O-CA 3.31Å; L128-H132 PolarHBondContact O-N 3.25Å; L128-H133 PolarHBondContact O-N 3.32Å; L128-F135 HydrophobicContact CD1-CE1 4.49Å
129A91.1Very high91.6Very high1 Ų155.1 Ų55.11%0.00825%0.251CS..Hα-helixtrans-59.7-39.3178.200000112.8T125 R126 Y127 H133 Y136T125-A129 WeakPolarHBondContact O-CB 3.49Å; T125-A129 PolarHBondContact O-N 3.11Å; R126-A129 PolarHBondContact O-N 3.44Å; Y127-A129 VanDerWaalsContact C-N 3.34Å; Y127-A129 PolarHBondContact O-N 2.99Å; A129-H133 WeakPolarHBondContact O-CB 3.43Å; A129-Y136 HydrophobicContact CB-CD1 4.31Å; A129-Y136 HydrophobicContact CB-CD2 3.63Å; A129-Y136 HydrophobicContact CB-CE1 4.29Å; A129-Y136 HydrophobicContact CB-CE2 3.57Å; A129-Y136 HydrophobicContact CB-CG 4.01Å
130I89.9Confident91.4Very high16 Ų1656.9 Ų56.98%0.08226%0.26CS..Hα-helixtrans-90.4-45.9-176.2-67.1172.2000111.9R126 Y127 L128 L212 F215 V216 F284 S291R126-I130 PolarHBondContact O-N 2.88Å; Y127-I130 PolarHBondContact O-N 3.43Å; L128-I130 VanDerWaalsContact C-N 3.3Å; L128-I130 PolarHBondContact O-N 3.24Å; I130-L212 HydrophobicContact CB-CD1 3.87Å; I130-L212 HydrophobicContact CD1-CD1 3.68Å; I130-L212 HydrophobicContact CD1-CD2 4.29Å; I130-L212 HydrophobicContact CD1-CG 4.49Å; I130-L212 HydrophobicContact CG1-CD1 4.32Å; I130-L212 HydrophobicContact CG2-CD1 3.97Å; I130-F215 HydrophobicContact CG2-CD1 4.21Å; I130-F215 HydrophobicContact CG2-CE1 4.21Å; I130-V216 HydrophobicContact CG2-CG2 3.8Å; I130-F284 HydrophobicContact CG2-CE2 4.2Å; I130-F284 HydrophobicContact CG2-CZ 4.33Å; I130-S291 VanDerWaalsContact CD1-OG 3.29Å; I130-S291 WeakPolarHBondContact CD1-OG 3.25Å
131A88.9Confident91.2Very high19 Ų1956.7 Ų56.716%0.15727%0.265CS..Hα-helixtrans-81.8-34.8-174.800000113Y127 F215Y127-A131 HydrophobicContact CD2-CB 4.32Å; Y127-A131 HydrophobicContact CE1-CB 4.1Å; Y127-A131 HydrophobicContact CE2-CB 3.92Å; Y127-A131 VanDerWaalsContact O-CB 3.27Å; Y127-A131 WeakPolarHBondContact O-CB 3.34Å; Y127-A131 PolarHBondContact O-N 3.34Å; A131-F215 HydrophobicContact CB-CD1 4.18Å; A131-F215 HydrophobicContact CB-CE1 3.83Å; A131-F215 HydrophobicContact CB-CE2 4.17Å; A131-F215 HydrophobicContact CB-CZ 3.81Å
132H88.7Confident91Very high101 Ų10160.9 Ų60.947%0.46828%0.281SS..  trans-132.152.7-174.9-62.3-71000111.6L128 R134 F135 Y136L128-H132 CarbonylContact O-C 3.01Å; L128-H132 WeakPolarHBondContact O-CA 3.31Å; L128-H132 PolarHBondContact O-N 3.25Å; H132-R134 PolarHBondContact O-N 2.95Å; H132-R134 VanDerWaalsContact O-N 3.08Å; H132-F135 HydrophobicContact CB-CB 4.18Å; H132-F135 WeakPolarHBondContact O-CB 3.21Å; H132-F135 PolarHBondContact O-N 2.64Å; H132-Y136 PolarHBondContact O-N 3.47Å
133H86.6Confident90.9Very high57 Ų5770 Ų7026%0.26432%0.315SS..Hα-helixtrans-50.8-37.9-174.7-178.470.7000114.4L128 A129 F135 Y136 T137 E283L128-H133 PolarHBondContact O-N 3.32Å; A129-H133 WeakPolarHBondContact O-CB 3.43Å; H133-F135 PolarHBondContact O-N 3.14Å; H133-Y136 PolarHBondContact O-N 2.87Å; H133-T137 WeakPolarHBondContact O-CG2 3.3Å; H133-T137 PolarHBondContact O-N 3.44Å; H133-T137 PolarHBondContact O-OG1 2.99Å; H133-E283 IonicContact CE1-OE1 3.37Å; H133-E283 PolarHBondContact CE1-OE1 3.37Å; H133-E283 IonicContact NE2-OE1 3.83Å
134R86.3Confident90.8Very high199 Ų19972.3 Ų72.375%0.75133%0.33SS*.Hα-helixtrans-66.4-35177.9-165-179-148.7-176.16.4113.3H132 T137 K138H132-R134 PolarHBondContact O-N 2.95Å; H132-R134 VanDerWaalsContact O-N 3.08Å; R134-T137 PolarHBondContact O-OG1 3.04Å; R134-K138 WeakPolarHBondContact O-CG 3.15Å
135F89.2Confident90.8Very high112 Ų11270 Ų7049%0.49132%0.316SS..Hα-helixtrans-73.2-45.1175.7179.5-91.6000109.9L128 H132 H133 T137 K138 R139L128-F135 HydrophobicContact CD1-CE1 4.49Å; H132-F135 HydrophobicContact CB-CB 4.18Å; H132-F135 WeakPolarHBondContact O-CB 3.21Å; H132-F135 PolarHBondContact O-N 2.64Å; H133-F135 PolarHBondContact O-N 3.14Å; F135-T137 PolarHBondContact O-N 2.83Å; F135-K138 PolarHBondContact O-N 3.15Å; F135-R139 HydrophobicContact CD1-CB 4.4Å; F135-R139 HydrophobicContact CD1-CG 4.33Å; F135-R139 HydrophobicContact CD2-CG 3.98Å; F135-R139 HydrophobicContact CE1-CB 4.11Å; F135-R139 HydrophobicContact CE1-CG 4.05Å; F135-R139 HydrophobicContact CE2-CG 3.69Å; F135-R139 HydrophobicContact CG-CG 4.3Å; F135-R139 HydrophobicContact CZ-CB 4.22Å; F135-R139 HydrophobicContact CZ-CG 3.73Å; F135-R139 WeakPolarHBondContact O-CB 3.35Å; F135-R139 PolarHBondContact O-N 2.99Å
136Y89.6Confident90.9Very high20 Ų2072.9 Ų72.98%0.07833%0.331CS..Hα-helixtrans-53.7-53176.9172.9-91.4000112.3P62 T125 R126 A129 H132 H133 K138 R139 L140P62-Y136 WeakPolarHBondContact CD-OH 3.33Å; T125-Y136 HydrophobicContact CG2-CD2 4.44Å; T125-Y136 HydrophobicContact CG2-CE2 3.86Å; R126-Y136 PolarHBondContact NH2-OH 3.39Å; A129-Y136 HydrophobicContact CB-CD1 4.31Å; A129-Y136 HydrophobicContact CB-CD2 3.63Å; A129-Y136 HydrophobicContact CB-CE1 4.29Å; A129-Y136 HydrophobicContact CB-CE2 3.57Å; A129-Y136 HydrophobicContact CB-CG 4.01Å; H132-Y136 PolarHBondContact O-N 3.47Å; H133-Y136 PolarHBondContact O-N 2.87Å; Y136-K138 VanDerWaalsContact C-N 3.28Å; Y136-K138 PolarHBondContact O-N 3.15Å; Y136-R139 PolarHBondContact O-N 3.28Å; Y136-L140 HydrophobicContact CD2-CB 4.25Å; Y136-L140 HydrophobicContact CD2-CD2 3.52Å; Y136-L140 HydrophobicContact CE2-CB 4.4Å; Y136-L140 HydrophobicContact CE2-CD2 3.02Å; Y136-L140 HydrophobicContact CE2-CG 4.33Å; Y136-L140 HydrophobicContact CG-CD2 4.5Å; Y136-L140 WeakPolarHBondContact O-CB 3.23Å; Y136-L140 PolarHBondContact O-N 3.18Å
137T86Confident91Very high73 Ų7375.7 Ų75.745%0.44835%0.354SS..Hα-helixtrans-65.6-28.6-177.5480000113.7H133 R134 F135H133-T137 WeakPolarHBondContact O-CG2 3.3Å; H133-T137 PolarHBondContact O-N 3.44Å; H133-T137 PolarHBondContact O-OG1 2.99Å; R134-T137 PolarHBondContact O-OG1 3.04Å; F135-T137 PolarHBondContact O-N 2.83Å
138K89.3Confident91.2Very high151 Ų15175.8 Ų75.866%0.65736%0.358SS*.Hα-helixtrans-84.9-35.5178.5-73.2-170174.5-165.60113.9R134 F135 Y136R134-K138 WeakPolarHBondContact O-CG 3.15Å; F135-K138 PolarHBondContact O-N 3.15Å; Y136-K138 VanDerWaalsContact C-N 3.28Å; Y136-K138 PolarHBondContact O-N 3.15Å
139R90.4Very high91.5Very high167 Ų16774.6 Ų74.663%0.6335%0.352SS*.Hα-helixtrans-99.8-30.7-170.5-68.7-68.4-166.9173.71.7113.3F135 Y136 T141 T144F135-R139 HydrophobicContact CD1-CB 4.4Å; F135-R139 HydrophobicContact CD1-CG 4.33Å; F135-R139 HydrophobicContact CD2-CG 3.98Å; F135-R139 HydrophobicContact CE1-CB 4.11Å; F135-R139 HydrophobicContact CE1-CG 4.05Å; F135-R139 HydrophobicContact CE2-CG 3.69Å; F135-R139 HydrophobicContact CG-CG 4.3Å; F135-R139 HydrophobicContact CZ-CB 4.22Å; F135-R139 HydrophobicContact CZ-CG 3.73Å; F135-R139 WeakPolarHBondContact O-CB 3.35Å; F135-R139 PolarHBondContact O-N 2.99Å; Y136-R139 PolarHBondContact O-N 3.28Å; R139-T141 VanDerWaalsContact C-N 3.31Å; R139-T141 PolarHBondContact O-N 3.35Å; R139-T144 WeakPolarHBondContact O-CG2 3.47Å; R139-T144 PolarHBondContact O-OG1 2.92Å
140L90.3Very high91.8Very high44 Ų4477.8 Ų77.823%0.2337%0.373CS..  trans-86.874.4-173.3-157.272.7000111.5A61 T125 Y136 T144A61-L140 HydrophobicContact CB-CD2 3.16Å; A61-L140 HydrophobicContact CB-CG 3.58Å; T125-L140 HydrophobicContact CG2-CD1 4.49Å; T125-L140 HydrophobicContact CG2-CD2 3.46Å; T125-L140 VanDerWaalsContact CG2-CD2 3.46Å; Y136-L140 HydrophobicContact CD2-CB 4.25Å; Y136-L140 HydrophobicContact CD2-CD2 3.52Å; Y136-L140 HydrophobicContact CE2-CB 4.4Å; Y136-L140 HydrophobicContact CE2-CD2 3.02Å; Y136-L140 HydrophobicContact CE2-CG 4.33Å; Y136-L140 HydrophobicContact CG-CD2 4.5Å; Y136-L140 WeakPolarHBondContact O-CB 3.23Å; Y136-L140 PolarHBondContact O-N 3.18Å; L140-T144 WeakPolarHBondContact CA-OG1 3.3Å
141T92.7Very high92.1Very high65 Ų6581.2 Ų81.240%0.39939%0.39SS..  trans-89.5170174.968.70000111.4R139 W143 T144 C145R139-T141 VanDerWaalsContact C-N 3.31Å; R139-T141 PolarHBondContact O-N 3.35Å; T141-W143 VanDerWaalsContact C-N 3.31Å; T141-W143 PolarHBondContact O-N 3.01Å; T141-T144 PolarHBondContact N-OG1 3.49Å; T141-T144 PolarHBondContact O-N 3.5Å; T141-T144 PolarHBondContact O-OG1 3.2Å; T141-T144 PolarHBondContact OG1-N 2.92Å; T141-C145 PolarHBondContact O-N 2.95Å; T141-C145 PolarHBondContact O-SG 3.1Å
142F91.3Very high92.5Very high107 Ų10780.3 Ų80.347%0.46938%0.382SS..Hα-helixtrans-52.1-47.7173.7175.1-100.8000112.6Y64 T144 C145 L146Y64-F142 HydrophobicContact CD2-CD2 4.38Å; Y64-F142 HydrophobicContact CE1-CD2 4.36Å; Y64-F142 HydrophobicContact CE1-CE2 4.48Å; Y64-F142 AromaticContact CE2-CD2 3.86Å; Y64-F142 HydrophobicContact CE2-CD2 3.86Å; Y64-F142 AromaticContact CZ-CD2 3.84Å; F142-T144 VanDerWaalsContact C-N 3.32Å; F142-T144 PolarHBondContact O-N 3.46Å; F142-C145 WeakPolarHBondContact O-CB 3.47Å; F142-C145 PolarHBondContact O-N 2.97Å; F142-C145 VanDerWaalsContact O-N 3.08Å; F142-L146 PolarHBondContact O-N 2.86Å
143W94.2Very high92.9Very high191 Ų19179 Ų7972%0.72337%0.374SS*.Hα-helixtrans-61.8-38179.4-64.5110.2000113T141 L146 A147T141-W143 VanDerWaalsContact C-N 3.31Å; T141-W143 PolarHBondContact O-N 3.01Å; W143-L146 HydrophobicContact CE3-CD2 4.09Å; W143-L146 HydrophobicContact CZ3-CD2 4.12Å; W143-L146 PolarHBondContact O-N 3.45Å; W143-A147 WeakPolarHBondContact O-CB 3.41Å; W143-A147 PolarHBondContact O-N 3.45Å
144T94.3Very high93.4Very high49 Ų4980.7 Ų80.730%0.30139%0.388SS..Hα-helixtrans-67.7-36.6174.460.80000112.4R139 L140 T141 F142 A147 V148R139-T144 WeakPolarHBondContact O-CG2 3.47Å; R139-T144 PolarHBondContact O-OG1 2.92Å; L140-T144 WeakPolarHBondContact CA-OG1 3.3Å; T141-T144 PolarHBondContact N-OG1 3.49Å; T141-T144 PolarHBondContact O-N 3.5Å; T141-T144 PolarHBondContact O-OG1 3.2Å; T141-T144 PolarHBondContact OG1-N 2.92Å; F142-T144 VanDerWaalsContact C-N 3.32Å; F142-T144 PolarHBondContact O-N 3.46Å; T144-A147 PolarHBondContact O-N 2.97Å; T144-V148 VanDerWaalsContact O-CG2 3.28Å; T144-V148 WeakPolarHBondContact O-CG2 3.29Å; T144-V148 PolarHBondContact O-N 3.43Å
145C95.1Very high93.8Very high2 Ų274.3 Ų74.31%0.01437%0.368CS..Hα-helixtrans-64.8-43.7175.2-60.10000110.7A61 Y64 F65 T141 F142 V148 I149A61-C145 WeakPolarHBondContact CB-SG 3.41Å; Y64-C145 HydrophobicContact CD2-CB 4.17Å; F65-C145 HydrophobicContact CE1-CB 3.97Å; F65-C145 HydrophobicContact CZ-CB 4.29Å; T141-C145 PolarHBondContact O-N 2.95Å; T141-C145 PolarHBondContact O-SG 3.1Å; F142-C145 WeakPolarHBondContact O-CB 3.47Å; F142-C145 PolarHBondContact O-N 2.97Å; F142-C145 VanDerWaalsContact O-N 3.08Å; C145-V148 PolarHBondContact O-N 3.18Å; C145-I149 WeakPolarHBondContact O-CG1 3.48Å; C145-I149 PolarHBondContact O-N 2.99Å
146L95.6Very high94.1Very high71 Ų7169 Ų6937%0.37235%0.345SS..Hα-helixtrans-60.6-46.4175.3-177.863.1000111.4F142 W143 V148 I149 C150F142-L146 PolarHBondContact O-N 2.86Å; W143-L146 HydrophobicContact CE3-CD2 4.09Å; W143-L146 HydrophobicContact CZ3-CD2 4.12Å; W143-L146 PolarHBondContact O-N 3.45Å; L146-V148 VanDerWaalsContact C-N 3.32Å; L146-V148 PolarHBondContact O-N 2.78Å; L146-I149 PolarHBondContact O-N 3.46Å; L146-C150 PolarHBondContact O-N 2.82Å; L146-C150 PolarHBondContact O-SG 3.37Å
147A96.8Very high94.2Very high60 Ų6070.9 Ų70.950%0.49636%0.359SS..Hα-helixtrans-60.5-40.317700000112.4W143 T144 M151W143-A147 WeakPolarHBondContact O-CB 3.41Å; W143-A147 PolarHBondContact O-N 3.45Å; T144-A147 PolarHBondContact O-N 2.97Å; A147-M151 VanDerWaalsContact O-CB 3.29Å; A147-M151 WeakPolarHBondContact O-CB 3.48Å; A147-M151 PolarHBondContact O-N 3.15Å
148V96.9Very high94.5Very high37 Ų3770.3 Ų70.322%0.22436%0.361CS..Hα-helixtrans-63.2-45.9174.3169.80000111F65 C121 T144 C145 L146 M151 V152F65-V148 HydrophobicContact CE1-CB 4.16Å; F65-V148 HydrophobicContact CE1-CG1 3.96Å; F65-V148 HydrophobicContact CZ-CB 4.3Å; F65-V148 HydrophobicContact CZ-CG1 4.04Å; C121-V148 HydrophobicContact CB-CG1 3.95Å; T144-V148 VanDerWaalsContact O-CG2 3.28Å; T144-V148 WeakPolarHBondContact O-CG2 3.29Å; T144-V148 PolarHBondContact O-N 3.43Å; C145-V148 PolarHBondContact O-N 3.18Å; L146-V148 VanDerWaalsContact C-N 3.32Å; L146-V148 PolarHBondContact O-N 2.78Å; V148-M151 PolarHBondContact O-N 3.33Å; V148-V152 WeakPolarHBondContact O-CG2 3.29Å; V148-V152 PolarHBondContact O-N 2.93Å
149I97.4Very high94.3Very high24 Ų2465.3 Ų65.312%0.12334%0.34CS..Hα-helixtrans-60.2-48.6177.6-69.9164.2000110.4F65 D68 M118 C145 L146 M151 V152 W153F65-I149 HydrophobicContact CD1-CD1 4.19Å; F65-I149 HydrophobicContact CD1-CG1 4Å; F65-I149 HydrophobicContact CE1-CD1 4.49Å; F65-I149 HydrophobicContact CE1-CG1 4.18Å; D68-I149 HydrophobicContact CB-CD1 4.13Å; D68-I149 HydrophobicContact CB-CG1 4.31Å; D68-I149 HydrophobicContact CB-CG2 4.47Å; D68-I149 WeakPolarHBondContact OD1-CG2 3.35Å; M118-I149 HydrophobicContact CE-CG1 4.07Å; C145-I149 WeakPolarHBondContact O-CG1 3.48Å; C145-I149 PolarHBondContact O-N 2.99Å; L146-I149 PolarHBondContact O-N 3.46Å; I149-M151 VanDerWaalsContact C-N 3.32Å; I149-M151 PolarHBondContact O-N 3.44Å; I149-V152 PolarHBondContact O-N 3.36Å; I149-V152 VanDerWaalsContact O-N 3.15Å; I149-W153 VanDerWaalsContact O-CD1 3.27Å; I149-W153 PolarHBondContact O-N 3.45Å
150C97.4Very high94.2Very high68 Ų6857.3 Ų57.346%0.45931%0.31SS..Hα-helixtrans-59.1-43.3177.1-67.60000112L146 V152 W153 T154L146-C150 PolarHBondContact O-N 2.82Å; L146-C150 PolarHBondContact O-SG 3.37Å; C150-V152 VanDerWaalsContact C-N 3.32Å; C150-V152 PolarHBondContact O-N 3.22Å; C150-W153 PolarHBondContact O-N 3.02Å; C150-T154 WeakPolarHBondContact O-CG2 3.47Å; C150-T154 PolarHBondContact O-N 3.35Å; C150-T154 PolarHBondContact O-OG1 3.04Å
151M97.2Very high93.9Very high88 Ų8860 Ų6043%0.43332%0.32SS..Hα-helixtrans-61.4-39.3176.1172.9-94.1-90.400112.1A147 V148 I149 T154 L155A147-M151 VanDerWaalsContact O-CB 3.29Å; A147-M151 WeakPolarHBondContact O-CB 3.48Å; A147-M151 PolarHBondContact O-N 3.15Å; V148-M151 PolarHBondContact O-N 3.33Å; I149-M151 VanDerWaalsContact C-N 3.32Å; I149-M151 PolarHBondContact O-N 3.44Å; M151-T154 WeakPolarHBondContact CA-OG1 3.28Å; M151-T154 PolarHBondContact O-N 2.85Å; M151-T154 PolarHBondContact O-OG1 3.36Å; M151-L155 HydrophobicContact CG-CD1 3.91Å; M151-L155 WeakPolarHBondContact O-CB 3.43Å; M151-L155 WeakPolarHBondContact O-CD1 3.39Å; M151-L155 WeakPolarHBondContact O-CG 3.18Å; M151-L155 PolarHBondContact O-N 2.92Å; M151-L155 HydrophobicContact SD-CD1 3.25Å; M151-L155 WeakPolarHBondContact SD-CD1 3.49Å; M151-L155 HydrophobicContact SD-CG 4.49Å
152V97.8Very high93.2Very high0 Ų059.1 Ų59.10%032%0.316CS..Hα-helixtrans-69.5-41.5177.5173.60000111.6F117 M118 V148 I149 C150 T154 L155 S156F117-V152 HydrophobicContact CB-CB 4.43Å; F117-V152 HydrophobicContact CB-CG1 3.48Å; F117-V152 VanDerWaalsContact CB-CG1 3.48Å; F117-V152 HydrophobicContact CB-CG2 4.24Å; M118-V152 HydrophobicContact CB-CG1 4.48Å; M118-V152 HydrophobicContact CG-CB 4.3Å; M118-V152 HydrophobicContact CG-CG1 3.59Å; M118-V152 HydrophobicContact SD-CB 3.59Å; M118-V152 VanDerWaalsContact SD-CB 3.59Å; M118-V152 HydrophobicContact SD-CG1 3.59Å; M118-V152 VanDerWaalsContact SD-CG1 3.59Å; M118-V152 HydrophobicContact SD-CG2 3.64Å; V148-V152 WeakPolarHBondContact O-CG2 3.29Å; V148-V152 PolarHBondContact O-N 2.93Å; I149-V152 PolarHBondContact O-N 3.36Å; I149-V152 VanDerWaalsContact O-N 3.15Å; C150-V152 VanDerWaalsContact C-N 3.32Å; C150-V152 PolarHBondContact O-N 3.22Å; V152-T154 PolarHBondContact O-N 3.48Å; V152-L155 PolarHBondContact O-N 3.39Å; V152-S156 WeakPolarHBondContact O-CB 3.46Å; V152-S156 PolarHBondContact O-N 2.96Å; V152-S156 PolarHBondContact O-OG 3.42Å
153W97.2Very high92.3Very high75 Ų7554.2 Ų54.228%0.28430%0.295SS..Hα-helixtrans-59.6-45173.7-83.9103000111.9D68 L75 L110 H114 I149 C150 S156 V157D68-W153 PolarHBondContact OD1-NE1 3.46Å; L75-W153 HydrophobicContact CD2-CH2 4.17Å; L110-W153 HydrophobicContact CD2-CZ3 4.01Å; L110-W153 HydrophobicContact CG-CZ3 4.26Å; H114-W153 AromaticContact CE1-CD1 3.52Å; H114-W153 AromaticContact CE1-CD2 3.73Å; H114-W153 AromaticContact CE1-CE2 3.36Å; H114-W153 AromaticContact CE1-CG 3.84Å; H114-W153 AromaticContact CE1-CZ2 3.91Å; H114-W153 AromaticContact CE1-NE1 3.2Å; H114-W153 PolarHBondContact CE1-NE1 3.07Å; H114-W153 AromaticContact ND1-CD2 3.64Å; H114-W153 AromaticContact ND1-CE2 3.7Å; H114-W153 AromaticContact ND1-CG 3.88Å; H114-W153 AromaticContact ND1-NE1 3.9Å; H114-W153 AromaticContact NE2-CE2 3.9Å; H114-W153 AromaticContact NE2-NE1 3.85Å; I149-W153 VanDerWaalsContact O-CD1 3.27Å; I149-W153 PolarHBondContact O-N 3.45Å; C150-W153 PolarHBondContact O-N 3.02Å; W153-S156 PolarHBondContact O-N 3.48Å; W153-V157 WeakPolarHBondContact O-CG2 3.41Å; W153-V157 PolarHBondContact O-N 3.39Å
