A0A087Y9D3_POEFO Loading...

Serine/threonine/tyrosine interacting protein

AlphaFold DB , UniProt , Accession A0A087Y9D3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 224 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
1M42.1Very low69.1Low238 Ų238139.8 Ų139.8100%1.17270%0.697SS**  0790-76.2177.1-74.800107
2E48.4Very low70.8Confident199 Ų199133.2 Ų133.293%0.9367%0.665SS**  trans-137.718.5-179.5-78.2-175.5166.800111.4
3E51.6Low71.9Confident165 Ų165126.6 Ų126.677%0.77164%0.638SS**  trans-1032.5-172.3-118.9176.9178.100114.7
4E54.1Low71.9Confident185 Ų185124.9 Ų124.986%0.86465%0.652SS**SBendtrans-92.80.8-163.3-89.6-179.616600117.3
5N58.5Low71.4Confident110 Ų110120.1 Ų120.159%0.58863%0.631SS**  trans-13543.2-177.4-90.2-24.7000114.6
6K69.6Low70.5Confident155 Ų155124.1 Ų124.167%0.67464%0.642SS**PPolyproline II helixtrans-88130.1167.7-73.2179.1-177.1170.20110.1Q8K6-Q8 PolarHBondContact O-N 3.41Å
7L79.1Confident69.5Low54 Ų54128.1 Ų128.128%0.28366%0.657SS.*PPolyproline II helixtrans-52.9122.9170.7-78.3161.5000109.7F9 L176 L179 M183L7-F9 HydrophobicContact CB-CE2 3.88Å; L7-F9 HydrophobicContact CB-CZ 4.44Å; L7-L176 HydrophobicContact CD1-CD2 3.67Å; L7-L179 HydrophobicContact CD2-CB 3.45Å; L7-L179 VanDerWaalsContact CD2-CB 3.45Å; L7-L179 HydrophobicContact CD2-CD1 4.18Å; L7-L179 HydrophobicContact CD2-CG 4.41Å; L7-M183 HydrophobicContact CD2-SD 3.34Å; L7-M183 WeakPolarHBondContact CD2-SD 3.32Å; L7-M183 HydrophobicContact CG-SD 3.98Å
8Q84.1Confident68.8Low186 Ų186129.2 Ų129.287%0.86966%0.658SS**PPolyproline II helixtrans-101.9126.6174.2-66.4-169.7700109.5K6K6-Q8 PolarHBondContact O-N 3.41Å
9F90.5Very high68.2Low65 Ų65131.5 Ų131.529%0.28567%0.671SS.*  trans-110.3146.5174.1-67-84.6000109.9L7 F140 G141 Y175 L176 L179L7-F9 HydrophobicContact CB-CE2 3.88Å; L7-F9 HydrophobicContact CB-CZ 4.44Å; F9-F140 WeakPolarHBondContact CB-O 3.42Å; F9-G141 VanDerWaalsContact CG-CA 3.42Å; F9-Y175 HydrophobicContact CZ-CE2 4.31Å; F9-L176 HydrophobicContact CE2-CD2 4.4Å; F9-L176 HydrophobicContact CZ-CD2 3.95Å; F9-L179 HydrophobicContact CE1-CD1 3.75Å; F9-L179 HydrophobicContact CZ-CD1 3.83Å
10P91.5Very high67.9Low74 Ų74129.9 Ų129.948%0.48166%0.664SS.*PPolyproline II helixtrans-59.9147.1172.227-34.6000110.3T139 F140P10-T139 WeakPolarHBondContact CD-O 3.37Å; P10-T139 WeakPolarHBondContact CG-O 3.43Å; P10-F140 HydrophobicContact CB-CD1 4.44Å; P10-F140 HydrophobicContact CG-CD1 3.98Å; P10-F140 HydrophobicContact CG-CE1 4.22Å; P10-F140 WeakPolarHBondContact O-CD1 3.36Å
11S90.3Very high68.2Low107 Ų107131 Ų13175%0.74867%0.672SS**PPolyproline II helixtrans-69.4150.717060.10000110.4
12L89.9Confident69.9Low60 Ų60124.1 Ų124.131%0.31463%0.633SS.*PPolyproline II helixtrans-57.5139.5171.1-75.2167.2000110.3L136 F140 M142 Y150L12-L136 HydrophobicContact CD2-CD2 4.24Å; L12-F140 HydrophobicContact CD2-CB 4.21Å; L12-F140 HydrophobicContact CD2-CD1 3.88Å; L12-F140 HydrophobicContact CD2-CD2 3.92Å; L12-F140 HydrophobicContact CD2-CE1 4.22Å; L12-F140 HydrophobicContact CD2-CE2 4.26Å; L12-F140 HydrophobicContact CD2-CG 3.72Å; L12-F140 HydrophobicContact CD2-CZ 4.4Å; L12-F140 HydrophobicContact CG-CD1 4.33Å; L12-F140 HydrophobicContact CG-CG 4.41Å; L12-M142 HydrophobicContact CD1-CE 4Å; L12-M142 HydrophobicContact CD1-SD 4.04Å; L12-M142 HydrophobicContact CD2-SD 4.01Å; L12-M142 HydrophobicContact CG-SD 4.37Å; L12-Y150 HydrophobicContact CD1-CD2 3.87Å; L12-Y150 HydrophobicContact CD1-CE2 3.74Å; L12-Y150 HydrophobicContact CD2-CE2 4.26Å; L12-Y150 HydrophobicContact CG-CE2 4.49Å
13P85Confident71.7Confident48 Ų48116.9 Ų116.931%0.31261%0.607SS.*PPolyproline II helixtrans-58.7141.5173.6-2233.3000110.3T15 P35P13-T15 PolarHBondContact O-N 3.31Å; P13-P35 HydrophobicContact CB-CG 3.89Å; P13-P35 HydrophobicContact CG-CG 4.44Å
14A72Confident73.1Confident102 Ų102115.8 Ų115.884%0.84360%0.596SS**  trans-59113.5172.800000109
15T63.9Low74.8Confident54 Ų54111.1 Ų111.133%0.33158%0.582SS.*  trans-82.5140.1171.951.50000108.9P13 E17 Y150 R154P13-T15 PolarHBondContact O-N 3.31Å; T15-E17 PolarHBondContact O-N 3.31Å; T15-Y150 WeakPolarHBondContact CG2-OH 3.46Å; T15-R154 VanDerWaalsContact CG2-NH2 3.32Å; T15-R154 PolarHBondContact OG1-NH2 3.49Å; T15-R154 VanDerWaalsContact OG1-NH2 3.14Å
16K57.9Low76.4Confident184 Ų184108.1 Ų108.180%0.857%0.565SS**  trans-59.1114.8163.6-69.5-178.4177.3-178.20106.3E18K16-E18 PolarHBondContact O-N 3.01Å
17E53.8Low77.5Confident192 Ų192104.9 Ų104.990%0.89755%0.549SS*.  trans-67.667.9172.4-73.6177.4160.100108.9T15T15-E17 PolarHBondContact O-N 3.31Å
18E57.2Low78.3Confident147 Ų147110.2 Ų110.269%0.68757%0.565SS**  trans-88103.7159.5-74.6177.7-168.500105.1K16 L20K16-E18 PolarHBondContact O-N 3.01Å; E18-L20 PolarHBondContact O-N 2.96Å
19L56.3Low78.8Confident173 Ų173104.4 Ų104.491%0.90654%0.54SS*.  trans-54.396.7163.7-77.9163.8000106.8D21L19-D21 PolarHBondContact O-N 2.93Å; L19-D21 VanDerWaalsContact O-N 3.13Å
20L62.9Low79.2Confident99 Ų99102.3 Ų102.352%0.51853%0.531SS..  trans-70.2109.4176.1-83.8158.6000107E18 W22 M26E18-L20 PolarHBondContact O-N 2.96Å; L20-W22 PolarHBondContact O-N 3.2Å; L20-M26 HydrophobicContact CD2-CE 4.1Å
21D74.7Confident79.4Confident155 Ų15599.5 Ų99.583%0.82951%0.512SS*.  trans-6387.4165.6-84.6-16.6000108.3L19 A23L19-D21 PolarHBondContact O-N 2.93Å; L19-D21 VanDerWaalsContact O-N 3.13Å; D21-A23 PolarHBondContact O-N 3.5Å
22W77.5Confident79.8Confident93 Ų9398.2 Ų98.235%0.35249%0.494SS..  trans-63.8125.8-176.5-177.691.3000110L20 Y24 F156L20-W22 PolarHBondContact O-N 3.2Å; W22-Y24 VanDerWaalsContact CH2-CA 3.47Å; W22-Y24 AromaticContact CH2-CD2 3.77Å; W22-Y24 HydrophobicContact CH2-CD2 3.77Å; W22-Y24 HydrophobicContact CH2-CG 4.3Å; W22-F156 HydrophobicContact CD2-CB 3.98Å; W22-F156 HydrophobicContact CD2-CD1 4.39Å; W22-F156 HydrophobicContact CD2-CG 4.43Å; W22-F156 HydrophobicContact CE3-CD1 4.37Å; W22-F156 HydrophobicContact CG-CB 4.01Å; W22-F156 HydrophobicContact CH2-CD1 4.07Å; W22-F156 HydrophobicContact CZ2-CB 4.26Å; W22-F156 HydrophobicContact CZ2-CD1 4.16Å; W22-F156 HydrophobicContact CZ3-CD1 4.22Å
23A84.5Confident80.1Confident47 Ų4795.4 Ų95.439%0.38848%0.479SS..  trans-116.5138.4171.400000109.8D21 P25 M26D21-A23 PolarHBondContact O-N 3.5Å; A23-P25 VanDerWaalsContact C-N 3.25Å; A23-P25 WeakPolarHBondContact O-CD 3.3Å; A23-M26 HydrophobicContact CB-CG 4.39Å; A23-M26 HydrophobicContact CB-SD 4.28Å; A23-M26 PolarHBondContact N-SD 3.31Å; A23-M26 WeakPolarHBondContact O-CB 3.49Å; A23-M26 VanDerWaalsContact O-CG 3.32Å; A23-M26 WeakPolarHBondContact O-CG 3.34Å; A23-M26 PolarHBondContact O-N 3.28Å
24Y82.6Confident80.6Confident141 Ų14193.5 Ų93.555%0.55347%0.466SS*.G310 helixtrans-47-37.8-179.8-173.9-94.5000115.3W22 M26 R27W22-Y24 VanDerWaalsContact CH2-CA 3.47Å; W22-Y24 AromaticContact CH2-CD2 3.77Å; W22-Y24 HydrophobicContact CH2-CD2 3.77Å; W22-Y24 HydrophobicContact CH2-CG 4.3Å; Y24-M26 PolarHBondContact O-N 2.72Å; Y24-R27 VanDerWaalsContact CE1-NE 3.29Å; Y24-R27 VanDerWaalsContact CZ-NE 3.32Å; Y24-R27 WeakPolarHBondContact O-CB 3.4Å; Y24-R27 WeakPolarHBondContact O-CD 3.3Å; Y24-R27 VanDerWaalsContact O-CG 3.23Å; Y24-R27 WeakPolarHBondContact O-CG 3.46Å; Y24-R27 PolarHBondContact O-N 2.95Å; Y24-R27 PolarHBondContact OH-NE 3.44Å; Y24-R27 PolarHBondContact OH-NH1 3.03Å; Y24-R27 PolarHBondContact OH-NH2 3.13Å
25P90.1Very high81.7Confident88 Ų8892 Ų9257%0.57145%0.449SS*.G310 helixtrans-57.9-28.2175.1-2737.4000114.9A23 R27 R28A23-P25 VanDerWaalsContact C-N 3.25Å; A23-P25 WeakPolarHBondContact O-CD 3.3Å; P25-R27 PolarHBondContact O-N 3.37Å; P25-R27 VanDerWaalsContact O-N 3.07Å; P25-R28 WeakPolarHBondContact O-CB 3.48Å; P25-R28 PolarHBondContact O-N 3.24Å
