YD230_YEAST Loading...

Putative uncharacterized protein YDR230W

AlphaFold DB , UniProt , Accession A0A023PZA9, Species YEAST (Saccharomyces cerevisiae (strain ATCC 204508 / S288c), Baker's yeast), Gene n/a, Length 115 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M25.5Very low26.2Very low221 Ų221146.2 Ų146.2100%1.08970%0.697SS**  0108.30-175.6168.7172.600107.4H3M1-H3 WeakPolarHBondContact CE-NE2 3.08Å
2L23.6Very low26.4Very low119 Ų119137.4 Ų137.462%0.62367%0.674SS**  trans-118.2123.6177.8-174.377.1000108.2F90L2-F90 HydrophobicContact CB-CD1 4.41Å; L2-F90 HydrophobicContact CB-CE1 3.74Å; L2-F90 HydrophobicContact CD2-CD1 3.46Å; L2-F90 VanDerWaalsContact CD2-CD1 3.46Å; L2-F90 HydrophobicContact CD2-CE1 3.55Å; L2-F90 HydrophobicContact CG-CE1 4.26Å
3H23.9Very low26.4Very low126 Ų126137.2 Ų137.258%0.58369%0.69SS**  trans-81.5117.5176.2-80.1-142.7000109.4M1 Y5M1-H3 WeakPolarHBondContact CE-NE2 3.08Å; H3-Y5 HydrophobicContact CB-CD2 4.25Å; H3-Y5 HydrophobicContact CB-CE2 4.1Å
4I27.2Very low26.7Very low82 Ų82134.1 Ų134.142%0.42170%0.695SS.*  trans-93.8104.7168.7-59177.3000107.7I6I4-I6 HydrophobicContact CG2-CG1 4.34Å; I4-I6 PolarHBondContact O-N 3.1Å
5Y24.7Very low26.9Very low193 Ų193128.5 Ų128.576%0.75767%0.672SS**  trans-78.4101.5167.5-81.8-98.3000108.9H3 G7H3-Y5 HydrophobicContact CB-CD2 4.25Å; H3-Y5 HydrophobicContact CB-CE2 4.1Å; Y5-G7 PolarHBondContact O-N 3.2Å
6I30.5Very low27.2Very low133 Ų133127.7 Ų127.768%0.68268%0.675SS**  trans-7672.3155.7-58.3175.4000106.3I4 K8I4-I6 HydrophobicContact CG2-CG1 4.34Å; I4-I6 PolarHBondContact O-N 3.1Å; I6-K8 VanDerWaalsContact C-N 3.25Å; I6-K8 PolarHBondContact O-N 3.12Å
7G22.9Very low27.6Very low63 Ų63124.8 Ų124.865%0.64966%0.655SS**  trans-80.862.4-175.800000112.5Y5Y5-G7 PolarHBondContact O-N 3.2Å
8K26.8Very low28.2Very low166 Ų166123.9 Ų123.972%0.72266%0.66SS**  trans-175.3116142.1-111177.4179.7176.50108.5I6 L10I6-K8 VanDerWaalsContact C-N 3.25Å; I6-K8 PolarHBondContact O-N 3.12Å; K8-L10 PolarHBondContact O-N 3.22Å
9R27.8Very low28.9Very low225 Ų225123.1 Ų123.185%0.84965%0.65SS**  trans-58.394.2152.7-135.2-177.8-175.3-168.7-0.2105.3K11R9-K11 PolarHBondContact O-N 2.79Å
10L27.7Very low29.6Very low84 Ų84118.5 Ų118.544%0.4463%0.628SS.*  trans-67.693.1166-73.9179.3000105.7K8 G12 S15 F17K8-L10 PolarHBondContact O-N 3.22Å; L10-G12 PolarHBondContact O-N 3.27Å; L10-S15 WeakPolarHBondContact CB-OG 3.33Å; L10-S15 VanDerWaalsContact CD1-CB 3.5Å; L10-S15 VanDerWaalsContact CD1-OG 3.24Å; L10-S15 WeakPolarHBondContact CD1-OG 3.42Å; L10-F17 HydrophobicContact CD1-CE1 3.89Å; L10-F17 HydrophobicContact CD1-CE2 3.95Å; L10-F17 HydrophobicContact CD1-CZ 3.23Å; L10-F17 HydrophobicContact CG-CZ 4.49Å
11K27.8Very low30.7Very low196 Ų196113.1 Ų113.185%0.85260%0.599SS**  trans-64.991.3165.5-75.5-176.1175-178.20106.4R9R9-K11 PolarHBondContact O-N 2.79Å
12G28.2Very low31.9Very low41 Ų41103.1 Ų103.142%0.42355%0.55SS.*SBendtrans-174.3141175.300000109.3L10 A14L10-G12 PolarHBondContact O-N 3.27Å; G12-A14 PolarHBondContact O-N 2.82Å; G12-A14 VanDerWaalsContact O-N 3.15Å
13P27.4Very low33.4Very low135 Ų13597.9 Ų97.988%0.87752%0.523SS*.THydrogen-bonded Turntrans-59.3120.3175.825.7-31.8000108.5S15P13-S15 PolarHBondContact O-N 3.04Å
14A30.7Very low34.7Very low93 Ų9395.5 Ų95.577%0.76951%0.511SS*.THydrogen-bonded Turntrans38.976.4174.100000114.6G12 T16G12-A14 PolarHBondContact O-N 2.82Å; G12-A14 VanDerWaalsContact O-N 3.15Å; A14-T16 PolarHBondContact O-N 2.89Å
15S28.9Very low35.7Very low50 Ų5092.6 Ų92.635%0.3550%0.497SS..  trans-66.1100.4168.821.80000109.3L10 P13 F17L10-S15 WeakPolarHBondContact CB-OG 3.33Å; L10-S15 VanDerWaalsContact CD1-CB 3.5Å; L10-S15 VanDerWaalsContact CD1-OG 3.24Å; L10-S15 WeakPolarHBondContact CD1-OG 3.42Å; P13-S15 PolarHBondContact O-N 3.04Å; S15-F17 WeakPolarHBondContact O-CD2 3.4Å; S15-F17 PolarHBondContact O-N 3.28Å
16T31.8Very low36.6Very low116 Ų11689.1 Ų89.171%0.71248%0.483SS*.  trans-67.9117.1168.330.70000108.7A14A14-T16 PolarHBondContact O-N 2.89Å
17F34.5Very low37.2Very low79 Ų7986 Ų8635%0.34647%0.47SS..  trans-89.3142.5168.2-65.6-87.8000108.9L10 S15 F19 S76 F79L10-F17 HydrophobicContact CD1-CE1 3.89Å; L10-F17 HydrophobicContact CD1-CE2 3.95Å; L10-F17 HydrophobicContact CD1-CZ 3.23Å; L10-F17 HydrophobicContact CG-CZ 4.49Å; S15-F17 WeakPolarHBondContact O-CD2 3.4Å; S15-F17 PolarHBondContact O-N 3.28Å; F17-F19 HydrophobicContact CB-CD2 4.11Å; F17-F19 HydrophobicContact CD1-CD2 4.13Å; F17-F19 HydrophobicContact CD1-CE2 4.13Å; F17-S76 PolarHBondContact N-OG 3.15Å; F17-S76 WeakPolarHBondContact O-CB 3.39Å; F17-S76 PolarHBondContact O-OG 3.44Å; F17-F79 HydrophobicContact CD2-CD2 4.17Å; F17-F79 HydrophobicContact CD2-CE2 4.05Å; F17-F79 HydrophobicContact CE2-CD2 4.38Å; F17-F79 HydrophobicContact CE2-CE2 4.31Å
18C37.8Very low38.3Very low109 Ų10984.9 Ų84.974%0.73645%0.452SS*.  trans-114.339.1176.6-70.50000110.9
19F40.8Very low39Very low108 Ų10881.2 Ų81.247%0.47444%0.443SS..SBendtrans-113.1144.5-177.8-53.8-68.8000110.7F17 L21 Y95F17-F19 HydrophobicContact CB-CD2 4.11Å; F17-F19 HydrophobicContact CD1-CD2 4.13Å; F17-F19 HydrophobicContact CD1-CE2 4.13Å; F19-L21 PolarHBondContact O-N 3.19Å; F19-Y95 HydrophobicContact CD1-CD2 4.36Å; F19-Y95 HydrophobicContact CD1-CE2 4.2Å; F19-Y95 HydrophobicContact CE1-CE2 4.11Å