154T96.3Very high91.2Very high92 Ų9248.1 Ų48.156%0.56428%0.278SS*.Hα-helixtrans-65.9-43.1179.5560000112.3C150 M151 V152 S156 V157 A158C150-T154 WeakPolarHBondContact O-CG2 3.47Å; C150-T154 PolarHBondContact O-N 3.35Å; C150-T154 PolarHBondContact O-OG1 3.04Å; M151-T154 WeakPolarHBondContact CA-OG1 3.28Å; M151-T154 PolarHBondContact O-N 2.85Å; M151-T154 PolarHBondContact O-OG1 3.36Å; V152-T154 PolarHBondContact O-N 3.48Å; T154-S156 VanDerWaalsContact C-N 3.29Å; T154-S156 PolarHBondContact O-N 3.46Å; T154-V157 PolarHBondContact O-N 2.92Å; T154-A158 WeakPolarHBondContact O-CB 3.42Å; T154-A158 PolarHBondContact O-N 3.26Å
155L94.6Very high90Very high64 Ų6451.2 Ų51.234%0.33529%0.293SS..Hα-helixtrans-59.9-40.8173.2-80.2159.3000111.8F117 M151 V152 A158 M159F117-L155 HydrophobicContact CD2-CB 4.22Å; F117-L155 HydrophobicContact CE2-CB 4.03Å; F117-L155 HydrophobicContact CZ-CB 4.39Å; M151-L155 HydrophobicContact CG-CD1 3.91Å; M151-L155 WeakPolarHBondContact O-CB 3.43Å; M151-L155 WeakPolarHBondContact O-CD1 3.39Å; M151-L155 WeakPolarHBondContact O-CG 3.18Å; M151-L155 PolarHBondContact O-N 2.92Å; M151-L155 HydrophobicContact SD-CD1 3.25Å; M151-L155 WeakPolarHBondContact SD-CD1 3.49Å; M151-L155 HydrophobicContact SD-CG 4.49Å; V152-L155 PolarHBondContact O-N 3.39Å; L155-A158 PolarHBondContact O-N 3.43Å; L155-M159 VanDerWaalsContact O-CG 3.3Å; L155-M159 WeakPolarHBondContact O-CG 3.19Å; L155-M159 PolarHBondContact O-N 3.06Å
156S95.1Very high88.6Confident0 Ų055.3 Ų55.30%031%0.314CS..Hα-helixtrans-68.2-41-179.2-540000111.7L110 H114 V152 W153 T154 M159 A160L110-S156 VanDerWaalsContact CD1-C 3.43Å; H114-S156 WeakPolarHBondContact CA-OG 3.21Å; H114-S156 PolarHBondContact N-OG 2.89Å; V152-S156 WeakPolarHBondContact O-CB 3.46Å; V152-S156 PolarHBondContact O-N 2.96Å; V152-S156 PolarHBondContact O-OG 3.42Å; W153-S156 PolarHBondContact O-N 3.48Å; T154-S156 VanDerWaalsContact C-N 3.29Å; T154-S156 PolarHBondContact O-N 3.46Å; S156-M159 PolarHBondContact O-N 3.47Å; S156-A160 WeakPolarHBondContact O-CB 3.29Å; S156-A160 PolarHBondContact O-N 3.29Å
157V93.1Very high86.7Confident61 Ų6158.7 Ų58.737%0.3734%0.337SS..Hα-helixtrans-62.6-46.2172.6171.40000110.3L110 W153 T154 M159 A160 F161L110-V157 HydrophobicContact CD1-CB 4.32Å; L110-V157 HydrophobicContact CD1-CG2 3.63Å; W153-V157 WeakPolarHBondContact O-CG2 3.41Å; W153-V157 PolarHBondContact O-N 3.39Å; T154-V157 PolarHBondContact O-N 2.92Å; V157-M159 PolarHBondContact O-N 2.91Å; V157-A160 PolarHBondContact O-N 3.22Å; V157-A160 VanDerWaalsContact O-N 3.13Å; V157-F161 WeakPolarHBondContact O-CB 3.41Å; V157-F161 PolarHBondContact O-N 3.43Å
158A90.7Very high84.9Confident60 Ų6057.6 Ų57.650%0.49633%0.333SS..Hα-helixtrans-58.6-32.1178.100000112.6T154 L155 P162T154-A158 WeakPolarHBondContact O-CB 3.42Å; T154-A158 PolarHBondContact O-N 3.26Å; L155-A158 PolarHBondContact O-N 3.43Å; A158-P162 WeakPolarHBondContact O-CD 3.41Å
159M86.9Confident83.7Confident46 Ų4657.3 Ų57.323%0.22733%0.331CS..Hα-helixtrans-82.3-32.8175.5-65.6-58.9164.500113.6F113 F117 L155 S156 V157 F194 L197F113-M159 HydrophobicContact CD1-CB 4.2Å; F113-M159 HydrophobicContact CD2-CB 4.07Å; F113-M159 HydrophobicContact CE1-CB 4.42Å; F113-M159 HydrophobicContact CE2-CB 4.28Å; F113-M159 HydrophobicContact CG-CB 4.03Å; F113-M159 HydrophobicContact CZ-CB 4.46Å; F117-M159 HydrophobicContact CE2-CG 4.06Å; F117-M159 HydrophobicContact CZ-CG 4.19Å; L155-M159 VanDerWaalsContact O-CG 3.3Å; L155-M159 WeakPolarHBondContact O-CG 3.19Å; L155-M159 PolarHBondContact O-N 3.06Å; S156-M159 PolarHBondContact O-N 3.47Å; V157-M159 PolarHBondContact O-N 2.91Å; M159-F194 WeakPolarHBondContact O-CE1 3.34Å; M159-L197 HydrophobicContact CE-CD2 3.4Å; M159-L197 HydrophobicContact CG-CD2 4.15Å; M159-L197 HydrophobicContact SD-CD2 3.27Å; M159-L197 WeakPolarHBondContact SD-CD2 3.27Å
160A86.6Confident83.1Confident0 Ų056.6 Ų56.60%033%0.326CS..Hα-helixtrans-82.1-19.8-179.400000113.7F106 V109 L110 S156 V157 Y170F106-A160 HydrophobicContact CD2-CB 3.84Å; F106-A160 WeakPolarHBondContact CD2-O 3.28Å; F106-A160 HydrophobicContact CE2-CB 3.58Å; F106-A160 HydrophobicContact CZ-CB 4.36Å; V109-A160 HydrophobicContact CG1-CB 4.12Å; L110-A160 HydrophobicContact CB-CB 4.04Å; L110-A160 HydrophobicContact CD1-CB 4.39Å; S156-A160 WeakPolarHBondContact O-CB 3.29Å; S156-A160 PolarHBondContact O-N 3.29Å; V157-A160 PolarHBondContact O-N 3.22Å; V157-A160 VanDerWaalsContact O-N 3.13Å; A160-Y170 PolarHBondContact O-OH 3.06Å
161F84.3Confident82.4Confident99 Ų9955.3 Ų55.343%0.43432%0.317SS..SBendtrans-76.3-40-172.6-167.8-105.2000116V157 V164 L165V157-F161 WeakPolarHBondContact O-CB 3.41Å; V157-F161 PolarHBondContact O-N 3.43Å; F161-V164 WeakPolarHBondContact O-CA 3.34Å; F161-V164 WeakPolarHBondContact O-CB 3.3Å; F161-V164 PolarHBondContact O-N 3.48Å; F161-L165 HydrophobicContact CD1-CD1 4Å; F161-L165 HydrophobicContact CD1-CG 4.1Å; F161-L165 HydrophobicContact CE1-CD1 3.66Å; F161-L165 HydrophobicContact CE1-CD2 3.68Å; F161-L165 HydrophobicContact CE1-CG 3.72Å; F161-L165 HydrophobicContact CZ-CD2 3.81Å; F161-L165 HydrophobicContact CZ-CG 4.28Å
162P78.8Confident81.9Confident47 Ų4752.8 Ų52.831%0.30530%0.303SS..Hα-helixtrans-56.8-41.3-175-22.931.7000114A158 V164 L165 D166 F194A158-P162 WeakPolarHBondContact O-CD 3.41Å; P162-V164 PolarHBondContact O-N 3.2Å; P162-V164 VanDerWaalsContact O-N 3.15Å; P162-L165 PolarHBondContact O-N 2.7Å; P162-L165 VanDerWaalsContact O-N 3.08Å; P162-D166 PolarHBondContact O-N 2.9Å; P162-F194 HydrophobicContact CB-CZ 3.78Å; P162-F194 HydrophobicContact CG-CE1 4.27Å; P162-F194 HydrophobicContact CG-CZ 3.82Å
163P72.1Confident81.2Confident5 Ų553.4 Ų53.43%0.03231%0.307CS..Hα-helixtrans-63.4-19.6174-21.433.1000114.4T169 Y170 F181 F194P163-T169 WeakPolarHBondContact CA-OG1 3.37Å; P163-T169 VanDerWaalsContact CB-OG1 3.3Å; P163-T169 WeakPolarHBondContact CB-OG1 3.37Å; P163-T169 PolarHBondContact O-OG1 3Å; P163-Y170 HydrophobicContact CB-CD2 4.18Å; P163-Y170 HydrophobicContact CB-CE1 4.2Å; P163-Y170 HydrophobicContact CB-CE2 3.61Å; P163-F181 HydrophobicContact CB-CD2 3.81Å; P163-F181 HydrophobicContact CB-CE2 3.92Å; P163-F181 HydrophobicContact CG-CD2 4Å; P163-F181 HydrophobicContact CG-CE2 4.01Å; P163-F194 HydrophobicContact CG-CE2 4.22Å; P163-F194 HydrophobicContact CG-CZ 4.31Å
164V70.6Confident80.5Confident62 Ų6253 Ų5338%0.37631%0.313SS..Hα-helixtrans-70-35174.6-175.60000111.4F106 F161 P162 Y170F106-V164 HydrophobicContact CB-CG2 4.4Å; F106-V164 HydrophobicContact CD2-CG2 3.55Å; F106-V164 HydrophobicContact CE2-CG2 4.22Å; F106-V164 HydrophobicContact CG-CG2 4.28Å; F161-V164 WeakPolarHBondContact O-CA 3.34Å; F161-V164 WeakPolarHBondContact O-CB 3.3Å; F161-V164 PolarHBondContact O-N 3.48Å; P162-V164 PolarHBondContact O-N 3.2Å; P162-V164 VanDerWaalsContact O-N 3.15Å; V164-Y170 HydrophobicContact CG2-CD2 4.25Å; V164-Y170 HydrophobicContact CG2-CE2 3.67Å
165L68.7Low79.8Confident115 Ų11553.1 Ų53.160%0.60231%0.308SS*.Hα-helixtrans-76.4-33.1-177.7-61.6179.9000112.3F161 P162 V167F161-L165 HydrophobicContact CD1-CD1 4Å; F161-L165 HydrophobicContact CD1-CG 4.1Å; F161-L165 HydrophobicContact CE1-CD1 3.66Å; F161-L165 HydrophobicContact CE1-CD2 3.68Å; F161-L165 HydrophobicContact CE1-CG 3.72Å; F161-L165 HydrophobicContact CZ-CD2 3.81Å; F161-L165 HydrophobicContact CZ-CG 4.28Å; P162-L165 PolarHBondContact O-N 2.7Å; P162-L165 VanDerWaalsContact O-N 3.08Å; L165-V167 PolarHBondContact O-N 3Å
166D65.6Low79.1Confident88 Ų8850.3 Ų50.347%0.47129%0.293SS..SBendtrans-78.3110.4175.4-75.7-44.6000111P162 G168 T169P162-D166 PolarHBondContact O-N 2.9Å; D166-G168 PolarHBondContact O-N 3.15Å; D166-T169 HydrophobicContact CB-CG2 3.66Å; D166-T169 PolarHBondContact O-N 2.95Å
167V57.3Low78.6Confident141 Ų14150.5 Ų50.586%0.85529%0.294SS*.THydrogen-bonded Turntrans-61.2101.3-179.9-174.60000109.9L165L165-V167 PolarHBondContact O-N 3Å
168G57.6Low78.3Confident38 Ų3849 Ų4939%0.39228%0.283SS..THydrogen-bonded Turntrans115.212.7169.500000116.7D166D166-G168 PolarHBondContact O-N 3.15Å
169T73.3Confident78Confident30 Ų3047.1 Ų47.118%0.18427%0.266CS..SBendtrans-86.8-35.3176.465.20000113.9P163 D166 F181 Q182P163-T169 WeakPolarHBondContact CA-OG1 3.37Å; P163-T169 VanDerWaalsContact CB-OG1 3.3Å; P163-T169 WeakPolarHBondContact CB-OG1 3.37Å; P163-T169 PolarHBondContact O-OG1 3Å; D166-T169 HydrophobicContact CB-CG2 3.66Å; D166-T169 PolarHBondContact O-N 2.95Å; T169-F181 HydrophobicContact CG2-CE2 4.13Å; T169-Q182 PolarHBondContact O-N 2.87Å
170Y83.7Confident77.9Confident9 Ų945.7 Ų45.74%0.03526%0.26CS..EExtended strand (participates in β ladder)trans-87110.2171-72.2-50.6000110.6A105 F106 V109 A160 P163 V164 F181A105-Y170 HydrophobicContact CB-CD1 3.42Å; A105-Y170 VanDerWaalsContact CB-CD1 3.42Å; A105-Y170 HydrophobicContact CB-CE1 4.03Å; A105-Y170 HydrophobicContact CB-CG 3.75Å; F106-Y170 HydrophobicContact CB-CE2 4.36Å; V109-Y170 HydrophobicContact CG2-CE1 3.9Å; A160-Y170 PolarHBondContact O-OH 3.06Å; P163-Y170 HydrophobicContact CB-CD2 4.18Å; P163-Y170 HydrophobicContact CB-CE1 4.2Å; P163-Y170 HydrophobicContact CB-CE2 3.61Å; V164-Y170 HydrophobicContact CG2-CD2 4.25Å; V164-Y170 HydrophobicContact CG2-CE2 3.67Å; Y170-F181 HydrophobicContact CD1-CB 4.23Å; Y170-F181 HydrophobicContact CE1-CB 4.04Å; Y170-F181 HydrophobicContact CE1-CD2 4.44Å
171T83.6Confident77.4Confident41 Ų4147 Ų4725%0.25227%0.266SS..EExtended strand (participates in β ladder)trans-133.9156.9-177.156.70000110.5T180T171-T180 PolarHBondContact N-O 3.43Å; T171-T180 VanDerWaalsContact N-O 3.12Å; T171-T180 PolarHBondContact O-N 3.1Å; T171-T180 VanDerWaalsContact O-N 3.11Å
172F85.5Confident76.9Confident36 Ų3646.5 Ų46.516%0.15827%0.265CS..EExtended strand (participates in β ladder)trans-73.9126.6169179.4-102.6000109.9S87 S92 L94 P174S87-F172 WeakPolarHBondContact OG-CE2 3.27Å; S87-F172 WeakPolarHBondContact OG-CZ 3.45Å; S92-F172 WeakPolarHBondContact O-CE1 3.45Å; S92-F172 WeakPolarHBondContact O-CZ 3.42Å; L94-F172 HydrophobicContact CB-CB 4.47Å; L94-F172 HydrophobicContact CB-CD1 4.1Å; L94-F172 HydrophobicContact CB-CG 4.23Å; L94-F172 HydrophobicContact CD1-CB 4.1Å; L94-F172 HydrophobicContact CD1-CD2 4.44Å; L94-F172 HydrophobicContact CD1-CG 4.23Å; F172-P174 HydrophobicContact CD1-CG 4.21Å; F172-P174 HydrophobicContact CE1-CB 4.2Å; F172-P174 HydrophobicContact CE1-CG 3.98Å
173I84.2Confident76.4Confident13 Ų1345.5 Ų45.57%0.06726%0.256CS..EExtended strand (participates in β ladder)trans-108.5105.8178.4-58-171.3000108.2E175 E176 D177 Q178 T180I173-E175 HydrophobicContact CG2-CB 4.37Å; I173-E175 WeakPolarHBondContact CG2-OE2 3.18Å; I173-E175 PolarHBondContact O-N 2.94Å; I173-E176 HydrophobicContact CB-CB 4.37Å; I173-E176 HydrophobicContact CB-CG 4.48Å; I173-E176 HydrophobicContact CG2-CB 4.22Å; I173-E176 HydrophobicContact CG2-CG 3.92Å; I173-E176 PolarHBondContact O-N 3.47Å; I173-E176 VanDerWaalsContact O-N 3.08Å; I173-D177 PolarHBondContact O-N 3.06Å; I173-Q178 PolarHBondContact N-O 3.09Å; I173-T180 HydrophobicContact CB-CG2 4.46Å; I173-T180 HydrophobicContact CD1-CG2 3.4Å; I173-T180 HydrophobicContact CG1-CG2 3.93Å
174P81.4Confident75.8Confident66 Ų6654 Ų5443%0.42929%0.287SS..G310 helixtrans-59-31.5-177.2-23.833.5000113.5F172 E176 D177F172-P174 HydrophobicContact CD1-CG 4.21Å; F172-P174 HydrophobicContact CE1-CB 4.2Å; F172-P174 HydrophobicContact CE1-CG 3.98Å; P174-E176 VanDerWaalsContact C-N 3.26Å; P174-E176 PolarHBondContact O-N 2.84Å; P174-D177 PolarHBondContact O-N 3.07Å
175E81.6Confident75Confident95 Ų9553.6 Ų53.644%0.44429%0.287SS..G310 helixtrans-71.5-20.1-179.9-5878.5-171.700113.6I173 L328I173-E175 HydrophobicContact CG2-CB 4.37Å; I173-E175 WeakPolarHBondContact CG2-OE2 3.18Å; I173-E175 PolarHBondContact O-N 2.94Å; E175-L328 HydrophobicContact CB-CD2 3.69Å
176E81.3Confident74.1Confident4 Ų453 Ų532%0.01928%0.28CS..G310 helixtrans-108-1.6179.3-59.9-175.9-149.100112.4I173 P174 Q178 Y308 R315 L328 V332I173-E176 HydrophobicContact CB-CB 4.37Å; I173-E176 HydrophobicContact CB-CG 4.48Å; I173-E176 HydrophobicContact CG2-CB 4.22Å; I173-E176 HydrophobicContact CG2-CG 3.92Å; I173-E176 PolarHBondContact O-N 3.47Å; I173-E176 VanDerWaalsContact O-N 3.08Å; P174-E176 VanDerWaalsContact C-N 3.26Å; P174-E176 PolarHBondContact O-N 2.84Å; E176-Q178 HydrophobicContact CB-CG 3.76Å; E176-Q178 PolarHBondContact O-N 3.25Å; E176-Q178 PolarHBondContact OE2-NE2 3.35Å; E176-Y308 WeakPolarHBondContact OE2-CE2 3.36Å; E176-Y308 PolarHBondContact OE2-OH 3.21Å; E176-R315 IonicContact OE1-CZ 3.61Å; E176-R315 IonicContact OE1-NH1 2.69Å; E176-R315 PolarHBondContact OE1-NH1 2.69Å; E176-R315 IonicContact OE1-NH2 3.88Å; E176-L328 HydrophobicContact CG-CD1 4.2Å; E176-L328 HydrophobicContact CG-CD2 3.92Å; E176-L328 HydrophobicContact CG-CG 4.18Å; E176-V332 HydrophobicContact CB-CG2 4.11Å; E176-V332 HydrophobicContact CG-CG2 3.9Å
177D82.8Confident73.3Confident5 Ų560.6 Ų60.63%0.02730%0.302CS..THydrogen-bonded Turntrans55.220-176.7-57.5-61.1000113.9K30 V84 V88 S92 I173 P174K30-D177 IonicContact NZ-OD2 2.69Å; K30-D177 PolarHBondContact NZ-OD2 3.2Å; V84-D177 HydrophobicContact CG1-CB 4.29Å; V88-D177 HydrophobicContact CG2-CB 3.64Å; S92-D177 VanDerWaalsContact CB-OD1 3.26Å; S92-D177 WeakPolarHBondContact CB-OD1 3.42Å; S92-D177 PolarHBondContact OG-OD1 3.01Å; I173-D177 PolarHBondContact O-N 3.06Å; P174-D177 PolarHBondContact O-N 3.07Å
178Q87.3Confident73.1Confident28 Ų2856 Ų5613%0.13128%0.279CS..EExtended strand (participates in β ladder)trans-141.4157.4-17270-178.9-27.800113.3V84 I173 E176 T180 F336V84-Q178 HydrophobicContact CG2-CB 3.85Å; I173-Q178 PolarHBondContact N-O 3.09Å; E176-Q178 HydrophobicContact CB-CG 3.76Å; E176-Q178 PolarHBondContact O-N 3.25Å; E176-Q178 PolarHBondContact OE2-NE2 3.35Å; Q178-T180 HydrophobicContact CG-CG2 4.29Å; Q178-F336 VanDerWaalsContact OE1-CE1 3.26Å; Q178-F336 VanDerWaalsContact OE1-CZ 3.25Å
179C85.5Confident73.1Confident21 Ų2160.8 Ų60.814%0.14230%0.295CS..EExtended strand (participates in β ladder)trans-83.6118.5167.4-67.90000109.3C101 A105C101-C179 WeakPolarHBondContact CA-SG 3.41Å; C101-C179 HydrophobicContact CB-CB 4.09Å; C101-C179 WeakPolarHBondContact CB-SG 3.3Å; C101-C179 VanDerWaalsContact O-CB 3.29Å; C101-C179 WeakPolarHBondContact O-CB 3.38Å; C101-C179 WeakPolarHBondContact SG-CB 3.48Å; C101-C179 CovalentContact SG-SG 2.03Å; C101-C179 PolarHBondContact SG-SG 3.43Å; A105-C179 WeakPolarHBondContact CA-O 3.27Å; A105-C179 HydrophobicContact CB-CB 4.06Å; A105-C179 WeakPolarHBondContact CB-O 3.43Å
180T83.4Confident72.5Confident16 Ų1664.2 Ų64.210%0.09831%0.312CS..EExtended strand (participates in β ladder)trans-150.1176.8-178.4-169.30000110.9T171 I173 Q178 Q182T171-T180 PolarHBondContact N-O 3.43Å; T171-T180 VanDerWaalsContact N-O 3.12Å; T171-T180 PolarHBondContact O-N 3.1Å; T171-T180 VanDerWaalsContact O-N 3.11Å; I173-T180 HydrophobicContact CB-CG2 4.46Å; I173-T180 HydrophobicContact CD1-CG2 3.4Å; I173-T180 HydrophobicContact CG1-CG2 3.93Å; Q178-T180 HydrophobicContact CG-CG2 4.29Å; T180-Q182 PolarHBondContact O-N 3.19Å
181F77.1Confident71.6Confident29 Ų2964.1 Ų64.113%0.12731%0.313CS..EExtended strand (participates in β ladder)trans-67.1126.6175.5-178.6-94.7000110.5P163 T169 Y170 H183 S191P163-F181 HydrophobicContact CB-CD2 3.81Å; P163-F181 HydrophobicContact CB-CE2 3.92Å; P163-F181 HydrophobicContact CG-CD2 4Å; P163-F181 HydrophobicContact CG-CE2 4.01Å; T169-F181 HydrophobicContact CG2-CE2 4.13Å; Y170-F181 HydrophobicContact CD1-CB 4.23Å; Y170-F181 HydrophobicContact CE1-CB 4.04Å; Y170-F181 HydrophobicContact CE1-CD2 4.44Å; F181-H183 PolarHBondContact O-CE1 3.14Å; F181-H183 PolarHBondContact O-N 3.36Å; F181-H183 PolarHBondContact O-ND1 3.44Å; F181-S191 VanDerWaalsContact CE1-CB 3.47Å
182Q73.9Confident71Confident88 Ų8864.2 Ų64.241%0.41131%0.312SS..  trans-71.1113175.8-165.9178.213.200109.9T169 T180 R184T169-Q182 PolarHBondContact O-N 2.87Å; T180-Q182 PolarHBondContact O-N 3.19Å; Q182-R184 VanDerWaalsContact C-N 3.26Å; Q182-R184 PolarHBondContact O-N 3.46Å