26M90.4Very high83.3Confident46 Ų4689.7 Ų89.723%0.22744%0.435CS..G310 helixtrans-61.4-19.3-179.6-63172.168.900113L20 A23 Y24 R28 D29 Q31L20-M26 HydrophobicContact CD2-CE 4.1Å; A23-M26 HydrophobicContact CB-CG 4.39Å; A23-M26 HydrophobicContact CB-SD 4.28Å; A23-M26 PolarHBondContact N-SD 3.31Å; A23-M26 WeakPolarHBondContact O-CB 3.49Å; A23-M26 VanDerWaalsContact O-CG 3.32Å; A23-M26 WeakPolarHBondContact O-CG 3.34Å; A23-M26 PolarHBondContact O-N 3.28Å; Y24-M26 PolarHBondContact O-N 2.72Å; M26-R28 PolarHBondContact O-N 3.29Å; M26-D29 PolarHBondContact O-N 3.06Å; M26-Q31 PolarHBondContact O-NE2 3.23Å
27R94.3Very high85.2Confident88 Ų8881 Ų8133%0.33240%0.397SS..G310 helixtrans-56.1-22.817381.4-173.5-167.9120.5-4.4113.4Y24 P25 P41 R155Y24-R27 VanDerWaalsContact CE1-NE 3.29Å; Y24-R27 VanDerWaalsContact CZ-NE 3.32Å; Y24-R27 WeakPolarHBondContact O-CB 3.4Å; Y24-R27 WeakPolarHBondContact O-CD 3.3Å; Y24-R27 VanDerWaalsContact O-CG 3.23Å; Y24-R27 WeakPolarHBondContact O-CG 3.46Å; Y24-R27 PolarHBondContact O-N 2.95Å; Y24-R27 PolarHBondContact OH-NE 3.44Å; Y24-R27 PolarHBondContact OH-NH1 3.03Å; Y24-R27 PolarHBondContact OH-NH2 3.13Å; P25-R27 PolarHBondContact O-N 3.37Å; P25-R27 VanDerWaalsContact O-N 3.07Å; R27-P41 WeakPolarHBondContact O-CG 3.19Å; R27-R155 PolarHBondContact O-NH1 3.32Å; R27-R155 PolarHBondContact O-NH2 3.2Å
28R94.6Very high87.4Confident165 Ų16571.9 Ų71.962%0.62336%0.355SS*.G310 helixtrans-83.6-12.5179.8-66.3-176.5172.4172.5-0.8114.2P25 M26 P41 S43P25-R28 WeakPolarHBondContact O-CB 3.48Å; P25-R28 PolarHBondContact O-N 3.24Å; M26-R28 PolarHBondContact O-N 3.29Å; R28-P41 WeakPolarHBondContact O-CG 3.31Å; R28-S43 PolarHBondContact O-OG 3.2Å
29D96Very high89.4Confident65 Ų6564.9 Ų64.935%0.34832%0.322SS..SBendtrans-107.2167.8177.9-63.2-56.8000110.7M26 Q31 P41 K49 R155M26-D29 PolarHBondContact O-N 3.06Å; D29-Q31 PolarHBondContact O-NE2 3.37Å; D29-Q31 PolarHBondContact O-OE1 3.35Å; D29-P41 VanDerWaalsContact O-CD 3.28Å; D29-P41 WeakPolarHBondContact O-CD 3.39Å; D29-K49 IonicContact OD1-NZ 3.31Å; D29-K49 PolarHBondContact OD1-NZ 3.33Å; D29-R155 PolarHBondContact O-NH1 3.39Å
30M97.6Very high91.4Very high20 Ų2056.7 Ų56.710%0.09928%0.279CS..  trans-86.1148.4171.167.1-172.9-169.100110.4F38 L39 A44 T52 L53 H56 I58 L118M30-F38 HydrophobicContact CB-CB 4.46Å; M30-F38 HydrophobicContact CE-CD1 4Å; M30-F38 HydrophobicContact CE-CE1 4.25Å; M30-F38 HydrophobicContact CG-CD1 4.02Å; M30-F38 HydrophobicContact SD-CB 4.29Å; M30-F38 HydrophobicContact SD-CD1 4.14Å; M30-F38 HydrophobicContact SD-CG 4.39Å; M30-L39 CarbonylContact C-O 3.56Å; M30-L39 VanDerWaalsContact CA-O 3.29Å; M30-L39 WeakPolarHBondContact CA-O 3.34Å; M30-A44 HydrophobicContact CB-CB 3.97Å; M30-A44 HydrophobicContact CG-CB 4.47Å; M30-T52 HydrophobicContact CE-CG2 4.23Å; M30-L53 HydrophobicContact CE-CD2 4.39Å; M30-L53 HydrophobicContact SD-CD2 4.08Å; M30-H56 HydrophobicContact CE-CB 3.74Å; M30-H56 WeakPolarHBondContact CE-CD2 3.36Å; M30-I58 HydrophobicContact CE-CD1 4.33Å; M30-I58 HydrophobicContact CE-CG1 4.09Å; M30-L118 HydrophobicContact CB-CD1 3.77Å; M30-L118 HydrophobicContact CG-CD1 4.47Å; M30-L118 HydrophobicContact SD-CD1 3.93Å; M30-L118 HydrophobicContact SD-CD2 4.04Å; M30-L118 HydrophobicContact SD-CG 4.42Å
31Q96.9Very high93.1Very high15 Ų1552.3 Ų52.37%0.0726%0.256CS..EExtended strand (participates in β ladder)trans-120.7143173.6-69.576.447.400109.8M26 D29 I33 F38 L39 R154M26-Q31 PolarHBondContact O-NE2 3.23Å; D29-Q31 PolarHBondContact O-NE2 3.37Å; D29-Q31 PolarHBondContact O-OE1 3.35Å; Q31-I33 PolarHBondContact O-N 2.99Å; Q31-F38 CarbonylContact O-C 3.58Å; Q31-F38 VanDerWaalsContact O-CA 3.26Å; Q31-F38 WeakPolarHBondContact O-CA 3.43Å; Q31-L39 PolarHBondContact N-O 3.47Å; Q31-L39 PolarHBondContact O-N 3.08Å; Q31-R154 WeakPolarHBondContact CG-O 3.2Å
32E97Very high94.2Very high81 Ų8148.3 Ų48.338%0.37923%0.23SC..EExtended strand (participates in β ladder)trans-73.7121.2171.4-163.8160.7-155.700108.6L34 P35 G36 F38E32-L34 WeakPolarHBondContact CG-O 3.36Å; E32-P35 WeakPolarHBondContact OE1-CA 3.23Å; E32-G36 PolarHBondContact OE1-N 2.91Å; E32-F38 HydrophobicContact CB-CD1 3.92Å; E32-F38 HydrophobicContact CB-CE1 3.52Å; E32-F38 HydrophobicContact CB-CE2 4.39Å; E32-F38 HydrophobicContact CB-CZ 3.77Å; E32-F38 VanDerWaalsContact CD-CZ 3.41Å; E32-F38 HydrophobicContact CG-CD1 4.45Å; E32-F38 HydrophobicContact CG-CD2 4.45Å; E32-F38 HydrophobicContact CG-CE1 3.98Å; E32-F38 HydrophobicContact CG-CE2 3.93Å; E32-F38 HydrophobicContact CG-CZ 3.67Å
33I96.9Very high95.1Very high1 Ų145.2 Ų45.21%0.00522%0.223CC..EExtended strand (participates in β ladder)trans-90.2-45.3-179.8-58.9-52.3000109.7Q31 L37 L39 V132 L136 Y150 V151 R154 R155Q31-I33 PolarHBondContact O-N 2.99Å; I33-L37 PolarHBondContact N-O 3.23Å; I33-L39 HydrophobicContact CD1-CB 4Å; I33-L39 HydrophobicContact CD1-CD2 4.48Å; I33-L39 HydrophobicContact CG1-CB 3.65Å; I33-V132 HydrophobicContact CB-CG1 4.41Å; I33-V132 HydrophobicContact CG1-CG1 4.28Å; I33-V132 HydrophobicContact CG2-CG1 3.95Å; I33-L136 HydrophobicContact CG2-CD1 4.13Å; I33-Y150 HydrophobicContact CG2-CD1 4.3Å; I33-Y150 HydrophobicContact CG2-CE1 4.09Å; I33-Y150 VanDerWaalsContact O-CE1 3.24Å; I33-Y150 WeakPolarHBondContact O-CE1 3.26Å; I33-Y150 PolarHBondContact O-OH 3.34Å; I33-V151 HydrophobicContact CD1-CG1 3.96Å; I33-V151 HydrophobicContact CG1-CG1 4.44Å; I33-V151 HydrophobicContact CG2-CG1 4.45Å; I33-V151 HydrophobicContact CG2-CG2 3.95Å; I33-R154 HydrophobicContact CD1-CB 3.81Å; I33-R154 WeakPolarHBondContact O-CD 3.42Å; I33-R154 PolarHBondContact O-NE 3.06Å; I33-R155 HydrophobicContact CD1-CB 4.36Å
34L94.8Very high95.8Very high7 Ų743.2 Ų43.24%0.03721%0.206CC..EExtended strand (participates in β ladder)trans-140.4163.6169.157.980.4000107.9E32 G36 L37 L111 Y135 L136 F140E32-L34 WeakPolarHBondContact CG-O 3.36Å; L34-G36 PolarHBondContact O-N 2.87Å; L34-L37 HydrophobicContact CD1-CB 3.38Å; L34-L37 HydrophobicContact CD1-CD2 4.23Å; L34-L37 HydrophobicContact CD1-CG 4.44Å; L34-L37 HydrophobicContact CD2-CB 4.44Å; L34-L37 HydrophobicContact CD2-CD2 3.82Å; L34-L37 HydrophobicContact CG-CB 3.66Å; L34-L37 HydrophobicContact CG-CD2 3.88Å; L34-L37 HydrophobicContact CG-CG 4.32Å; L34-L37 PolarHBondContact N-O 3.17Å; L34-L37 PolarHBondContact O-N 3.43Å; L34-L111 HydrophobicContact CD1-CD1 4.18Å; L34-Y135 HydrophobicContact CD2-CD1 4.31Å; L34-Y135 HydrophobicContact CD2-CE1 3.8Å; L34-L136 HydrophobicContact CD2-CD2 3.67Å; L34-F140 HydrophobicContact CD2-CE2 3.81Å; L34-F140 HydrophobicContact CD2-CZ 4.24Å
35P96.2Very high96.5Very high72 Ų7236.6 Ų36.647%0.46818%0.18SC..THydrogen-bonded Turntrans-48.2111.2179.3-30.237.2000112.3P13 E32P13-P35 HydrophobicContact CB-CG 3.89Å; P13-P35 HydrophobicContact CG-CG 4.44Å; E32-P35 WeakPolarHBondContact OE1-CA 3.23Å
36G97.4Very high96.9Very high5 Ų536.1 Ų36.15%0.05217%0.172CC..THydrogen-bonded Turntrans87.1-3.6179.800000117.5E32 L34 K116 V117E32-G36 PolarHBondContact OE1-N 2.91Å; L34-G36 PolarHBondContact O-N 2.87Å; G36-K116 CarbonylContact O-C 3.52Å; G36-K116 WeakPolarHBondContact O-CA 3.49Å; G36-K116 WeakPolarHBondContact O-CB 3.21Å; G36-V117 PolarHBondContact O-N 3.29Å