20P44.6Very low39.8Very low31 Ų3173.8 Ų73.820%0.20142%0.42CS..  trans-64.4133.4172.925.6-31.1000110.4V72 F73 I96P20-V72 HydrophobicContact CB-CG1 4.19Å; P20-F73 WeakPolarHBondContact CA-O 3.36Å; P20-F73 VanDerWaalsContact CB-O 3.24Å; P20-F73 WeakPolarHBondContact CB-O 3.45Å; P20-I96 HydrophobicContact CB-CD1 4.14Å; P20-I96 HydrophobicContact CG-CB 3.73Å; P20-I96 HydrophobicContact CG-CD1 3.83Å; P20-I96 HydrophobicContact CG-CG1 3.89Å
21L51.9Low40.4Very low6 Ų671.8 Ų71.83%0.03141%0.413CS..EExtended strand (participates in β ladder)trans-94.6130.4175175.868.4000108.5F19 L23 F52 V72 F73 P77 V91 L93F19-L21 PolarHBondContact O-N 3.19Å; L21-L23 HydrophobicContact CD1-CD2 4.48Å; L21-L23 HydrophobicContact CD2-CD1 4.45Å; L21-L23 HydrophobicContact CD2-CD2 3.93Å; L21-L23 HydrophobicContact CD2-CG 4.07Å; L21-L23 HydrophobicContact CG-CD2 4.22Å; L21-L23 HydrophobicContact CG-CG 4.23Å; L21-F52 HydrophobicContact CD2-CE1 4Å; L21-F52 HydrophobicContact CD2-CZ 4.44Å; L21-V72 WeakPolarHBondContact O-CA 3Å; L21-F73 HydrophobicContact CB-CB 4.4Å; L21-F73 HydrophobicContact CB-CD2 4.43Å; L21-F73 HydrophobicContact CD2-CD2 4.48Å; L21-F73 PolarHBondContact N-O 3.11Å; L21-F73 PolarHBondContact O-N 2.76Å; L21-P77 HydrophobicContact CD2-CG 3.91Å; L21-V91 HydrophobicContact CD1-CG1 4.4Å; L21-L93 HydrophobicContact CD1-CD2 3.49Å; L21-L93 VanDerWaalsContact CD1-CD2 3.49Å
22V51.4Low41Very low10 Ų1066.7 Ų66.76%0.06140%0.402CS..EExtended strand (participates in β ladder)trans-106.1120.2168-174.60000108.9F24 A70 L71 V72 A94V22-F24 HydrophobicContact CB-CE2 4.31Å; V22-F24 HydrophobicContact CG1-CD2 4.18Å; V22-F24 HydrophobicContact CG1-CE1 4.46Å; V22-F24 HydrophobicContact CG1-CE2 3.6Å; V22-F24 HydrophobicContact CG1-CZ 3.77Å; V22-A70 HydrophobicContact CG1-CB 4Å; V22-L71 VanDerWaalsContact CA-O 3.29Å; V22-L71 WeakPolarHBondContact CA-O 3.37Å; V22-V72 HydrophobicContact CG2-CG2 4.31Å; V22-A94 HydrophobicContact CB-CB 4.13Å; V22-A94 HydrophobicContact CG2-CB 3.83Å
23L54.4Low41.3Very low9 Ų969.4 Ų69.45%0.04740%0.404CS..EExtended strand (participates in β ladder)trans-100.3126.7172-64.7169.1000109.3L21 F52 A70 L71 F73 V91L21-L23 HydrophobicContact CD1-CD2 4.48Å; L21-L23 HydrophobicContact CD2-CD1 4.45Å; L21-L23 HydrophobicContact CD2-CD2 3.93Å; L21-L23 HydrophobicContact CD2-CG 4.07Å; L21-L23 HydrophobicContact CG-CD2 4.22Å; L21-L23 HydrophobicContact CG-CG 4.23Å; L23-F52 HydrophobicContact CD1-CE1 4.21Å; L23-F52 HydrophobicContact CD1-CE2 3.61Å; L23-F52 HydrophobicContact CD1-CZ 3.28Å; L23-F52 HydrophobicContact CG-CZ 4.45Å; L23-A70 WeakPolarHBondContact O-CA 3.36Å; L23-L71 HydrophobicContact CB-CB 4.41Å; L23-L71 PolarHBondContact N-O 3.07Å; L23-L71 VanDerWaalsContact N-O 3.13Å; L23-L71 PolarHBondContact O-N 2.85Å; L23-L71 VanDerWaalsContact O-N 3.15Å; L23-F73 HydrophobicContact CD1-CD2 4.43Å; L23-F73 HydrophobicContact CD1-CE2 3.6Å; L23-F73 HydrophobicContact CD1-CZ 4.33Å; L23-F73 HydrophobicContact CG-CE2 4.26Å; L23-V91 HydrophobicContact CD2-CG1 4.24Å; L23-V91 HydrophobicContact CD2-CG2 4.09Å
24F51Low41.7Very low77 Ų7773.7 Ų73.734%0.33840%0.402SS..EExtended strand (participates in β ladder)trans-101.4117.8167.1-63.7-88.4000108.3V22 A70 F90V22-F24 HydrophobicContact CB-CE2 4.31Å; V22-F24 HydrophobicContact CG1-CD2 4.18Å; V22-F24 HydrophobicContact CG1-CE1 4.46Å; V22-F24 HydrophobicContact CG1-CE2 3.6Å; V22-F24 HydrophobicContact CG1-CZ 3.77Å; F24-A70 HydrophobicContact CE1-CB 4.27Å; F24-F90 VanDerWaalsContact O-O 3.12Å
25T48.6Very low42Very low21 Ų2175 Ų7513%0.12939%0.388CS..EExtended strand (participates in β ladder)trans-130.5147.8177.2178.80000110.5T27 C28 T46 G69T25-T27 VanDerWaalsContact C-N 3.32Å; T25-T27 WeakPolarHBondContact CG2-O 3.47Å; T25-T27 PolarHBondContact OG1-N 3.3Å; T25-T27 PolarHBondContact OG1-O 3.04Å; T25-C28 HydrophobicContact CG2-CB 3.5Å; T25-C28 VanDerWaalsContact CG2-CB 3.5Å; T25-T46 HydrophobicContact CG2-CG2 3.81Å; T25-G69 PolarHBondContact O-N 3.4Å
26R43.4Very low42.5Very low120 Ų12079 Ų7945%0.45341%0.412SS..SBendtrans-70.2-30.8177.3-78.3-175.2175.3178.7-0.5113.3H67 Y68R26-H67 VanDerWaalsContact CA-O 3.22Å; R26-H67 WeakPolarHBondContact CA-O 3.46Å; R26-Y68 HydrophobicContact CG-CE1 4.4Å
27T42.9Very low42.8Very low66 Ų6682.1 Ų82.141%0.40542%0.419SS..SBendtrans-141126.4179.546.10000107.5T25 T46 D47T25-T27 VanDerWaalsContact C-N 3.32Å; T25-T27 WeakPolarHBondContact CG2-O 3.47Å; T25-T27 PolarHBondContact OG1-N 3.3Å; T25-T27 PolarHBondContact OG1-O 3.04Å; T27-T46 WeakPolarHBondContact O-CB 3.44Å; T27-D47 VanDerWaalsContact OG1-CG 3.31Å; T27-D47 PolarHBondContact OG1-OD1 2.83Å; T27-D47 PolarHBondContact OG1-OD2 3.13Å
28C45.5Very low43Very low40 Ų4080.5 Ų80.527%0.2741%0.413SS..  trans-133114.4176.7-166.80000108.8T25 V44 L71T25-C28 HydrophobicContact CG2-CB 3.5Å; T25-C28 VanDerWaalsContact CG2-CB 3.5Å; C28-V44 WeakPolarHBondContact SG-CG1 3.43Å; C28-L71 WeakPolarHBondContact SG-CD1 3.47Å