183H68Low70.4Confident26 Ų2664.3 Ų64.312%0.1232%0.323CS..  trans-7279.9175.7-59.588.2000110.1F181 C312 R315 V316F181-H183 PolarHBondContact O-CE1 3.14Å; F181-H183 PolarHBondContact O-N 3.36Å; F181-H183 PolarHBondContact O-ND1 3.44Å; H183-C312 PolarHBondContact CE1-SG 3.13Å; H183-C312 PolarHBondContact NE2-SG 2.92Å; H183-R315 HydrophobicContact CB-CB 4.37Å; H183-V316 HydrophobicContact CB-CG2 4.45Å
184R60.3Low70Confident183 Ų18365.6 Ų65.669%0.69133%0.328SS*.  trans-74.7138.8178.4-157.1169.3-170.9167.61.9110.2Q182Q182-R184 VanDerWaalsContact C-N 3.26Å; Q182-R184 PolarHBondContact O-N 3.46Å
185S52.4Low69.9Low53 Ų5363.3 Ų63.337%0.37131%0.312SS..  trans-58.5144.7180-168.20000111.7R187S185-R187 PolarHBondContact O-N 3.19Å
186F50.6Low70Confident103 Ų10363 Ų6345%0.45231%0.313SS..SBendtrans-11.1-18.1179-169.4-101.8000122A188 L192F186-A188 VanDerWaalsContact C-N 3.35Å; F186-A188 PolarHBondContact O-N 2.97Å; F186-L192 HydrophobicContact CD2-CD1 4.32Å; F186-L192 HydrophobicContact CE2-CD1 4.4Å
187R48.8Very low70.3Confident247 Ų24765.1 Ų65.193%0.93232%0.324SS*.SBendtrans-81.6-2.9-170.7-153.3171.8-177.8165.60.6115.1S185S185-R187 PolarHBondContact O-N 3.19Å
188A53.6Low70.5Confident45 Ų4565.4 Ų65.437%0.37233%0.325SS..SBendtrans-121.9117.6168.700000108.3F186 D190F186-A188 VanDerWaalsContact C-N 3.35Å; F186-A188 PolarHBondContact O-N 2.97Å; A188-D190 PolarHBondContact O-N 3.45Å
189N56.1Low70.7Confident138 Ų13865.6 Ų65.674%0.73833%0.332SS*.THydrogen-bonded Turntrans-62.4-12.4-171.5-83.7-10000114.3
190D61.8Low71Confident102 Ų10269.6 Ų69.655%0.54535%0.351SS..Hα-helixtrans-82.9-33.7-165.1-50.5-45.3000113.6A188 F194A188-D190 PolarHBondContact O-N 3.45Å; D190-F194 WeakPolarHBondContact O-CD2 3.4Å; D190-F194 WeakPolarHBondContact O-CE2 3.35Å
191S65.2Low71.5Confident7 Ų769.6 Ų69.65%0.04935%0.35CS..Hα-helixtrans-70.9-34.9-178.8590000113.8F181 G193 M195F181-S191 VanDerWaalsContact CE1-CB 3.47Å; S191-G193 VanDerWaalsContact C-N 3.35Å; S191-M195 PolarHBondContact O-N 3.08Å
192L69.9Low72.2Confident44 Ų4468.7 Ų68.723%0.2335%0.347CS..Hα-helixtrans-70-34.5-179.5-177.3146.5000111.1F186 M195 L196 V316 F317F186-L192 HydrophobicContact CD2-CD1 4.32Å; F186-L192 HydrophobicContact CE2-CD1 4.4Å; L192-M195 PolarHBondContact O-N 3.4Å; L192-L196 HydrophobicContact CD2-CD1 3.33Å; L192-L196 HydrophobicContact CD2-CG 3.9Å; L192-L196 HydrophobicContact CG-CD1 4.28Å; L192-L196 HydrophobicContact CG-CG 4.36Å; L192-L196 VanDerWaalsContact O-CB 3.3Å; L192-L196 WeakPolarHBondContact O-CB 3.41Å; L192-L196 VanDerWaalsContact O-CG 3.31Å; L192-L196 WeakPolarHBondContact O-CG 3.49Å; L192-L196 PolarHBondContact O-N 3.4Å; L192-V316 HydrophobicContact CD1-CG1 4.46Å; L192-F317 HydrophobicContact CD1-CE1 4.21Å; L192-F317 HydrophobicContact CD1-CZ 3.95Å
193G74.3Confident73.2Confident37 Ų3769.3 Ų69.338%0.38135%0.352SS..Hα-helixtrans-59.5-47.517500000112.9S191 M195 L196 L197S191-G193 VanDerWaalsContact C-N 3.35Å; G193-M195 PolarHBondContact O-N 3.41Å; G193-L196 PolarHBondContact O-N 3.24Å; G193-L197 VanDerWaalsContact O-CB 3.3Å; G193-L197 WeakPolarHBondContact O-CB 3.3Å; G193-L197 PolarHBondContact O-N 2.91Å
194F75.8Confident74.5Confident41 Ų4169.6 Ų69.618%0.1836%0.359CS..Hα-helixtrans-61.7-45.4178.6-70.1-70.1000112.6F113 M159 P162 P163 D190 L197 L198F113-F194 HydrophobicContact CZ-CB 4.44Å; F113-F194 HydrophobicContact CZ-CD1 4.32Å; M159-F194 WeakPolarHBondContact O-CE1 3.34Å; P162-F194 HydrophobicContact CB-CZ 3.78Å; P162-F194 HydrophobicContact CG-CE1 4.27Å; P162-F194 HydrophobicContact CG-CZ 3.82Å; P163-F194 HydrophobicContact CG-CE2 4.22Å; P163-F194 HydrophobicContact CG-CZ 4.31Å; D190-F194 WeakPolarHBondContact O-CD2 3.4Å; D190-F194 WeakPolarHBondContact O-CE2 3.35Å; F194-L197 PolarHBondContact O-N 2.89Å; F194-L198 PolarHBondContact O-N 3.33Å
195M79Confident76.1Confident18 Ų1861 Ų619%0.08933%0.327CS..Hα-helixtrans-66.5-43179.7-66.3-60.3-58.600111.7S191 L192 G193 L198 A199 L309 C312 Y313S191-M195 PolarHBondContact O-N 3.08Å; L192-M195 PolarHBondContact O-N 3.4Å; G193-M195 PolarHBondContact O-N 3.41Å; M195-L198 PolarHBondContact O-N 3.17Å; M195-A199 WeakPolarHBondContact O-CB 3.41Å; M195-A199 PolarHBondContact O-N 2.93Å; M195-L309 HydrophobicContact CE-CD2 3.87Å; M195-C312 HydrophobicContact CE-CB 3.23Å; M195-C312 HydrophobicContact SD-CB 4.14Å; M195-Y313 HydrophobicContact CB-CE1 4.05Å; M195-Y313 HydrophobicContact CB-CE2 4.47Å; M195-Y313 HydrophobicContact CE-CD2 4.37Å; M195-Y313 HydrophobicContact CE-CE2 4.26Å; M195-Y313 PolarHBondContact O-OH 2.91Å
196L83.8Confident78.1Confident88 Ų8860 Ų6046%0.46132%0.316SS..Hα-helixtrans-63.2-43.3176.4-79.5-174.3000111.7L192 G193 A199 L200 Y313L192-L196 HydrophobicContact CD2-CD1 3.33Å; L192-L196 HydrophobicContact CD2-CG 3.9Å; L192-L196 HydrophobicContact CG-CD1 4.28Å; L192-L196 HydrophobicContact CG-CG 4.36Å; L192-L196 VanDerWaalsContact O-CB 3.3Å; L192-L196 WeakPolarHBondContact O-CB 3.41Å; L192-L196 VanDerWaalsContact O-CG 3.31Å; L192-L196 WeakPolarHBondContact O-CG 3.49Å; L192-L196 PolarHBondContact O-N 3.4Å; G193-L196 PolarHBondContact O-N 3.24Å; L196-A199 PolarHBondContact O-N 3.27Å; L196-L200 VanDerWaalsContact O-CB 3.3Å; L196-L200 WeakPolarHBondContact O-CB 3.41Å; L196-L200 PolarHBondContact O-N 3.35Å; L196-Y313 VanDerWaalsContact CA-OH 3.23Å; L196-Y313 WeakPolarHBondContact CA-OH 3.38Å; L196-Y313 HydrophobicContact CD2-CE1 4.28Å; L196-Y313 PolarHBondContact N-OH 3.46Å
197L86.3Confident80.2Confident48 Ų4859.8 Ų59.825%0.25132%0.32SS..Hα-helixtrans-62.5-45.8178.2179.264.6000111.2M159 G193 F194 A199 L200 I201M159-L197 HydrophobicContact CE-CD2 3.4Å; M159-L197 HydrophobicContact CG-CD2 4.15Å; M159-L197 HydrophobicContact SD-CD2 3.27Å; M159-L197 WeakPolarHBondContact SD-CD2 3.27Å; G193-L197 VanDerWaalsContact O-CB 3.3Å; G193-L197 WeakPolarHBondContact O-CB 3.3Å; G193-L197 PolarHBondContact O-N 2.91Å; F194-L197 PolarHBondContact O-N 2.89Å; L197-A199 VanDerWaalsContact C-N 3.34Å; L197-A199 PolarHBondContact O-N 3.29Å; L197-L200 WeakPolarHBondContact O-CB 3.25Å; L197-L200 PolarHBondContact O-N 3.38Å; L197-I201 HydrophobicContact CD1-CD1 4.05Å; L197-I201 HydrophobicContact CD1-CG1 4.32Å; L197-I201 HydrophobicContact CG-CD1 3.83Å; L197-I201 WeakPolarHBondContact O-CD1 3.38Å; L197-I201 VanDerWaalsContact O-CG1 3.29Å; L197-I201 WeakPolarHBondContact O-CG1 3.3Å; L197-I201 PolarHBondContact O-N 3.09Å
198L88Confident82.4Confident11 Ų1149.4 Ų49.46%0.05828%0.284CS..Hα-helixtrans-59.7-45.8176.5-177.157000111.1F113 A116 F194 M195 L200 I201 L202 L309F113-L198 HydrophobicContact CD1-CD1 4.28Å; F113-L198 HydrophobicContact CE1-CB 3.95Å; F113-L198 HydrophobicContact CE1-CD1 4.21Å; F113-L198 HydrophobicContact CZ-CB 4.4Å; A116-L198 HydrophobicContact CB-CD1 3.73Å; F194-L198 PolarHBondContact O-N 3.33Å; M195-L198 PolarHBondContact O-N 3.17Å; L198-L200 VanDerWaalsContact C-N 3.35Å; L198-L200 PolarHBondContact O-N 3.13Å; L198-I201 PolarHBondContact O-N 3.03Å; L198-L202 HydrophobicContact CG-CD1 4.44Å; L198-L202 VanDerWaalsContact O-CG 3.29Å; L198-L202 WeakPolarHBondContact O-CG 3.18Å; L198-L202 PolarHBondContact O-N 2.7Å; L198-L309 HydrophobicContact CD2-CD2 3.59Å; L198-L309 HydrophobicContact CG-CD2 4.25Å
199A90.4Very high84.3Confident32 Ų3247.4 Ų47.426%0.26427%0.266SS..Hα-helixtrans-61.7-40.7175.700000112.5M195 L196 L197 L202 L203 Y313M195-A199 WeakPolarHBondContact O-CB 3.41Å; M195-A199 PolarHBondContact O-N 2.93Å; L196-A199 PolarHBondContact O-N 3.27Å; L197-A199 VanDerWaalsContact C-N 3.34Å; L197-A199 PolarHBondContact O-N 3.29Å; A199-L202 PolarHBondContact O-N 3.09Å; A199-L203 WeakPolarHBondContact O-CB 3.36Å; A199-L203 PolarHBondContact O-N 3.24Å; A199-Y313 HydrophobicContact CB-CE2 4.25Å; A199-Y313 WeakPolarHBondContact CB-OH 3.44Å
200L92.4Very high86Confident106 Ų10644.7 Ų44.756%0.55525%0.251SS*.Hα-helixtrans-62.4-44.7177.2-17970000111.5L196 L197 L198 L202 L203 A204L196-L200 VanDerWaalsContact O-CB 3.3Å; L196-L200 WeakPolarHBondContact O-CB 3.41Å; L196-L200 PolarHBondContact O-N 3.35Å; L197-L200 WeakPolarHBondContact O-CB 3.25Å; L197-L200 PolarHBondContact O-N 3.38Å; L198-L200 VanDerWaalsContact C-N 3.35Å; L198-L200 PolarHBondContact O-N 3.13Å; L200-L202 VanDerWaalsContact C-N 3.35Å; L200-L203 PolarHBondContact O-N 3.2Å; L200-A204 VanDerWaalsContact O-CB 3.25Å; L200-A204 WeakPolarHBondContact O-CB 3.39Å; L200-A204 PolarHBondContact O-N 3.01Å
201I94.2Very high87.6Confident16 Ų1645.6 Ų45.68%0.08225%0.251CS..Hα-helixtrans-63.7-42.8178.4-67157.4000110.4A116 F117 F120 L197 L198 A204 T205A116-I201 HydrophobicContact CB-CG2 4.28Å; F117-I201 HydrophobicContact CD1-CD1 3.87Å; F117-I201 HydrophobicContact CD1-CG1 4.41Å; F117-I201 HydrophobicContact CD1-CG2 4.34Å; F117-I201 HydrophobicContact CE1-CD1 3.19Å; F117-I201 HydrophobicContact CE1-CG1 3.93Å; F117-I201 HydrophobicContact CE2-CD1 4.39Å; F117-I201 HydrophobicContact CZ-CD1 3.49Å; F117-I201 VanDerWaalsContact CZ-CD1 3.49Å; F120-I201 HydrophobicContact CB-CG2 4.27Å; L197-I201 HydrophobicContact CD1-CD1 4.05Å; L197-I201 HydrophobicContact CD1-CG1 4.32Å; L197-I201 HydrophobicContact CG-CD1 3.83Å; L197-I201 WeakPolarHBondContact O-CD1 3.38Å; L197-I201 VanDerWaalsContact O-CG1 3.29Å; L197-I201 WeakPolarHBondContact O-CG1 3.3Å; L197-I201 PolarHBondContact O-N 3.09Å; L198-I201 PolarHBondContact O-N 3.03Å; I201-A204 PolarHBondContact O-N 2.77Å; I201-T205 WeakPolarHBondContact O-CB 3.43Å; I201-T205 PolarHBondContact O-N 3.49Å; I201-T205 PolarHBondContact O-OG1 3.11Å
202L92.3Very high88.8Confident10 Ų1045.8 Ų45.85%0.05225%0.251CS..Hα-helixtrans-64.9-44.1177.3-64.9177.6000111.5A116 L198 A199 L200 T205 Q206 F301 L309A116-L202 HydrophobicContact CB-CD2 4.29Å; L198-L202 HydrophobicContact CG-CD1 4.44Å; L198-L202 VanDerWaalsContact O-CG 3.29Å; L198-L202 WeakPolarHBondContact O-CG 3.18Å; L198-L202 PolarHBondContact O-N 2.7Å; A199-L202 PolarHBondContact O-N 3.09Å; L200-L202 VanDerWaalsContact C-N 3.35Å; L202-T205 WeakPolarHBondContact O-CB 3.42Å; L202-T205 PolarHBondContact O-N 3.44Å; L202-Q206 WeakPolarHBondContact O-CG 3.3Å; L202-Q206 PolarHBondContact O-N 2.94Å; L202-F301 HydrophobicContact CD1-CE1 4.23Å; L202-F301 HydrophobicContact CD2-CD1 3.83Å; L202-F301 HydrophobicContact CD2-CE1 3.44Å; L202-F301 VanDerWaalsContact CD2-CE1 3.44Å; L202-F301 HydrophobicContact CG-CE1 4.47Å; L202-L309 HydrophobicContact CD1-CD1 3.44Å; L202-L309 VanDerWaalsContact CD1-CD1 3.44Å
203L93.3Very high89.8Confident101 Ų10147.1 Ų47.153%0.52926%0.258SS..Hα-helixtrans-60.4-49174.6-179.265.1000111.3A199 L200 T205 Q206 L207A199-L203 WeakPolarHBondContact O-CB 3.36Å; A199-L203 PolarHBondContact O-N 3.24Å; L200-L203 PolarHBondContact O-N 3.2Å; L203-T205 VanDerWaalsContact C-N 3.26Å; L203-T205 PolarHBondContact O-N 3.3Å; L203-Q206 WeakPolarHBondContact O-CB 3.29Å; L203-Q206 PolarHBondContact O-N 2.92Å; L203-L207 HydrophobicContact CG-CD1 4.33Å; L203-L207 WeakPolarHBondContact O-CG 3.39Å; L203-L207 PolarHBondContact O-N 2.9Å
204A95.4Very high90.6Very high31 Ų3152.4 Ų52.426%0.25627%0.27SS..Hα-helixtrans-57.2-41.6177.900000111.5F120 L200 I201 Q206 L207 V208F120-A204 HydrophobicContact CD2-CB 4.37Å; F120-A204 HydrophobicContact CE2-CB 4.05Å; L200-A204 VanDerWaalsContact O-CB 3.25Å; L200-A204 WeakPolarHBondContact O-CB 3.39Å; L200-A204 PolarHBondContact O-N 3.01Å; I201-A204 PolarHBondContact O-N 2.77Å; A204-Q206 PolarHBondContact O-N 3.43Å; A204-L207 PolarHBondContact O-N 3.25Å; A204-V208 WeakPolarHBondContact O-CG2 3.43Å; A204-V208 PolarHBondContact O-N 3.35Å
205T95.1Very high91.3Very high2 Ų252.8 Ų52.81%0.01227%0.272CS..Hα-helixtrans-60.2-44.5175.4-55.40000111.4F120 I201 L202 L203 V208 Y209 T298F120-T205 WeakPolarHBondContact CA-OG1 3.44Å; F120-T205 WeakPolarHBondContact CB-OG1 3.49Å; I201-T205 WeakPolarHBondContact O-CB 3.43Å; I201-T205 PolarHBondContact O-N 3.49Å; I201-T205 PolarHBondContact O-OG1 3.11Å; L202-T205 WeakPolarHBondContact O-CB 3.42Å; L202-T205 PolarHBondContact O-N 3.44Å; L203-T205 VanDerWaalsContact C-N 3.26Å; L203-T205 PolarHBondContact O-N 3.3Å; T205-V208 PolarHBondContact O-N 3.15Å; T205-Y209 HydrophobicContact CG2-CD2 4.09Å; T205-Y209 HydrophobicContact CG2-CE2 3.98Å; T205-Y209 WeakPolarHBondContact O-CD2 3.44Å; T205-Y209 PolarHBondContact O-N 3.32Å; T205-Y209 VanDerWaalsContact O-N 3.15Å; T205-T298 HydrophobicContact CG2-CG2 3.61Å
206Q92.9Very high91.7Very high32 Ų3252.8 Ų52.815%0.1527%0.273CS..Hα-helixtrans-64-41.9176-62.1-52-35.500112L202 L203 A204 V208 Y209 L210 L302L202-Q206 WeakPolarHBondContact O-CG 3.3Å; L202-Q206 PolarHBondContact O-N 2.94Å; L203-Q206 WeakPolarHBondContact O-CB 3.29Å; L203-Q206 PolarHBondContact O-N 2.92Å; A204-Q206 PolarHBondContact O-N 3.43Å; Q206-V208 VanDerWaalsContact C-N 3.32Å; Q206-V208 PolarHBondContact O-N 3.47Å; Q206-Y209 PolarHBondContact O-N 3.34Å; Q206-L210 WeakPolarHBondContact O-CB 3.34Å; Q206-L210 VanDerWaalsContact O-CG 3.31Å; Q206-L210 WeakPolarHBondContact O-CG 3.33Å; Q206-L210 PolarHBondContact O-N 3.49Å; Q206-L302 HydrophobicContact CG-CD2 4.13Å
207L94.9Very high91.9Very high100 Ų10053.1 Ų53.152%0.52427%0.272SS..Hα-helixtrans-60.7-40177.4-66.8177000112.1L203 A204 L210 K211L203-L207 HydrophobicContact CG-CD1 4.33Å; L203-L207 WeakPolarHBondContact O-CG 3.39Å; L203-L207 PolarHBondContact O-N 2.9Å; A204-L207 PolarHBondContact O-N 3.25Å; L207-L210 HydrophobicContact CD2-CD1 4.41Å; L207-L210 PolarHBondContact O-N 3.13Å; L207-K211 WeakPolarHBondContact O-CB 3.2Å; L207-K211 PolarHBondContact O-N 3.35Å
208V95.8Very high91.9Very high29 Ų2955.4 Ų55.418%0.17628%0.284CS..Hα-helixtrans-63.3-43.4175.1174.30000111.1F120 S123 V124 A204 T205 Q206 K211 L212F120-V208 HydrophobicContact CE2-CG2 4.15Å; S123-V208 WeakPolarHBondContact OG-CG1 3.43Å; V124-V208 HydrophobicContact CG2-CG1 4.41Å; V124-V208 HydrophobicContact CG2-CG2 4.44Å; A204-V208 WeakPolarHBondContact O-CG2 3.43Å; A204-V208 PolarHBondContact O-N 3.35Å; T205-V208 PolarHBondContact O-N 3.15Å; Q206-V208 VanDerWaalsContact C-N 3.32Å; Q206-V208 PolarHBondContact O-N 3.47Å; V208-K211 PolarHBondContact O-N 3.3Å; V208-L212 PolarHBondContact O-N 2.97Å
209Y92.7Very high91.5Very high2 Ų261.5 Ų61.51%0.00831%0.306CS..Hα-helixtrans-67.1-40.2176.3-84.3-63.2000113.1T205 Q206 K211 L212 I213 Y295 T298T205-Y209 HydrophobicContact CG2-CD2 4.09Å; T205-Y209 HydrophobicContact CG2-CE2 3.98Å; T205-Y209 WeakPolarHBondContact O-CD2 3.44Å; T205-Y209 PolarHBondContact O-N 3.32Å; T205-Y209 VanDerWaalsContact O-N 3.15Å; Q206-Y209 PolarHBondContact O-N 3.34Å; Y209-K211 VanDerWaalsContact C-N 3.35Å; Y209-L212 HydrophobicContact CD1-CD2 4.18Å; Y209-L212 HydrophobicContact CE1-CD2 4.47Å; Y209-L212 WeakPolarHBondContact O-CB 3.33Å; Y209-L212 PolarHBondContact O-N 2.85Å; Y209-I213 VanDerWaalsContact O-CG1 3.32Å; Y209-I213 WeakPolarHBondContact O-CG1 3.46Å; Y209-I213 PolarHBondContact O-N 2.96Å; Y209-Y295 AromaticContact CD1-CD2 3.71Å; Y209-Y295 HydrophobicContact CD1-CD2 3.71Å; Y209-Y295 HydrophobicContact CD1-CG 4.38Å; Y209-Y295 HydrophobicContact CD2-CD2 4.33Å; Y209-Y295 HydrophobicContact CE1-CD2 4.29Å; Y209-Y295 AromaticContact CG-CD2 3.74Å; Y209-Y295 HydrophobicContact CG-CD2 3.74Å; Y209-Y295 HydrophobicContact CG-CE2 4.41Å; Y209-T298 HydrophobicContact CD2-CG2 4.17Å; Y209-T298 HydrophobicContact CE2-CG2 3.81Å; Y209-T298 WeakPolarHBondContact CE2-OG1 3.46Å; Y209-T298 PolarHBondContact OH-OG1 2.97Å
210L92.9Very high90.9Very high81 Ų8167.4 Ų67.442%0.42432%0.322SS..Hα-helixtrans-59.4-47.8173.9-72.4172.4000110.4Q206 L207 L212 I213 F214Q206-L210 WeakPolarHBondContact O-CB 3.34Å; Q206-L210 VanDerWaalsContact O-CG 3.31Å; Q206-L210 WeakPolarHBondContact O-CG 3.33Å; Q206-L210 PolarHBondContact O-N 3.49Å; L207-L210 HydrophobicContact CD2-CD1 4.41Å; L207-L210 PolarHBondContact O-N 3.13Å; L210-L212 VanDerWaalsContact C-N 3.29Å; L210-L212 PolarHBondContact O-N 2.96Å; L210-I213 PolarHBondContact O-N 3.31Å; L210-I213 VanDerWaalsContact O-N 3.1Å; L210-F214 HydrophobicContact CB-CE2 4.46Å; L210-F214 WeakPolarHBondContact O-CD2 3.49Å; L210-F214 PolarHBondContact O-N 3.47Å