37L98.6Very high97.2Very high0 Ų041 Ų410%019%0.192CC..EExtended strand (participates in β ladder)trans-114.7118.9174.7173.364.3000110.6I33 L34 I107 V117 V119 V132 Y135I33-L37 PolarHBondContact N-O 3.23Å; L34-L37 HydrophobicContact CD1-CB 3.38Å; L34-L37 HydrophobicContact CD1-CD2 4.23Å; L34-L37 HydrophobicContact CD1-CG 4.44Å; L34-L37 HydrophobicContact CD2-CB 4.44Å; L34-L37 HydrophobicContact CD2-CD2 3.82Å; L34-L37 HydrophobicContact CG-CB 3.66Å; L34-L37 HydrophobicContact CG-CD2 3.88Å; L34-L37 HydrophobicContact CG-CG 4.32Å; L34-L37 PolarHBondContact N-O 3.17Å; L34-L37 PolarHBondContact O-N 3.43Å; L37-I107 HydrophobicContact CD1-CD1 4.07Å; L37-I107 HydrophobicContact CD1-CG1 4.38Å; L37-I107 HydrophobicContact CD1-CG2 4.38Å; L37-V117 HydrophobicContact CB-CG1 4.33Å; L37-V117 HydrophobicContact CD1-CG1 3.59Å; L37-V119 HydrophobicContact CD1-CG2 3.74Å; L37-V132 HydrophobicContact CD2-CG1 4.14Å; L37-Y135 HydrophobicContact CD2-CD1 3.66Å; L37-Y135 HydrophobicContact CD2-CE1 3.96Å
38F98.8Very high97.3Very high2 Ų241.3 Ų41.31%0.00921%0.207CC..EExtended strand (participates in β ladder)trans-112.1145.1-178-67.6-104.3000111.2M30 Q31 E32 H56 I58 K116 V117 L118 V119M30-F38 HydrophobicContact CB-CB 4.46Å; M30-F38 HydrophobicContact CE-CD1 4Å; M30-F38 HydrophobicContact CE-CE1 4.25Å; M30-F38 HydrophobicContact CG-CD1 4.02Å; M30-F38 HydrophobicContact SD-CB 4.29Å; M30-F38 HydrophobicContact SD-CD1 4.14Å; M30-F38 HydrophobicContact SD-CG 4.39Å; Q31-F38 CarbonylContact O-C 3.58Å; Q31-F38 VanDerWaalsContact O-CA 3.26Å; Q31-F38 WeakPolarHBondContact O-CA 3.43Å; E32-F38 HydrophobicContact CB-CD1 3.92Å; E32-F38 HydrophobicContact CB-CE1 3.52Å; E32-F38 HydrophobicContact CB-CE2 4.39Å; E32-F38 HydrophobicContact CB-CZ 3.77Å; E32-F38 VanDerWaalsContact CD-CZ 3.41Å; E32-F38 HydrophobicContact CG-CD1 4.45Å; E32-F38 HydrophobicContact CG-CD2 4.45Å; E32-F38 HydrophobicContact CG-CE1 3.98Å; E32-F38 HydrophobicContact CG-CE2 3.93Å; E32-F38 HydrophobicContact CG-CZ 3.67Å; F38-H56 HydrophobicContact CE1-CB 4.38Å; F38-H56 AromaticContact CE1-ND1 3.72Å; F38-H56 HydrophobicContact CZ-CB 4.17Å; F38-H56 AromaticContact CZ-ND1 3.84Å; F38-I58 HydrophobicContact CB-CD1 4.48Å; F38-I58 HydrophobicContact CD2-CD1 3.56Å; F38-I58 HydrophobicContact CE2-CD1 3.96Å; F38-I58 HydrophobicContact CG-CD1 4.03Å; F38-K116 HydrophobicContact CE2-CB 4.41Å; F38-K116 HydrophobicContact CE2-CD 4.25Å; F38-V117 PolarHBondContact N-O 2.71Å; F38-L118 HydrophobicContact CB-CB 4.45Å; F38-L118 HydrophobicContact CB-CD1 3.95Å; F38-V119 PolarHBondContact O-N 2.98Å
39L98.9Very high97.5Very high0 Ų035.9 Ų35.90%019%0.188CC..EExtended strand (participates in β ladder)trans-121.9132.8172.8175.960.1000109.8M30 Q31 I33 V119 S128 A129 V132 V151 I158M30-L39 CarbonylContact C-O 3.56Å; M30-L39 VanDerWaalsContact CA-O 3.29Å; M30-L39 WeakPolarHBondContact CA-O 3.34Å; Q31-L39 PolarHBondContact N-O 3.47Å; Q31-L39 PolarHBondContact O-N 3.08Å; I33-L39 HydrophobicContact CD1-CB 4Å; I33-L39 HydrophobicContact CD1-CD2 4.48Å; I33-L39 HydrophobicContact CG1-CB 3.65Å; L39-V119 WeakPolarHBondContact CA-O 2.98Å; L39-S128 WeakPolarHBondContact CD1-OG 3.34Å; L39-A129 HydrophobicContact CD2-CB 4.04Å; L39-V132 HydrophobicContact CB-CG2 4.41Å; L39-V132 HydrophobicContact CD1-CG2 4.19Å; L39-V151 HydrophobicContact CD2-CG1 3.72Å; L39-I158 HydrophobicContact CD2-CG2 3.78Å
40G98.5Very high97.6Very high0 Ų034.6 Ų34.60%018%0.181CC..EExtended strand (participates in β ladder)trans-159.4176.9179.700000115.8V119 H120 G121 G124G40-V119 PolarHBondContact N-O 3.17Å; G40-V119 VanDerWaalsContact N-O 3.11Å; G40-H120 VanDerWaalsContact O-CA 3.24Å; G40-H120 WeakPolarHBondContact O-CA 3.24Å; G40-H120 VanDerWaalsContact O-CB 3.3Å; G40-H120 WeakPolarHBondContact O-CB 3.3Å; G40-G121 PolarHBondContact O-N 2.7Å; G40-G124 WeakPolarHBondContact O-CA 3.28Å
41P98.5Very high97.6Very high7 Ų737.1 Ų37.15%0.04520%0.199CC..  trans-80.6169.5169.736.4-37000111.5R27 R28 D29 S43 A44 G121 N122R27-P41 WeakPolarHBondContact O-CG 3.19Å; R28-P41 WeakPolarHBondContact O-CG 3.31Å; D29-P41 VanDerWaalsContact O-CD 3.28Å; D29-P41 WeakPolarHBondContact O-CD 3.39Å; P41-S43 WeakPolarHBondContact CG-OG 3.22Å; P41-S43 PolarHBondContact O-N 3.09Å; P41-S43 VanDerWaalsContact O-N 3.14Å; P41-A44 HydrophobicContact CG-CB 4.44Å; P41-A44 WeakPolarHBondContact O-CB 3.21Å; P41-A44 PolarHBondContact O-N 3.17Å; P41-G121 CarbonylContact C-O 3.09Å; P41-N122 CarbonylContact C-O 3.54Å; P41-N122 VanDerWaalsContact CA-O 3.28Å; P41-N122 WeakPolarHBondContact CA-O 3.32Å; P41-N122 VanDerWaalsContact CB-O 3.32Å; P41-N122 WeakPolarHBondContact CB-O 3.19Å
42Y98.1Very high97.7Very high72 Ų7238.1 Ų38.128%0.28221%0.206SC..G310 helixtrans-59.4-29.4176.384.4-88.6000112.1A44 A45 M46 F72 I73 G121 N122Y42-A44 PolarHBondContact O-N 3.02Å; Y42-A45 PolarHBondContact O-N 3.13Å; Y42-M46 HydrophobicContact CD2-CG 4.28Å; Y42-M46 HydrophobicContact CD2-SD 4.44Å; Y42-M46 HydrophobicContact CE2-CG 4.32Å; Y42-M46 HydrophobicContact CE2-SD 3.91Å; Y42-M46 PolarHBondContact O-N 3.12Å; Y42-F72 HydrophobicContact CE2-CD2 4.44Å; Y42-I73 HydrophobicContact CD2-CG1 4.48Å; Y42-I73 HydrophobicContact CG-CD1 4.45Å; Y42-I73 HydrophobicContact CG-CG1 4.08Å; Y42-G121 WeakPolarHBondContact CA-O 3.48Å; Y42-G121 WeakPolarHBondContact CB-O 3.49Å; Y42-G121 PolarHBondContact N-O 3.44Å; Y42-N122 WeakPolarHBondContact CD1-O 3.1Å; Y42-N122 PolarHBondContact N-O 2.91Å
43S97.6Very high97.7Very high28 Ų2834.3 Ų34.320%0.19619%0.188CC..G310 helixtrans-61.5-23.9178570000113.1R28 P41 A45 K49R28-S43 PolarHBondContact O-OG 3.2Å; P41-S43 WeakPolarHBondContact CG-OG 3.22Å; P41-S43 PolarHBondContact O-N 3.09Å; P41-S43 VanDerWaalsContact O-N 3.14Å; S43-A45 VanDerWaalsContact C-N 3.27Å; S43-A45 PolarHBondContact O-N 3.14Å; S43-K49 VanDerWaalsContact O-CG 3.25Å; S43-K49 WeakPolarHBondContact O-CG 3.22Å
44A97.8Very high97.8Very high4 Ų438.5 Ų38.53%0.03321%0.208CC..G310 helixtrans-74.5-16.2175.100000113.2M30 P41 Y42 K49M30-A44 HydrophobicContact CB-CB 3.97Å; M30-A44 HydrophobicContact CG-CB 4.47Å; P41-A44 HydrophobicContact CG-CB 4.44Å; P41-A44 WeakPolarHBondContact O-CB 3.21Å; P41-A44 PolarHBondContact O-N 3.17Å; Y42-A44 PolarHBondContact O-N 3.02Å; A44-K49 VanDerWaalsContact O-CB 3.28Å; A44-K49 WeakPolarHBondContact O-CB 3.4Å
45A97.8Very high97.9Very high2 Ų246.8 Ų46.82%0.01724%0.239CC..G310 helixtrans-110.913.1179.700000113.3Y42 S43 N76 L118Y42-A45 PolarHBondContact O-N 3.13Å; S43-A45 VanDerWaalsContact C-N 3.27Å; S43-A45 PolarHBondContact O-N 3.14Å; A45-N76 PolarHBondContact O-ND2 3.15Å; A45-L118 HydrophobicContact CB-CD2 4.18Å
46M97.6Very high98Very high78 Ų7846.7 Ų46.738%0.38423%0.232SC..SBendtrans-71.7159.9175.7-71.7-177.483.900112.1Y42 S48 K49 F77Y42-M46 HydrophobicContact CD2-CG 4.28Å; Y42-M46 HydrophobicContact CD2-SD 4.44Å; Y42-M46 HydrophobicContact CE2-CG 4.32Å; Y42-M46 HydrophobicContact CE2-SD 3.91Å; Y42-M46 PolarHBondContact O-N 3.12Å; M46-S48 PolarHBondContact O-N 3.4Å; M46-S48 VanDerWaalsContact O-N 3.13Å; M46-K49 WeakPolarHBondContact O-CB 3.35Å; M46-K49 PolarHBondContact O-N 2.93Å; M46-F77 WeakPolarHBondContact O-CZ 3.4Å
47K97.2Very high98.1Very high150 Ų15048 Ų4865%0.65225%0.245SC*.G310 helixtrans-49.3-41.3178.8-70.3-172.3178.6-176.50113.8K49 L50 N76 F77K47-K49 PolarHBondContact O-N 2.88Å; K47-L50 PolarHBondContact O-N 3.37Å; K47-N76 HydrophobicContact CG-CB 4.06Å; K47-F77 VanDerWaalsContact CA-CZ 3.44Å
48S97.1Very high98.1Very high93 Ų9348.3 Ų48.365%0.6525%0.247SC*.G310 helixtrans-66.4-15.7178.854.40000114.3M46M46-S48 PolarHBondContact O-N 3.4Å; M46-S48 VanDerWaalsContact O-N 3.13Å