29T42.9Very low43Very low89 Ų8982.4 Ų82.455%0.54642%0.416SS..EExtended strand (participates in β ladder)trans-106.8113.5162.4-53.10000107.4Q45T29-Q45 PolarHBondContact N-O 2.76Å; T29-Q45 CarbonylContact O-C 3.53Å; T29-Q45 WeakPolarHBondContact O-CA 3.43Å; T29-Q45 WeakPolarHBondContact O-CB 3.45Å; T29-Q45 PolarHBondContact O-N 2.59Å; T29-Q45 VanDerWaalsContact O-O 3.08Å
30I44.5Very low42.8Very low70 Ų7081 Ų8136%0.35942%0.42SS..EExtended strand (participates in β ladder)trans-87.1118172.4-52.2174.9000106.9P56 L71I30-P56 HydrophobicContact CD1-CG 4.14Å; I30-L71 HydrophobicContact CD1-CD2 3.59Å; I30-L71 HydrophobicContact CG1-CD2 4.35Å
31S39.5Very low42.5Very low41 Ų4180 Ų8029%0.28742%0.415SS..EExtended strand (participates in β ladder)trans-117.2124.4173.2-174.20000109.2Q33 F43S31-Q33 PolarHBondContact O-N 2.75Å; S31-Q33 VanDerWaalsContact O-N 3.12Å; S31-F43 PolarHBondContact N-O 3.11Å; S31-F43 CarbonylContact O-C 3.59Å; S31-F43 WeakPolarHBondContact O-CA 3.1Å; S31-F43 WeakPolarHBondContact O-CB 3.31Å; S31-F43 PolarHBondContact O-N 2.87Å
32S39.7Very low41.8Very low90 Ų9084 Ų8463%0.62943%0.431SS*.  trans-80.187.816763.50000108.7
33Q34.3Very low41.4Very low98 Ų9884.6 Ų84.646%0.45843%0.432SS..  trans-89119.8165.2-76.6-172.3-5.700109.6S31 R35 F43S31-Q33 PolarHBondContact O-N 2.75Å; S31-Q33 VanDerWaalsContact O-N 3.12Å; Q33-R35 PolarHBondContact O-N 3.26Å; Q33-F43 HydrophobicContact CB-CD2 3.65Å; Q33-F43 HydrophobicContact CB-CE2 3.97Å; Q33-F43 HydrophobicContact CB-CG 4.35Å; Q33-F43 WeakPolarHBondContact O-CD2 3.24Å; Q33-F43 WeakPolarHBondContact O-CE2 3.22Å
34R36.2Very low40.9Very low225 Ų22584.2 Ų84.285%0.84943%0.43SS*.  trans-77.499.9165-123.8-179.2179.6-175.7-0.5107
35R36.9Very low40.4Very low121 Ų12186.3 Ų86.346%0.45744%0.441SS..  trans-82.9127.8166.8-76.2-162-179-162.40.1108.9Q33 E37 I38 F43Q33-R35 PolarHBondContact O-N 3.26Å; R35-E37 PolarHBondContact O-N 3.24Å; R35-E37 VanDerWaalsContact O-N 3.1Å; R35-I38 PolarHBondContact O-N 2.83Å; R35-F43 HydrophobicContact CB-CZ 4.35Å; R35-F43 HydrophobicContact CG-CE2 4.11Å; R35-F43 HydrophobicContact CG-CZ 3.76Å
36P39.1Very low40.3Very low134 Ų13486.1 Ų86.187%0.8744%0.44SS*.THydrogen-bonded Turntrans-62.8-17.9-177.421.1-29.9000113.9
37E38.9Very low40.2Very low181 Ų18186.5 Ų86.585%0.84645%0.451SS*.THydrogen-bonded Turntrans-91.9-11-178.1-61.4173.6-171.400114R35R35-E37 PolarHBondContact O-N 3.24Å; R35-E37 VanDerWaalsContact O-N 3.1Å
38I38.4Very low40Very low44 Ų4483.4 Ų83.423%0.22643%0.432CS..SBendtrans-129.3107.2-176.2-60176.5000106.4R35 S40 W53R35-I38 PolarHBondContact O-N 2.83Å; I38-S40 PolarHBondContact O-N 3.3Å; I38-W53 HydrophobicContact CG2-CD2 4.48Å; I38-W53 HydrophobicContact CG2-CE3 3.87Å; I38-W53 HydrophobicContact CG2-CH2 3.79Å; I38-W53 HydrophobicContact CG2-CZ2 4.38Å; I38-W53 HydrophobicContact CG2-CZ3 3.5Å; I38-W53 VanDerWaalsContact CG2-CZ3 3.5Å
39N39Very low40Very low149 Ų14984.3 Ų84.380%0.79744%0.443SS*.THydrogen-bonded Turntrans-40.3102.5170.7-84.8-25.5000110.2G41N39-G41 PolarHBondContact O-N 3.18Å
40S34.8Very low40.3Very low80 Ų8081.2 Ų81.256%0.55942%0.422SS*.THydrogen-bonded Turntrans31.272.8170.557.50000115.5I38I38-S40 PolarHBondContact O-N 3.3Å
41G38.6Very low40.4Very low10 Ų1082.6 Ų82.610%0.10343%0.426CS..PPolyproline II helixtrans-91157.8168.900000112.7N39 F52N39-G41 PolarHBondContact O-N 3.18Å; G41-F52 WeakPolarHBondContact CA-O 3.29Å
42Y38.5Very low41.1Very low90 Ų9081.2 Ų81.235%0.35342%0.415SS..EExtended strand (participates in β ladder)trans-102.9132.1167.8-75.7-101.6000108.7F52 P55Y42-F52 PolarHBondContact N-O 3.28Å; Y42-F52 PolarHBondContact O-N 3.28Å; Y42-P55 HydrophobicContact CD1-CB 3.75Å; Y42-P55 HydrophobicContact CD2-CB 3.55Å; Y42-P55 HydrophobicContact CD2-CG 3.78Å; Y42-P55 HydrophobicContact CE1-CB 3.63Å; Y42-P55 HydrophobicContact CE1-CG 4.27Å; Y42-P55 HydrophobicContact CE2-CB 3.45Å; Y42-P55 VanDerWaalsContact CE2-CB 3.45Å; Y42-P55 HydrophobicContact CE2-CG 3.32Å; Y42-P55 HydrophobicContact CG-CB 3.69Å; Y42-P55 HydrophobicContact CG-CG 4.42Å; Y42-P55 VanDerWaalsContact CZ-CB 3.46Å
43F41.9Very low41.5Very low21 Ų2183.9 Ų83.99%0.09241%0.411CS..EExtended strand (participates in β ladder)trans-99.1121.5178.6-67.8-96.5000108.4S31 Q33 R35 H51S31-F43 PolarHBondContact N-O 3.11Å; S31-F43 CarbonylContact O-C 3.59Å; S31-F43 WeakPolarHBondContact O-CA 3.1Å; S31-F43 WeakPolarHBondContact O-CB 3.31Å; S31-F43 PolarHBondContact O-N 2.87Å; Q33-F43 HydrophobicContact CB-CD2 3.65Å; Q33-F43 HydrophobicContact CB-CE2 3.97Å; Q33-F43 HydrophobicContact CB-CG 4.35Å; Q33-F43 WeakPolarHBondContact O-CD2 3.24Å; Q33-F43 WeakPolarHBondContact O-CE2 3.22Å; R35-F43 HydrophobicContact CB-CZ 4.35Å; R35-F43 HydrophobicContact CG-CE2 4.11Å; R35-F43 HydrophobicContact CG-CZ 3.76Å; F43-H51 AromaticContact CD1-CD2 3.6Å; F43-H51 AromaticContact CD1-NE2 3.94Å; F43-H51 AromaticContact CE1-CD2 3.58Å; F43-H51 AromaticContact CE1-NE2 3.69Å
44V43.7Very low42.2Very low1 Ų185.9 Ų85.91%0.00642%0.415CS..EExtended strand (participates in β ladder)trans-100.7101.2170.1-177.20000106.2C28 T46 F50 F52 L71 F73C28-V44 WeakPolarHBondContact SG-CG1 3.43Å; V44-T46 HydrophobicContact CG1-CG2 3.73Å; V44-T46 PolarHBondContact O-N 3.42Å; V44-F50 PolarHBondContact N-O 2.85Å; V44-F50 PolarHBondContact O-N 2.97Å; V44-F52 HydrophobicContact CB-CD2 4.04Å; V44-F52 HydrophobicContact CB-CE2 4.06Å; V44-F52 HydrophobicContact CG2-CD2 3.66Å; V44-F52 HydrophobicContact CG2-CE2 4.03Å; V44-L71 HydrophobicContact CB-CD1 4.34Å; V44-L71 HydrophobicContact CG1-CD1 3.45Å; V44-L71 VanDerWaalsContact CG1-CD1 3.45Å; V44-L71 HydrophobicContact CG2-CD1 3.91Å; V44-F73 HydrophobicContact CG2-CZ 4.04Å