211K94.2Very high89.7Confident122 Ų12269.4 Ų69.453%0.5333%0.326SS..Hα-helixtrans-55.8-43.5174-172.6-173.8-178.1-178.70111.8Y127 L207 V208 Y209 F215Y127-K211 HydrophobicContact CE2-CD 3.88Å; Y127-K211 HydrophobicContact CE2-CG 4.03Å; Y127-K211 VanDerWaalsContact OH-CE 3.29Å; Y127-K211 WeakPolarHBondContact OH-CE 3.36Å; Y127-K211 PolarHBondContact OH-NZ 2.76Å; L207-K211 WeakPolarHBondContact O-CB 3.2Å; L207-K211 PolarHBondContact O-N 3.35Å; V208-K211 PolarHBondContact O-N 3.3Å; Y209-K211 VanDerWaalsContact C-N 3.35Å; K211-F215 WeakPolarHBondContact O-CB 3.49Å; K211-F215 PolarHBondContact O-N 3.43Å
212L91.9Very high88.1Confident11 Ų1173 Ų736%0.05834%0.344CS..Hα-helixtrans-61.6-44.9175.6172.163.6000112R126 Y127 I130 V208 Y209 L210 F215 V216R126-L212 HydrophobicContact CB-CD2 4.4Å; Y127-L212 HydrophobicContact CD2-CB 4.24Å; I130-L212 HydrophobicContact CB-CD1 3.87Å; I130-L212 HydrophobicContact CD1-CD1 3.68Å; I130-L212 HydrophobicContact CD1-CD2 4.29Å; I130-L212 HydrophobicContact CD1-CG 4.49Å; I130-L212 HydrophobicContact CG1-CD1 4.32Å; I130-L212 HydrophobicContact CG2-CD1 3.97Å; V208-L212 PolarHBondContact O-N 2.97Å; Y209-L212 HydrophobicContact CD1-CD2 4.18Å; Y209-L212 HydrophobicContact CE1-CD2 4.47Å; Y209-L212 WeakPolarHBondContact O-CB 3.33Å; Y209-L212 PolarHBondContact O-N 2.85Å; L210-L212 VanDerWaalsContact C-N 3.29Å; L210-L212 PolarHBondContact O-N 2.96Å; L212-F215 PolarHBondContact O-N 2.9Å; L212-V216 HydrophobicContact CD1-CG2 4.03Å; L212-V216 VanDerWaalsContact O-CG2 3.32Å; L212-V216 WeakPolarHBondContact O-CG2 3.39Å; L212-V216 PolarHBondContact O-N 3.34Å
213I90.6Very high86.3Confident72 Ų7281.7 Ų81.737%0.36938%0.381SS..Hα-helixtrans-63-46.5180-69.2165.6000110.6Y209 L210 V216 H217 Y295Y209-I213 VanDerWaalsContact O-CG1 3.32Å; Y209-I213 WeakPolarHBondContact O-CG1 3.46Å; Y209-I213 PolarHBondContact O-N 2.96Å; L210-I213 PolarHBondContact O-N 3.31Å; L210-I213 VanDerWaalsContact O-N 3.1Å; I213-V216 PolarHBondContact O-N 3.32Å; I213-H217 WeakPolarHBondContact O-CB 3.47Å; I213-H217 PolarHBondContact O-N 3.23Å; I213-Y295 HydrophobicContact CD1-CE2 3.96Å
214F91.3Very high84.7Confident147 Ų14782.6 Ų82.665%0.64539%0.393SS*.Hα-helixtrans-60.4-45.3175.9-76.3-62.9000111.6L210 V216 H217 D218L210-F214 HydrophobicContact CB-CE2 4.46Å; L210-F214 WeakPolarHBondContact O-CD2 3.49Å; L210-F214 PolarHBondContact O-N 3.47Å; F214-V216 VanDerWaalsContact C-N 3.34Å; F214-V216 PolarHBondContact O-N 2.86Å; F214-H217 PolarHBondContact O-N 3.49Å; F214-H217 VanDerWaalsContact O-N 3.15Å; F214-D218 WeakPolarHBondContact O-CB 3.41Å; F214-D218 PolarHBondContact O-N 3.07Å
215F90.3Very high82.6Confident49 Ų4986.5 Ų86.522%0.21541%0.413CS..Hα-helixtrans-57.9-44.7176.1-178.9-93.1000112.3I130 A131 K211 L212 R219I130-F215 HydrophobicContact CG2-CD1 4.21Å; I130-F215 HydrophobicContact CG2-CE1 4.21Å; A131-F215 HydrophobicContact CB-CD1 4.18Å; A131-F215 HydrophobicContact CB-CE1 3.83Å; A131-F215 HydrophobicContact CB-CE2 4.17Å; A131-F215 HydrophobicContact CB-CZ 3.81Å; K211-F215 WeakPolarHBondContact O-CB 3.49Å; K211-F215 PolarHBondContact O-N 3.43Å; L212-F215 PolarHBondContact O-N 2.9Å; F215-R219 HydrophobicContact CD1-CG 4.34Å; F215-R219 HydrophobicContact CE1-CG 4.03Å; F215-R219 HydrophobicContact CZ-CG 4.15Å; F215-R219 WeakPolarHBondContact O-CB 3.37Å; F215-R219 WeakPolarHBondContact O-CG 3.19Å; F215-R219 PolarHBondContact O-N 3.42Å; F215-R219 VanDerWaalsContact O-N 3.12Å
216V87.8Confident80Confident18 Ų1894.9 Ų94.911%0.10945%0.452CS..Hα-helixtrans-69.6-33.4177.9173.70000111.8I130 L212 I213 F214 R220I130-V216 HydrophobicContact CG2-CG2 3.8Å; L212-V216 HydrophobicContact CD1-CG2 4.03Å; L212-V216 VanDerWaalsContact O-CG2 3.32Å; L212-V216 WeakPolarHBondContact O-CG2 3.39Å; L212-V216 PolarHBondContact O-N 3.34Å; I213-V216 PolarHBondContact O-N 3.32Å; F214-V216 VanDerWaalsContact C-N 3.34Å; F214-V216 PolarHBondContact O-N 2.86Å; V216-R220 WeakPolarHBondContact O-CG 3.4Å; V216-R220 PolarHBondContact O-N 3.32Å
217H87.3Confident77.9Confident95 Ų95100.3 Ų100.344%0.4448%0.476SS..Hα-helixtrans-68.4-45.4176.6-175.286.8000111.3I213 F214 R219 R220 K221I213-H217 WeakPolarHBondContact O-CB 3.47Å; I213-H217 PolarHBondContact O-N 3.23Å; F214-H217 PolarHBondContact O-N 3.49Å; F214-H217 VanDerWaalsContact O-N 3.15Å; H217-R219 PolarHBondContact O-N 3.46Å; H217-R220 WeakPolarHBondContact O-CB 3.4Å; H217-R220 PolarHBondContact O-N 2.92Å; H217-R220 VanDerWaalsContact O-N 3.17Å; H217-K221 VanDerWaalsContact NE2-CE 3.33Å; H217-K221 WeakPolarHBondContact NE2-CE 3.45Å
218D85.5Confident75.4Confident96 Ų96101.4 Ų101.451%0.51349%0.486SS..Hα-helixtrans-61.5-45.3178.1-170.255.1000111.7F214 R220 K221F214-D218 WeakPolarHBondContact O-CB 3.41Å; F214-D218 PolarHBondContact O-N 3.07Å; D218-R220 VanDerWaalsContact C-N 3.26Å; D218-R220 PolarHBondContact O-N 3.15Å; D218-K221 WeakPolarHBondContact O-CB 3.32Å; D218-K221 PolarHBondContact O-N 3.41Å; D218-K221 VanDerWaalsContact O-N 3.11Å
219R80.5Confident73.1Confident139 Ų139103 Ų10353%0.52550%0.497SS..Hα-helixtrans-66.3-22176.1-66.1-92.5179.2-145.90.3114.1F215 H217 K221 M222F215-R219 HydrophobicContact CD1-CG 4.34Å; F215-R219 HydrophobicContact CE1-CG 4.03Å; F215-R219 HydrophobicContact CZ-CG 4.15Å; F215-R219 WeakPolarHBondContact O-CB 3.37Å; F215-R219 WeakPolarHBondContact O-CG 3.19Å; F215-R219 PolarHBondContact O-N 3.42Å; F215-R219 VanDerWaalsContact O-N 3.12Å; H217-R219 PolarHBondContact O-N 3.46Å; R219-K221 VanDerWaalsContact C-N 3.27Å; R219-K221 PolarHBondContact O-N 3.3Å; R219-M222 HydrophobicContact CG-CE 4.07Å; R219-M222 VanDerWaalsContact NH1-CE 3.32Å; R219-M222 PolarHBondContact NH1-SD 3.16Å; R219-M222 VanDerWaalsContact NH1-SD 3.37Å; R219-M222 PolarHBondContact O-N 3.45Å
220R76.7Confident70.8Confident156 Ų156107.6 Ų107.659%0.58954%0.536SS*.Hα-helixtrans-70.7-23.8174.2-90.6-172.3-92.2-146.93.2112.9V216 H217 D218 M222V216-R220 WeakPolarHBondContact O-CG 3.4Å; V216-R220 PolarHBondContact O-N 3.32Å; H217-R220 WeakPolarHBondContact O-CB 3.4Å; H217-R220 PolarHBondContact O-N 2.92Å; H217-R220 VanDerWaalsContact O-N 3.17Å; D218-R220 VanDerWaalsContact C-N 3.26Å; D218-R220 PolarHBondContact O-N 3.15Å; R220-M222 VanDerWaalsContact C-N 3.27Å
221K67.1Low68.6Low149 Ų149108.3 Ų108.365%0.64854%0.543SS*.THydrogen-bonded Turntrans-79.2-11.8176.9-61.8-177.8179.3179.40112.6H217 D218 R219 K223H217-K221 VanDerWaalsContact NE2-CE 3.33Å; H217-K221 WeakPolarHBondContact NE2-CE 3.45Å; D218-K221 WeakPolarHBondContact O-CB 3.32Å; D218-K221 PolarHBondContact O-N 3.41Å; D218-K221 VanDerWaalsContact O-N 3.11Å; R219-K221 VanDerWaalsContact C-N 3.27Å; R219-K221 PolarHBondContact O-N 3.3Å; K221-K223 PolarHBondContact O-N 3.19Å
222M62.2Low66.3Low90 Ų90105.2 Ų105.244%0.44354%0.537SS..SBendtrans-74.5119.8177.2-58.3-175.7-166.800109.7R219 R220R219-M222 HydrophobicContact CG-CE 4.07Å; R219-M222 VanDerWaalsContact NH1-CE 3.32Å; R219-M222 PolarHBondContact NH1-SD 3.16Å; R219-M222 VanDerWaalsContact NH1-SD 3.37Å; R219-M222 PolarHBondContact O-N 3.45Å; R220-M222 VanDerWaalsContact C-N 3.27Å
223K54.1Low64.1Low194 Ų194113.3 Ų113.384%0.84358%0.575SS**PPolyproline II helixtrans-62.2139.8169.8-66.3-177.3-179.8-178.50108.5K221 V225K221-K223 PolarHBondContact O-N 3.19Å; K223-V225 PolarHBondContact O-N 3.47Å
224P58.8Low62Low120 Ų120116.2 Ų116.278%0.77959%0.591SS**PPolyproline II helixtrans-54.5134.2175.922.9-31.8000109Q226P224-Q226 PolarHBondContact O-N 3.22Å
225V52.2Low60.1Low112 Ų112116 Ų11668%0.67959%0.586SS**  trans-55.9106.6-179.9174.20000108.4K223 F227K223-V225 PolarHBondContact O-N 3.47Å; V225-F227 HydrophobicContact CB-CE2 4.45Å; V225-F227 HydrophobicContact CG1-CD1 4.42Å; V225-F227 HydrophobicContact CG1-CD2 4.29Å; V225-F227 HydrophobicContact CG1-CE1 4.23Å; V225-F227 HydrophobicContact CG1-CE2 4.1Å; V225-F227 HydrophobicContact CG1-CG 4.46Å; V225-F227 HydrophobicContact CG1-CZ 4.07Å; V225-F227 PolarHBondContact O-N 2.92Å; V225-F227 VanDerWaalsContact O-N 3.15Å
226Q41.3Very low58Low179 Ų179118.9 Ų118.984%0.83661%0.607SS**  trans-75.9100.1171.9-127.5167.7-16.800105.6P224 V228P224-Q226 PolarHBondContact O-N 3.22Å; Q226-V228 VanDerWaalsContact C-N 3.28Å; Q226-V228 PolarHBondContact O-N 3.45Å
227F47.6Very low55.9Low146 Ų146124.5 Ų124.564%0.6463%0.631SS**  trans-67.495.4170.7-70.6-82.4000107.1V225 P229V225-F227 HydrophobicContact CB-CE2 4.45Å; V225-F227 HydrophobicContact CG1-CD1 4.42Å; V225-F227 HydrophobicContact CG1-CD2 4.29Å; V225-F227 HydrophobicContact CG1-CE1 4.23Å; V225-F227 HydrophobicContact CG1-CE2 4.1Å; V225-F227 HydrophobicContact CG1-CG 4.46Å; V225-F227 HydrophobicContact CG1-CZ 4.07Å; V225-F227 PolarHBondContact O-N 2.92Å; V225-F227 VanDerWaalsContact O-N 3.15Å; F227-P229 WeakPolarHBondContact O-CD 3.38Å
228V43Very low53.6Low122 Ų122128.4 Ų128.474%0.73965%0.649SS**  trans-62.9119.4165.9-171.20000105.3Q226 A230Q226-V228 VanDerWaalsContact C-N 3.28Å; Q226-V228 PolarHBondContact O-N 3.45Å; V228-A230 PolarHBondContact O-N 3.15Å
229P46.2Very low51.9Low62 Ų62125.5 Ų125.540%0.40364%0.642SS.*  trans-56140.3173.923.8-31000107.9F227 V231 F254F227-P229 WeakPolarHBondContact O-CD 3.38Å; P229-V231 VanDerWaalsContact C-N 3.35Å; P229-V231 PolarHBondContact O-N 3.28Å; P229-F254 HydrophobicContact CG-CE1 4.47Å; P229-F254 HydrophobicContact CG-CE2 4.44Å; P229-F254 HydrophobicContact CG-CZ 4.11Å
230A45.3Very low50.3Low99 Ų99126 Ų12682%0.81866%0.663SS**  trans-61.6100.6175.200000108.2V228 S232V228-A230 PolarHBondContact O-N 3.15Å; A230-S232 PolarHBondContact O-N 2.96Å
231V46Very low49.1Very low96 Ų96121 Ų12158%0.58266%0.66SS**  trans-88.798.5172.2-177.90000106P229 Q233P229-V231 VanDerWaalsContact C-N 3.35Å; P229-V231 PolarHBondContact O-N 3.28Å; V231-Q233 PolarHBondContact O-N 3.4Å
232S46.1Very low48.4Very low58 Ų58114.5 Ų114.541%0.40664%0.635SS.*  trans-70.9120.716765.60000107.9A230 N234A230-S232 PolarHBondContact O-N 2.96Å; S232-N234 PolarHBondContact O-N 3.31Å
233Q47.2Very low48.1Very low181 Ų181113.5 Ų113.585%0.84664%0.636SS**SBendtrans-68.9-20.3173.6-71.5-168.2-25.800112.4V231V231-Q233 PolarHBondContact O-N 3.4Å
234N44.6Very low48.3Very low132 Ų132104.5 Ų104.571%0.70660%0.599SS**SBendtrans-112.699.6177.3-65.9-7000110S232 T236S232-N234 PolarHBondContact O-N 3.31Å; N234-T236 VanDerWaalsContact C-N 3.29Å; N234-T236 PolarHBondContact O-N 2.92Å
235W51.4Low48.4Very low142 Ų142104.9 Ų104.954%0.53859%0.59SS.*  trans-77.478.7172.9-62.188.7000110A246 N249W235-A246 HydrophobicContact CZ3-CB 4.22Å; W235-N249 HydrophobicContact CH2-CB 3.96Å
236T47.3Very low48.8Very low110 Ų110101.3 Ų101.368%0.67557%0.573SS**  trans-124.965.6166.854.90000108.7N234N234-T236 VanDerWaalsContact C-N 3.29Å; N234-T236 PolarHBondContact O-N 2.92Å
237F43.1Very low49.9Very low137 Ų13793.5 Ų93.560%0.60154%0.538SS*.  trans-95.593.5173.2-162.8-129000107.7A242F237-A242 HydrophobicContact CB-CB 4.02Å; F237-A242 HydrophobicContact CD1-CB 3.01Å; F237-A242 HydrophobicContact CE1-CB 3.55Å; F237-A242 HydrophobicContact CG-CB 3.76Å; F237-A242 WeakPolarHBondContact O-CB 3.27Å
238H40.4Very low50.5Low176 Ų17687.5 Ų87.582%0.81552%0.516SS*.  trans-94.6109.8173.9-71.2-84.3000108.8
239G49Very low51.5Low36 Ų3684 Ų8437%0.37149%0.493SS..SBendtrans174.4157.9173.300000112.4G241 A242G239-G241 PolarHBondContact O-N 3.41Å; G239-A242 WeakPolarHBondContact O-CB 3.29Å; G239-A242 PolarHBondContact O-N 2.89Å
240P47.2Very low52.3Low148 Ų14885 Ų8596%0.96149%0.489SS*.THydrogen-bonded Turntrans-63.4-4.9-173-21.332.6000116.2
241G50.7Low53.1Low52 Ų5287.2 Ų87.254%0.53649%0.486SS..THydrogen-bonded Turntrans-109.82.3175.800000114.8G239G239-G241 PolarHBondContact O-N 3.41Å
242A53Low54Low13 Ų1385.5 Ų85.511%0.10748%0.482CS..Hα-helixtrans-77.3-37.6-166.700000116.1F237 G239 G244 A246F237-A242 HydrophobicContact CB-CB 4.02Å; F237-A242 HydrophobicContact CD1-CB 3.01Å; F237-A242 HydrophobicContact CE1-CB 3.55Å; F237-A242 HydrophobicContact CG-CB 3.76Å; F237-A242 WeakPolarHBondContact O-CB 3.27Å; G239-A242 WeakPolarHBondContact O-CB 3.29Å; G239-A242 PolarHBondContact O-N 2.89Å; A242-G244 PolarHBondContact O-N 3.37Å; A242-A246 PolarHBondContact O-N 3.41Å
243S56.4Low54.6Low68 Ų6886 Ų8648%0.47650%0.496SS..Hα-helixtrans-61.9-24.9-179.342.70000112.4A247S243-A247 PolarHBondContact O-N 3.29Å
244G58.5Low55.3Low6 Ų683.2 Ų83.26%0.06248%0.482CS..Hα-helixtrans-70.8-49.4-178.800000116.7A242 A248 I266A242-G244 PolarHBondContact O-N 3.37Å; G244-A248 PolarHBondContact O-N 2.99Å; G244-A248 VanDerWaalsContact O-N 3.17Å; G244-I266 VanDerWaalsContact C-CD1 3.42Å
245Q60.4Low56Low127 Ų12778.5 Ų78.559%0.59346%0.464SS*.Hα-helixtrans-72.5-31.2178.4-92.7144-4100112.1A248 N249Q245-A248 PolarHBondContact O-N 3.45Å; Q245-N249 WeakPolarHBondContact O-CB 3.48Å; Q245-N249 VanDerWaalsContact O-CG 3.32Å; Q245-N249 PolarHBondContact O-N 3.18Å; Q245-N249 PolarHBondContact O-ND2 3.38Å
246A60.7Low56.1Low38 Ų3884 Ų8431%0.31449%0.485SS..Hα-helixtrans-62.7-45.517300000111.9W235 A242 N249 W250W235-A246 HydrophobicContact CZ3-CB 4.22Å; A242-A246 PolarHBondContact O-N 3.41Å; A246-N249 PolarHBondContact O-N 2.95Å; A246-W250 PolarHBondContact O-N 2.79Å
247A62.9Low56.7Low14 Ų1481.1 Ų81.112%0.11648%0.477CS..Hα-helixtrans-63.7-40.9175.700000112.8S243 N249 W250 L251 P260S243-A247 PolarHBondContact O-N 3.29Å; A247-N249 PolarHBondContact O-N 3.17Å; A247-W250 PolarHBondContact O-N 3Å; A247-L251 PolarHBondContact O-N 2.87Å; A247-P260 HydrophobicContact CB-CB 4.4Å; A247-P260 HydrophobicContact CB-CG 4.04Å
248A61.1Low57.2Low21 Ų2180.6 Ų80.617%0.17449%0.487CS..Hα-helixtrans-64.3-37.9177.300000112.9G244 Q245 A252G244-A248 PolarHBondContact O-N 2.99Å; G244-A248 VanDerWaalsContact O-N 3.17Å; Q245-A248 PolarHBondContact O-N 3.45Å; A248-A252 WeakPolarHBondContact O-CB 3.44Å; A248-A252 PolarHBondContact O-N 3.37Å
249N63.2Low57.6Low48 Ų4876.9 Ų76.926%0.25748%0.477SS..Hα-helixtrans-72.2-32.7176.4-72.7-16.7000112.3W235 Q245 A246 A247 A252 F254W235-N249 HydrophobicContact CH2-CB 3.96Å; Q245-N249 WeakPolarHBondContact O-CB 3.48Å; Q245-N249 VanDerWaalsContact O-CG 3.32Å; Q245-N249 PolarHBondContact O-N 3.18Å; Q245-N249 PolarHBondContact O-ND2 3.38Å; A246-N249 PolarHBondContact O-N 2.95Å; A247-N249 PolarHBondContact O-N 3.17Å; N249-A252 PolarHBondContact O-N 3.08Å; N249-F254 WeakPolarHBondContact O-CB 3.27Å; N249-F254 PolarHBondContact O-N 3.2Å; N249-F254 VanDerWaalsContact O-N 3.14Å
250W64.4Low57.9Low83 Ų8377.3 Ų77.331%0.31447%0.474SS..Iπ-helixtrans-65.6-47.7173.8-165100.8000111.6A246 A247 A252 G253 G257 T259 P260A246-W250 PolarHBondContact O-N 2.79Å; A247-W250 PolarHBondContact O-N 3Å; W250-A252 PolarHBondContact O-N 2.88Å; W250-G253 PolarHBondContact O-N 2.68Å; W250-G257 PolarHBondContact NE1-O 3.38Å; W250-T259 HydrophobicContact CH2-CG2 3.11Å; W250-T259 HydrophobicContact CZ2-CG2 3.45Å; W250-T259 VanDerWaalsContact CZ2-CG2 3.45Å; W250-T259 HydrophobicContact CZ3-CG2 3.7Å; W250-P260 HydrophobicContact CB-CG 3.95Å; W250-P260 HydrophobicContact CD2-CG 4.39Å; W250-P260 VanDerWaalsContact CG-CD 3.46Å; W250-P260 HydrophobicContact CG-CG 4Å
251L61.7Low58.1Low145 Ų14575.7 Ų75.776%0.75946%0.463SS*.Iπ-helixtrans-61.2-28175.4-75.8168.5000113.4A247 G253A247-L251 PolarHBondContact O-N 2.87Å; L251-G253 PolarHBondContact O-N 3.23Å
252A64.7Low57.9Low61 Ų6179.6 Ų79.650%0.50448%0.476SS..Iπ-helixtrans-81.76.8175.800000113.7A248 N249 W250 F254A248-A252 WeakPolarHBondContact O-CB 3.44Å; A248-A252 PolarHBondContact O-N 3.37Å; N249-A252 PolarHBondContact O-N 3.08Å; W250-A252 PolarHBondContact O-N 2.88Å; A252-F254 HydrophobicContact CB-CD2 3.73Å; A252-F254 HydrophobicContact CB-CE2 3.84Å
253G59.5Low57.6Low68 Ų6883.3 Ų83.370%0.70149%0.494SS*.Iπ-helixtrans848.917500000115W250 L251W250-G253 PolarHBondContact O-N 2.68Å; L251-G253 PolarHBondContact O-N 3.23Å
254F62.2Low57Low122 Ų12288.2 Ų88.254%0.53551%0.514SS..Iπ-helixtrans-92.4-0.7178.4-58.6-73.6000113.5P229 N249 A252P229-F254 HydrophobicContact CG-CE1 4.47Å; P229-F254 HydrophobicContact CG-CE2 4.44Å; P229-F254 HydrophobicContact CG-CZ 4.11Å; N249-F254 WeakPolarHBondContact O-CB 3.27Å; N249-F254 PolarHBondContact O-N 3.2Å; N249-F254 VanDerWaalsContact O-N 3.14Å; A252-F254 HydrophobicContact CB-CD2 3.73Å; A252-F254 HydrophobicContact CB-CE2 3.84Å
255G58.1Low56.4Low33 Ų3391.2 Ų91.234%0.3455%0.545SS..  trans-82.7131.4179.900000112.8