49K97.9Very high98.1Very high52 Ų5250.8 Ų50.823%0.22626%0.262CS..G310 helixtrans-94.73.8-179.8-65-69.5-175.1164.80113.7D29 S43 A44 M46 K47 P51 T52 L53D29-K49 IonicContact OD1-NZ 3.31Å; D29-K49 PolarHBondContact OD1-NZ 3.33Å; S43-K49 VanDerWaalsContact O-CG 3.25Å; S43-K49 WeakPolarHBondContact O-CG 3.22Å; A44-K49 VanDerWaalsContact O-CB 3.28Å; A44-K49 WeakPolarHBondContact O-CB 3.4Å; M46-K49 WeakPolarHBondContact O-CB 3.35Å; M46-K49 PolarHBondContact O-N 2.93Å; K47-K49 PolarHBondContact O-N 2.88Å; K49-P51 VanDerWaalsContact C-CD 3.47Å; K49-P51 VanDerWaalsContact C-N 3.33Å; K49-T52 WeakPolarHBondContact O-CA 3.43Å; K49-T52 WeakPolarHBondContact O-CB 3.49Å; K49-T52 PolarHBondContact O-N 2.75Å; K49-L53 WeakPolarHBondContact O-CG 3.36Å; K49-L53 PolarHBondContact O-N 3.3Å
50L98.2Very high98.1Very high37 Ų3751.3 Ų51.319%0.19427%0.265CS..Hα-helixtrans-49.1-47.9175.6-177.560.3000113K47 T52 L53 E54 F77 F81K47-L50 PolarHBondContact O-N 3.37Å; L50-T52 VanDerWaalsContact C-N 3.26Å; L50-T52 PolarHBondContact O-N 3.1Å; L50-L53 PolarHBondContact O-N 3.36Å; L50-E54 HydrophobicContact CD1-CG 4.02Å; L50-E54 HydrophobicContact CG-CG 4.41Å; L50-E54 WeakPolarHBondContact O-CG 3.37Å; L50-E54 PolarHBondContact O-N 2.77Å; L50-F77 HydrophobicContact CB-CE1 3.63Å; L50-F77 HydrophobicContact CB-CZ 3.65Å; L50-F77 HydrophobicContact CD1-CD1 3.94Å; L50-F77 HydrophobicContact CD1-CE1 3.89Å; L50-F77 HydrophobicContact CD1-CG 4.3Å; L50-F77 HydrophobicContact CD1-CZ 4.19Å; L50-F77 HydrophobicContact CD2-CD1 4.34Å; L50-F77 HydrophobicContact CD2-CE1 4.04Å; L50-F77 HydrophobicContact CG-CE1 4.06Å; L50-F77 HydrophobicContact CG-CZ 4.43Å; L50-F81 HydrophobicContact CD1-CE2 4Å; L50-F81 HydrophobicContact CD1-CZ 3.85Å
51P98.3Very high98.1Very high73 Ų7351.3 Ų51.347%0.47427%0.265SS..Hα-helixtrans-62.9-32.7179.4-22.134.9000113.1K49 R55K49-P51 VanDerWaalsContact C-CD 3.47Å; K49-P51 VanDerWaalsContact C-N 3.33Å; P51-R55 WeakPolarHBondContact O-CB 3.43Å; P51-R55 PolarHBondContact O-N 3.32Å
52T98Very high98.1Very high37 Ų3751 Ų5123%0.22726%0.262CS..Hα-helixtrans-70.6-44.3176.6-61.10000111M30 K49 L50 R55 H56M30-T52 HydrophobicContact CE-CG2 4.23Å; K49-T52 WeakPolarHBondContact O-CA 3.43Å; K49-T52 WeakPolarHBondContact O-CB 3.49Å; K49-T52 PolarHBondContact O-N 2.75Å; L50-T52 VanDerWaalsContact C-N 3.26Å; L50-T52 PolarHBondContact O-N 3.1Å; T52-R55 PolarHBondContact O-N 3.34Å; T52-H56 PolarHBondContact O-CD2 2.53Å; T52-H56 VanDerWaalsContact O-CD2 3.25Å; T52-H56 PolarHBondContact O-N 2.89Å
53L98.6Very high98.1Very high0 Ų047.6 Ų47.60%025%0.249CC..Hα-helixtrans-60.3-46.2176.9-65.8170.3000111.1M30 K49 L50 H56 G57 I58 I61 F77 F81 L118M30-L53 HydrophobicContact CE-CD2 4.39Å; M30-L53 HydrophobicContact SD-CD2 4.08Å; K49-L53 WeakPolarHBondContact O-CG 3.36Å; K49-L53 PolarHBondContact O-N 3.3Å; L50-L53 PolarHBondContact O-N 3.36Å; L53-H56 PolarHBondContact O-N 2.94Å; L53-G57 PolarHBondContact O-N 3.41Å; L53-G57 VanDerWaalsContact O-N 3.17Å; L53-I58 HydrophobicContact CB-CB 4.27Å; L53-I58 HydrophobicContact CB-CG1 4.41Å; L53-I58 HydrophobicContact CD2-CB 4.27Å; L53-I58 HydrophobicContact CD2-CG1 3.95Å; L53-I58 HydrophobicContact CD2-CG2 4.32Å; L53-I58 PolarHBondContact O-N 3.5Å; L53-I61 HydrophobicContact CD1-CD1 4.3Å; L53-F77 HydrophobicContact CD1-CD2 4.13Å; L53-F77 HydrophobicContact CD1-CE2 3.66Å; L53-F77 HydrophobicContact CD1-CZ 4.48Å; L53-F81 HydrophobicContact CB-CE1 4.46Å; L53-F81 HydrophobicContact CB-CE2 4.29Å; L53-F81 HydrophobicContact CB-CZ 3.74Å; L53-F81 HydrophobicContact CD1-CE2 3.71Å; L53-F81 HydrophobicContact CD1-CZ 4.05Å; L53-L118 HydrophobicContact CD2-CD2 3.77Å
54E97.9Very high98.2Very high89 Ų8946.2 Ų46.242%0.41624%0.24SC..Hα-helixtrans-65.6-42.7177.7-70.4178.1158.100111.8L50 H56 G57 R80L50-E54 HydrophobicContact CD1-CG 4.02Å; L50-E54 HydrophobicContact CG-CG 4.41Å; L50-E54 WeakPolarHBondContact O-CG 3.37Å; L50-E54 PolarHBondContact O-N 2.77Å; E54-H56 VanDerWaalsContact C-N 3.29Å; E54-H56 PolarHBondContact O-N 3.34Å; E54-G57 PolarHBondContact O-N 3.06Å; E54-R80 IonicContact OE1-CZ 3.86Å; E54-R80 IonicContact OE1-NH1 2.78Å; E54-R80 PolarHBondContact OE1-NH1 3.18Å
55R98Very high98.2Very high182 Ų18247.6 Ų47.669%0.68724%0.244SC*.Hα-helixtrans-58.9-40.2176.5-174.2-169.5-581292.4112.4P51 T52 G57P51-R55 WeakPolarHBondContact O-CB 3.43Å; P51-R55 PolarHBondContact O-N 3.32Å; T52-R55 PolarHBondContact O-N 3.34Å; R55-G57 PolarHBondContact O-N 3.46Å
56H97.9Very high98.1Very high69 Ų6950.3 Ų50.332%0.31926%0.256SS..Hα-helixtrans-77.2-12.3177.4-78.6-73.5000113.1M30 F38 T52 L53 E54 I58 K116M30-H56 HydrophobicContact CE-CB 3.74Å; M30-H56 WeakPolarHBondContact CE-CD2 3.36Å; F38-H56 HydrophobicContact CE1-CB 4.38Å; F38-H56 AromaticContact CE1-ND1 3.72Å; F38-H56 HydrophobicContact CZ-CB 4.17Å; F38-H56 AromaticContact CZ-ND1 3.84Å; T52-H56 PolarHBondContact O-CD2 2.53Å; T52-H56 VanDerWaalsContact O-CD2 3.25Å; T52-H56 PolarHBondContact O-N 2.89Å; L53-H56 PolarHBondContact O-N 2.94Å; E54-H56 VanDerWaalsContact C-N 3.29Å; E54-H56 PolarHBondContact O-N 3.34Å; H56-I58 HydrophobicContact CB-CD1 4.49Å; H56-I58 HydrophobicContact CB-CG1 4.26Å; H56-K116 WeakPolarHBondContact O-CD 3.44Å; H56-K116 PolarHBondContact O-NZ 2.81Å; H56-K116 VanDerWaalsContact O-NZ 3.09Å
57G98.1Very high98Very high32 Ų3251.3 Ų51.333%0.3326%0.263SS..THydrogen-bonded Turntrans78.528.9-177.500000113.3L53 E54 R55 T59 K116L53-G57 PolarHBondContact O-N 3.41Å; L53-G57 VanDerWaalsContact O-N 3.17Å; E54-G57 PolarHBondContact O-N 3.06Å; R55-G57 PolarHBondContact O-N 3.46Å; G57-T59 PolarHBondContact O-N 2.97Å; G57-K116 WeakPolarHBondContact O-CB 3.45Å
58I98.7Very high98Very high8 Ų850.6 Ų50.64%0.04127%0.265CS..EExtended strand (participates in β ladder)trans-63.5133.8176.6-58.4-59.9000109.3M30 F38 L53 H56 H60 I61 F81 K116 L118M30-I58 HydrophobicContact CE-CD1 4.33Å; M30-I58 HydrophobicContact CE-CG1 4.09Å; F38-I58 HydrophobicContact CB-CD1 4.48Å; F38-I58 HydrophobicContact CD2-CD1 3.56Å; F38-I58 HydrophobicContact CE2-CD1 3.96Å; F38-I58 HydrophobicContact CG-CD1 4.03Å; L53-I58 HydrophobicContact CB-CB 4.27Å; L53-I58 HydrophobicContact CB-CG1 4.41Å; L53-I58 HydrophobicContact CD2-CB 4.27Å; L53-I58 HydrophobicContact CD2-CG1 3.95Å; L53-I58 HydrophobicContact CD2-CG2 4.32Å; L53-I58 PolarHBondContact O-N 3.5Å; H56-I58 HydrophobicContact CB-CD1 4.49Å; H56-I58 HydrophobicContact CB-CG1 4.26Å; I58-H60 WeakPolarHBondContact CG2-O 3.29Å; I58-I61 HydrophobicContact CG2-CD1 4.34Å; I58-I61 HydrophobicContact CG2-CG1 3.88Å; I58-F81 HydrophobicContact CB-CE1 4.5Å; I58-F81 HydrophobicContact CG2-CD1 4.42Å; I58-F81 VanDerWaalsContact O-CD1 3.29Å; I58-F81 WeakPolarHBondContact O-CD1 3.46Å; I58-F81 WeakPolarHBondContact O-CE1 3.11Å; I58-K116 HydrophobicContact CD1-CB 4.15Å; I58-L118 HydrophobicContact CD1-CB 4.31Å; I58-L118 HydrophobicContact CG2-CB 4.21Å
59T98.7Very high98Very high53 Ų5347 Ų4733%0.32524%0.238SC..EExtended strand (participates in β ladder)trans-124.3-28.6179.658.30000111.8G57 F81 R82 G115 K116G57-T59 PolarHBondContact O-N 2.97Å; T59-F81 WeakPolarHBondContact O-CA 3.36Å; T59-R82 PolarHBondContact O-N 3.14Å; T59-G115 WeakPolarHBondContact OG1-CA 3.42Å; T59-K116 PolarHBondContact N-O 3.34Å; T59-K116 PolarHBondContact OG1-N 3.12Å; T59-K116 PolarHBondContact OG1-O 3.41Å; T59-K116 VanDerWaalsContact OG1-O 3.07Å