45Q41.3Very low42.7Very low121 Ų12177.4 Ų77.457%0.56539%0.389SS*.EExtended strand (participates in β ladder)trans-82.795.5172.7-173173.2-15.100107.5T29T29-Q45 PolarHBondContact N-O 2.76Å; T29-Q45 CarbonylContact O-C 3.53Å; T29-Q45 WeakPolarHBondContact O-CA 3.43Å; T29-Q45 WeakPolarHBondContact O-CB 3.45Å; T29-Q45 PolarHBondContact O-N 2.59Å; T29-Q45 VanDerWaalsContact O-O 3.08Å
46T46.2Very low43.7Very low18 Ų1872.7 Ų72.711%0.1137%0.374CS..SBendtrans-96.9-178.4159.875.30000108T25 T27 V44 S48 F50T25-T46 HydrophobicContact CG2-CG2 3.81Å; T27-T46 WeakPolarHBondContact O-CB 3.44Å; V44-T46 HydrophobicContact CG1-CG2 3.73Å; V44-T46 PolarHBondContact O-N 3.42Å; T46-S48 CarbonylContact C-O 3.53Å; T46-S48 PolarHBondContact N-O 3.28Å; T46-S48 CarbonylContact O-C 3.29Å; T46-S48 VanDerWaalsContact O-C 3.29Å; T46-S48 PolarHBondContact O-N 2.81Å; T46-S48 PolarHBondContact OG1-N 3.03Å; T46-S48 VanDerWaalsContact OG1-N 3.11Å; T46-S48 PolarHBondContact OG1-O 2.96Å; T46-F50 HydrophobicContact CG2-CD2 4.42Å
47D40.8Very low44.6Very low127 Ų12771.8 Ų71.868%0.67936%0.361SS*.SBendtrans-53.5-12.9167.4-61.9-16.3000112.6T27T27-D47 VanDerWaalsContact OG1-CG 3.31Å; T27-D47 PolarHBondContact OG1-OD1 2.83Å; T27-D47 PolarHBondContact OG1-OD2 3.13Å
48S39.1Very low45Very low2 Ų265 Ų651%0.01434%0.336CS..SBendtrans-117.1133158.2-660000111.5T46 F50 S86T46-S48 CarbonylContact C-O 3.53Å; T46-S48 PolarHBondContact N-O 3.28Å; T46-S48 CarbonylContact O-C 3.29Å; T46-S48 VanDerWaalsContact O-C 3.29Å; T46-S48 PolarHBondContact O-N 2.81Å; T46-S48 PolarHBondContact OG1-N 3.03Å; T46-S48 VanDerWaalsContact OG1-N 3.11Å; T46-S48 PolarHBondContact OG1-O 2.96Å; S48-F50 WeakPolarHBondContact O-CD2 3.35Å; S48-F50 PolarHBondContact O-N 3.44Å; S48-S86 VanDerWaalsContact OG-CB 3.24Å; S48-S86 WeakPolarHBondContact OG-CB 3.24Å; S48-S86 PolarHBondContact OG-OG 2.75Å
49A45.4Very low45.6Very low59 Ų5968 Ų6849%0.48836%0.358SS..EExtended strand (participates in β ladder)trans-73116174.200000110.6
50F49.9Very low46.1Very low24 Ų2462.3 Ų62.311%0.10533%0.332CS..EExtended strand (participates in β ladder)trans-108.7134.9170.5-66.3-78.8000110.3V44 T46 S48 F52V44-F50 PolarHBondContact N-O 2.85Å; V44-F50 PolarHBondContact O-N 2.97Å; T46-F50 HydrophobicContact CG2-CD2 4.42Å; S48-F50 WeakPolarHBondContact O-CD2 3.35Å; S48-F50 PolarHBondContact O-N 3.44Å; F50-F52 HydrophobicContact CB-CD2 4.1Å; F50-F52 HydrophobicContact CB-CE2 3.31Å; F50-F52 HydrophobicContact CB-CZ 3.79Å; F50-F52 HydrophobicContact CG-CE2 4.19Å; F50-F52 HydrophobicContact CG-CZ 4.32Å
51H47.1Very low46.7Very low99 Ų9966.4 Ų66.446%0.45834%0.342SS..EExtended strand (participates in β ladder)trans-100.8114.1177.4-62.3172.2000109.7F43F43-H51 AromaticContact CD1-CD2 3.6Å; F43-H51 AromaticContact CD1-NE2 3.94Å; F43-H51 AromaticContact CE1-CD2 3.58Å; F43-H51 AromaticContact CE1-NE2 3.69Å
52F52.7Low46.9Very low11 Ų1172.5 Ų72.55%0.04837%0.37CS..EExtended strand (participates in β ladder)trans-111133.6174.1-64.2-79.5000110.3L21 L23 G41 Y42 V44 F50 R54 F73 P77L21-F52 HydrophobicContact CD2-CE1 4Å; L21-F52 HydrophobicContact CD2-CZ 4.44Å; L23-F52 HydrophobicContact CD1-CE1 4.21Å; L23-F52 HydrophobicContact CD1-CE2 3.61Å; L23-F52 HydrophobicContact CD1-CZ 3.28Å; L23-F52 HydrophobicContact CG-CZ 4.45Å; G41-F52 WeakPolarHBondContact CA-O 3.29Å; Y42-F52 PolarHBondContact N-O 3.28Å; Y42-F52 PolarHBondContact O-N 3.28Å; V44-F52 HydrophobicContact CB-CD2 4.04Å; V44-F52 HydrophobicContact CB-CE2 4.06Å; V44-F52 HydrophobicContact CG2-CD2 3.66Å; V44-F52 HydrophobicContact CG2-CE2 4.03Å; F50-F52 HydrophobicContact CB-CD2 4.1Å; F50-F52 HydrophobicContact CB-CE2 3.31Å; F50-F52 HydrophobicContact CB-CZ 3.79Å; F50-F52 HydrophobicContact CG-CE2 4.19Å; F50-F52 HydrophobicContact CG-CZ 4.32Å; F52-R54 PolarHBondContact O-N 2.94Å; F52-F73 HydrophobicContact CB-CD1 4.2Å; F52-F73 HydrophobicContact CB-CE1 3.64Å; F52-F73 HydrophobicContact CB-CZ 4.3Å; F52-F73 AromaticContact CD1-CD1 3.92Å; F52-F73 HydrophobicContact CD1-CD1 3.92Å; F52-F73 HydrophobicContact CD1-CD2 4.39Å; F52-F73 AromaticContact CD1-CE1 3.73Å; F52-F73 HydrophobicContact CD1-CE1 3.73Å; F52-F73 HydrophobicContact CD1-CE2 4.23Å; F52-F73 HydrophobicContact CD1-CG 4.24Å; F52-F73 AromaticContact CD1-CZ 3.9Å; F52-F73 HydrophobicContact CD1-CZ 3.9Å; F52-F73 AromaticContact CD2-CE1 3.78Å; F52-F73 HydrophobicContact CD2-CE1 3.78Å; F52-F73 HydrophobicContact CD2-CE2 4.32Å; F52-F73 AromaticContact CD2-CZ 3.53Å; F52-F73 HydrophobicContact CD2-CZ 3.53Å; F52-F73 HydrophobicContact CE1-CD2 4.3Å; F52-F73 HydrophobicContact CE1-CE1 4.4Å; F52-F73 HydrophobicContact CE1-CE2 4.09Å; F52-F73 HydrophobicContact CE1-CZ 4.14Å; F52-F73 HydrophobicContact CE2-CE1 4.4Å; F52-F73 HydrophobicContact CE2-CE2 4.13Å; F52-F73 AromaticContact CE2-CZ 3.75Å; F52-F73 HydrophobicContact CE2-CZ 3.75Å; F52-F73 HydrophobicContact CG-CD1 4.03Å; F52-F73 AromaticContact CG-CE1 3.41Å; F52-F73 HydrophobicContact CG-CE1 3.41Å; F52-F73 VanDerWaalsContact CG-CE1 3.41Å; F52-F73 HydrophobicContact CG-CE2 4.38Å; F52-F73 AromaticContact CG-CZ 3.62Å; F52-F73 HydrophobicContact CG-CZ 3.62Å; F52-F73 HydrophobicContact CZ-CE2 4.08Å; F52-F73 HydrophobicContact CZ-CZ 4.11Å; F52-P77 HydrophobicContact CE1-CB 4.32Å