256R53.7Low55.8Low258 Ų25889.7 Ų89.797%0.97454%0.54SS*.  trans-112.1111.2159.3-70.9-166175.1171.2-0.6108
257G60.4Low55Low49 Ų4999.2 Ų99.251%0.50557%0.568SS.*SBendtrans137.7172.8-17800000113.4W250W250-G257 PolarHBondContact NE1-O 3.38Å
258P52.3Low54.4Low126 Ų126104.1 Ų104.182%0.81859%0.588SS**SBendtrans-61.3149.3-177.224.2-32000112.3
259T50.5Low53.8Low99 Ų99109 Ų10961%0.60761%0.611SS**PPolyproline II helixtrans-51.7125.3-179.246.30000111.2W250W250-T259 HydrophobicContact CH2-CG2 3.11Å; W250-T259 HydrophobicContact CZ2-CG2 3.45Å; W250-T259 VanDerWaalsContact CZ2-CG2 3.45Å; W250-T259 HydrophobicContact CZ3-CG2 3.7Å
260P54.3Low53.2Low45 Ų45109.8 Ų109.829%0.29262%0.621SS.*PPolyproline II helixtrans-64.3146.6172.124-28.9000110A247 W250 T262A247-P260 HydrophobicContact CB-CB 4.4Å; A247-P260 HydrophobicContact CB-CG 4.04Å; W250-P260 HydrophobicContact CB-CG 3.95Å; W250-P260 HydrophobicContact CD2-CG 4.39Å; W250-P260 VanDerWaalsContact CG-CD 3.46Å; W250-P260 HydrophobicContact CG-CG 4Å; P260-T262 PolarHBondContact O-N 3.2Å
261P51.4Low52.8Low113 Ų113111.4 Ų111.473%0.73464%0.636SS**PPolyproline II helixtrans-56.4133.1177.923.2-32.1000109.4L263P261-L263 PolarHBondContact O-N 2.95Å
262T46.7Very low52.6Low134 Ų134106.6 Ų106.682%0.82262%0.617SS**  trans-56.696.8-174.239.60000111.4P260 L264P260-T262 PolarHBondContact O-N 3.2Å; T262-L264 VanDerWaalsContact C-N 3.35Å; T262-L264 PolarHBondContact O-N 2.92Å
263L47.6Very low52.3Low91 Ų91106.2 Ų106.248%0.47661%0.614SS.*  trans-76.987.5169.9-95.6160.1000109.2P261 G265P261-L263 PolarHBondContact O-N 2.95Å; L263-G265 PolarHBondContact O-N 3.31Å
264L43.4Very low52.4Low172 Ų172104.8 Ų104.890%0.90160%0.599SS**THydrogen-bonded Turntrans-61.195.4163-72.6164.3000108.5T262T262-L264 VanDerWaalsContact C-N 3.35Å; T262-L264 PolarHBondContact O-N 2.92Å
265G45.3Very low52.4Low69 Ų69108 Ų10871%0.71161%0.608SS**THydrogen-bonded Turntrans170.6-21.1174.700000117.1L263 R267L263-G265 PolarHBondContact O-N 3.31Å; G265-R267 PolarHBondContact O-N 3.08Å
266I47.4Very low52.8Low94 Ų94115.7 Ų115.748%0.48263%0.626SS.*  trans-96.682-177.5-59.4176.2000109.9G244 Q268G244-I266 VanDerWaalsContact C-CD1 3.42Å; I266-Q268 VanDerWaalsContact C-N 3.26Å; I266-Q268 HydrophobicContact CG2-CG 4.34Å; I266-Q268 PolarHBondContact O-N 2.79Å
267R43.8Very low53.3Low238 Ų238111 Ų11190%0.89861%0.608SS**  trans-68.990.6158.4-167.2177.3-167.6-177.65107.1G265 N269G265-R267 PolarHBondContact O-N 3.08Å; R267-N269 PolarHBondContact O-N 2.97Å
268Q50.7Low53.7Low117 Ų117114.6 Ų114.655%0.54762%0.615SS.*  trans-52118.4167.3-91.2-171-5.900107.8I266 S270I266-Q268 VanDerWaalsContact C-N 3.26Å; I266-Q268 HydrophobicContact CG2-CG 4.34Å; I266-Q268 PolarHBondContact O-N 2.79Å; Q268-S270 PolarHBondContact O-N 3.39Å; Q268-S270 PolarHBondContact O-OG 2.91Å
269N48.4Very low54.6Low124 Ų124114 Ų11466%0.66361%0.605SS**THydrogen-bonded Turntrans-7435.2172.6-155.414.8000111.2R267 N271 A272 A273R267-N269 PolarHBondContact O-N 2.97Å; N269-N271 PolarHBondContact O-N 3.35Å; N269-A272 PolarHBondContact O-N 2.87Å; N269-A272 VanDerWaalsContact OD1-CB 3.3Å; N269-A272 WeakPolarHBondContact OD1-CB 3.49Å; N269-A273 PolarHBondContact O-N 3.48Å
270S51.6Low55.6Low64 Ų64113.2 Ų113.245%0.44860%0.6SS.*Hα-helixtrans-56.3-32.117857.10000111.1Q268 A272 G274Q268-S270 PolarHBondContact O-N 3.39Å; Q268-S270 PolarHBondContact O-OG 2.91Å; S270-A272 PolarHBondContact O-N 3.47Å; S270-G274 PolarHBondContact O-N 3.33Å
271N55.3Low56.6Low118 Ų118115.6 Ų115.663%0.63161%0.609SS**Hα-helixtrans-64.9-35.9175.7-74.7-16.2000113.5N269 R275N269-N271 PolarHBondContact O-N 3.35Å; N271-R275 VanDerWaalsContact O-CB 3.27Å; N271-R275 WeakPolarHBondContact O-CB 3.2Å; N271-R275 VanDerWaalsContact O-CG 3.28Å; N271-R275 WeakPolarHBondContact O-CG 3.25Å; N271-R275 PolarHBondContact O-N 3.07Å
272A56.4Low57.7Low44 Ų44114.5 Ų114.536%0.36460%0.597SS.*Hα-helixtrans-74.4-42.5178.400000111.9N269 S270 R276N269-A272 PolarHBondContact O-N 2.87Å; N269-A272 VanDerWaalsContact OD1-CB 3.3Å; N269-A272 WeakPolarHBondContact OD1-CB 3.49Å; S270-A272 PolarHBondContact O-N 3.47Å; A272-R276 WeakPolarHBondContact O-CB 3.46Å; A272-R276 PolarHBondContact O-N 3.32Å
273A59.3Low59.2Low53 Ų53111.8 Ų111.844%0.43858%0.575SS.*Hα-helixtrans-66.9-40.4175.700000112N269 R276 R277N269-A273 PolarHBondContact O-N 3.48Å; A273-R276 PolarHBondContact O-N 3.08Å; A273-R277 WeakPolarHBondContact O-CG 3.36Å; A273-R277 PolarHBondContact O-N 2.79Å
274G61.3Low60.8Low38 Ų38111.5 Ų111.539%0.39257%0.571SS.*Hα-helixtrans-63.6-47174.400000112.8S270 R276 R277 L278S270-G274 PolarHBondContact O-N 3.33Å; G274-R276 PolarHBondContact O-N 3.46Å; G274-R277 PolarHBondContact O-N 2.95Å; G274-L278 WeakPolarHBondContact O-CB 3.22Å; G274-L278 PolarHBondContact O-N 2.99Å
275R62.5Low62.6Low190 Ų190109.3 Ų109.372%0.71755%0.554SS**Hα-helixtrans-59-44174.3-82.2177-176.7175.41.1112N271 R277 L278 L279N271-R275 VanDerWaalsContact O-CB 3.27Å; N271-R275 WeakPolarHBondContact O-CB 3.2Å; N271-R275 VanDerWaalsContact O-CG 3.28Å; N271-R275 WeakPolarHBondContact O-CG 3.25Å; N271-R275 PolarHBondContact O-N 3.07Å; R275-R277 PolarHBondContact O-N 3.18Å; R275-L278 PolarHBondContact O-N 3.44Å; R275-L279 WeakPolarHBondContact O-CG 3.27Å; R275-L279 PolarHBondContact O-N 3.1Å
276R65.5Low64.4Low193 Ų193106.6 Ų106.673%0.72852%0.524SS*.Hα-helixtrans-62.6-41.5178.5-161.1178.1-162.71776.6112.1A272 A273 G274 V280A272-R276 WeakPolarHBondContact O-CB 3.46Å; A272-R276 PolarHBondContact O-N 3.32Å; A273-R276 PolarHBondContact O-N 3.08Å; G274-R276 PolarHBondContact O-N 3.46Å; R276-V280 WeakPolarHBondContact O-CG2 3.33Å; R276-V280 PolarHBondContact O-N 3.48Å; R276-V280 VanDerWaalsContact O-N 3.15Å
277R65.9Low66.2Low159 Ų159102.3 Ų102.360%0.650%0.501SS*.Hα-helixtrans-64.6-40.9175.5-73.3175.5-175.4-176.50.9112.3A273 G274 R275 V280 L281A273-R277 WeakPolarHBondContact O-CG 3.36Å; A273-R277 PolarHBondContact O-N 2.79Å; G274-R277 PolarHBondContact O-N 2.95Å; R275-R277 PolarHBondContact O-N 3.18Å; R277-V280 PolarHBondContact O-N 3.32Å; R277-L281 PolarHBondContact O-N 2.86Å
278L68.4Low68.2Low125 Ų12594.6 Ų94.665%0.65447%0.474SS*.Hα-helixtrans-66.6-38.8179.8-163.6138.9000111.7G274 R275 L281 D282G274-L278 WeakPolarHBondContact O-CB 3.22Å; G274-L278 PolarHBondContact O-N 2.99Å; R275-L278 PolarHBondContact O-N 3.44Å; L278-L281 PolarHBondContact O-N 3.4Å; L278-D282 WeakPolarHBondContact O-CB 3.46Å; L278-D282 PolarHBondContact O-N 3.42Å
279L70.3Confident69.8Low115 Ų11593.1 Ų93.160%0.60246%0.464SS*.Hα-helixtrans-63.2-45.6173.5-70.7170.9000112.4R275 L281 D282 E283R275-L279 WeakPolarHBondContact O-CG 3.27Å; R275-L279 PolarHBondContact O-N 3.1Å; L279-L281 VanDerWaalsContact C-N 3.31Å; L279-L281 PolarHBondContact O-N 2.93Å; L279-D282 PolarHBondContact O-N 3.35Å; L279-E283 WeakPolarHBondContact O-CB 3.42Å; L279-E283 PolarHBondContact O-N 2.93Å
280V73Confident71.7Confident82 Ų8287.3 Ų87.350%0.49743%0.433SS..Hα-helixtrans-62.8-38.7177.8173.10000111.5R276 R277 F284R276-V280 WeakPolarHBondContact O-CG2 3.33Å; R276-V280 PolarHBondContact O-N 3.48Å; R276-V280 VanDerWaalsContact O-N 3.15Å; R277-V280 PolarHBondContact O-N 3.32Å; V280-F284 WeakPolarHBondContact O-CB 3.48Å; V280-F284 PolarHBondContact O-N 3Å
281L73.4Confident73.5Confident94 Ų9484.6 Ų84.649%0.49241%0.414SS..Hα-helixtrans-67.4-38.6176.5-17566.9000112.1R277 L278 L279 F284 K285R277-L281 PolarHBondContact O-N 2.86Å; L278-L281 PolarHBondContact O-N 3.4Å; L279-L281 VanDerWaalsContact C-N 3.31Å; L279-L281 PolarHBondContact O-N 2.93Å; L281-F284 PolarHBondContact O-N 2.92Å; L281-K285 WeakPolarHBondContact O-CG 3.25Å; L281-K285 PolarHBondContact O-N 3.36Å
282D75.1Confident75.1Confident90 Ų9085.7 Ų85.748%0.48141%0.409SS..Hα-helixtrans-69.3-39.7177.6-163.249.1000112.1L278 L279 F284 K285 T286L278-D282 WeakPolarHBondContact O-CB 3.46Å; L278-D282 PolarHBondContact O-N 3.42Å; L279-D282 PolarHBondContact O-N 3.35Å; D282-F284 PolarHBondContact O-N 3.34Å; D282-K285 PolarHBondContact O-N 3.1Å; D282-T286 WeakPolarHBondContact O-CB 3.34Å; D282-T286 PolarHBondContact O-N 2.85Å; D282-T286 PolarHBondContact O-OG1 3.45Å
283E79.4Confident76.8Confident77 Ų7783.6 Ų83.636%0.3639%0.392SS..Hα-helixtrans-60.2-45.5172.3-168174.5156.100111H133 L279 K285 T286 E287H133-E283 IonicContact CE1-OE1 3.37Å; H133-E283 PolarHBondContact CE1-OE1 3.37Å; H133-E283 IonicContact NE2-OE1 3.83Å; L279-E283 WeakPolarHBondContact O-CB 3.42Å; L279-E283 PolarHBondContact O-N 2.93Å; E283-K285 PolarHBondContact O-N 2.68Å; E283-T286 WeakPolarHBondContact O-CB 3.35Å; E283-T286 PolarHBondContact O-N 3.29Å; E283-E287 WeakPolarHBondContact O-CG 3.44Å; E283-E287 PolarHBondContact O-N 2.91Å
284F80.6Confident78.4Confident86 Ų8681.1 Ų81.138%0.37737%0.371SS..Hα-helixtrans-62.5-41.7176-174.2-98.2000113.1I130 V280 L281 D282 T286 E287 K288I130-F284 HydrophobicContact CG2-CE2 4.2Å; I130-F284 HydrophobicContact CG2-CZ 4.33Å; V280-F284 WeakPolarHBondContact O-CB 3.48Å; V280-F284 PolarHBondContact O-N 3Å; L281-F284 PolarHBondContact O-N 2.92Å; D282-F284 PolarHBondContact O-N 3.34Å; F284-T286 VanDerWaalsContact C-N 3.28Å; F284-T286 PolarHBondContact O-N 2.92Å; F284-E287 PolarHBondContact O-N 3.16Å; F284-K288 PolarHBondContact O-N 2.75Å
285K81.4Confident79.9Confident125 Ų12583 Ų8354%0.54337%0.367SS..Hα-helixtrans-61.3-39.9174.5-76.8173.7-177.9175.70111.4L281 D282 E283 K288 R289L281-K285 WeakPolarHBondContact O-CG 3.25Å; L281-K285 PolarHBondContact O-N 3.36Å; D282-K285 PolarHBondContact O-N 3.1Å; E283-K285 PolarHBondContact O-N 2.68Å; K285-K288 PolarHBondContact O-N 3.48Å; K285-R289 PolarHBondContact O-N 2.88Å; K285-R289 VanDerWaalsContact O-N 3.09Å
286T82.4Confident81.3Confident13 Ų1376.1 Ų76.18%0.0834%0.344CS..Hα-helixtrans-64.9-48.9177.7-56.60000110.7D282 E283 F284 K288 R289 I290D282-T286 WeakPolarHBondContact O-CB 3.34Å; D282-T286 PolarHBondContact O-N 2.85Å; D282-T286 PolarHBondContact O-OG1 3.45Å; E283-T286 WeakPolarHBondContact O-CB 3.35Å; E283-T286 PolarHBondContact O-N 3.29Å; F284-T286 VanDerWaalsContact C-N 3.28Å; F284-T286 PolarHBondContact O-N 2.92Å; T286-K288 VanDerWaalsContact C-N 3.27Å; T286-K288 PolarHBondContact O-N 2.96Å; T286-R289 WeakPolarHBondContact O-CB 3.44Å; T286-R289 PolarHBondContact O-N 3.03Å; T286-I290 HydrophobicContact CG2-CD1 3.98Å; T286-I290 WeakPolarHBondContact O-CG1 3.22Å; T286-I290 PolarHBondContact O-N 3.47Å
287E85.8Confident82.5Confident3 Ų367 Ų671%0.01431%0.309CS..Hα-helixtrans-58.8-36.7176.1-71.7-58.8137.500112.6R126 E283 F284 I290 S291R126-E287 IonicContact CZ-OE2 3.65Å; R126-E287 IonicContact NH1-OE2 2.66Å; R126-E287 PolarHBondContact NH1-OE2 3.23Å; R126-E287 IonicContact NH2-OE2 3.87Å; E283-E287 WeakPolarHBondContact O-CG 3.44Å; E283-E287 PolarHBondContact O-N 2.91Å; F284-E287 PolarHBondContact O-N 3.16Å; E287-I290 PolarHBondContact O-N 3.29Å; E287-S291 VanDerWaalsContact O-CB 3.31Å; E287-S291 WeakPolarHBondContact O-CB 3.25Å; E287-S291 PolarHBondContact O-N 2.79Å; E287-S291 PolarHBondContact O-OG 3.33Å
288K84.9Confident83.9Confident77 Ų7759.6 Ų59.634%0.33528%0.282SS..Hα-helixtrans-66.4-40.1174.4-170.8175-177.4174.90112.5F284 K285 T286 S291 R292F284-K288 PolarHBondContact O-N 2.75Å; K285-K288 PolarHBondContact O-N 3.48Å; T286-K288 VanDerWaalsContact C-N 3.27Å; T286-K288 PolarHBondContact O-N 2.96Å; K288-S291 PolarHBondContact O-N 2.85Å; K288-R292 PolarHBondContact O-N 2.88Å
289R85.4Confident85Confident85 Ų8558.5 Ų58.532%0.32127%0.272SS..Hα-helixtrans-64.8-45176-174.6-174-66.2161.52.3110.9K285 T286 R292 M293K285-R289 PolarHBondContact O-N 2.88Å; K285-R289 VanDerWaalsContact O-N 3.09Å; T286-R289 WeakPolarHBondContact O-CB 3.44Å; T286-R289 PolarHBondContact O-N 3.03Å; R289-R292 PolarHBondContact O-N 3.27Å; R289-M293 PolarHBondContact O-N 2.9Å
290I87.6Confident86.1Confident3 Ų357.2 Ų57.22%0.01526%0.262CS..Hα-helixtrans-60.9-46.8176.3-65.7170000110P62 Y63 T286 E287 R292 M293 F294P62-I290 HydrophobicContact CB-CG2 3.8Å; P62-I290 HydrophobicContact CG-CD1 4.49Å; P62-I290 HydrophobicContact CG-CG2 3.98Å; Y63-I290 HydrophobicContact CE2-CD1 4.14Å; T286-I290 HydrophobicContact CG2-CD1 3.98Å; T286-I290 WeakPolarHBondContact O-CG1 3.22Å; T286-I290 PolarHBondContact O-N 3.47Å; E287-I290 PolarHBondContact O-N 3.29Å; I290-R292 VanDerWaalsContact C-N 3.3Å; I290-R292 PolarHBondContact O-N 3.46Å; I290-M293 WeakPolarHBondContact O-CB 3.45Å; I290-M293 PolarHBondContact O-N 3.43Å; I290-M293 VanDerWaalsContact O-N 3.08Å; I290-F294 HydrophobicContact CG2-CD2 3.8Å; I290-F294 HydrophobicContact CG2-CE2 3.61Å; I290-F294 WeakPolarHBondContact O-CD2 3.44Å; I290-F294 PolarHBondContact O-N 3.47Å; I290-F294 VanDerWaalsContact O-N 3.1Å
291S89.9Confident87.1Confident6 Ų653.5 Ų53.54%0.04224%0.239CC..Hα-helixtrans-61-38.8178.7-58.40000112.5I130 E287 K288 F294 Y295I130-S291 VanDerWaalsContact CD1-OG 3.29Å; I130-S291 WeakPolarHBondContact CD1-OG 3.25Å; E287-S291 VanDerWaalsContact O-CB 3.31Å; E287-S291 WeakPolarHBondContact O-CB 3.25Å; E287-S291 PolarHBondContact O-N 2.79Å; E287-S291 PolarHBondContact O-OG 3.33Å; K288-S291 PolarHBondContact O-N 2.85Å; S291-F294 PolarHBondContact O-N 3.05Å; S291-Y295 WeakPolarHBondContact O-CB 3.46Å; S291-Y295 PolarHBondContact O-N 3.05Å
292R89.6Confident88.1Confident141 Ų14152 Ų5253%0.53223%0.231SC..Hα-helixtrans-62.9-41.5173.5-176.2-179.266.1-173.33.1112K288 R289 I290 Y295 I296K288-R292 PolarHBondContact O-N 2.88Å; R289-R292 PolarHBondContact O-N 3.27Å; I290-R292 VanDerWaalsContact C-N 3.3Å; I290-R292 PolarHBondContact O-N 3.46Å; R292-Y295 PolarHBondContact O-N 2.98Å; R292-I296 HydrophobicContact CG-CD1 4.02Å; R292-I296 VanDerWaalsContact O-CG1 3.27Å; R292-I296 WeakPolarHBondContact O-CG1 3.06Å; R292-I296 PolarHBondContact O-N 3.35Å
293M91.2Very high89Confident1 Ų149.7 Ų49.71%0.00523%0.225CC..Hα-helixtrans-58.6-51.9176.9-177.1-174.585.600110.9L66 R289 I290 Y295 I296 M297 I345 N350 L353L66-M293 HydrophobicContact CD2-CE 4.06Å; R289-M293 PolarHBondContact O-N 2.9Å; I290-M293 WeakPolarHBondContact O-CB 3.45Å; I290-M293 PolarHBondContact O-N 3.43Å; I290-M293 VanDerWaalsContact O-N 3.08Å; M293-Y295 VanDerWaalsContact C-N 3.35Å; M293-Y295 PolarHBondContact O-N 3.47Å; M293-I296 PolarHBondContact O-N 2.9Å; M293-M297 HydrophobicContact CE-SD 4.42Å; M293-M297 WeakPolarHBondContact O-CG 3.09Å; M293-M297 PolarHBondContact O-N 2.95Å; M293-I345 HydrophobicContact CG-CG2 3.91Å; M293-N350 HydrophobicContact SD-CB 3.94Å; M293-L353 HydrophobicContact SD-CD1 4.46Å
294F92.5Very high89.7Confident0 Ų047.3 Ų47.30%021%0.214CC..Hα-helixtrans-64.3-37.8178.6-76.3-71.8000113.1P62 L66 V122 R126 I290 S291 I296 M297 T298P62-F294 HydrophobicContact CB-CE2 3.6Å; P62-F294 HydrophobicContact CB-CZ 4.07Å; P62-F294 VanDerWaalsContact O-CZ 3.23Å; P62-F294 WeakPolarHBondContact O-CZ 3.37Å; L66-F294 HydrophobicContact CB-CE1 4.23Å; L66-F294 HydrophobicContact CB-CZ 4.04Å; L66-F294 HydrophobicContact CD1-CE1 4.47Å; V122-F294 HydrophobicContact CG1-CB 3.78Å; V122-F294 HydrophobicContact CG1-CD1 3.41Å; V122-F294 VanDerWaalsContact CG1-CD1 3.41Å; V122-F294 HydrophobicContact CG1-CD2 4.24Å; V122-F294 HydrophobicContact CG1-CE1 3.99Å; V122-F294 HydrophobicContact CG1-CG 3.53Å; V122-F294 HydrophobicContact CG2-CE1 4.49Å; R126-F294 HydrophobicContact CG-CB 4.4Å; R126-F294 HydrophobicContact CG-CD2 4.43Å; I290-F294 HydrophobicContact CG2-CD2 3.8Å; I290-F294 HydrophobicContact CG2-CE2 3.61Å; I290-F294 WeakPolarHBondContact O-CD2 3.44Å; I290-F294 PolarHBondContact O-N 3.47Å; I290-F294 VanDerWaalsContact O-N 3.1Å; S291-F294 PolarHBondContact O-N 3.05Å; F294-I296 VanDerWaalsContact C-N 3.32Å; F294-I296 PolarHBondContact O-N 2.98Å; F294-M297 HydrophobicContact CD1-SD 3.89Å; F294-M297 HydrophobicContact CE1-SD 4.15Å; F294-M297 WeakPolarHBondContact O-CB 3.3Å; F294-M297 PolarHBondContact O-N 2.78Å; F294-M297 VanDerWaalsContact O-N 3.15Å; F294-T298 PolarHBondContact O-N 3.38Å; F294-T298 PolarHBondContact O-OG1 2.92Å; F294-T298 VanDerWaalsContact O-OG1 3.05Å