60H98.8Very high97.9Very high12 Ų1246 Ų466%0.05624%0.24CC..EExtended strand (participates in β ladder)trans-126144.9-177.4-68.674.2000110.5I58 R82 F106 C110 K116 V117 L118I58-H60 WeakPolarHBondContact CG2-O 3.29Å; H60-R82 CarbonylContact C-O 3.5Å; H60-R82 VanDerWaalsContact CA-O 3.3Å; H60-R82 WeakPolarHBondContact CA-O 3.47Å; H60-R82 WeakPolarHBondContact NE2-CD 3.49Å; H60-F106 HydrophobicContact CB-CE1 3.71Å; H60-F106 HydrophobicContact CB-CZ 3.98Å; H60-F106 AromaticContact CD2-CE1 3.96Å; H60-F106 AromaticContact CD2-CE2 3.99Å; H60-F106 AromaticContact CD2-CZ 3.58Å; H60-C110 HydrophobicContact CB-CB 4.15Å; H60-C110 PolarHBondContact ND1-SG 3.25Å; H60-K116 PolarHBondContact N-O 3.39Å; H60-K116 VanDerWaalsContact N-O 3.11Å; H60-V117 HydrophobicContact CB-CB 4.06Å; H60-V117 HydrophobicContact CB-CG2 4.1Å; H60-V117 VanDerWaalsContact O-CA 3.28Å; H60-V117 WeakPolarHBondContact O-CA 3.26Å; H60-L118 PolarHBondContact O-N 3.49Å
61I98.9Very high97.8Very high0 Ų050.9 Ų50.90%027%0.266CS..EExtended strand (participates in β ladder)trans-135.7122.1178.1-59-178.1000110.1L53 I58 F81 R82 Y83 L84 L118L53-I61 HydrophobicContact CD1-CD1 4.3Å; I58-I61 HydrophobicContact CG2-CD1 4.34Å; I58-I61 HydrophobicContact CG2-CG1 3.88Å; I61-F81 HydrophobicContact CD1-CB 4.08Å; I61-F81 HydrophobicContact CD1-CD2 3.5Å; I61-F81 HydrophobicContact CD1-CE2 4.15Å; I61-F81 HydrophobicContact CD1-CG 3.86Å; I61-F81 HydrophobicContact CG1-CB 4.14Å; I61-F81 HydrophobicContact CG1-CD2 4.41Å; I61-F81 HydrophobicContact CG1-CG 4.28Å; I61-R82 PolarHBondContact N-O 2.83Å; I61-Y83 HydrophobicContact CB-CD1 3.78Å; I61-Y83 HydrophobicContact CB-CE1 3.59Å; I61-Y83 HydrophobicContact CB-CG 4.49Å; I61-Y83 HydrophobicContact CD1-CE1 3.99Å; I61-Y83 HydrophobicContact CG1-CE1 4.31Å; I61-Y83 HydrophobicContact CG2-CD1 3.95Å; I61-Y83 HydrophobicContact CG2-CE1 3.6Å; I61-Y83 VanDerWaalsContact O-CA 3.3Å; I61-Y83 WeakPolarHBondContact O-CA 3.34Å; I61-L84 PolarHBondContact O-N 3.44Å; I61-L118 CarbonylContact C-O 3.54Å; I61-L118 VanDerWaalsContact CA-O 3.3Å; I61-L118 WeakPolarHBondContact CA-O 3.41Å; I61-L118 HydrophobicContact CG1-CB 4.37Å
62I98.9Very high97.6Very high0 Ų052 Ų520%026%0.264CS..EExtended strand (participates in β ladder)trans-92.9114.2166.6-51.9-174.1000108.1V64 L84 L86 T103 F106 I107 V117 L118 V119 H120 L131I62-V64 HydrophobicContact CG2-CG2 4.01Å; I62-L84 CarbonylContact C-O 3.57Å; I62-L84 VanDerWaalsContact CA-O 3.32Å; I62-L84 WeakPolarHBondContact CA-O 3.45Å; I62-L84 HydrophobicContact CD1-CD2 4.29Å; I62-L84 HydrophobicContact CG1-CB 4.28Å; I62-L84 HydrophobicContact CG1-CD2 4.39Å; I62-L84 HydrophobicContact CG2-CD2 4.37Å; I62-L84 HydrophobicContact CG2-CG 4.47Å; I62-L86 HydrophobicContact CG2-CD1 3.92Å; I62-L86 HydrophobicContact CG2-CG 4.33Å; I62-T103 HydrophobicContact CD1-CG2 3.45Å; I62-T103 VanDerWaalsContact CD1-CG2 3.45Å; I62-F106 HydrophobicContact CD1-CD1 3.77Å; I62-F106 HydrophobicContact CD1-CE1 4.38Å; I62-F106 HydrophobicContact CG1-CD1 3.58Å; I62-F106 HydrophobicContact CG1-CE1 3.68Å; I62-I107 HydrophobicContact CD1-CD1 4.29Å; I62-I107 HydrophobicContact CD1-CG1 3.99Å; I62-V117 HydrophobicContact CG1-CG2 4.16Å; I62-L118 PolarHBondContact N-O 3.19Å; I62-V119 HydrophobicContact CB-CB 4.39Å; I62-V119 HydrophobicContact CB-CG1 4.08Å; I62-V119 HydrophobicContact CB-CG2 4.24Å; I62-V119 HydrophobicContact CD1-CG2 3.98Å; I62-V119 HydrophobicContact CG1-CG2 4.26Å; I62-V119 HydrophobicContact CG2-CG1 4.28Å; I62-H120 PolarHBondContact O-N 3.34Å; I62-L131 HydrophobicContact CG2-CD1 4.37Å
63C98.7Very high97.6Very high0 Ų050.4 Ų50.40%025%0.253CS..EExtended strand (participates in β ladder)trans-104.3105.7-178.9176.10000109.4Y83 L84 V85 L86 H120C63-Y83 HydrophobicContact CB-CD1 4.46Å; C63-L84 PolarHBondContact N-O 3.32Å; C63-V85 HydrophobicContact CB-CG2 4.27Å; C63-V85 WeakPolarHBondContact O-CA 3.12Å; C63-L86 PolarHBondContact O-N 3.32Å; C63-H120 VanDerWaalsContact SG-CE1 3.52Å
64V98.7Very high97.5Very high0 Ų055.3 Ų55.30%028%0.275CS..EExtended strand (participates in β ladder)trans-102.7116.7-178.6-168.70000110I62 L86 I88 H120 G121 R127 L131I62-V64 HydrophobicContact CG2-CG2 4.01Å; V64-L86 HydrophobicContact CG2-CD1 4.46Å; V64-I88 HydrophobicContact CG1-CB 3.77Å; V64-I88 HydrophobicContact CG1-CD1 3.8Å; V64-I88 HydrophobicContact CG1-CG1 4.09Å; V64-I88 HydrophobicContact CG1-CG2 4.46Å; V64-H120 WeakPolarHBondContact CB-O 3.24Å; V64-H120 PolarHBondContact N-O 3.07Å; V64-G121 WeakPolarHBondContact O-CA 3.46Å; V64-R127 HydrophobicContact CG1-CB 3.77Å; V64-R127 HydrophobicContact CG1-CG 4.49Å; V64-L131 HydrophobicContact CG2-CD1 3.52Å
65R98Very high97.5Very high33 Ų3353.4 Ų53.413%0.12527%0.27CS..EExtended strand (participates in β ladder)trans-156.8155-175.981.4-61.3173.6-79.9-2.3111D67 E69 I73 L86 D87 I88R65-D67 IonicContact CZ-OD1 3.18Å; R65-D67 VanDerWaalsContact CZ-OD1 3.31Å; R65-D67 IonicContact NH1-OD1 3.09Å; R65-D67 PolarHBondContact NH1-OD1 2.81Å; R65-D67 IonicContact NH2-OD1 3.36Å; R65-D67 PolarHBondContact NH2-OD1 3.13Å; R65-E69 WeakPolarHBondContact CA-OE2 3.12Å; R65-E69 HydrophobicContact CB-CB 4.21Å; R65-I73 HydrophobicContact CB-CB 3.8Å; R65-I73 HydrophobicContact CB-CD1 4.22Å; R65-I73 HydrophobicContact CB-CG2 3.7Å; R65-I73 HydrophobicContact CG-CB 4.31Å; R65-I73 HydrophobicContact CG-CG2 4.38Å; R65-L86 PolarHBondContact N-O 3.42Å; R65-D87 IonicContact NH1-OD1 3.79Å; R65-D87 PolarHBondContact NH1-OD1 3.37Å; R65-D87 VanDerWaalsContact O-CA 3.26Å; R65-D87 WeakPolarHBondContact O-CA 3.36Å; R65-I88 PolarHBondContact O-N 3.48Å
66Q97.1Very high97.5Very high59 Ų5946.6 Ų46.628%0.27625%0.247SC..  trans-78.7154.8162.7-67.7-179.4-70.700110.2I68 E69 A70 D87 I88 A89Q66-I68 HydrophobicContact CB-CG1 3.78Å; Q66-I68 PolarHBondContact O-N 3.4Å; Q66-E69 HydrophobicContact CB-CG 4.29Å; Q66-E69 PolarHBondContact N-OE2 3.09Å; Q66-E69 WeakPolarHBondContact O-CA 3.4Å; Q66-E69 WeakPolarHBondContact O-CB 3.35Å; Q66-E69 PolarHBondContact O-N 2.97Å; Q66-A70 PolarHBondContact O-N 3.27Å; Q66-D87 WeakPolarHBondContact CA-OD1 3.48Å; Q66-I88 WeakPolarHBondContact CG-O 3.43Å; Q66-A89 VanDerWaalsContact CG-CA 3.42Å; Q66-A89 HydrophobicContact CG-CB 3.98Å
67D95.3Very high97.4Very high99 Ų9944.4 Ų44.453%0.52924%0.237SC..G310 helixtrans-57-32.2174.6-80.7-4.5000113.5R65 E69 A70 D87R65-D67 IonicContact CZ-OD1 3.18Å; R65-D67 VanDerWaalsContact CZ-OD1 3.31Å; R65-D67 IonicContact NH1-OD1 3.09Å; R65-D67 PolarHBondContact NH1-OD1 2.81Å; R65-D67 IonicContact NH2-OD1 3.36Å; R65-D67 PolarHBondContact NH2-OD1 3.13Å; D67-E69 PolarHBondContact O-N 2.99Å; D67-A70 WeakPolarHBondContact O-CB 3.17Å; D67-A70 PolarHBondContact O-N 2.9Å; D67-D87 PolarHBondContact N-OD1 2.93Å
68I95.9Very high97.1Very high135 Ų13546.8 Ų46.869%0.69225%0.248SC*.G310 helixtrans-63-22.8172.563.4168.4000113.3Q66Q66-I68 HydrophobicContact CB-CG1 3.78Å; Q66-I68 PolarHBondContact O-N 3.4Å
69E97.5Very high96.9Very high17 Ų1755.3 Ų55.38%0.07929%0.288CS..G310 helixtrans-91.5-8.3177.7-57.9175.2125.500112.3R65 Q66 D67 N71 F72 I73 N122 R127R65-E69 WeakPolarHBondContact CA-OE2 3.12Å; R65-E69 HydrophobicContact CB-CB 4.21Å; Q66-E69 HydrophobicContact CB-CG 4.29Å; Q66-E69 PolarHBondContact N-OE2 3.09Å; Q66-E69 WeakPolarHBondContact O-CA 3.4Å; Q66-E69 WeakPolarHBondContact O-CB 3.35Å; Q66-E69 PolarHBondContact O-N 2.97Å; D67-E69 PolarHBondContact O-N 2.99Å; E69-N71 PolarHBondContact O-N 2.88Å; E69-F72 HydrophobicContact CB-CE1 4Å; E69-F72 HydrophobicContact CB-CE2 4.25Å; E69-F72 HydrophobicContact CB-CZ 3.68Å; E69-F72 HydrophobicContact CG-CE1 4.38Å; E69-F72 HydrophobicContact CG-CZ 3.81Å; E69-F72 WeakPolarHBondContact O-CD1 3.47Å; E69-F72 PolarHBondContact O-N 3.42Å; E69-I73 HydrophobicContact CB-CB 4.5Å; E69-I73 HydrophobicContact CB-CD1 3.89Å; E69-I73 HydrophobicContact CB-CG1 4.15Å; E69-I73 HydrophobicContact CG-CD1 4.4Å; E69-I73 PolarHBondContact O-N 2.95Å; E69-N122 PolarHBondContact OE1-ND2 2.7Å; E69-R127 IonicContact OE1-CZ 3.95Å; E69-R127 IonicContact OE1-NH1 2.78Å; E69-R127 IonicContact OE1-NH2 3.78Å; E69-R127 PolarHBondContact OE1-NH2 2.94Å; E69-R127 IonicContact OE2-CZ 2.7Å; E69-R127 IonicContact OE2-NH1 2.99Å; E69-R127 PolarHBondContact OE2-NH1 3.27Å; E69-R127 IonicContact OE2-NH2 3.95Å; E69-R127 PolarHBondContact OE2-NH2 2.77Å; E69-R127 VanDerWaalsContact OE2-NH2 3.09Å