53W48.4Very low47.1Very low146 Ų14669.8 Ų69.855%0.55337%0.369SS*.SBendtrans-79.3-8.2-179.7-65.779.9000112.9I38I38-W53 HydrophobicContact CG2-CD2 4.48Å; I38-W53 HydrophobicContact CG2-CE3 3.87Å; I38-W53 HydrophobicContact CG2-CH2 3.79Å; I38-W53 HydrophobicContact CG2-CZ2 4.38Å; I38-W53 HydrophobicContact CG2-CZ3 3.5Å; I38-W53 VanDerWaalsContact CG2-CZ3 3.5Å
54R49.2Very low46.8Very low140 Ų14077.7 Ų77.753%0.52841%0.406SS..SBendtrans-142.8148.6179.7-70.8-173.4178.5-170.8-2109.8F52 F75F52-R54 PolarHBondContact O-N 2.94Å; R54-F75 VanDerWaalsContact CD-CE2 3.5Å
55P48.1Very low46.6Very low48 Ų4884.8 Ų84.831%0.31244%0.439SS..  trans-65.6157177.923.2-23.5000110.5Y42Y42-P55 HydrophobicContact CD1-CB 3.75Å; Y42-P55 HydrophobicContact CD2-CB 3.55Å; Y42-P55 HydrophobicContact CD2-CG 3.78Å; Y42-P55 HydrophobicContact CE1-CB 3.63Å; Y42-P55 HydrophobicContact CE1-CG 4.27Å; Y42-P55 HydrophobicContact CE2-CB 3.45Å; Y42-P55 VanDerWaalsContact CE2-CB 3.45Å; Y42-P55 HydrophobicContact CE2-CG 3.32Å; Y42-P55 HydrophobicContact CG-CB 3.69Å; Y42-P55 HydrophobicContact CG-CG 4.42Å; Y42-P55 VanDerWaalsContact CZ-CB 3.46Å
56P56.9Low46.4Very low22 Ų2280.9 Ų80.914%0.14343%0.431CS..  trans-61.2145.2163.829.2-33.1000110I30 A58 L71 V72 F73I30-P56 HydrophobicContact CD1-CG 4.14Å; P56-A58 VanDerWaalsContact C-N 3.32Å; P56-L71 HydrophobicContact CB-CB 4.31Å; P56-L71 HydrophobicContact CB-CD2 4.46Å; P56-L71 HydrophobicContact CG-CD2 4.29Å; P56-V72 CarbonylContact C-O 3.5Å; P56-V72 WeakPolarHBondContact CA-O 3.36Å; P56-V72 WeakPolarHBondContact CB-O 3.49Å; P56-F73 HydrophobicContact CB-CD1 4.41Å; P56-F73 HydrophobicContact CB-CE1 4.12Å; P56-F73 HydrophobicContact CB-CZ 4.24Å; P56-F73 HydrophobicContact CG-CE1 4.5Å
57I57Low46.1Very low114 Ų11485 Ų8559%0.58545%0.448SS*.SBendtrans-75.5-26.2178.1-33.9171.9000111.2V72 P74I57-V72 HydrophobicContact CD1-CG1 4.35Å; I57-V72 PolarHBondContact N-O 2.91Å; I57-P74 VanDerWaalsContact CD1-CA 3.49Å; I57-P74 HydrophobicContact CD1-CB 3.4Å; I57-P74 HydrophobicContact CD1-CG 4.01Å; I57-P74 HydrophobicContact CG1-CB 3.54Å; I57-P74 HydrophobicContact CG1-CG 3.52Å
58A49.2Very low46.3Very low40 Ų4083.6 Ų83.633%0.33143%0.434SS..EExtended strand (participates in β ladder)trans-130.7135.7179.600000109.3P56 V72P56-A58 VanDerWaalsContact C-N 3.32Å; A58-V72 HydrophobicContact CB-CB 4.42Å; A58-V72 HydrophobicContact CB-CG2 4.38Å
59P49.2Very low46.8Very low105 Ų10583.8 Ų83.868%0.68244%0.437SS*.EExtended strand (participates in β ladder)trans-63.4155.717428.2-33000110E61P59-E61 PolarHBondContact O-N 3.34Å
60A50.9Low47Very low31 Ų3182.3 Ų82.326%0.25643%0.425SS..EExtended strand (participates in β ladder)trans-55.798.917000000109.5M62 A70 L71A60-M62 PolarHBondContact O-N 3.06Å; A60-A70 WeakPolarHBondContact CA-O 3.44Å; A60-L71 HydrophobicContact CB-CD2 3.85Å
61E47Very low47.3Very low165 Ų16581.2 Ų81.277%0.77142%0.42SS*.EExtended strand (participates in β ladder)trans-62.6110.3156-74-173.2-179.900105.3P59 G63P59-E61 PolarHBondContact O-N 3.34Å; E61-G63 PolarHBondContact O-N 2.51Å; E61-G63 VanDerWaalsContact O-N 3.11Å
62M42.8Very low47.6Very low139 Ų13977.9 Ų77.969%0.68541%0.407SS*.EExtended strand (participates in β ladder)trans-63.5112.9171.3-78.5-166.4-68.700106.6A60 Y68A60-M62 PolarHBondContact O-N 3.06Å; M62-Y68 CarbonylContact C-O 3.36Å; M62-Y68 WeakPolarHBondContact CA-O 3.07Å
63G43.5Very low47.8Very low32 Ų3277.6 Ų77.633%0.3341%0.406SS..  trans-53.4161.2169.800000110.6E61 E65 G66 Y68E61-G63 PolarHBondContact O-N 2.51Å; E61-G63 VanDerWaalsContact O-N 3.11Å; G63-E65 PolarHBondContact O-N 2.93Å; G63-G66 PolarHBondContact O-N 3.15Å; G63-Y68 PolarHBondContact N-O 3.06Å
64H34.8Very low47.7Very low188 Ų18872.7 Ų72.787%0.8739%0.393SS*.THydrogen-bonded Turntrans-41.2119.9174-142.7-54.4000108.7
65E39.3Very low47.8Very low150 Ų15070.9 Ų70.970%0.70139%0.389SS*.THydrogen-bonded Turntrans92.11.7-175.4-49.4179.4166.400118.8G63 H67G63-E65 PolarHBondContact O-N 2.93Å; E65-H67 VanDerWaalsContact CB-CD2 3.49Å; E65-H67 WeakPolarHBondContact CB-CD2 3.24Å; E65-H67 PolarHBondContact O-CD2 3.29Å; E65-H67 VanDerWaalsContact O-CD2 3.29Å; E65-H67 PolarHBondContact O-N 3.46Å; E65-H67 IonicContact OE2-CD2 3.68Å
66G38Very low47.8Very low39 Ų3969.9 Ų69.940%0.40238%0.382SS..SBendtrans722.1175.300000114.5G63G63-G66 PolarHBondContact O-N 3.15Å
67H39.5Very low47.4Very low103 Ų10369.5 Ų69.548%0.47738%0.38SS..  trans-93.8-4.2-173.6-68.4-48.4000114.2R26 E65R26-H67 VanDerWaalsContact CA-O 3.22Å; R26-H67 WeakPolarHBondContact CA-O 3.46Å; E65-H67 VanDerWaalsContact CB-CD2 3.49Å; E65-H67 WeakPolarHBondContact CB-CD2 3.24Å; E65-H67 PolarHBondContact O-CD2 3.29Å; E65-H67 VanDerWaalsContact O-CD2 3.29Å; E65-H67 PolarHBondContact O-N 3.46Å; E65-H67 IonicContact OE2-CD2 3.68Å