295Y92.3Very high90.3Very high78 Ų7844.2 Ų44.231%0.30620%0.2SC..Hα-helixtrans-57.9-45.1173.4172.7-104.6000112Y209 I213 S291 R292 M293 M297 T298 F299Y209-Y295 AromaticContact CD1-CD2 3.71Å; Y209-Y295 HydrophobicContact CD1-CD2 3.71Å; Y209-Y295 HydrophobicContact CD1-CG 4.38Å; Y209-Y295 HydrophobicContact CD2-CD2 4.33Å; Y209-Y295 HydrophobicContact CE1-CD2 4.29Å; Y209-Y295 AromaticContact CG-CD2 3.74Å; Y209-Y295 HydrophobicContact CG-CD2 3.74Å; Y209-Y295 HydrophobicContact CG-CE2 4.41Å; I213-Y295 HydrophobicContact CD1-CE2 3.96Å; S291-Y295 WeakPolarHBondContact O-CB 3.46Å; S291-Y295 PolarHBondContact O-N 3.05Å; R292-Y295 PolarHBondContact O-N 2.98Å; M293-Y295 VanDerWaalsContact C-N 3.35Å; M293-Y295 PolarHBondContact O-N 3.47Å; Y295-M297 VanDerWaalsContact C-N 3.33Å; Y295-M297 PolarHBondContact O-N 3.47Å; Y295-T298 PolarHBondContact O-N 2.81Å; Y295-F299 WeakPolarHBondContact O-CB 3.33Å; Y295-F299 PolarHBondContact O-N 3.25Å
296I92.3Very high90.8Very high46 Ų4639.1 Ų39.124%0.23618%0.183CC..Hα-helixtrans-62.1-42.8175.9-64.5165.1000110R292 M293 F294 T298 F299 F300 I345R292-I296 HydrophobicContact CG-CD1 4.02Å; R292-I296 VanDerWaalsContact O-CG1 3.27Å; R292-I296 WeakPolarHBondContact O-CG1 3.06Å; R292-I296 PolarHBondContact O-N 3.35Å; M293-I296 PolarHBondContact O-N 2.9Å; F294-I296 VanDerWaalsContact C-N 3.32Å; F294-I296 PolarHBondContact O-N 2.98Å; I296-T298 PolarHBondContact O-N 3.12Å; I296-F299 PolarHBondContact O-N 2.92Å; I296-F300 HydrophobicContact CG2-CD2 3.7Å; I296-F300 HydrophobicContact CG2-CE2 3.7Å; I296-F300 WeakPolarHBondContact O-CD2 3.4Å; I296-F300 PolarHBondContact O-N 3.46Å; I296-I345 HydrophobicContact CB-CG2 4.34Å; I296-I345 HydrophobicContact CG2-CD1 3.99Å; I296-I345 HydrophobicContact CG2-CG1 4.26Å; I296-I345 HydrophobicContact CG2-CG2 4.14Å
297M92.3Very high91.4Very high1 Ų140 Ų401%0.00519%0.189CC..Hα-helixtrans-58.2-47.9175.6-65.3175.771.300112.4L66 L69 M293 F294 Y295 F299 F300 F301 N342 I345L66-M297 HydrophobicContact CD1-CE 3.58Å; L66-M297 HydrophobicContact CD1-SD 4.04Å; L69-M297 HydrophobicContact CD1-CE 4.29Å; M293-M297 HydrophobicContact CE-SD 4.42Å; M293-M297 WeakPolarHBondContact O-CG 3.09Å; M293-M297 PolarHBondContact O-N 2.95Å; F294-M297 HydrophobicContact CD1-SD 3.89Å; F294-M297 HydrophobicContact CE1-SD 4.15Å; F294-M297 WeakPolarHBondContact O-CB 3.3Å; F294-M297 PolarHBondContact O-N 2.78Å; F294-M297 VanDerWaalsContact O-N 3.15Å; Y295-M297 VanDerWaalsContact C-N 3.33Å; Y295-M297 PolarHBondContact O-N 3.47Å; M297-F299 VanDerWaalsContact C-N 3.33Å; M297-F299 PolarHBondContact O-N 2.96Å; M297-F300 PolarHBondContact O-N 3.27Å; M297-F301 PolarHBondContact O-N 3.27Å; M297-N342 HydrophobicContact CE-CB 3.77Å; M297-N342 VanDerWaalsContact CE-CG 3.45Å; M297-N342 WeakPolarHBondContact CE-OD1 3.07Å; M297-I345 HydrophobicContact CB-CD1 4.15Å; M297-I345 HydrophobicContact CG-CB 4.03Å; M297-I345 HydrophobicContact CG-CD1 3.72Å; M297-I345 HydrophobicContact CG-CG1 4.5Å; M297-I345 HydrophobicContact CG-CG2 3.65Å
298T93.6Very high91.6Very high4 Ų440.6 Ų40.63%0.02519%0.191CC..Hα-helixtrans-64-38.3177.8-53.40000112.1T205 Y209 F294 Y295 I296 F301 L302T205-T298 HydrophobicContact CG2-CG2 3.61Å; Y209-T298 HydrophobicContact CD2-CG2 4.17Å; Y209-T298 HydrophobicContact CE2-CG2 3.81Å; Y209-T298 WeakPolarHBondContact CE2-OG1 3.46Å; Y209-T298 PolarHBondContact OH-OG1 2.97Å; F294-T298 PolarHBondContact O-N 3.38Å; F294-T298 PolarHBondContact O-OG1 2.92Å; F294-T298 VanDerWaalsContact O-OG1 3.05Å; Y295-T298 PolarHBondContact O-N 2.81Å; I296-T298 PolarHBondContact O-N 3.12Å; T298-F301 WeakPolarHBondContact O-CB 3.38Å; T298-F301 PolarHBondContact O-N 2.99Å; T298-L302 PolarHBondContact O-N 3.35Å; T298-L302 VanDerWaalsContact O-N 3.1Å
299F92.5Very high91.9Very high102 Ų10237.7 Ų37.745%0.44718%0.179SC..Hα-helixtrans-62.8-46.7176.4176.3-95.7000111.8Y295 I296 M297 F301 L302 A303Y295-F299 WeakPolarHBondContact O-CB 3.33Å; Y295-F299 PolarHBondContact O-N 3.25Å; I296-F299 PolarHBondContact O-N 2.92Å; M297-F299 VanDerWaalsContact C-N 3.33Å; M297-F299 PolarHBondContact O-N 2.96Å; F299-F301 VanDerWaalsContact C-N 3.33Å; F299-F301 PolarHBondContact O-N 2.98Å; F299-L302 PolarHBondContact O-N 3.45Å; F299-A303 PolarHBondContact O-N 3.18Å
300F93.8Very high92.1Very high88 Ų8837.2 Ų37.239%0.38619%0.185SC..Hα-helixtrans-64.8-36.5176.4-86.5-79.5000112.6I296 M297 L302 A303 L304 Q338 V341 I345I296-F300 HydrophobicContact CG2-CD2 3.7Å; I296-F300 HydrophobicContact CG2-CE2 3.7Å; I296-F300 WeakPolarHBondContact O-CD2 3.4Å; I296-F300 PolarHBondContact O-N 3.46Å; M297-F300 PolarHBondContact O-N 3.27Å; F300-L302 VanDerWaalsContact C-N 3.33Å; F300-L302 PolarHBondContact O-N 3.27Å; F300-A303 PolarHBondContact O-N 3.2Å; F300-L304 WeakPolarHBondContact O-CB 3.37Å; F300-L304 WeakPolarHBondContact O-CG 3.37Å; F300-L304 PolarHBondContact O-N 3.49Å; F300-Q338 PolarHBondContact O-OE1 2.96Å; F300-V341 HydrophobicContact CB-CG1 3.82Å; F300-V341 HydrophobicContact CG-CG1 4.22Å; F300-I345 HydrophobicContact CB-CD1 4.33Å; F300-I345 HydrophobicContact CD2-CD1 3.79Å; F300-I345 HydrophobicContact CG-CD1 4.32Å
301F93.8Very high92.1Very high4 Ų437 Ų372%0.01819%0.185CC..Hα-helixtrans-55.4-49.6171.9-177.2-82.8000111.1L119 L202 M297 T298 F299 A303 L304 W305 Q338L119-F301 HydrophobicContact CD1-CB 3.68Å; L119-F301 HydrophobicContact CD1-CD1 3.96Å; L119-F301 HydrophobicContact CD1-CD2 3.68Å; L119-F301 HydrophobicContact CD1-CE2 4.31Å; L119-F301 HydrophobicContact CD1-CG 3.47Å; L119-F301 VanDerWaalsContact CD1-CG 3.47Å; L202-F301 HydrophobicContact CD1-CE1 4.23Å; L202-F301 HydrophobicContact CD2-CD1 3.83Å; L202-F301 HydrophobicContact CD2-CE1 3.44Å; L202-F301 VanDerWaalsContact CD2-CE1 3.44Å; L202-F301 HydrophobicContact CG-CE1 4.47Å; M297-F301 PolarHBondContact O-N 3.27Å; T298-F301 WeakPolarHBondContact O-CB 3.38Å; T298-F301 PolarHBondContact O-N 2.99Å; F299-F301 VanDerWaalsContact C-N 3.33Å; F299-F301 PolarHBondContact O-N 2.98Å; F301-A303 PolarHBondContact O-N 3.02Å; F301-L304 PolarHBondContact O-N 3.39Å; F301-W305 HydrophobicContact CD1-CG 4.49Å; F301-W305 AromaticContact CD2-CD1 3.66Å; F301-W305 AromaticContact CD2-NE1 3.87Å; F301-W305 HydrophobicContact CE1-CB 4.2Å; F301-W305 AromaticContact CE1-CD1 3.93Å; F301-W305 HydrophobicContact CE1-CG 4.02Å; F301-W305 AromaticContact CE2-CD1 3.48Å; F301-W305 VanDerWaalsContact CE2-CD1 3.48Å; F301-W305 HydrophobicContact CE2-CG 4.2Å; F301-W305 AromaticContact CE2-NE1 3.41Å; F301-W305 AromaticContact CG-CD1 3.99Å; F301-W305 AromaticContact CZ-CD1 3.62Å; F301-W305 HydrophobicContact CZ-CD2 4.23Å; F301-W305 AromaticContact CZ-CG 3.88Å; F301-W305 HydrophobicContact CZ-CG 3.88Å; F301-W305 AromaticContact CZ-NE1 3.79Å; F301-W305 VanDerWaalsContact O-CB 3.29Å; F301-W305 WeakPolarHBondContact O-CB 3.41Å; F301-W305 PolarHBondContact O-N 3.25Å; F301-Q338 HydrophobicContact CD2-CG 3.97Å
302L93.3Very high91.9Very high61 Ų6136.9 Ų36.932%0.31918%0.184SC..Hα-helixtrans-63.3-41.8177.5-17866000112.2Q206 T298 F299 F300 L304 G306Q206-L302 HydrophobicContact CG-CD2 4.13Å; T298-L302 PolarHBondContact O-N 3.35Å; T298-L302 VanDerWaalsContact O-N 3.1Å; F299-L302 PolarHBondContact O-N 3.45Å; F300-L302 VanDerWaalsContact C-N 3.33Å; F300-L302 PolarHBondContact O-N 3.27Å; L302-L304 VanDerWaalsContact C-N 3.33Å; L302-L304 PolarHBondContact O-N 3.05Å; L302-G306 VanDerWaalsContact O-CA 3.24Å; L302-G306 WeakPolarHBondContact O-CA 3.42Å; L302-G306 PolarHBondContact O-N 2.64Å
303A94.1Very high91.7Very high43 Ų4332.3 Ų32.336%0.35517%0.166SC..Hα-helixtrans-65.2-36.2-179.500000112.7F299 F300 F301 P307 M334F299-A303 PolarHBondContact O-N 3.18Å; F300-A303 PolarHBondContact O-N 3.2Å; F301-A303 PolarHBondContact O-N 3.02Å; A303-P307 VanDerWaalsContact O-CD 3.26Å; A303-P307 WeakPolarHBondContact O-CD 3.49Å; A303-M334 WeakPolarHBondContact O-CE 3.12Å
304L94.9Very high91.4Very high26 Ų2638.6 Ų38.614%0.13619%0.19CC..Hα-helixtrans-87.4-32.8-177.4-71.6172.3000113.3F300 F301 L302 M334 S335 Q338 V341F300-L304 WeakPolarHBondContact O-CB 3.37Å; F300-L304 WeakPolarHBondContact O-CG 3.37Å; F300-L304 PolarHBondContact O-N 3.49Å; F301-L304 PolarHBondContact O-N 3.39Å; L302-L304 VanDerWaalsContact C-N 3.33Å; L302-L304 PolarHBondContact O-N 3.05Å; L304-M334 WeakPolarHBondContact CB-O 3.16Å; L304-M334 HydrophobicContact CD2-CB 3.99Å; L304-M334 HydrophobicContact CD2-CE 3.99Å; L304-M334 HydrophobicContact CD2-CG 4.28Å; L304-M334 CarbonylContact O-C 3.54Å; L304-M334 WeakPolarHBondContact O-CB 3.36Å; L304-S335 PolarHBondContact O-N 3.39Å; L304-Q338 HydrophobicContact CB-CB 4.33Å; L304-Q338 HydrophobicContact CD1-CB 4.24Å; L304-Q338 VanDerWaalsContact CD1-OE1 3.29Å; L304-V341 HydrophobicContact CD1-CG2 3.49Å; L304-V341 VanDerWaalsContact CD1-CG2 3.49Å
305W93.3Very high90.8Very high22 Ų2241.6 Ų41.68%0.08320%0.201CC..Hα-helixtrans-87.6-26.2175.4-79.686.7000113.8C112 F301 Y308 L309C112-W305 HydrophobicContact CB-CH2 3.81Å; C112-W305 HydrophobicContact CB-CZ2 4.32Å; C112-W305 HydrophobicContact CB-CZ3 4.32Å; C112-W305 WeakPolarHBondContact SG-CH2 3.4Å; C112-W305 WeakPolarHBondContact SG-CZ3 3.15Å; F301-W305 HydrophobicContact CD1-CG 4.49Å; F301-W305 AromaticContact CD2-CD1 3.66Å; F301-W305 AromaticContact CD2-NE1 3.87Å; F301-W305 HydrophobicContact CE1-CB 4.2Å; F301-W305 AromaticContact CE1-CD1 3.93Å; F301-W305 HydrophobicContact CE1-CG 4.02Å; F301-W305 AromaticContact CE2-CD1 3.48Å; F301-W305 VanDerWaalsContact CE2-CD1 3.48Å; F301-W305 HydrophobicContact CE2-CG 4.2Å; F301-W305 AromaticContact CE2-NE1 3.41Å; F301-W305 AromaticContact CG-CD1 3.99Å; F301-W305 AromaticContact CZ-CD1 3.62Å; F301-W305 HydrophobicContact CZ-CD2 4.23Å; F301-W305 AromaticContact CZ-CG 3.88Å; F301-W305 HydrophobicContact CZ-CG 3.88Å; F301-W305 AromaticContact CZ-NE1 3.79Å; F301-W305 VanDerWaalsContact O-CB 3.29Å; F301-W305 WeakPolarHBondContact O-CB 3.41Å; F301-W305 PolarHBondContact O-N 3.25Å; W305-Y308 HydrophobicContact CE3-CD1 4.11Å; W305-Y308 AromaticContact CZ3-CD1 3.99Å; W305-Y308 HydrophobicContact CZ3-CD1 3.99Å; W305-Y308 HydrophobicContact CZ3-CE1 4.35Å; W305-Y308 WeakPolarHBondContact O-CB 3.26Å; W305-Y308 PolarHBondContact O-N 3.01Å; W305-L309 WeakPolarHBondContact O-CG 3.45Å; W305-L309 PolarHBondContact O-N 3.3Å
306G91.9Very high90.2Very high18 Ų1838 Ų3819%0.18619%0.188CC..Hα-helixtrans-52-50.5-176.600000113.9L302 Y308 L309 V310L302-G306 VanDerWaalsContact O-CA 3.24Å; L302-G306 WeakPolarHBondContact O-CA 3.42Å; L302-G306 PolarHBondContact O-N 2.64Å; G306-Y308 VanDerWaalsContact C-N 3.29Å; G306-Y308 PolarHBondContact O-N 3.03Å; G306-L309 PolarHBondContact O-N 2.82Å; G306-V310 WeakPolarHBondContact O-CG2 3.17Å; G306-V310 PolarHBondContact O-N 3.44Å
307P94.3Very high89.5Confident30 Ų3041.4 Ų41.420%0.19520%0.201CC..Hα-helixtrans-59.4-37.7177.3-26.136.1000113.2A303 V310 A311 Y327 A331 M334A303-P307 VanDerWaalsContact O-CD 3.26Å; A303-P307 WeakPolarHBondContact O-CD 3.49Å; P307-V310 PolarHBondContact O-N 3Å; P307-A311 WeakPolarHBondContact O-CB 3.38Å; P307-A311 PolarHBondContact O-N 3.43Å; P307-Y327 PolarHBondContact O-OH 3.04Å; P307-Y327 VanDerWaalsContact O-OH 3.05Å; P307-A331 HydrophobicContact CB-CB 3.92Å; P307-M334 HydrophobicContact CB-SD 4.46Å; P307-M334 HydrophobicContact CG-CE 3.83Å; P307-M334 HydrophobicContact CG-SD 3.99Å
308Y91.2Very high88.6Confident17 Ų1742.7 Ų42.77%0.06721%0.212CC..Hα-helixtrans-66.9-44.4177.2-174.2-110.4000111.2E176 W305 G306 V310 A311 C312 V332E176-Y308 WeakPolarHBondContact OE2-CE2 3.36Å; E176-Y308 PolarHBondContact OE2-OH 3.21Å; W305-Y308 HydrophobicContact CE3-CD1 4.11Å; W305-Y308 AromaticContact CZ3-CD1 3.99Å; W305-Y308 HydrophobicContact CZ3-CD1 3.99Å; W305-Y308 HydrophobicContact CZ3-CE1 4.35Å; W305-Y308 WeakPolarHBondContact O-CB 3.26Å; W305-Y308 PolarHBondContact O-N 3.01Å; G306-Y308 VanDerWaalsContact C-N 3.29Å; G306-Y308 PolarHBondContact O-N 3.03Å; Y308-V310 VanDerWaalsContact C-N 3.32Å; Y308-V310 PolarHBondContact O-N 2.91Å; Y308-A311 WeakPolarHBondContact O-CB 3.18Å; Y308-A311 PolarHBondContact O-N 3.25Å; Y308-A311 VanDerWaalsContact O-N 3.15Å; Y308-C312 PolarHBondContact O-N 3.21Å; Y308-C312 PolarHBondContact O-SG 2.94Å; Y308-V332 HydrophobicContact CD2-CG2 3.89Å; Y308-V332 HydrophobicContact CE2-CG2 3.69Å
309L89.6Confident87.2Confident15 Ų1551.6 Ų51.68%0.07925%0.245CC..Hα-helixtrans-59.5-43.9175.5-63.9176.6000111.8M195 L198 L202 W305 G306 A311 C312 Y313M195-L309 HydrophobicContact CE-CD2 3.87Å; L198-L309 HydrophobicContact CD2-CD2 3.59Å; L198-L309 HydrophobicContact CG-CD2 4.25Å; L202-L309 HydrophobicContact CD1-CD1 3.44Å; L202-L309 VanDerWaalsContact CD1-CD1 3.44Å; W305-L309 WeakPolarHBondContact O-CG 3.45Å; W305-L309 PolarHBondContact O-N 3.3Å; G306-L309 PolarHBondContact O-N 2.82Å; L309-A311 VanDerWaalsContact C-N 3.34Å; L309-A311 PolarHBondContact O-N 3.34Å; L309-C312 PolarHBondContact O-N 3.41Å; L309-Y313 WeakPolarHBondContact O-CD2 3.42Å; L309-Y313 PolarHBondContact O-N 3.2Å
310V90.3Very high85.6Confident75 Ų7550.5 Ų50.546%0.45526%0.263SS..Hα-helixtrans-61.1-43.2175.9172.90000110.9G306 P307 Y308 C312 Y313 W314 Y327G306-V310 WeakPolarHBondContact O-CG2 3.17Å; G306-V310 PolarHBondContact O-N 3.44Å; P307-V310 PolarHBondContact O-N 3Å; Y308-V310 VanDerWaalsContact C-N 3.32Å; Y308-V310 PolarHBondContact O-N 2.91Å; V310-C312 VanDerWaalsContact C-N 3.35Å; V310-C312 PolarHBondContact O-N 3.21Å; V310-Y313 PolarHBondContact O-N 3.4Å; V310-W314 WeakPolarHBondContact O-CB 3.37Å; V310-W314 PolarHBondContact O-N 3.48Å; V310-Y327 WeakPolarHBondContact CB-OH 3.24Å; V310-Y327 WeakPolarHBondContact CG1-OH 3.46Å
311A88.5Confident84.1Confident0 Ų049.5 Ų49.50%027%0.267CS..Hα-helixtrans-59.7-44175.400000112.3P307 Y308 L309 W314 R315 Y327 L328P307-A311 WeakPolarHBondContact O-CB 3.38Å; P307-A311 PolarHBondContact O-N 3.43Å; Y308-A311 WeakPolarHBondContact O-CB 3.18Å; Y308-A311 PolarHBondContact O-N 3.25Å; Y308-A311 VanDerWaalsContact O-N 3.15Å; L309-A311 VanDerWaalsContact C-N 3.34Å; L309-A311 PolarHBondContact O-N 3.34Å; A311-W314 WeakPolarHBondContact O-CB 3.38Å; A311-W314 PolarHBondContact O-N 2.98Å; A311-R315 WeakPolarHBondContact O-CG 3.29Å; A311-R315 PolarHBondContact O-N 2.89Å; A311-Y327 HydrophobicContact CB-CD1 4.32Å; A311-Y327 HydrophobicContact CB-CE1 3.67Å; A311-L328 HydrophobicContact CB-CD1 4.3Å
312C85.1Confident83.1Confident3 Ų356 Ų562%0.0231%0.306CS..Hα-helixtrans-63.3-45.9177.5-64.70000111.6H183 M195 Y308 L309 V310 W314 R315 V316H183-C312 PolarHBondContact CE1-SG 3.13Å; H183-C312 PolarHBondContact NE2-SG 2.92Å; M195-C312 HydrophobicContact CE-CB 3.23Å; M195-C312 HydrophobicContact SD-CB 4.14Å; Y308-C312 PolarHBondContact O-N 3.21Å; Y308-C312 PolarHBondContact O-SG 2.94Å; L309-C312 PolarHBondContact O-N 3.41Å; V310-C312 VanDerWaalsContact C-N 3.35Å; V310-C312 PolarHBondContact O-N 3.21Å; C312-W314 VanDerWaalsContact C-N 3.34Å; C312-W314 PolarHBondContact O-N 2.95Å; C312-R315 PolarHBondContact O-N 2.89Å; C312-V316 WeakPolarHBondContact O-CG2 3.3Å; C312-V316 PolarHBondContact O-N 2.98Å; C312-V316 VanDerWaalsContact O-N 3.15Å
313Y84.9Confident82.6Confident44 Ų4453.7 Ų53.717%0.17330%0.295CS..Hα-helixtrans-62.6-40.7175.1-83.9-65.5000112.4M195 L196 A199 L309 V310 R315 V316 F317M195-Y313 HydrophobicContact CB-CE1 4.05Å; M195-Y313 HydrophobicContact CB-CE2 4.47Å; M195-Y313 HydrophobicContact CE-CD2 4.37Å; M195-Y313 HydrophobicContact CE-CE2 4.26Å; M195-Y313 PolarHBondContact O-OH 2.91Å; L196-Y313 VanDerWaalsContact CA-OH 3.23Å; L196-Y313 WeakPolarHBondContact CA-OH 3.38Å; L196-Y313 HydrophobicContact CD2-CE1 4.28Å; L196-Y313 PolarHBondContact N-OH 3.46Å; A199-Y313 HydrophobicContact CB-CE2 4.25Å; A199-Y313 WeakPolarHBondContact CB-OH 3.44Å; L309-Y313 WeakPolarHBondContact O-CD2 3.42Å; L309-Y313 PolarHBondContact O-N 3.2Å; V310-Y313 PolarHBondContact O-N 3.4Å; Y313-R315 VanDerWaalsContact C-N 3.32Å; Y313-R315 PolarHBondContact O-N 2.65Å; Y313-V316 PolarHBondContact O-N 3.27Å; Y313-V316 VanDerWaalsContact O-N 3.15Å; Y313-F317 HydrophobicContact CD1-CD2 4.07Å; Y313-F317 AromaticContact CD1-CE2 3.59Å; Y313-F317 HydrophobicContact CD1-CE2 3.59Å; Y313-F317 HydrophobicContact CE1-CE2 4.16Å; Y313-F317 WeakPolarHBondContact O-CD2 3.39Å; Y313-F317 PolarHBondContact O-N 3.49Å