70A96.1Very high96.8Very high32 Ų3260.7 Ų60.726%0.26430%0.302SS..THydrogen-bonded Turntrans-62.6-19.3-171.400000114.2Q66 D67 F72Q66-A70 PolarHBondContact O-N 3.27Å; D67-A70 WeakPolarHBondContact O-CB 3.17Å; D67-A70 PolarHBondContact O-N 2.9Å; A70-F72 VanDerWaalsContact C-N 3.27Å; A70-F72 PolarHBondContact O-N 3.3Å
71N95Very high96.8Very high138 Ų13860.8 Ų60.874%0.73830%0.302SS*.THydrogen-bonded Turntrans-64.2-32.1175-75.7-33.2000112.8E69 K74E69-N71 PolarHBondContact O-N 2.88Å; N71-K74 PolarHBondContact O-NZ 3.05Å
72F94.8Very high96.7Very high98 Ų9869.3 Ų69.343%0.4333%0.334SS..THydrogen-bonded Turntrans-122.2-20.7-176.361.9-87.8000114.4Y42 E69 A70Y42-F72 HydrophobicContact CE2-CD2 4.44Å; E69-F72 HydrophobicContact CB-CE1 4Å; E69-F72 HydrophobicContact CB-CE2 4.25Å; E69-F72 HydrophobicContact CB-CZ 3.68Å; E69-F72 HydrophobicContact CG-CE1 4.38Å; E69-F72 HydrophobicContact CG-CZ 3.81Å; E69-F72 WeakPolarHBondContact O-CD1 3.47Å; E69-F72 PolarHBondContact O-N 3.42Å; A70-F72 VanDerWaalsContact C-N 3.27Å; A70-F72 PolarHBondContact O-N 3.3Å
73I97.3Very high96.7Very high2 Ų271.5 Ų71.51%0.0134%0.343CS..SBendtrans-108.497.5172.1-46.7-176.4000108.7Y42 R65 E69 N122Y42-I73 HydrophobicContact CD2-CG1 4.48Å; Y42-I73 HydrophobicContact CG-CD1 4.45Å; Y42-I73 HydrophobicContact CG-CG1 4.08Å; R65-I73 HydrophobicContact CB-CB 3.8Å; R65-I73 HydrophobicContact CB-CD1 4.22Å; R65-I73 HydrophobicContact CB-CG2 3.7Å; R65-I73 HydrophobicContact CG-CB 4.31Å; R65-I73 HydrophobicContact CG-CG2 4.38Å; E69-I73 HydrophobicContact CB-CB 4.5Å; E69-I73 HydrophobicContact CB-CD1 3.89Å; E69-I73 HydrophobicContact CB-CG1 4.15Å; E69-I73 HydrophobicContact CG-CD1 4.4Å; E69-I73 PolarHBondContact O-N 2.95Å; I73-N122 HydrophobicContact CD1-CB 3.56Å
74K97.1Very high96.7Very high104 Ų10472.9 Ų72.945%0.45235%0.35SS..SBendtrans-153.1160.9-176.160.1-174.3172.6-164.50112.4N71 N76N71-K74 PolarHBondContact O-NZ 3.05Å; K74-N76 PolarHBondContact O-N 3.23Å; K74-N76 PolarHBondContact O-ND2 3.4Å
75P97.9Very high96.7Very high48 Ų4875.6 Ų75.631%0.31237%0.366SS..  trans-57.3110170.2-2536000111.5Y83 V85P75-Y83 HydrophobicContact CB-CD1 3.71Å; P75-Y83 HydrophobicContact CB-CD2 3.94Å; P75-Y83 HydrophobicContact CB-CE1 3.69Å; P75-Y83 HydrophobicContact CB-CE2 3.92Å; P75-Y83 HydrophobicContact CB-CG 3.82Å; P75-Y83 HydrophobicContact CG-CD1 3.77Å; P75-Y83 HydrophobicContact CG-CE1 4.14Å; P75-Y83 HydrophobicContact CG-CG 4.01Å; P75-V85 HydrophobicContact CG-CG2 3.64Å
76N97.4Very high96.8Very high40 Ų4074.2 Ų74.221%0.21436%0.362CS..SBendtrans-88.1-16.1179.1-74.9-55.6000113A45 K47 K74 Y83A45-N76 PolarHBondContact O-ND2 3.15Å; K47-N76 HydrophobicContact CG-CB 4.06Å; K74-N76 PolarHBondContact O-N 3.23Å; K74-N76 PolarHBondContact O-ND2 3.4Å; N76-Y83 PolarHBondContact N-OH 3.16Å
77F96.4Very high96.8Very high23 Ų2375 Ų7510%0.10137%0.368CS..  trans-138.951.3-171.3-42.7-79.9000112.1M46 K47 L50 L53 H79 R80 F81 Y83M46-F77 WeakPolarHBondContact O-CZ 3.4Å; K47-F77 VanDerWaalsContact CA-CZ 3.44Å; L50-F77 HydrophobicContact CB-CE1 3.63Å; L50-F77 HydrophobicContact CB-CZ 3.65Å; L50-F77 HydrophobicContact CD1-CD1 3.94Å; L50-F77 HydrophobicContact CD1-CE1 3.89Å; L50-F77 HydrophobicContact CD1-CG 4.3Å; L50-F77 HydrophobicContact CD1-CZ 4.19Å; L50-F77 HydrophobicContact CD2-CD1 4.34Å; L50-F77 HydrophobicContact CD2-CE1 4.04Å; L50-F77 HydrophobicContact CG-CE1 4.06Å; L50-F77 HydrophobicContact CG-CZ 4.43Å; L53-F77 HydrophobicContact CD1-CD2 4.13Å; L53-F77 HydrophobicContact CD1-CE2 3.66Å; L53-F77 HydrophobicContact CD1-CZ 4.48Å; F77-H79 PolarHBondContact O-N 3.23Å; F77-R80 HydrophobicContact CB-CB 3.99Å; F77-R80 HydrophobicContact CB-CG 4.29Å; F77-R80 PolarHBondContact O-N 2.91Å; F77-F81 HydrophobicContact CB-CD2 3.64Å; F77-F81 HydrophobicContact CB-CE2 3.74Å; F77-F81 AromaticContact CD2-CD2 3.88Å; F77-F81 HydrophobicContact CD2-CD2 3.88Å; F77-F81 AromaticContact CD2-CE2 3.54Å; F77-F81 HydrophobicContact CD2-CE2 3.54Å; F77-F81 HydrophobicContact CE2-CE2 4.26Å; F77-F81 HydrophobicContact CG-CD2 4.11Å; F77-F81 AromaticContact CG-CE2 3.8Å; F77-F81 HydrophobicContact CG-CE2 3.8Å; F77-F81 PolarHBondContact O-N 2.93Å; F77-F81 VanDerWaalsContact O-N 3.15Å; F77-Y83 PolarHBondContact N-OH 3.34Å
78S92.3Very high97Very high81 Ų8170.2 Ų70.257%0.56634%0.342SS*.THydrogen-bonded Turntrans-55.2-20-176.436.90000115.2
79H94.2Very high97.1Very high188 Ų18864.2 Ų64.287%0.8731%0.312SS*.THydrogen-bonded Turntrans-95.2-6.9176-55.5-63.2000114.4F77F77-H79 PolarHBondContact O-N 3.23Å
80R96.3Very high97.1Very high165 Ų16566.9 Ų66.962%0.62333%0.327SS*.THydrogen-bonded Turntrans-108.6-38.3-176.5-63.1-112.2172.9175.4-8.4112.5E54 F77E54-R80 IonicContact OE1-CZ 3.86Å; E54-R80 IonicContact OE1-NH1 2.78Å; E54-R80 PolarHBondContact OE1-NH1 3.18Å; F77-R80 HydrophobicContact CB-CB 3.99Å; F77-R80 HydrophobicContact CB-CG 4.29Å; F77-R80 PolarHBondContact O-N 2.91Å
81F98.3Very high97.1Very high15 Ų1567.8 Ų67.87%0.06633%0.328CS..SBendtrans-121.4151.3-177.5-49-61.2000110.6L50 L53 I58 T59 I61 F77 Y83L50-F81 HydrophobicContact CD1-CE2 4Å; L50-F81 HydrophobicContact CD1-CZ 3.85Å; L53-F81 HydrophobicContact CB-CE1 4.46Å; L53-F81 HydrophobicContact CB-CE2 4.29Å; L53-F81 HydrophobicContact CB-CZ 3.74Å; L53-F81 HydrophobicContact CD1-CE2 3.71Å; L53-F81 HydrophobicContact CD1-CZ 4.05Å; I58-F81 HydrophobicContact CB-CE1 4.5Å; I58-F81 HydrophobicContact CG2-CD1 4.42Å; I58-F81 VanDerWaalsContact O-CD1 3.29Å; I58-F81 WeakPolarHBondContact O-CD1 3.46Å; I58-F81 WeakPolarHBondContact O-CE1 3.11Å; T59-F81 WeakPolarHBondContact O-CA 3.36Å; I61-F81 HydrophobicContact CD1-CB 4.08Å; I61-F81 HydrophobicContact CD1-CD2 3.5Å; I61-F81 HydrophobicContact CD1-CE2 4.15Å; I61-F81 HydrophobicContact CD1-CG 3.86Å; I61-F81 HydrophobicContact CG1-CB 4.14Å; I61-F81 HydrophobicContact CG1-CD2 4.41Å; I61-F81 HydrophobicContact CG1-CG 4.28Å; F77-F81 HydrophobicContact CB-CD2 3.64Å; F77-F81 HydrophobicContact CB-CE2 3.74Å; F77-F81 AromaticContact CD2-CD2 3.88Å; F77-F81 HydrophobicContact CD2-CD2 3.88Å; F77-F81 AromaticContact CD2-CE2 3.54Å; F77-F81 HydrophobicContact CD2-CE2 3.54Å; F77-F81 HydrophobicContact CE2-CE2 4.26Å; F77-F81 HydrophobicContact CG-CD2 4.11Å; F77-F81 AromaticContact CG-CE2 3.8Å; F77-F81 HydrophobicContact CG-CE2 3.8Å; F77-F81 PolarHBondContact O-N 2.93Å; F77-F81 VanDerWaalsContact O-N 3.15Å; F81-Y83 HydrophobicContact CB-CD2 4.33Å; F81-Y83 HydrophobicContact CB-CE2 3.85Å; F81-Y83 HydrophobicContact CD2-CE2 4.43Å; F81-Y83 VanDerWaalsContact O-CD2 3.31Å; F81-Y83 WeakPolarHBondContact O-CD2 3.33Å
82R98.4Very high97.3Very high178 Ų17864.4 Ų64.467%0.67231%0.313SS*.EExtended strand (participates in β ladder)trans-81131.6167.6-70.5175.5174.6-164.13.2109T59 H60 I61T59-R82 PolarHBondContact O-N 3.14Å; H60-R82 CarbonylContact C-O 3.5Å; H60-R82 VanDerWaalsContact CA-O 3.3Å; H60-R82 WeakPolarHBondContact CA-O 3.47Å; H60-R82 WeakPolarHBondContact NE2-CD 3.49Å; I61-R82 PolarHBondContact N-O 2.83Å