68Y44.9Very low46.8Very low98 Ų9874.2 Ų74.238%0.38439%0.391SS..  trans-142.8111.7-175.3-62.2-77.8000109.8R26 M62 G63R26-Y68 HydrophobicContact CG-CE1 4.4Å; M62-Y68 CarbonylContact C-O 3.36Å; M62-Y68 WeakPolarHBondContact CA-O 3.07Å; G63-Y68 PolarHBondContact N-O 3.06Å
69G48.3Very low46.5Very low7 Ų777.3 Ų77.37%0.07240%0.397CS..EExtended strand (participates in β ladder)trans-98.3135.8168.700000110.5T25T25-G69 PolarHBondContact O-N 3.4Å
70A51Low46.4Very low28 Ų2878 Ų7823%0.23140%0.402CS..EExtended strand (participates in β ladder)trans-99.7113.7169.600000110.3V22 L23 F24 A60V22-A70 HydrophobicContact CG1-CB 4Å; L23-A70 WeakPolarHBondContact O-CA 3.36Å; F24-A70 HydrophobicContact CE1-CB 4.27Å; A60-A70 WeakPolarHBondContact CA-O 3.44Å
71L54.7Low46.1Very low0 Ų078.4 Ų78.40%040%0.399CS..EExtended strand (participates in β ladder)trans-99.7117.8172.7-59.4177.9000110V22 L23 C28 I30 V44 P56 A60 F73V22-L71 VanDerWaalsContact CA-O 3.29Å; V22-L71 WeakPolarHBondContact CA-O 3.37Å; L23-L71 HydrophobicContact CB-CB 4.41Å; L23-L71 PolarHBondContact N-O 3.07Å; L23-L71 VanDerWaalsContact N-O 3.13Å; L23-L71 PolarHBondContact O-N 2.85Å; L23-L71 VanDerWaalsContact O-N 3.15Å; C28-L71 WeakPolarHBondContact SG-CD1 3.47Å; I30-L71 HydrophobicContact CD1-CD2 3.59Å; I30-L71 HydrophobicContact CG1-CD2 4.35Å; V44-L71 HydrophobicContact CB-CD1 4.34Å; V44-L71 HydrophobicContact CG1-CD1 3.45Å; V44-L71 VanDerWaalsContact CG1-CD1 3.45Å; V44-L71 HydrophobicContact CG2-CD1 3.91Å; P56-L71 HydrophobicContact CB-CB 4.31Å; P56-L71 HydrophobicContact CB-CD2 4.46Å; P56-L71 HydrophobicContact CG-CD2 4.29Å; A60-L71 HydrophobicContact CB-CD2 3.85Å; L71-F73 HydrophobicContact CB-CD2 4.44Å; L71-F73 HydrophobicContact CB-CE2 3.63Å; L71-F73 HydrophobicContact CB-CZ 4.13Å; L71-F73 HydrophobicContact CD1-CE2 4.38Å; L71-F73 HydrophobicContact CD1-CZ 4.28Å
72V53.8Low45.7Very low30 Ų3074.3 Ų74.318%0.18239%0.387CS..EExtended strand (participates in β ladder)trans-96.8116.8177.8-1750000109.5P20 L21 V22 P56 I57 A58 I96P20-V72 HydrophobicContact CB-CG1 4.19Å; L21-V72 WeakPolarHBondContact O-CA 3Å; V22-V72 HydrophobicContact CG2-CG2 4.31Å; P56-V72 CarbonylContact C-O 3.5Å; P56-V72 WeakPolarHBondContact CA-O 3.36Å; P56-V72 WeakPolarHBondContact CB-O 3.49Å; I57-V72 HydrophobicContact CD1-CG1 4.35Å; I57-V72 PolarHBondContact N-O 2.91Å; A58-V72 HydrophobicContact CB-CB 4.42Å; A58-V72 HydrophobicContact CB-CG2 4.38Å; V72-I96 HydrophobicContact CG1-CD1 4.16Å
73F57.5Low45.5Very low5 Ų574.1 Ų74.12%0.02239%0.387CS..EExtended strand (participates in β ladder)trans-98.5140.9174.6-66.3-87.7000111.3P20 L21 L23 V44 F52 P56 L71 F75P20-F73 WeakPolarHBondContact CA-O 3.36Å; P20-F73 VanDerWaalsContact CB-O 3.24Å; P20-F73 WeakPolarHBondContact CB-O 3.45Å; L21-F73 HydrophobicContact CB-CB 4.4Å; L21-F73 HydrophobicContact CB-CD2 4.43Å; L21-F73 HydrophobicContact CD2-CD2 4.48Å; L21-F73 PolarHBondContact N-O 3.11Å; L21-F73 PolarHBondContact O-N 2.76Å; L23-F73 HydrophobicContact CD1-CD2 4.43Å; L23-F73 HydrophobicContact CD1-CE2 3.6Å; L23-F73 HydrophobicContact CD1-CZ 4.33Å; L23-F73 HydrophobicContact CG-CE2 4.26Å; V44-F73 HydrophobicContact CG2-CZ 4.04Å; F52-F73 HydrophobicContact CB-CD1 4.2Å; F52-F73 HydrophobicContact CB-CE1 3.64Å; F52-F73 HydrophobicContact CB-CZ 4.3Å; F52-F73 AromaticContact CD1-CD1 3.92Å; F52-F73 HydrophobicContact CD1-CD1 3.92Å; F52-F73 HydrophobicContact CD1-CD2 4.39Å; F52-F73 AromaticContact CD1-CE1 3.73Å; F52-F73 HydrophobicContact CD1-CE1 3.73Å; F52-F73 HydrophobicContact CD1-CE2 4.23Å; F52-F73 HydrophobicContact CD1-CG 4.24Å; F52-F73 AromaticContact CD1-CZ 3.9Å; F52-F73 HydrophobicContact CD1-CZ 3.9Å; F52-F73 AromaticContact CD2-CE1 3.78Å; F52-F73 HydrophobicContact CD2-CE1 3.78Å; F52-F73 HydrophobicContact CD2-CE2 4.32Å; F52-F73 AromaticContact CD2-CZ 3.53Å; F52-F73 HydrophobicContact CD2-CZ 3.53Å; F52-F73 HydrophobicContact CE1-CD2 4.3Å; F52-F73 HydrophobicContact CE1-CE1 4.4Å; F52-F73 HydrophobicContact CE1-CE2 4.09Å; F52-F73 HydrophobicContact CE1-CZ 4.14Å; F52-F73 HydrophobicContact CE2-CE1 4.4Å; F52-F73 HydrophobicContact CE2-CE2 4.13Å; F52-F73 AromaticContact CE2-CZ 3.75Å; F52-F73 HydrophobicContact CE2-CZ 3.75Å; F52-F73 HydrophobicContact CG-CD1 4.03Å; F52-F73 AromaticContact CG-CE1 3.41Å; F52-F73 HydrophobicContact CG-CE1 3.41Å; F52-F73 VanDerWaalsContact CG-CE1 3.41Å; F52-F73 HydrophobicContact CG-CE2 4.38Å; F52-F73 AromaticContact CG-CZ 3.62Å; F52-F73 HydrophobicContact CG-CZ 3.62Å; F52-F73 HydrophobicContact CZ-CE2 4.08Å; F52-F73 HydrophobicContact CZ-CZ 4.11Å; P56-F73 HydrophobicContact CB-CD1 4.41Å; P56-F73 HydrophobicContact CB-CE1 4.12Å; P56-F73 HydrophobicContact CB-CZ 4.24Å; P56-F73 HydrophobicContact CG-CE1 4.5Å; L71-F73 HydrophobicContact CB-CD2 4.44Å; L71-F73 HydrophobicContact CB-CE2 3.63Å; L71-F73 HydrophobicContact CB-CZ 4.13Å; L71-F73 HydrophobicContact CD1-CE2 4.38Å; L71-F73 HydrophobicContact CD1-CZ 4.28Å; F73-F75 PolarHBondContact O-N 3.38Å
74P45.6Very low45.1Very low43 Ų4375.5 Ų75.528%0.27939%0.389SS..SBendtrans-74.1-9179.820.5-18.9000114.6I57I57-P74 VanDerWaalsContact CD1-CA 3.49Å; I57-P74 HydrophobicContact CD1-CB 3.4Å; I57-P74 HydrophobicContact CD1-CG 4.01Å; I57-P74 HydrophobicContact CG1-CB 3.54Å; I57-P74 HydrophobicContact CG1-CG 3.52Å