314W85.6Confident82.3Confident133 Ų13355.8 Ų55.850%0.50430%0.304SS..Hα-helixtrans-58.3-45.7176-165.9-65.6000111.1V310 A311 C312 V316 F317 A318 V323V310-W314 WeakPolarHBondContact O-CB 3.37Å; V310-W314 PolarHBondContact O-N 3.48Å; A311-W314 WeakPolarHBondContact O-CB 3.38Å; A311-W314 PolarHBondContact O-N 2.98Å; C312-W314 VanDerWaalsContact C-N 3.34Å; C312-W314 PolarHBondContact O-N 2.95Å; W314-V316 VanDerWaalsContact C-N 3.29Å; W314-V316 PolarHBondContact O-N 3.35Å; W314-F317 PolarHBondContact O-N 3.4Å; W314-A318 HydrophobicContact CG-CB 4.36Å; W314-A318 WeakPolarHBondContact O-CB 3.19Å; W314-A318 PolarHBondContact O-N 3.47Å; W314-V323 HydrophobicContact CB-CG2 4.05Å; W314-V323 HydrophobicContact CG-CG2 3.91Å
315R80.3Confident81.8Confident63 Ų6363.8 Ų63.824%0.23833%0.333CS..Hα-helixtrans-63-32.7176.8-73.6-179.2169.6-176.2-6.5113.5E176 H183 A311 C312 Y313 V323E176-R315 IonicContact OE1-CZ 3.61Å; E176-R315 IonicContact OE1-NH1 2.69Å; E176-R315 PolarHBondContact OE1-NH1 2.69Å; E176-R315 IonicContact OE1-NH2 3.88Å; H183-R315 HydrophobicContact CB-CB 4.37Å; A311-R315 WeakPolarHBondContact O-CG 3.29Å; A311-R315 PolarHBondContact O-N 2.89Å; C312-R315 PolarHBondContact O-N 2.89Å; Y313-R315 VanDerWaalsContact C-N 3.32Å; Y313-R315 PolarHBondContact O-N 2.65Å; R315-V323 HydrophobicContact CG-CG2 3.71Å
316V78.4Confident81.4Confident4 Ų465.4 Ų65.42%0.02436%0.356CS..Hα-helixtrans-75.3-43.5179.5173.20000111.5H183 L192 C312 Y313 W314H183-V316 HydrophobicContact CB-CG2 4.45Å; L192-V316 HydrophobicContact CD1-CG1 4.46Å; C312-V316 WeakPolarHBondContact O-CG2 3.3Å; C312-V316 PolarHBondContact O-N 2.98Å; C312-V316 VanDerWaalsContact O-N 3.15Å; Y313-V316 PolarHBondContact O-N 3.27Å; Y313-V316 VanDerWaalsContact O-N 3.15Å; W314-V316 VanDerWaalsContact C-N 3.29Å; W314-V316 PolarHBondContact O-N 3.35Å
317F78.3Confident81.4Confident116 Ų11668.8 Ų68.851%0.50936%0.364SS..Hα-helixtrans-93.7-37.2-171.6-73.7-66.7000114.8L192 Y313 W314 R319L192-F317 HydrophobicContact CD1-CE1 4.21Å; L192-F317 HydrophobicContact CD1-CZ 3.95Å; Y313-F317 HydrophobicContact CD1-CD2 4.07Å; Y313-F317 AromaticContact CD1-CE2 3.59Å; Y313-F317 HydrophobicContact CD1-CE2 3.59Å; Y313-F317 HydrophobicContact CE1-CE2 4.16Å; Y313-F317 WeakPolarHBondContact O-CD2 3.39Å; Y313-F317 PolarHBondContact O-N 3.49Å; W314-F317 PolarHBondContact O-N 3.4Å; F317-R319 PolarHBondContact O-N 2.82Å; F317-R319 VanDerWaalsContact O-N 3.1Å
318A73.8Confident81.1Confident28 Ų2867.5 Ų67.523%0.23136%0.356CS..SBendtrans-83.291.5-177.200000110.3W314 G320W314-A318 HydrophobicContact CG-CB 4.36Å; W314-A318 WeakPolarHBondContact O-CB 3.19Å; W314-A318 PolarHBondContact O-N 3.47Å; A318-G320 PolarHBondContact O-N 3.38Å; A318-G320 VanDerWaalsContact O-N 3.07Å
319R62.8Low81Confident192 Ų19268.5 Ų68.573%0.72536%0.363SS*.THydrogen-bonded Turntrans-62.3109.2174.4-68.1-177.4-179.7168.22.6109.8F317F317-R319 PolarHBondContact O-N 2.82Å; F317-R319 VanDerWaalsContact O-N 3.1Å
320G60Low81.1Confident79 Ų7970.1 Ų70.181%0.81438%0.379SS*.THydrogen-bonded Turntrans88-6.8172.600000116.2A318 V322A318-G320 PolarHBondContact O-N 3.38Å; A318-G320 VanDerWaalsContact O-N 3.07Å; G320-V322 PolarHBondContact O-N 3.25Å
321S62.5Low81.3Confident67 Ų6766.6 Ų66.647%0.46936%0.358SS..  trans-85.1109.5171.6-54.90000110.2V323S321-V323 PolarHBondContact O-N 2.97Å
322V73Confident81.5Confident139 Ų13966.8 Ų66.884%0.84236%0.359SS*.PPolyproline II helixtrans-67.2121.7174.9-1280000109G320G320-V322 PolarHBondContact O-N 3.25Å
323V81.7Confident81.9Confident14 Ų1468.4 Ų68.49%0.08537%0.365CS..PPolyproline II helixtrans-60.5128.6171.2176.90000108.2W314 R315 S321 R325 Y327 L328W314-V323 HydrophobicContact CB-CG2 4.05Å; W314-V323 HydrophobicContact CG-CG2 3.91Å; R315-V323 HydrophobicContact CG-CG2 3.71Å; S321-V323 PolarHBondContact O-N 2.97Å; V323-R325 PolarHBondContact O-N 2.93Å; V323-Y327 HydrophobicContact CG1-CD1 3.68Å; V323-Y327 HydrophobicContact CG1-CE1 4.35Å; V323-L328 HydrophobicContact CG1-CB 4.25Å
324P88.1Confident82.4Confident86 Ų8669.5 Ų69.556%0.55837%0.372SS*.PPolyproline II helixtrans-54.6129.6178.7-26.334000111.7G326 Y327 L328P324-G326 PolarHBondContact O-N 3.17Å; P324-Y327 PolarHBondContact O-N 3.08Å; P324-L328 PolarHBondContact O-N 3.04Å; P324-L328 VanDerWaalsContact O-N 3.1Å
325R83.9Confident82.8Confident194 Ų19463.2 Ų63.273%0.73235%0.349SS*.Hα-helixtrans-56-38.1-176.1-68-177.7178.9170.5-0.7112.9V323 T329V323-R325 PolarHBondContact O-N 2.93Å; R325-T329 WeakPolarHBondContact O-CB 3.19Å; R325-T329 PolarHBondContact O-N 3.21Å; R325-T329 PolarHBondContact O-OG1 3.43Å
326G86Confident83.5Confident56 Ų5660.6 Ų60.658%0.57734%0.339SS*.Hα-helixtrans-64.6-42.2177.400000113.1P324 A330P324-G326 PolarHBondContact O-N 3.17Å; G326-A330 WeakPolarHBondContact O-CB 3.45Å; G326-A330 PolarHBondContact O-N 3.37Å
327Y90.6Very high84.3Confident89 Ų8962.1 Ų62.135%0.34935%0.352SS..Hα-helixtrans-65.2-46.7177.1173.7-100.9000111.5P307 V310 A311 V323 P324 A330 A331P307-Y327 PolarHBondContact O-OH 3.04Å; P307-Y327 VanDerWaalsContact O-OH 3.05Å; V310-Y327 WeakPolarHBondContact CB-OH 3.24Å; V310-Y327 WeakPolarHBondContact CG1-OH 3.46Å; A311-Y327 HydrophobicContact CB-CD1 4.32Å; A311-Y327 HydrophobicContact CB-CE1 3.67Å; V323-Y327 HydrophobicContact CG1-CD1 3.68Å; V323-Y327 HydrophobicContact CG1-CE1 4.35Å; P324-Y327 PolarHBondContact O-N 3.08Å; Y327-A330 PolarHBondContact O-N 3.05Å; Y327-A331 VanDerWaalsContact O-CB 3.3Å; Y327-A331 WeakPolarHBondContact O-CB 3.21Å; Y327-A331 PolarHBondContact O-N 2.71Å
328L89.3Confident85.1Confident4 Ų457 Ų572%0.02133%0.33CS..Hα-helixtrans-60-48.9177.3179.677.8000111.6E175 E176 A311 V323 P324 A330 A331 V332E175-L328 HydrophobicContact CB-CD2 3.69Å; E176-L328 HydrophobicContact CG-CD1 4.2Å; E176-L328 HydrophobicContact CG-CD2 3.92Å; E176-L328 HydrophobicContact CG-CG 4.18Å; A311-L328 HydrophobicContact CB-CD1 4.3Å; V323-L328 HydrophobicContact CG1-CB 4.25Å; P324-L328 PolarHBondContact O-N 3.04Å; P324-L328 VanDerWaalsContact O-N 3.1Å; L328-A330 VanDerWaalsContact C-N 3.31Å; L328-A330 PolarHBondContact O-N 3.36Å; L328-A331 PolarHBondContact O-N 3.22Å; L328-V332 HydrophobicContact CG-CG2 4.48Å; L328-V332 WeakPolarHBondContact O-CG2 3.46Å; L328-V332 PolarHBondContact O-N 2.69Å
329T88.9Confident86Confident37 Ų3755.6 Ų55.623%0.22732%0.319CS..Hα-helixtrans-59.3-44.8179.9-57.60000110.5R325 V332 W333R325-T329 WeakPolarHBondContact O-CB 3.19Å; R325-T329 PolarHBondContact O-N 3.21Å; R325-T329 PolarHBondContact O-OG1 3.43Å; T329-V332 PolarHBondContact O-N 3.14Å; T329-W333 PolarHBondContact O-N 2.51Å
330A91.9Very high87.3Confident50 Ų5046.8 Ų46.841%0.41329%0.287SS..Hα-helixtrans-62.8-44.5176.200000112.2G326 Y327 L328 V332 W333 M334G326-A330 WeakPolarHBondContact O-CB 3.45Å; G326-A330 PolarHBondContact O-N 3.37Å; Y327-A330 PolarHBondContact O-N 3.05Å; L328-A330 VanDerWaalsContact C-N 3.31Å; L328-A330 PolarHBondContact O-N 3.36Å; A330-V332 PolarHBondContact O-N 3.38Å; A330-W333 PolarHBondContact O-N 2.79Å; A330-M334 VanDerWaalsContact O-CG 3.27Å; A330-M334 WeakPolarHBondContact O-CG 3.36Å; A330-M334 PolarHBondContact O-N 2.96Å
331A94.2Very high88.8Confident1 Ų143.8 Ų43.81%0.00825%0.253CS..Hα-helixtrans-62.5-40.9179.300000112.7P307 Y327 L328 M334 S335P307-A331 HydrophobicContact CB-CB 3.92Å; Y327-A331 VanDerWaalsContact O-CB 3.3Å; Y327-A331 WeakPolarHBondContact O-CB 3.21Å; Y327-A331 PolarHBondContact O-N 2.71Å; L328-A331 PolarHBondContact O-N 3.22Å; A331-M334 PolarHBondContact O-N 2.87Å; A331-S335 PolarHBondContact O-N 2.93Å; A331-S335 VanDerWaalsContact O-N 3.14Å
332V92.3Very high90.2Very high3 Ų340.8 Ų40.82%0.01823%0.232CC..Hα-helixtrans-64.4-46.1173.8172.40000110.8E176 Y308 L328 T329 A330 M334 S335 F336E176-V332 HydrophobicContact CB-CG2 4.11Å; E176-V332 HydrophobicContact CG-CG2 3.9Å; Y308-V332 HydrophobicContact CD2-CG2 3.89Å; Y308-V332 HydrophobicContact CE2-CG2 3.69Å; L328-V332 HydrophobicContact CG-CG2 4.48Å; L328-V332 WeakPolarHBondContact O-CG2 3.46Å; L328-V332 PolarHBondContact O-N 2.69Å; T329-V332 PolarHBondContact O-N 3.14Å; A330-V332 PolarHBondContact O-N 3.38Å; V332-M334 VanDerWaalsContact C-N 3.29Å; V332-M334 PolarHBondContact O-N 3.48Å; V332-S335 PolarHBondContact O-N 3.49Å; V332-S335 PolarHBondContact O-OG 2.95Å; V332-F336 HydrophobicContact CG1-CD2 4.16Å; V332-F336 HydrophobicContact CG1-CE1 3.97Å; V332-F336 HydrophobicContact CG1-CE2 3.45Å; V332-F336 VanDerWaalsContact CG1-CE2 3.45Å; V332-F336 HydrophobicContact CG1-CZ 3.35Å; V332-F336 WeakPolarHBondContact O-CG 3.43Å; V332-F336 PolarHBondContact O-N 3.38Å; V332-F336 VanDerWaalsContact O-N 3.07Å
333W93.7Very high90.9Very high37 Ų3734.5 Ų34.514%0.1419%0.194CC..Hα-helixtrans-62.7-36.1177.2-77.1123.2000113.2K30 L34 I37 T329 A330 F336 A337K30-W333 HydrophobicContact CB-CZ2 3.83Å; K30-W333 HydrophobicContact CD-CZ2 4.25Å; K30-W333 HydrophobicContact CG-CZ2 3.83Å; L34-W333 HydrophobicContact CB-CH2 3.55Å; L34-W333 HydrophobicContact CB-CZ3 3.54Å; L34-W333 HydrophobicContact CD1-CH2 3.95Å; L34-W333 HydrophobicContact CD1-CZ3 3.53Å; L34-W333 HydrophobicContact CD2-CH2 3.95Å; L34-W333 HydrophobicContact CD2-CZ3 4.37Å; L34-W333 HydrophobicContact CG-CH2 3.99Å; L34-W333 HydrophobicContact CG-CZ3 3.94Å; I37-W333 HydrophobicContact CD1-CE3 4.01Å; I37-W333 HydrophobicContact CD1-CZ3 4.36Å; T329-W333 PolarHBondContact O-N 2.51Å; A330-W333 PolarHBondContact O-N 2.79Å; W333-F336 HydrophobicContact CD2-CD2 4.32Å; W333-F336 HydrophobicContact CE3-CB 4.37Å; W333-F336 AromaticContact CE3-CD2 3.53Å; W333-F336 HydrophobicContact CE3-CD2 3.53Å; W333-F336 HydrophobicContact CE3-CE2 4.3Å; W333-F336 HydrophobicContact CE3-CG 4.44Å; W333-F336 HydrophobicContact CH2-CD2 4.19Å; W333-F336 HydrophobicContact CH2-CE2 4.34Å; W333-F336 AromaticContact CZ3-CD2 3.48Å; W333-F336 HydrophobicContact CZ3-CD2 3.48Å; W333-F336 VanDerWaalsContact CZ3-CD2 3.48Å; W333-F336 HydrophobicContact CZ3-CE2 4.07Å; W333-F336 PolarHBondContact O-N 3.26Å; W333-A337 WeakPolarHBondContact O-CB 3.4Å; W333-A337 PolarHBondContact O-N 3.35Å
334M95Very high91.2Very high67 Ų6738.5 Ų38.533%0.3321%0.21SC..Hα-helixtrans-63.2-43.6174.6-73177.871.400111.6A303 L304 P307 A330 A331 V332 F336 A337 Q338A303-M334 WeakPolarHBondContact O-CE 3.12Å; L304-M334 WeakPolarHBondContact CB-O 3.16Å; L304-M334 HydrophobicContact CD2-CB 3.99Å; L304-M334 HydrophobicContact CD2-CE 3.99Å; L304-M334 HydrophobicContact CD2-CG 4.28Å; L304-M334 CarbonylContact O-C 3.54Å; L304-M334 WeakPolarHBondContact O-CB 3.36Å; P307-M334 HydrophobicContact CB-SD 4.46Å; P307-M334 HydrophobicContact CG-CE 3.83Å; P307-M334 HydrophobicContact CG-SD 3.99Å; A330-M334 VanDerWaalsContact O-CG 3.27Å; A330-M334 WeakPolarHBondContact O-CG 3.36Å; A330-M334 PolarHBondContact O-N 2.96Å; A331-M334 PolarHBondContact O-N 2.87Å; V332-M334 VanDerWaalsContact C-N 3.29Å; V332-M334 PolarHBondContact O-N 3.48Å; M334-F336 VanDerWaalsContact C-N 3.28Å; M334-F336 PolarHBondContact O-N 3.4Å; M334-A337 PolarHBondContact O-N 2.99Å; M334-Q338 PolarHBondContact O-N 2.88Å
335S94.3Very high91.2Very high2 Ų235 Ų351%0.01419%0.186CC..Hα-helixtrans-65.9-30.9177.377.80000112.4R76 L304 A331 V332 Q338R76-S335 PolarHBondContact NH1-O 3.01Å; R76-S335 VanDerWaalsContact NH1-O 3.08Å; L304-S335 PolarHBondContact O-N 3.39Å; A331-S335 PolarHBondContact O-N 2.93Å; A331-S335 VanDerWaalsContact O-N 3.14Å; V332-S335 PolarHBondContact O-N 3.49Å; V332-S335 PolarHBondContact O-OG 2.95Å; S335-Q338 WeakPolarHBondContact O-CB 3.14Å
336F94.8Very high91.3Very high7 Ų725.7 Ų25.73%0.03115%0.152CC..Hα-helixtrans-70.3-44.2172.4-62.5-14.1000112.2L34 I37 F81 V84 Q178 V332 W333 M334 Q338 A339L34-F336 HydrophobicContact CD1-CD2 4.4Å; I37-F336 HydrophobicContact CD1-CB 4.27Å; I37-F336 HydrophobicContact CG2-CB 4.43Å; I37-F336 WeakPolarHBondContact CG2-O 3.44Å; F81-F336 HydrophobicContact CD1-CD1 4.35Å; F81-F336 HydrophobicContact CD1-CG 4.47Å; F81-F336 HydrophobicContact CE1-CB 4.02Å; F81-F336 AromaticContact CE1-CD1 3.51Å; F81-F336 HydrophobicContact CE1-CD1 3.51Å; F81-F336 HydrophobicContact CE1-CE1 4.1Å; F81-F336 AromaticContact CE1-CG 3.8Å; F81-F336 HydrophobicContact CE1-CG 3.8Å; F81-F336 HydrophobicContact CZ-CB 3.83Å; F81-F336 HydrophobicContact CZ-CD1 4.1Å; F81-F336 HydrophobicContact CZ-CG 4.14Å; V84-F336 HydrophobicContact CG1-CE2 3.89Å; V84-F336 HydrophobicContact CG1-CZ 4.3Å; V84-F336 HydrophobicContact CG2-CZ 4.27Å; Q178-F336 VanDerWaalsContact OE1-CE1 3.26Å; Q178-F336 VanDerWaalsContact OE1-CZ 3.25Å; V332-F336 HydrophobicContact CG1-CD2 4.16Å; V332-F336 HydrophobicContact CG1-CE1 3.97Å; V332-F336 HydrophobicContact CG1-CE2 3.45Å; V332-F336 VanDerWaalsContact CG1-CE2 3.45Å; V332-F336 HydrophobicContact CG1-CZ 3.35Å; V332-F336 WeakPolarHBondContact O-CG 3.43Å; V332-F336 PolarHBondContact O-N 3.38Å; V332-F336 VanDerWaalsContact O-N 3.07Å; W333-F336 HydrophobicContact CD2-CD2 4.32Å; W333-F336 HydrophobicContact CE3-CB 4.37Å; W333-F336 AromaticContact CE3-CD2 3.53Å; W333-F336 HydrophobicContact CE3-CD2 3.53Å; W333-F336 HydrophobicContact CE3-CE2 4.3Å; W333-F336 HydrophobicContact CE3-CG 4.44Å; W333-F336 HydrophobicContact CH2-CD2 4.19Å; W333-F336 HydrophobicContact CH2-CE2 4.34Å; W333-F336 AromaticContact CZ3-CD2 3.48Å; W333-F336 HydrophobicContact CZ3-CD2 3.48Å; W333-F336 VanDerWaalsContact CZ3-CD2 3.48Å; W333-F336 HydrophobicContact CZ3-CE2 4.07Å; W333-F336 PolarHBondContact O-N 3.26Å; M334-F336 VanDerWaalsContact C-N 3.28Å; M334-F336 PolarHBondContact O-N 3.4Å; F336-Q338 PolarHBondContact O-N 3.36Å; F336-Q338 VanDerWaalsContact O-N 3.09Å; F336-A339 WeakPolarHBondContact O-CB 3.18Å; F336-A339 PolarHBondContact O-N 2.67Å
337A94.7Very high91Very high37 Ų3725.1 Ų25.131%0.30614%0.135SC..Hα-helixtrans-57.6-26.3178.800000113.1I37 W333 M334 A339 G340I37-A337 HydrophobicContact CD1-CB 4.35Å; W333-A337 WeakPolarHBondContact O-CB 3.4Å; W333-A337 PolarHBondContact O-N 3.35Å; M334-A337 PolarHBondContact O-N 2.99Å; A337-A339 PolarHBondContact O-N 3.41Å; A337-A339 VanDerWaalsContact O-N 3.09Å; A337-G340 PolarHBondContact O-N 3.08Å
338Q95.1Very high90.4Very high7 Ų727.7 Ų27.73%0.03315%0.148CC..G310 helixtrans-51.2-33173.6178.659.726.200113F300 F301 L304 M334 S335 F336 G340 V341F300-Q338 PolarHBondContact O-OE1 2.96Å; F301-Q338 HydrophobicContact CD2-CG 3.97Å; L304-Q338 HydrophobicContact CB-CB 4.33Å; L304-Q338 HydrophobicContact CD1-CB 4.24Å; L304-Q338 VanDerWaalsContact CD1-OE1 3.29Å; M334-Q338 PolarHBondContact O-N 2.88Å; S335-Q338 WeakPolarHBondContact O-CB 3.14Å; F336-Q338 PolarHBondContact O-N 3.36Å; F336-Q338 VanDerWaalsContact O-N 3.09Å; Q338-G340 PolarHBondContact O-N 2.85Å; Q338-V341 WeakPolarHBondContact O-CB 3.46Å; Q338-V341 PolarHBondContact O-N 2.93Å; Q338-V341 VanDerWaalsContact O-N 3.13Å
339A93.3Very high89.7Confident0 Ų028.5 Ų28.50%015%0.154CC..G310 helixtrans-59.4-31.7-179.900000112.9N45 R76 S77 F81 F336 A337N45-A339 PolarHBondContact ND2-O 3.15Å; R76-A339 VanDerWaalsContact NH2-N 3.13Å; S77-A339 WeakPolarHBondContact OG-CB 3.3Å; F81-A339 HydrophobicContact CE2-CB 3.7Å; F81-A339 HydrophobicContact CZ-CB 4.07Å; F336-A339 WeakPolarHBondContact O-CB 3.18Å; F336-A339 PolarHBondContact O-N 2.67Å; A337-A339 PolarHBondContact O-N 3.41Å; A337-A339 VanDerWaalsContact O-N 3.09Å
340G91.1Very high88.8Confident6 Ų626.9 Ų26.96%0.06214%0.144CC..G310 helixtrans-87.4-4.1-178.300000114.2A337 Q338 P343 F344A337-G340 PolarHBondContact O-N 3.08Å; Q338-G340 PolarHBondContact O-N 2.85Å; G340-P343 WeakPolarHBondContact O-CD 3.43Å; G340-F344 WeakPolarHBondContact O-CD2 3.25Å; G340-F344 VanDerWaalsContact O-CE2 3.27Å; G340-F344 WeakPolarHBondContact O-CE2 3.44Å
341V91.6Very high87.7Confident17 Ų1732 Ų3210%0.10315%0.152CC..Hα-helixtrans-78-38.5-169.2169.50000113.1F300 L304 Q338 F344 I345F300-V341 HydrophobicContact CB-CG1 3.82Å; F300-V341 HydrophobicContact CG-CG1 4.22Å; L304-V341 HydrophobicContact CD1-CG2 3.49Å; L304-V341 VanDerWaalsContact CD1-CG2 3.49Å; Q338-V341 WeakPolarHBondContact O-CB 3.46Å; Q338-V341 PolarHBondContact O-N 2.93Å; Q338-V341 VanDerWaalsContact O-N 3.13Å; V341-F344 PolarHBondContact O-N 2.82Å; V341-I345 HydrophobicContact CG1-CD1 3.27Å; V341-I345 HydrophobicContact CG1-CG1 3.91Å; V341-I345 WeakPolarHBondContact O-CG1 3.44Å; V341-I345 PolarHBondContact O-N 3.45Å
342N90.4Very high86.5Confident4 Ų434.2 Ų34.22%0.02116%0.162CC..Hα-helixtrans-57.2-47.2-174.3-55.9-20.2000112.8D73 M297 F344 I345 C346D73-N342 PolarHBondContact OD2-ND2 2.94Å; M297-N342 HydrophobicContact CE-CB 3.77Å; M297-N342 VanDerWaalsContact CE-CG 3.45Å; M297-N342 WeakPolarHBondContact CE-OD1 3.07Å; N342-F344 PolarHBondContact O-N 3Å; N342-I345 PolarHBondContact O-N 3.36Å; N342-C346 WeakPolarHBondContact O-CB 3.35Å; N342-C346 PolarHBondContact O-N 3.12Å; N342-C346 PolarHBondContact O-SG 3.3Å