83Y98.7Very high97.4Very high47 Ų4766.1 Ų66.118%0.18433%0.331CS..EExtended strand (participates in β ladder)trans-113.2139.2-176.7-79.4-93.6000112.1I61 C63 P75 N76 F77 F81I61-Y83 HydrophobicContact CB-CD1 3.78Å; I61-Y83 HydrophobicContact CB-CE1 3.59Å; I61-Y83 HydrophobicContact CB-CG 4.49Å; I61-Y83 HydrophobicContact CD1-CE1 3.99Å; I61-Y83 HydrophobicContact CG1-CE1 4.31Å; I61-Y83 HydrophobicContact CG2-CD1 3.95Å; I61-Y83 HydrophobicContact CG2-CE1 3.6Å; I61-Y83 VanDerWaalsContact O-CA 3.3Å; I61-Y83 WeakPolarHBondContact O-CA 3.34Å; C63-Y83 HydrophobicContact CB-CD1 4.46Å; P75-Y83 HydrophobicContact CB-CD1 3.71Å; P75-Y83 HydrophobicContact CB-CD2 3.94Å; P75-Y83 HydrophobicContact CB-CE1 3.69Å; P75-Y83 HydrophobicContact CB-CE2 3.92Å; P75-Y83 HydrophobicContact CB-CG 3.82Å; P75-Y83 HydrophobicContact CG-CD1 3.77Å; P75-Y83 HydrophobicContact CG-CE1 4.14Å; P75-Y83 HydrophobicContact CG-CG 4.01Å; N76-Y83 PolarHBondContact N-OH 3.16Å; F77-Y83 PolarHBondContact N-OH 3.34Å; F81-Y83 HydrophobicContact CB-CD2 4.33Å; F81-Y83 HydrophobicContact CB-CE2 3.85Å; F81-Y83 HydrophobicContact CD2-CE2 4.43Å; F81-Y83 VanDerWaalsContact O-CD2 3.31Å; F81-Y83 WeakPolarHBondContact O-CD2 3.33Å
84L98.8Very high97.5Very high28 Ų2867.6 Ų67.615%0.14734%0.338CS..EExtended strand (participates in β ladder)trans-113.6119.1158176.160.9000107.5I61 I62 C63 L86 M102 F106I61-L84 PolarHBondContact O-N 3.44Å; I62-L84 CarbonylContact C-O 3.57Å; I62-L84 VanDerWaalsContact CA-O 3.32Å; I62-L84 WeakPolarHBondContact CA-O 3.45Å; I62-L84 HydrophobicContact CD1-CD2 4.29Å; I62-L84 HydrophobicContact CG1-CB 4.28Å; I62-L84 HydrophobicContact CG1-CD2 4.39Å; I62-L84 HydrophobicContact CG2-CD2 4.37Å; I62-L84 HydrophobicContact CG2-CG 4.47Å; C63-L84 PolarHBondContact N-O 3.32Å; L84-L86 HydrophobicContact CD1-CD2 3.88Å; L84-L86 HydrophobicContact CD2-CD1 4.42Å; L84-L86 HydrophobicContact CD2-CD2 4.17Å; L84-L86 HydrophobicContact CD2-CG 4.42Å; L84-L86 HydrophobicContact CG-CD2 3.85Å; L84-L86 HydrophobicContact CG-CG 4.1Å; L84-M102 HydrophobicContact CD1-CG 4.46Å; L84-M102 HydrophobicContact CD1-SD 3.94Å; L84-M102 HydrophobicContact CD2-CG 4.22Å; L84-F106 HydrophobicContact CB-CD1 4.19Å; L84-F106 HydrophobicContact CB-CD2 3.94Å; L84-F106 HydrophobicContact CB-CE1 4.01Å; L84-F106 HydrophobicContact CB-CE2 3.79Å; L84-F106 HydrophobicContact CB-CG 4.13Å; L84-F106 HydrophobicContact CB-CZ 3.81Å; L84-F106 HydrophobicContact CD2-CB 3.96Å; L84-F106 HydrophobicContact CD2-CD1 4.38Å; L84-F106 HydrophobicContact CD2-CD2 4.31Å; L84-F106 HydrophobicContact CD2-CG 3.98Å
85V98.6Very high97.5Very high57 Ų5766.2 Ų66.235%0.34534%0.336SS..EExtended strand (participates in β ladder)trans-109.2120.2-178.4-176.60000108.6C63 P75C63-V85 HydrophobicContact CB-CG2 4.27Å; C63-V85 WeakPolarHBondContact O-CA 3.12Å; P75-V85 HydrophobicContact CG-CG2 3.64Å
86L98.6Very high97.5Very high5 Ų564 Ų643%0.02632%0.321CS..EExtended strand (participates in β ladder)trans-114.9122.9-176.1-57.6-180000110.1I62 C63 V64 R65 L84 I88 F99 M102 L131I62-L86 HydrophobicContact CG2-CD1 3.92Å; I62-L86 HydrophobicContact CG2-CG 4.33Å; C63-L86 PolarHBondContact O-N 3.32Å; V64-L86 HydrophobicContact CG2-CD1 4.46Å; R65-L86 PolarHBondContact N-O 3.42Å; L84-L86 HydrophobicContact CD1-CD2 3.88Å; L84-L86 HydrophobicContact CD2-CD1 4.42Å; L84-L86 HydrophobicContact CD2-CD2 4.17Å; L84-L86 HydrophobicContact CD2-CG 4.42Å; L84-L86 HydrophobicContact CG-CD2 3.85Å; L84-L86 HydrophobicContact CG-CG 4.1Å; L86-I88 HydrophobicContact CB-CD1 3.73Å; L86-I88 HydrophobicContact CB-CG1 3.98Å; L86-I88 HydrophobicContact CD1-CD1 4.06Å; L86-I88 PolarHBondContact O-N 3.39Å; L86-F99 HydrophobicContact CD1-CB 4.36Å; L86-F99 HydrophobicContact CD2-CD1 3.86Å; L86-F99 HydrophobicContact CD2-CE1 4.23Å; L86-M102 HydrophobicContact CD2-SD 4.08Å; L86-L131 HydrophobicContact CD1-CD1 3.7Å
87D98.3Very high97.6Very high74 Ų7463.4 Ų63.440%0.39632%0.318SS..EExtended strand (participates in β ladder)trans-83.598.7172.8-17031.5000110.5R65 Q66 D67R65-D87 IonicContact NH1-OD1 3.79Å; R65-D87 PolarHBondContact NH1-OD1 3.37Å; R65-D87 VanDerWaalsContact O-CA 3.26Å; R65-D87 WeakPolarHBondContact O-CA 3.36Å; Q66-D87 WeakPolarHBondContact CA-OD1 3.48Å; D67-D87 PolarHBondContact N-OD1 2.93Å
88I98.4Very high97.6Very high0 Ų068.9 Ų68.90%034%0.338CS..  trans-137.6122.7-173-57.1177.2000109.4V64 R65 Q66 L86 E94 I96 F99 R127 F164V64-I88 HydrophobicContact CG1-CB 3.77Å; V64-I88 HydrophobicContact CG1-CD1 3.8Å; V64-I88 HydrophobicContact CG1-CG1 4.09Å; V64-I88 HydrophobicContact CG1-CG2 4.46Å; R65-I88 PolarHBondContact O-N 3.48Å; Q66-I88 WeakPolarHBondContact CG-O 3.43Å; L86-I88 HydrophobicContact CB-CD1 3.73Å; L86-I88 HydrophobicContact CB-CG1 3.98Å; L86-I88 HydrophobicContact CD1-CD1 4.06Å; L86-I88 PolarHBondContact O-N 3.39Å; I88-E94 HydrophobicContact CG2-CG 3.76Å; I88-I96 HydrophobicContact CD1-CD1 4.36Å; I88-I96 HydrophobicContact CD1-CG1 4.13Å; I88-I96 HydrophobicContact CG2-CD1 4.1Å; I88-I96 HydrophobicContact CG2-CG1 4.29Å; I88-F99 HydrophobicContact CD1-CB 4.39Å; I88-F99 HydrophobicContact CD1-CD2 3.55Å; I88-F99 HydrophobicContact CD1-CE2 3.89Å; I88-F99 HydrophobicContact CD1-CG 3.99Å; I88-F99 HydrophobicContact CG1-CD2 3.85Å; I88-F99 HydrophobicContact CG1-CE2 3.61Å; I88-F99 HydrophobicContact CG1-CZ 4.15Å; I88-R127 HydrophobicContact CG2-CB 4.5Å; I88-R127 HydrophobicContact CG2-CG 3.96Å; I88-R127 WeakPolarHBondContact O-CD 3.34Å; I88-R127 PolarHBondContact O-NH1 3.14Å; I88-F164 HydrophobicContact CG2-CZ 4.22Å
89A97.9Very high97.9Very high8 Ų866.1 Ų66.17%0.06632%0.316CS..  trans-78.1139.5172.700000112.9Q66 N91 E94 F164Q66-A89 VanDerWaalsContact CG-CA 3.42Å; Q66-A89 HydrophobicContact CG-CB 3.98Å; A89-N91 WeakPolarHBondContact CB-ND2 3.08Å; A89-N91 PolarHBondContact O-N 3.31Å; A89-N91 VanDerWaalsContact O-N 3.08Å; A89-E94 HydrophobicContact CB-CB 4.2Å; A89-E94 HydrophobicContact CB-CG 4.21Å; A89-E94 WeakPolarHBondContact O-CB 3.29Å; A89-E94 WeakPolarHBondContact O-CG 3.31Å; A89-F164 WeakPolarHBondContact O-CZ 3.44Å
90D97.9Very high98.1Very high73 Ų7357.3 Ų57.339%0.3928%0.275SS..SBendtrans-88.165.1176.4-153.6-7.8000111S126 R127 N161D90-S126 VanDerWaalsContact OD1-CB 3.22Å; D90-S126 WeakPolarHBondContact OD1-CB 3.44Å; D90-S126 PolarHBondContact OD1-OG 3.38Å; D90-S126 VanDerWaalsContact OD2-CB 3.31Å; D90-S126 WeakPolarHBondContact OD2-CB 3.04Å; D90-R127 HydrophobicContact CB-CG 3.93Å; D90-R127 IonicContact OD2-NE 2.71Å; D90-N161 PolarHBondContact OD1-ND2 2.76Å; D90-N161 VanDerWaalsContact OD1-ND2 3.15Å
91N97.5Very high98.2Very high51 Ų5152.1 Ų52.127%0.27326%0.263SS..SBendtrans-137157.4176.374.368.9000110.6A89 V93 E94 N161A89-N91 WeakPolarHBondContact CB-ND2 3.08Å; A89-N91 PolarHBondContact O-N 3.31Å; A89-N91 VanDerWaalsContact O-N 3.08Å; N91-V93 PolarHBondContact O-N 3.09Å; N91-V93 WeakPolarHBondContact OD1-CA 3.41Å; N91-V93 WeakPolarHBondContact OD1-CG2 3.22Å; N91-V93 PolarHBondContact OD1-N 2.95Å; N91-E94 PolarHBondContact O-N 2.87Å; N91-E94 PolarHBondContact OD1-N 3.45Å; N91-N161 PolarHBondContact O-ND2 3.13Å
92P97.5Very high98.2Very high67 Ų6755.9 Ų55.944%0.43528%0.281SS..THydrogen-bonded Turntrans-66.3-16-175.3-24.336000116.2N161 V162 G163P92-N161 WeakPolarHBondContact CA-OD1 3.44Å; P92-V162 HydrophobicContact CB-CG2 4.11Å; P92-V162 HydrophobicContact CG-CG2 4.07Å; P92-G163 WeakPolarHBondContact O-CA 3.46Å