75F51.2Low45Very low102 Ų10278.1 Ų78.145%0.44739%0.391SS..SBendtrans-144.1154.7-174.5-53.4-80000109.8R54 F73R54-F75 VanDerWaalsContact CD-CE2 3.5Å; F73-F75 PolarHBondContact O-N 3.38Å
76S49.5Very low44.8Very low26 Ų2672.6 Ų72.618%0.18237%0.369CS..  trans-64.4144.1171.271.90000110.6F17F17-S76 PolarHBondContact N-OG 3.15Å; F17-S76 WeakPolarHBondContact O-CB 3.39Å; F17-S76 PolarHBondContact O-OG 3.44Å
77P48.8Very low44.6Very low15 Ų1574.3 Ų74.310%0.09739%0.387CS..  trans-60.4141.3164.127.6-33.4000108.9L21 F52 F79 L81L21-P77 HydrophobicContact CD2-CG 3.91Å; F52-P77 HydrophobicContact CE1-CB 4.32Å; P77-F79 HydrophobicContact CG-CE2 4.12Å; P77-F79 HydrophobicContact CG-CZ 4.38Å; P77-F79 WeakPolarHBondContact O-CD2 3.39Å; P77-F79 PolarHBondContact O-N 2.86Å; P77-L81 HydrophobicContact CB-CD2 3.6Å; P77-L81 HydrophobicContact CB-CG 4.16Å; P77-L81 HydrophobicContact CG-CD1 3.97Å; P77-L81 HydrophobicContact CG-CD2 3.89Å; P77-L81 HydrophobicContact CG-CG 4Å
78R43.2Very low44.4Very low212 Ų21274.8 Ų74.880%0.839%0.393SS*.  trans-65.5110.6165.3-74.4-173.2174.5-179.7-1.6107.7
79F43.3Very low43.9Very low105 Ų10574 Ų7446%0.46139%0.392SS..SBendtrans-70.4155.7175.6-80.6-88000111.7F17 P77 L81F17-F79 HydrophobicContact CD2-CD2 4.17Å; F17-F79 HydrophobicContact CD2-CE2 4.05Å; F17-F79 HydrophobicContact CE2-CD2 4.38Å; F17-F79 HydrophobicContact CE2-CE2 4.31Å; P77-F79 HydrophobicContact CG-CE2 4.12Å; P77-F79 HydrophobicContact CG-CZ 4.38Å; P77-F79 WeakPolarHBondContact O-CD2 3.39Å; P77-F79 PolarHBondContact O-N 2.86Å; F79-L81 HydrophobicContact CD1-CG 4.31Å; F79-L81 HydrophobicContact CE1-CB 4.49Å; F79-L81 HydrophobicContact CE1-CD1 3.96Å; F79-L81 HydrophobicContact CE1-CG 4.09Å; F79-L81 HydrophobicContact CZ-CD1 4.24Å
80P46.5Very low43.5Very low121 Ų12177.6 Ų77.679%0.78641%0.406SS*.PPolyproline II helixcis-81.6129.43.130.7-31.3000112.2
81L44.3Very low42.9Very low38 Ų3878 Ų7820%0.19941%0.406CS..PPolyproline II helixtrans-57.5127.8163-73.4171.6000107.4P77 F79 I83P77-L81 HydrophobicContact CB-CD2 3.6Å; P77-L81 HydrophobicContact CB-CG 4.16Å; P77-L81 HydrophobicContact CG-CD1 3.97Å; P77-L81 HydrophobicContact CG-CD2 3.89Å; P77-L81 HydrophobicContact CG-CG 4Å; F79-L81 HydrophobicContact CD1-CG 4.31Å; F79-L81 HydrophobicContact CE1-CB 4.49Å; F79-L81 HydrophobicContact CE1-CD1 3.96Å; F79-L81 HydrophobicContact CE1-CG 4.09Å; F79-L81 HydrophobicContact CZ-CD1 4.24Å; L81-I83 PolarHBondContact O-N 2.91Å
82P39.2Very low42.1Very low79 Ų7981.2 Ų81.251%0.51343%0.427SS..  trans-59.7113.6172.422.5-29.3000107.6V84P82-V84 HydrophobicContact CB-CG2 4.39Å; P82-V84 PolarHBondContact O-N 3.38Å
83I39.7Very low41.3Very low135 Ų13586 Ų8669%0.69245%0.451SS*.  trans-70.586.2170.6-58.9174.1000105.8L81 R85L81-I83 PolarHBondContact O-N 2.91Å; I83-R85 PolarHBondContact O-N 2.85Å
84V33.3Very low40.3Very low62 Ų6287.5 Ų87.538%0.37647%0.465SS..  trans-76107.7167.2-174.40000105.6P82 S86P82-V84 HydrophobicContact CB-CG2 4.39Å; P82-V84 PolarHBondContact O-N 3.38Å; V84-S86 PolarHBondContact O-N 3.33Å
85R33.5Very low39.6Very low243 Ų24393.3 Ų93.392%0.91748%0.482SS*.  trans-62.486.2170.1-80.3-177.4172.2-177.8-1.9108.4I83I83-R85 PolarHBondContact O-N 2.85Å
86S34.4Very low38.8Very low33 Ų3392.5 Ų92.523%0.23148%0.482CS..  trans-112.1138.116181.70000108.6S48 V84 N88 F89S48-S86 VanDerWaalsContact OG-CB 3.24Å; S48-S86 WeakPolarHBondContact OG-CB 3.24Å; S48-S86 PolarHBondContact OG-OG 2.75Å; V84-S86 PolarHBondContact O-N 3.33Å; S86-N88 VanDerWaalsContact C-N 3.3Å; S86-N88 PolarHBondContact O-N 2.99Å; S86-F89 VanDerWaalsContact O-CD1 3.31Å; S86-F89 WeakPolarHBondContact O-CD1 3.49Å
87G34.2Very low37.7Very low76 Ų7693.5 Ų93.578%0.78449%0.491SS*.SBendtrans-73.512.1-149.800000118.7
88N34.8Very low36.7Very low112 Ų11298.4 Ų98.460%0.59952%0.523SS*.  trans-164.766.9176.8-80.9-51.3000112.9S86S86-N88 VanDerWaalsContact C-N 3.3Å; S86-N88 PolarHBondContact O-N 2.99Å
89F35.9Very low35.9Very low81 Ų8195.8 Ų95.836%0.35552%0.524SS..  trans-110.5144.5171.666-95.9000112.9S86 V91S86-F89 VanDerWaalsContact O-CD1 3.31Å; S86-F89 WeakPolarHBondContact O-CD1 3.49Å; F89-V91 HydrophobicContact CD2-CG2 3.85Å; F89-V91 HydrophobicContact CE2-CG2 4.28Å
90F39.1Very low35Very low83 Ų83102 Ų10236%0.36454%0.544SS..BIsolated β-bridgetrans-11898.4172.1-66.1-90.1000108L2 F24 S92L2-F90 HydrophobicContact CB-CD1 4.41Å; L2-F90 HydrophobicContact CB-CE1 3.74Å; L2-F90 HydrophobicContact CD2-CD1 3.46Å; L2-F90 VanDerWaalsContact CD2-CD1 3.46Å; L2-F90 HydrophobicContact CD2-CE1 3.55Å; L2-F90 HydrophobicContact CG-CE1 4.26Å; F24-F90 VanDerWaalsContact O-O 3.12Å; F90-S92 PolarHBondContact O-N 3.46Å
91V39.5Very low34.1Very low38 Ų38105.1 Ų105.123%0.2355%0.548CS..  trans-90.297168.7177.40000106.6L21 L23 F89L21-V91 HydrophobicContact CD1-CG1 4.4Å; L23-V91 HydrophobicContact CD2-CG1 4.24Å; L23-V91 HydrophobicContact CD2-CG2 4.09Å; F89-V91 HydrophobicContact CD2-CG2 3.85Å; F89-V91 HydrophobicContact CE2-CG2 4.28Å
92S36.4Very low33.6Very low66 Ų66108.5 Ų108.546%0.46258%0.575SS.*  trans-90.8110.8169.7-1670000108.4F90 A94F90-S92 PolarHBondContact O-N 3.46Å; S92-A94 PolarHBondContact O-N 3.02Å