343P89Confident85.3Confident6 Ų634.1 Ų34.14%0.03916%0.162CC..Hα-helixtrans-60.9-42.9179-23.635.9000113I48 G340 C346 I347I48-P343 HydrophobicContact CG1-CB 4Å; I48-P343 HydrophobicContact CG1-CG 4.34Å; G340-P343 WeakPolarHBondContact O-CD 3.43Å; P343-C346 PolarHBondContact O-N 3.11Å; P343-I347 WeakPolarHBondContact O-CB 3.44Å; P343-I347 WeakPolarHBondContact O-CD1 3.09Å; P343-I347 VanDerWaalsContact O-CG1 3.25Å; P343-I347 WeakPolarHBondContact O-CG1 3.46Å; P343-I347 PolarHBondContact O-N 3.02Å
344F87.3Confident84.4Confident99 Ų9937.4 Ų37.443%0.43417%0.174SC..Hα-helixtrans-60.8-50.6177.2-66.9-64.3000110.9V40 G340 V341 N342 C346 I347 F348V40-F344 HydrophobicContact CG1-CE2 3.62Å; V40-F344 HydrophobicContact CG1-CZ 3.88Å; G340-F344 WeakPolarHBondContact O-CD2 3.25Å; G340-F344 VanDerWaalsContact O-CE2 3.27Å; G340-F344 WeakPolarHBondContact O-CE2 3.44Å; V341-F344 PolarHBondContact O-N 2.82Å; N342-F344 PolarHBondContact O-N 3Å; F344-C346 VanDerWaalsContact C-N 3.28Å; F344-C346 PolarHBondContact O-N 3.11Å; F344-I347 PolarHBondContact O-N 2.91Å; F344-F348 HydrophobicContact CB-CD2 4.27Å; F344-F348 HydrophobicContact CB-CE2 4.42Å; F344-F348 HydrophobicContact CD1-CE2 4.21Å; F344-F348 WeakPolarHBondContact O-CB 3.44Å; F344-F348 WeakPolarHBondContact O-CD2 3.4Å; F344-F348 PolarHBondContact O-N 3.45Å
345I88.6Confident83.3Confident11 Ų1142.5 Ų42.56%0.05619%0.19CC..Hα-helixtrans-61.8-40.4-178.5-63.6174.8000110.9M293 I296 M297 F300 V341 N342 F348 S349M293-I345 HydrophobicContact CG-CG2 3.91Å; I296-I345 HydrophobicContact CB-CG2 4.34Å; I296-I345 HydrophobicContact CG2-CD1 3.99Å; I296-I345 HydrophobicContact CG2-CG1 4.26Å; I296-I345 HydrophobicContact CG2-CG2 4.14Å; M297-I345 HydrophobicContact CB-CD1 4.15Å; M297-I345 HydrophobicContact CG-CB 4.03Å; M297-I345 HydrophobicContact CG-CD1 3.72Å; M297-I345 HydrophobicContact CG-CG1 4.5Å; M297-I345 HydrophobicContact CG-CG2 3.65Å; F300-I345 HydrophobicContact CB-CD1 4.33Å; F300-I345 HydrophobicContact CD2-CD1 3.79Å; F300-I345 HydrophobicContact CG-CD1 4.32Å; V341-I345 HydrophobicContact CG1-CD1 3.27Å; V341-I345 HydrophobicContact CG1-CG1 3.91Å; V341-I345 WeakPolarHBondContact O-CG1 3.44Å; V341-I345 PolarHBondContact O-N 3.45Å; N342-I345 PolarHBondContact O-N 3.36Å; I345-F348 PolarHBondContact O-N 2.91Å; I345-S349 WeakPolarHBondContact O-CA 2.98Å; I345-S349 WeakPolarHBondContact O-CB 3.43Å; I345-S349 PolarHBondContact O-N 2.9Å; I345-S349 PolarHBondContact O-OG 2.9Å; I345-S349 VanDerWaalsContact O-OG 3.04Å
346C84.6Confident82Confident0 Ų043.3 Ų43.30%020%0.196CC..Hα-helixtrans-61.8-46178-72.10000112.4I48 N342 P343 F344 N350 L353I48-C346 HydrophobicContact CD1-CB 3.83Å; I48-C346 HydrophobicContact CG1-CB 4.47Å; N342-C346 WeakPolarHBondContact O-CB 3.35Å; N342-C346 PolarHBondContact O-N 3.12Å; N342-C346 PolarHBondContact O-SG 3.3Å; P343-C346 PolarHBondContact O-N 3.11Å; F344-C346 VanDerWaalsContact C-N 3.28Å; F344-C346 PolarHBondContact O-N 3.11Å; C346-N350 WeakPolarHBondContact O-CB 3.29Å; C346-N350 PolarHBondContact O-N 3.36Å; C346-L353 HydrophobicContact CB-CD1 3.83Å
347I80.7Confident80.9Confident43 Ų4345.3 Ų45.322%0.22120%0.204CC..Hα-helixtrans-68.7-41179.9-67.3166000111.5I48 P343 F344 R354I48-I347 HydrophobicContact CD1-CG1 4.47Å; P343-I347 WeakPolarHBondContact O-CB 3.44Å; P343-I347 WeakPolarHBondContact O-CD1 3.09Å; P343-I347 VanDerWaalsContact O-CG1 3.25Å; P343-I347 WeakPolarHBondContact O-CG1 3.46Å; P343-I347 PolarHBondContact O-N 3.02Å; F344-I347 PolarHBondContact O-N 2.91Å; I347-R354 PolarHBondContact O-NE 3.15Å; I347-R354 PolarHBondContact O-NH2 3.44Å
348F78Confident79.8Confident144 Ų14446.2 Ų46.263%0.63221%0.208SC*.Hα-helixtrans-78.6-38.9-177.3-74.9-66.8000113.2F344 I345 R354F344-F348 HydrophobicContact CB-CD2 4.27Å; F344-F348 HydrophobicContact CB-CE2 4.42Å; F344-F348 HydrophobicContact CD1-CE2 4.21Å; F344-F348 WeakPolarHBondContact O-CB 3.44Å; F344-F348 WeakPolarHBondContact O-CD2 3.4Å; F344-F348 PolarHBondContact O-N 3.45Å; I345-F348 PolarHBondContact O-N 2.91Å; F348-R354 PolarHBondContact O-NH2 3.45Å
349S74Confident78.7Confident20 Ų2050.2 Ų50.214%0.1423%0.233CC..Hα-helixtrans-89.4-27.4-171.7-58.90000113.7I345I345-S349 WeakPolarHBondContact O-CA 2.98Å; I345-S349 WeakPolarHBondContact O-CB 3.43Å; I345-S349 PolarHBondContact O-N 2.9Å; I345-S349 PolarHBondContact O-OG 2.9Å; I345-S349 VanDerWaalsContact O-OG 3.04Å
350N69.6Low77.5Confident3 Ų352.2 Ų52.22%0.01625%0.246CC..  trans-113.4108.1-172.7-163.3-13.9000112.6Y63 M293 C346 E352 L353 R354Y63-N350 PolarHBondContact OH-ND2 3.36Å; M293-N350 HydrophobicContact SD-CB 3.94Å; C346-N350 WeakPolarHBondContact O-CB 3.29Å; C346-N350 PolarHBondContact O-N 3.36Å; N350-E352 PolarHBondContact O-N 2.87Å; N350-E352 WeakPolarHBondContact OD1-CB 3.42Å; N350-E352 PolarHBondContact OD1-N 3.23Å; N350-L353 HydrophobicContact CB-CB 4.06Å; N350-L353 HydrophobicContact CB-CD1 3.84Å; N350-L353 HydrophobicContact CB-CG 4.1Å; N350-L353 PolarHBondContact O-N 3.43Å; N350-R354 PolarHBondContact O-N 3.3Å
351R69.1Low76.4Confident158 Ų15856.5 Ų56.560%0.59627%0.267SS*.Hα-helixtrans-64-27.9176.6-70.5-174.3178.4-177.3-1.5112.8R355R351-R355 WeakPolarHBondContact O-CG 3.34Å; R351-R355 PolarHBondContact O-N 3.07Å; R351-R355 VanDerWaalsContact O-N 3.11Å
352E68.4Low75Confident47 Ų4760.8 Ų60.822%0.2229%0.288CS..Hα-helixtrans-69.4-52.1177.4-66.9171.2-176.200109.9L58 Y63 N350 R354 R355 C356L58-E352 HydrophobicContact CD2-CB 4.33Å; Y63-E352 PolarHBondContact OH-OE2 3.1Å; N350-E352 PolarHBondContact O-N 2.87Å; N350-E352 WeakPolarHBondContact OD1-CB 3.42Å; N350-E352 PolarHBondContact OD1-N 3.23Å; E352-R354 VanDerWaalsContact C-N 3.27Å; E352-R354 PolarHBondContact O-N 3Å; E352-R355 WeakPolarHBondContact O-CB 3.41Å; E352-R355 PolarHBondContact O-N 3.33Å; E352-C356 PolarHBondContact O-N 3.4Å; E352-C356 PolarHBondContact O-SG 3.4Å
353L68Low73.4Confident2 Ų269 Ų691%0.0132%0.32CS..Hα-helixtrans-57.5-40.5175.5-71.5171.2000112.3L52 L58 Y63 M293 C346 N350 R355 C356 F357L52-L353 HydrophobicContact CD2-CD2 3.82Å; L58-L353 HydrophobicContact CD1-CD2 3.57Å; Y63-L353 HydrophobicContact CE1-CD1 4.37Å; M293-L353 HydrophobicContact SD-CD1 4.46Å; C346-L353 HydrophobicContact CB-CD1 3.83Å; N350-L353 HydrophobicContact CB-CB 4.06Å; N350-L353 HydrophobicContact CB-CD1 3.84Å; N350-L353 HydrophobicContact CB-CG 4.1Å; N350-L353 PolarHBondContact O-N 3.43Å; L353-R355 PolarHBondContact O-N 3.16Å; L353-C356 PolarHBondContact O-N 3.23Å; L353-F357 VanDerWaalsContact O-CB 3.28Å; L353-F357 WeakPolarHBondContact O-CB 3.03Å; L353-F357 PolarHBondContact O-N 3.29Å
354R75.7Confident71.7Confident106 Ų10671.8 Ų71.840%0.434%0.339SS..Hα-helixtrans-62.2-41.2176-166.8-177.7-55.6173.64.8112.5I347 F348 N350 E352 F357 S358I347-R354 PolarHBondContact O-NE 3.15Å; I347-R354 PolarHBondContact O-NH2 3.44Å; F348-R354 PolarHBondContact O-NH2 3.45Å; N350-R354 PolarHBondContact O-N 3.3Å; E352-R354 VanDerWaalsContact C-N 3.27Å; E352-R354 PolarHBondContact O-N 3Å; R354-F357 PolarHBondContact O-N 3.38Å; R354-S358 PolarHBondContact O-N 3.46Å; R354-S358 PolarHBondContact O-OG 2.91Å
355R70.8Confident70.2Confident173 Ų17375.9 Ų75.965%0.65335%0.351SS*.Hα-helixtrans-63.6-47.3176.2-76.1174-176.8167.2-2.4110.8R351 E352 L353 F357 S358 T359R351-R355 WeakPolarHBondContact O-CG 3.34Å; R351-R355 PolarHBondContact O-N 3.07Å; R351-R355 VanDerWaalsContact O-N 3.11Å; E352-R355 WeakPolarHBondContact O-CB 3.41Å; E352-R355 PolarHBondContact O-N 3.33Å; L353-R355 PolarHBondContact O-N 3.16Å; R355-F357 VanDerWaalsContact C-N 3.29Å; R355-F357 PolarHBondContact O-N 3.02Å; R355-S358 PolarHBondContact O-N 3.47Å; R355-T359 PolarHBondContact O-N 3.46Å; R355-T359 PolarHBondContact O-OG1 2.03Å
356C67.2Low68.3Low20 Ų2083.3 Ų83.314%0.13538%0.383CS..Hα-helixtrans-64-36.7179.6-54.20000111.9L51 D55 E352 L353 T359 T360L51-C356 HydrophobicContact CD2-CB 4.39Å; D55-C356 PolarHBondContact OD2-SG 3.48Å; E352-C356 PolarHBondContact O-N 3.4Å; E352-C356 PolarHBondContact O-SG 3.4Å; L353-C356 PolarHBondContact O-N 3.23Å; C356-T359 PolarHBondContact O-N 2.88Å; C356-T360 WeakPolarHBondContact O-CB 3.45Å; C356-T360 PolarHBondContact O-N 2.87Å; C356-T360 PolarHBondContact O-OG1 2.99Å
357F72.6Confident66.7Low49 Ų4987.3 Ų87.322%0.21541%0.412CS..Hα-helixtrans-61.8-49.2172.5-179.8-115.3000111.9L47 L51 L353 R354 R355 T359 T360 L361L47-F357 HydrophobicContact CD1-CD2 3.99Å; L47-F357 HydrophobicContact CD1-CE2 3.83Å; L47-F357 HydrophobicContact CD2-CD2 3.85Å; L47-F357 HydrophobicContact CD2-CE2 3.26Å; L47-F357 HydrophobicContact CD2-CZ 4.05Å; L47-F357 HydrophobicContact CG-CD2 4.21Å; L47-F357 HydrophobicContact CG-CE2 4Å; L51-F357 HydrophobicContact CD1-CB 3.96Å; L51-F357 HydrophobicContact CD1-CD2 4.07Å; L51-F357 HydrophobicContact CD1-CG 4.48Å; L353-F357 VanDerWaalsContact O-CB 3.28Å; L353-F357 WeakPolarHBondContact O-CB 3.03Å; L353-F357 PolarHBondContact O-N 3.29Å; R354-F357 PolarHBondContact O-N 3.38Å; R355-F357 VanDerWaalsContact C-N 3.29Å; R355-F357 PolarHBondContact O-N 3.02Å; F357-T359 PolarHBondContact O-N 3.32Å; F357-T360 PolarHBondContact O-N 3.37Å; F357-L361 HydrophobicContact CD1-CD1 3.94Å; F357-L361 HydrophobicContact CD2-CD1 4.36Å; F357-L361 HydrophobicContact CE1-CD1 3.4Å; F357-L361 HydrophobicContact CE1-CG 4.47Å; F357-L361 HydrophobicContact CE2-CD1 3.83Å; F357-L361 HydrophobicContact CE2-CG 4.09Å; F357-L361 HydrophobicContact CG-CD1 4.41Å; F357-L361 HydrophobicContact CZ-CD1 3.36Å; F357-L361 HydrophobicContact CZ-CG 4.11Å; F357-L361 PolarHBondContact O-N 3.01Å
358S70.9Confident65.1Low56 Ų5695.3 Ų95.339%0.39244%0.439SS..Hα-helixtrans-60.7-42.8176.5-63.60000112.6R354 R355 T360 L361 L362R354-S358 PolarHBondContact O-N 3.46Å; R354-S358 PolarHBondContact O-OG 2.91Å; R355-S358 PolarHBondContact O-N 3.47Å; S358-T360 PolarHBondContact O-N 3Å; S358-L361 PolarHBondContact O-N 3.3Å; S358-L362 WeakPolarHBondContact O-CB 3.37Å; S358-L362 WeakPolarHBondContact O-CD1 3.23Å; S358-L362 VanDerWaalsContact O-CG 3.25Å; S358-L362 WeakPolarHBondContact O-CG 3.3Å; S358-L362 PolarHBondContact O-N 3.14Å
359T70.7Confident63.4Low91 Ų9194.3 Ų94.356%0.55844%0.439SS*.Hα-helixtrans-65-40.1178.1-50.30000111.7R355 C356 F357 L362 Y363R355-T359 PolarHBondContact O-N 3.46Å; R355-T359 PolarHBondContact O-OG1 2.03Å; C356-T359 PolarHBondContact O-N 2.88Å; F357-T359 PolarHBondContact O-N 3.32Å; T359-L362 PolarHBondContact O-N 2.97Å; T359-Y363 WeakPolarHBondContact O-CB 3.47Å; T359-Y363 PolarHBondContact O-N 2.86Å
360T68.8Low61.8Low42 Ų4298.9 Ų98.926%0.25847%0.469SS..Hα-helixtrans-67.1-43.5178.7-580000111.4L51 C356 F357 S358 L362 Y363 C364L51-T360 HydrophobicContact CD2-CG2 4.4Å; L51-T360 WeakPolarHBondContact CD2-OG1 3.27Å; C356-T360 WeakPolarHBondContact O-CB 3.45Å; C356-T360 PolarHBondContact O-N 2.87Å; C356-T360 PolarHBondContact O-OG1 2.99Å; F357-T360 PolarHBondContact O-N 3.37Å; S358-T360 PolarHBondContact O-N 3Å; T360-L362 VanDerWaalsContact C-N 3.34Å; T360-L362 PolarHBondContact O-N 3Å; T360-Y363 PolarHBondContact O-N 3.28Å; T360-C364 PolarHBondContact O-N 3.23Å
361L67.8Low60.5Low96 Ų96109.4 Ų109.450%0.50351%0.508SS..Hα-helixtrans-61.2-41.5172.6-82.5172.2000112.3F357 S358 C364 R365F357-L361 HydrophobicContact CD1-CD1 3.94Å; F357-L361 HydrophobicContact CD2-CD1 4.36Å; F357-L361 HydrophobicContact CE1-CD1 3.4Å; F357-L361 HydrophobicContact CE1-CG 4.47Å; F357-L361 HydrophobicContact CE2-CD1 3.83Å; F357-L361 HydrophobicContact CE2-CG 4.09Å; F357-L361 HydrophobicContact CG-CD1 4.41Å; F357-L361 HydrophobicContact CZ-CD1 3.36Å; F357-L361 HydrophobicContact CZ-CG 4.11Å; F357-L361 PolarHBondContact O-N 3.01Å; S358-L361 PolarHBondContact O-N 3.3Å; L361-C364 PolarHBondContact O-N 3.45Å; L361-R365 WeakPolarHBondContact O-CB 3.5Å; L361-R365 PolarHBondContact O-N 2.89Å
362L62Low59.3Low106 Ų106109.8 Ų109.856%0.55552%0.517SS*.Hα-helixtrans-67.2-36.8176.6-76.7164.2000112.4S358 T359 T360 R365 K366S358-L362 WeakPolarHBondContact O-CB 3.37Å; S358-L362 WeakPolarHBondContact O-CD1 3.23Å; S358-L362 VanDerWaalsContact O-CG 3.25Å; S358-L362 WeakPolarHBondContact O-CG 3.3Å; S358-L362 PolarHBondContact O-N 3.14Å; T359-L362 PolarHBondContact O-N 2.97Å; T360-L362 VanDerWaalsContact C-N 3.34Å; T360-L362 PolarHBondContact O-N 3Å; L362-R365 WeakPolarHBondContact O-CB 3.5Å; L362-R365 PolarHBondContact O-N 2.92Å; L362-K366 PolarHBondContact O-N 3.39Å
363Y57.2Low58Low178 Ų178113.4 Ų113.470%0.69854%0.544SS*.Hα-helixtrans-68.3-42.5175.7-156.5-93.2000111.4T359 T360 R365 K366 S367T359-Y363 WeakPolarHBondContact O-CB 3.47Å; T359-Y363 PolarHBondContact O-N 2.86Å; T360-Y363 PolarHBondContact O-N 3.28Å; Y363-R365 PolarHBondContact O-N 3.07Å; Y363-K366 PolarHBondContact O-N 2.96Å; Y363-S367 PolarHBondContact O-N 3.1Å; Y363-S367 PolarHBondContact O-OG 3.28Å
364C54.4Low56.7Low63 Ų63122.8 Ų122.843%0.42658%0.581SS.*Hα-helixtrans-64.2-23.5170.9-75.20000113.5T360 L361 S367 R368T360-C364 PolarHBondContact O-N 3.23Å; L361-C364 PolarHBondContact O-N 3.45Å; C364-S367 WeakPolarHBondContact CA-OG 3.43Å; C364-S367 PolarHBondContact O-OG 3.16Å; C364-R368 WeakPolarHBondContact O-CG 3.22Å
365R54.3Low55Low185 Ų185123.6 Ų123.670%0.69860%0.602SS**Hα-helixtrans-81-41.1173.1-171.8176174.5-179.8-1.8111.6L361 L362 Y363 S367 R368L361-R365 WeakPolarHBondContact O-CB 3.5Å; L361-R365 PolarHBondContact O-N 2.89Å; L362-R365 WeakPolarHBondContact O-CB 3.5Å; L362-R365 PolarHBondContact O-N 2.92Å; Y363-R365 PolarHBondContact O-N 3.07Å; R365-S367 VanDerWaalsContact C-N 3.34Å; R365-R368 PolarHBondContact O-N 2.96Å
366K49.4Very low53.9Low167 Ų167121.8 Ų121.873%0.72661%0.609SS**Hα-helixtrans-65.2-34.4174.5-102.4-174.5175-175.60112.7L362 Y363 R368 L369L362-K366 PolarHBondContact O-N 3.39Å; Y363-K366 PolarHBondContact O-N 2.96Å; K366-R368 PolarHBondContact O-N 3.02Å; K366-L369 PolarHBondContact O-N 3.05Å
367S51.3Low53Low85 Ų85131.8 Ų131.859%0.59466%0.659SS**THydrogen-bonded Turntrans-74.2-8176.364.90000114.4Y363 C364 R365Y363-S367 PolarHBondContact O-N 3.1Å; Y363-S367 PolarHBondContact O-OG 3.28Å; C364-S367 WeakPolarHBondContact CA-OG 3.43Å; C364-S367 PolarHBondContact O-OG 3.16Å; R365-S367 VanDerWaalsContact C-N 3.34Å
368R47.7Very low52Low211 Ų211135.9 Ų135.980%0.79668%0.681SS**THydrogen-bonded Turntrans-99.8-0.5175.5-73.2-173.8-151.3-120.75.9113.9C364 R365 K366C364-R368 WeakPolarHBondContact O-CG 3.22Å; R365-R368 PolarHBondContact O-N 2.96Å; K366-R368 PolarHBondContact O-N 3.02Å
369L42.4Very low51Low122 Ų122140.1 Ų140.164%0.63970%0.696SS**SBendtrans-86.6124.3168.4-80.3150.3000107.6K366 R371K366-L369 PolarHBondContact O-N 3.05Å; L369-R371 PolarHBondContact O-N 3.43Å
370P40.5Very low49.9Very low116 Ų116142.8 Ų142.875%0.75370%0.704SS**  trans-58.5129.5174.422-27.4000108.3E372P370-E372 PolarHBondContact O-N 3.44Å
371R41Very low48.8Very low225 Ų225148.8 Ų148.885%0.84973%0.73SS**  trans-59.4110.7168.6-88.7177.7167.4176.3-5.5106.7L369L369-R371 PolarHBondContact O-N 3.43Å
372E43.3Very low47.6Very low165 Ų165152.1 Ų152.177%0.77175%0.745SS**  trans-55.1133.6163.8-80.9-170.4153.300108.6P370 Y374P370-E372 PolarHBondContact O-N 3.44Å; E372-Y374 PolarHBondContact O-N 3.21Å
373P42.4Very low46.7Very low123 Ų123155.1 Ų155.180%0.79976%0.757SS**  trans-68.4116.7175.827.1-30.2000108.2C375P373-C375 PolarHBondContact O-N 3.05Å
374Y41Very low45.9Very low200 Ų200153.5 Ų153.578%0.78476%0.761SS**  trans-61107.5170.1-53.7-87000108.4E372 V376E372-Y374 PolarHBondContact O-N 3.21Å; Y374-V376 PolarHBondContact O-N 3.33Å
375C40.1Very low45.3Very low123 Ų123160.5 Ų160.583%0.83179%0.787SS**  trans-75111.6166.8-153.80000106.9P373 I377P373-C375 PolarHBondContact O-N 3.05Å; C375-I377 PolarHBondContact O-N 3.38Å
376V45.9Very low44.5Very low135 Ų135158.4 Ų158.482%0.81880%0.795SS**  trans-76.2119.2169.5-1750000106.1Y374Y374-V376 PolarHBondContact O-N 3.33Å
377I48.9Very low44.1Very low229 Ų229157.6 Ų157.6100%1.17480%0.801SS**  trans-78.50170.7-62.1173.3000108.6C375C375-I377 PolarHBondContact O-N 3.38Å

Retrieved 377 of 377 residues in 99.5 ms (Link to these results)