93L37.5Very low33.5Very low130 Ų130109.5 Ų109.568%0.68158%0.584SS**  trans-69.495.8170.1-74.5163.6000108.2L21 Y95L21-L93 HydrophobicContact CD1-CD2 3.49Å; L21-L93 VanDerWaalsContact CD1-CD2 3.49Å; L93-Y95 PolarHBondContact O-N 2.91Å
94A36.9Very low33.5Very low37 Ų37108.8 Ų108.831%0.30659%0.588SS.*  trans-80.1115.3170.200000109.3V22 S92 I96V22-A94 HydrophobicContact CB-CB 4.13Å; V22-A94 HydrophobicContact CG2-CB 3.83Å; S92-A94 PolarHBondContact O-N 3.02Å; A94-I96 PolarHBondContact O-N 3.47Å
95Y31Very low34Very low165 Ų165111.7 Ų111.765%0.64761%0.606SS**  trans-70.5111165.8177.4-103.9000108.5F19 L93 A97F19-Y95 HydrophobicContact CD1-CD2 4.36Å; F19-Y95 HydrophobicContact CD1-CE2 4.2Å; F19-Y95 HydrophobicContact CE1-CE2 4.11Å; L93-Y95 PolarHBondContact O-N 2.91Å; Y95-A97 HydrophobicContact CD1-CB 4.1Å; Y95-A97 HydrophobicContact CE1-CB 3.5Å; Y95-A97 VanDerWaalsContact CE1-CB 3.5Å; Y95-A97 PolarHBondContact O-N 3.27Å
96I32.9Very low34.6Very low86 Ų86105.5 Ų105.544%0.44160%0.599SS.*  trans-90.699.7167.3-52.8178.6000106.6P20 V72 A94P20-I96 HydrophobicContact CB-CD1 4.14Å; P20-I96 HydrophobicContact CG-CB 3.73Å; P20-I96 HydrophobicContact CG-CD1 3.83Å; P20-I96 HydrophobicContact CG-CG1 3.89Å; V72-I96 HydrophobicContact CG1-CD1 4.16Å; A94-I96 PolarHBondContact O-N 3.47Å
97A28Very low35.1Very low46 Ų46112.5 Ų112.538%0.3863%0.629SS.*  trans-64.2137164.800000108.3Y95 I99Y95-A97 HydrophobicContact CD1-CB 4.1Å; Y95-A97 HydrophobicContact CE1-CB 3.5Å; Y95-A97 VanDerWaalsContact CE1-CB 3.5Å; Y95-A97 PolarHBondContact O-N 3.27Å; A97-I99 PolarHBondContact O-N 3.05Å
98P26.5Very low35.8Very low118 Ų118113.6 Ų113.677%0.76662%0.624SS**  trans-59.9115.3167.823-29.6000108.8R100P98-R100 PolarHBondContact O-N 2.95Å
99I26.3Very low36.4Very low158 Ų158113.1 Ų113.181%0.8163%0.63SS**  trans-67.4120.2168.4-61.5173000106A97 Q101A97-I99 PolarHBondContact O-N 3.05Å; I99-Q101 PolarHBondContact O-N 3.09Å; I99-Q101 VanDerWaalsContact O-N 3.09Å
100R26.2Very low37.4Very low235 Ų235114.9 Ų114.989%0.88765%0.652SS**  trans-60.6115.7164.6-74.9-172.5177.7-172.8-0.4106.3P98 S102P98-R100 PolarHBondContact O-N 2.95Å; R100-S102 PolarHBondContact O-N 3.3Å
101Q26.1Very low37.9Very low186 Ų186116.3 Ų116.387%0.86967%0.67SS**  trans-53.4112.2165.2-81.7178.1-47.900106.8I99 S103I99-Q101 PolarHBondContact O-N 3.09Å; I99-Q101 VanDerWaalsContact O-N 3.09Å; Q101-S103 PolarHBondContact O-N 2.84Å
102S35.4Very low38.4Very low110 Ų110122 Ų12277%0.76970%0.699SS**  trans-57.2123158.749.50000105.4R100R100-S102 PolarHBondContact O-N 3.3Å
103S36.5Very low39.6Very low100 Ų100123.7 Ų123.770%0.69971%0.711SS**  trans-40.1144.2174.5-52.40000110.6Q101 V105Q101-S103 PolarHBondContact O-N 2.84Å; S103-V105 PolarHBondContact O-N 2.98Å; S103-V105 VanDerWaalsContact O-N 3.14Å
104P40Very low40.7Very low119 Ų119128.1 Ų128.177%0.77372%0.719SS**  trans-50.1128.3179.420.9-31.3000108.9S106P104-S106 PolarHBondContact O-N 3.14Å
105V43.4Very low41.2Very low124 Ų124135.5 Ų135.575%0.75276%0.763SS**  trans-56.1112.5168.8176.60000105.4S103 E107S103-V105 PolarHBondContact O-N 2.98Å; S103-V105 VanDerWaalsContact O-N 3.14Å; V105-E107 HydrophobicContact CG1-CG 4.07Å; V105-E107 PolarHBondContact O-N 3.21Å
106S46Very low41.8Very low112 Ų112134.1 Ų134.178%0.78377%0.769SS**  trans-64.786.9164.1-650000107.2P104 S108P104-S106 PolarHBondContact O-N 3.14Å; S106-S108 PolarHBondContact O-N 3.28Å
107E44Very low42.2Very low181 Ų181136.6 Ų136.685%0.84679%0.786SS**  trans-71.375.5157.8-76.6-173.6163.700107.4V105 S109V105-E107 HydrophobicContact CG1-CG 4.07Å; V105-E107 PolarHBondContact O-N 3.21Å; E107-S109 VanDerWaalsContact C-N 3.31Å; E107-S109 PolarHBondContact O-N 2.95Å
108S49Very low43Very low99 Ų99141.6 Ų141.669%0.69281%0.809SS**  trans-88.982.7163690000108.1S106 S110S106-S108 PolarHBondContact O-N 3.28Å; S108-S110 PolarHBondContact O-N 3.09Å
109S48.7Very low44Very low102 Ų102143 Ų14371%0.71381%0.812SS**  trans23.197.7143.6580000116.2E107 P111E107-S109 VanDerWaalsContact C-N 3.31Å; E107-S109 PolarHBondContact O-N 2.95Å; S109-P111 WeakPolarHBondContact O-CD 3.44Å
110S55.5Low45.1Very low117 Ų117142.1 Ų142.182%0.81881%0.812SS**  trans-63123.3148.9-67.20000107.6S108 N112S108-S110 PolarHBondContact O-N 3.09Å; S110-N112 PolarHBondContact O-N 3.14Å; S110-N112 VanDerWaalsContact O-N 3.14Å
111P50.2Low46.4Very low114 Ų114135.9 Ų135.974%0.7481%0.807SS**  trans-69115173.627.3-29.1000107.9S109 S113S109-P111 WeakPolarHBondContact O-CD 3.44Å; P111-S113 PolarHBondContact O-N 3.47Å; P111-S113 VanDerWaalsContact O-N 3.09Å
112N50.5Low47.8Very low157 Ų157132.3 Ų132.384%0.8480%0.802SS**  trans-58.5109.5159.3-103.5-10.2000107.7S110S110-N112 PolarHBondContact O-N 3.14Å; S110-N112 VanDerWaalsContact O-N 3.14Å
113S61.1Low48.8Very low102 Ų102134 Ų13471%0.71381%0.805SS**  trans-121.299.5158.557.10000107.9P111P111-S113 PolarHBondContact O-N 3.47Å; P111-S113 VanDerWaalsContact O-N 3.09Å
114W59.7Low49.8Very low223 Ų223136.8 Ų136.885%0.84581%0.813SS**  trans-63.9147.4150.8-80.343.7000107.7
115P49.4Very low50.7Low192 Ų192138.5 Ų138.5100%1.24782%0.817SS**  cis-95.803535.2-35.5000116.7

Retrieved 115 of 115 residues in 118.4 ms (Link to these results)