93V97.8Very high98.2Very high134 Ų13447.5 Ų47.581%0.81225%0.25SS*.THydrogen-bonded Turntrans-97.5-5.2-179.7-57.90000113N91 N95N91-V93 PolarHBondContact O-N 3.09Å; N91-V93 WeakPolarHBondContact OD1-CA 3.41Å; N91-V93 WeakPolarHBondContact OD1-CG2 3.22Å; N91-V93 PolarHBondContact OD1-N 2.95Å; V93-N95 PolarHBondContact O-N 2.8Å
94E98.3Very high98.2Very high33 Ų3346.9 Ų46.915%0.15425%0.248CC..SBendtrans-67126.3174.8177.959.4-135.800110.2I88 A89 N91 I96 R98 F164 Q167I88-E94 HydrophobicContact CG2-CG 3.76Å; A89-E94 HydrophobicContact CB-CB 4.2Å; A89-E94 HydrophobicContact CB-CG 4.21Å; A89-E94 WeakPolarHBondContact O-CB 3.29Å; A89-E94 WeakPolarHBondContact O-CG 3.31Å; N91-E94 PolarHBondContact O-N 2.87Å; N91-E94 PolarHBondContact OD1-N 3.45Å; E94-I96 PolarHBondContact O-N 2.96Å; E94-R98 IonicContact OE1-CZ 2.77Å; E94-R98 IonicContact OE1-NH2 3.32Å; E94-R98 PolarHBondContact OE1-NH2 2.98Å; E94-F164 HydrophobicContact CB-CE1 4.02Å; E94-F164 HydrophobicContact CB-CZ 4.4Å; E94-F164 HydrophobicContact CG-CE1 4.36Å; E94-Q167 PolarHBondContact O-NE2 3.46Å
95N98.1Very high98.2Very high76 Ų7651.9 Ų51.941%0.40627%0.271SS..  trans-78.287.8176.3-179.6-15.5000109.2V93 I97 R98V93-N95 PolarHBondContact O-N 2.8Å; N95-I97 WeakPolarHBondContact OD1-CG2 3.3Å; N95-R98 WeakPolarHBondContact O-CD 3.39Å; N95-R98 WeakPolarHBondContact O-CG 3.28Å; N95-R98 PolarHBondContact O-NE 3.02Å; N95-R98 PolarHBondContact OD1-N 2.84Å
96I98.6Very high98.2Very high0 Ų051 Ų510%026%0.263CS..  trans-83.2-26.6177-166.2164.9000112.2I88 E94 R98 F99 F100 A130 L131 F164 Q167I88-I96 HydrophobicContact CD1-CD1 4.36Å; I88-I96 HydrophobicContact CD1-CG1 4.13Å; I88-I96 HydrophobicContact CG2-CD1 4.1Å; I88-I96 HydrophobicContact CG2-CG1 4.29Å; E94-I96 PolarHBondContact O-N 2.96Å; I96-R98 PolarHBondContact O-N 2.93Å; I96-R98 VanDerWaalsContact O-N 3.16Å; I96-F99 WeakPolarHBondContact O-CB 3.3Å; I96-F99 PolarHBondContact O-N 3.15Å; I96-F100 HydrophobicContact CB-CE1 4.49Å; I96-F100 HydrophobicContact CD1-CE1 4.43Å; I96-F100 HydrophobicContact CG1-CE1 3.9Å; I96-F100 HydrophobicContact CG2-CE1 4.06Å; I96-F100 HydrophobicContact CG2-CZ 3.81Å; I96-A130 HydrophobicContact CD1-CB 4.03Å; I96-L131 HydrophobicContact CD1-CD2 4.08Å; I96-L131 HydrophobicContact CD1-CG 4.38Å; I96-L131 HydrophobicContact CG1-CD2 4Å; I96-F164 HydrophobicContact CB-CD1 3.91Å; I96-F164 HydrophobicContact CB-CE1 3.72Å; I96-F164 HydrophobicContact CB-CZ 4.33Å; I96-F164 HydrophobicContact CD1-CD1 4.36Å; I96-F164 HydrophobicContact CD1-CD2 4.22Å; I96-F164 HydrophobicContact CD1-CE1 4.16Å; I96-F164 HydrophobicContact CD1-CE2 4.03Å; I96-F164 HydrophobicContact CD1-CG 4.39Å; I96-F164 HydrophobicContact CD1-CZ 3.98Å; I96-F164 HydrophobicContact CG2-CB 4.35Å; I96-F164 HydrophobicContact CG2-CD1 3.32Å; I96-F164 HydrophobicContact CG2-CE1 3.7Å; I96-F164 HydrophobicContact CG2-CG 3.92Å; I96-Q167 HydrophobicContact CG2-CB 4.29Å
97I98.1Very high98.2Very high28 Ų2850.8 Ų50.814%0.14426%0.262CS..G310 helixtrans-58.5-32.7-174.4-169.1170000113N95 F99 F100 Q167 E170 Y171 I174N95-I97 WeakPolarHBondContact OD1-CG2 3.3Å; I97-F99 PolarHBondContact O-N 2.82Å; I97-F99 VanDerWaalsContact O-N 3.14Å; I97-F100 HydrophobicContact CB-CD2 4.14Å; I97-F100 HydrophobicContact CB-CE2 3.94Å; I97-F100 HydrophobicContact CG1-CD2 3.72Å; I97-F100 HydrophobicContact CG1-CE2 3.82Å; I97-F100 PolarHBondContact O-N 2.97Å; I97-Q167 HydrophobicContact CB-CB 4.18Å; I97-Q167 HydrophobicContact CB-CG 4.35Å; I97-Q167 WeakPolarHBondContact CD1-O 3.35Å; I97-Q167 HydrophobicContact CG2-CG 4.42Å; I97-E170 HydrophobicContact CD1-CB 4.19Å; I97-Y171 HydrophobicContact CD1-CD2 4.08Å; I97-Y171 HydrophobicContact CG1-CD2 3.75Å; I97-Y171 HydrophobicContact CG1-CG 4.32Å; I97-I174 HydrophobicContact CD1-CD1 3.68Å
98R97.8Very high98.2Very high138 Ų13850 Ų5052%0.52126%0.257SS..G310 helixtrans-59-23.2174.867.9-173.3161.6132-3.9114.1E94 N95 I96E94-R98 IonicContact OE1-CZ 2.77Å; E94-R98 IonicContact OE1-NH2 3.32Å; E94-R98 PolarHBondContact OE1-NH2 2.98Å; N95-R98 WeakPolarHBondContact O-CD 3.39Å; N95-R98 WeakPolarHBondContact O-CG 3.28Å; N95-R98 PolarHBondContact O-NE 3.02Å; N95-R98 PolarHBondContact OD1-N 2.84Å; I96-R98 PolarHBondContact O-N 2.93Å; I96-R98 VanDerWaalsContact O-N 3.16Å
99F98.6Very high98.2Very high24 Ų2453.1 Ų53.111%0.10528%0.279CS..G310 helixtrans-92.4-12.1-178.5-61.1-73000113.7L86 I88 I96 I97 M102 T103 L131L86-F99 HydrophobicContact CD1-CB 4.36Å; L86-F99 HydrophobicContact CD2-CD1 3.86Å; L86-F99 HydrophobicContact CD2-CE1 4.23Å; I88-F99 HydrophobicContact CD1-CB 4.39Å; I88-F99 HydrophobicContact CD1-CD2 3.55Å; I88-F99 HydrophobicContact CD1-CE2 3.89Å; I88-F99 HydrophobicContact CD1-CG 3.99Å; I88-F99 HydrophobicContact CG1-CD2 3.85Å; I88-F99 HydrophobicContact CG1-CE2 3.61Å; I88-F99 HydrophobicContact CG1-CZ 4.15Å; I96-F99 WeakPolarHBondContact O-CB 3.3Å; I96-F99 PolarHBondContact O-N 3.15Å; I97-F99 PolarHBondContact O-N 2.82Å; I97-F99 VanDerWaalsContact O-N 3.14Å; F99-M102 PolarHBondContact O-N 2.8Å; F99-T103 WeakPolarHBondContact O-CB 3.3Å; F99-T103 PolarHBondContact O-N 2.89Å; F99-T103 PolarHBondContact O-OG1 2.96Å; F99-L131 HydrophobicContact CB-CD2 4.34Å
100F98.6Very high98.3Very high3 Ų352.7 Ų52.71%0.01328%0.276CS..Hα-helixtrans-60.6-46.6-177.2-59.9-25.1000112.9I96 I97 M102 T103 K104 L131 A134 L168 Y171I96-F100 HydrophobicContact CB-CE1 4.49Å; I96-F100 HydrophobicContact CD1-CE1 4.43Å; I96-F100 HydrophobicContact CG1-CE1 3.9Å; I96-F100 HydrophobicContact CG2-CE1 4.06Å; I96-F100 HydrophobicContact CG2-CZ 3.81Å; I97-F100 HydrophobicContact CB-CD2 4.14Å; I97-F100 HydrophobicContact CB-CE2 3.94Å; I97-F100 HydrophobicContact CG1-CD2 3.72Å; I97-F100 HydrophobicContact CG1-CE2 3.82Å; I97-F100 PolarHBondContact O-N 2.97Å; F100-M102 PolarHBondContact O-N 2.79Å; F100-T103 PolarHBondContact O-N 3.33Å; F100-K104 WeakPolarHBondContact O-CB 3.32Å; F100-K104 PolarHBondContact O-N 2.81Å; F100-L131 HydrophobicContact CD1-CD2 3.72Å; F100-L131 HydrophobicContact CE1-CD2 3.9Å; F100-A134 HydrophobicContact CB-CB 4.1Å; F100-A134 HydrophobicContact CD1-CB 3.52Å; F100-A134 HydrophobicContact CD2-CB 3.81Å; F100-A134 HydrophobicContact CE1-CB 3.77Å; F100-A134 HydrophobicContact CE2-CB 4.05Å; F100-A134 HydrophobicContact CG-CB 3.55Å; F100-A134 HydrophobicContact CZ-CB 4.02Å; F100-L168 HydrophobicContact CE1-CD2 4.44Å; F100-L168 HydrophobicContact CE2-CD2 4.01Å; F100-L168 HydrophobicContact CZ-CD2 3.74Å; F100-L168 HydrophobicContact CZ-CG 4.17Å; F100-Y171 HydrophobicContact CB-CD1 4.29Å; F100-Y171 HydrophobicContact CB-CD2 4.35Å; F100-Y171 HydrophobicContact CB-CE1 3.77Å; F100-Y171 HydrophobicContact CB-CE2 3.82Å; F100-Y171 AromaticContact CD2-CD1 3.65Å; F100-Y171 HydrophobicContact CD2-CD1 3.65Å; F100-Y171 AromaticContact CD2-CD2 3.66Å; F100-Y171 HydrophobicContact CD2-CD2 3.66Å; F100-Y171 HydrophobicContact CD2-CE1 4.04Å; F100-Y171 HydrophobicContact CD2-CE2 4.03Å; F100-Y171 AromaticContact CD2-CG 3.46Å; F100-Y171 HydrophobicContact CD2-CG 3.46Å; F100-Y171 VanDerWaalsContact CD2-CG 3.46Å; F100-Y171 HydrophobicContact CE2-CD1 4.38Å; F100-Y171 HydrophobicContact CE2-CG 4.07Å; F100-Y171 HydrophobicContact CG-CD1 4.36Å; F100-Y171 HydrophobicContact CG-CE1 4.32Å; F100-Y171 HydrophobicContact CG-CE2 4.47Å; F100-Y171 HydrophobicContact CG-CG 4.46Å
101P97.9Very high98.2Very high55 Ų5551.1 Ų51.136%0.35727%0.267SS..Hα-helixtrans-62.2-43.4178.7-23.334.8000113K104 E105 Y171P101-K104 PolarHBondContact O-N 3.11Å; P101-E105 WeakPolarHBondContact O-CB 3.43Å; P101-E105 PolarHBondContact O-N 2.81Å; P101-Y171 HydrophobicContact CG-CE2 4.35Å
102M98.4Very high98.2Very high94 Ų9452.9 Ų52.946%0.46329%0.288SS..Hα-helixtrans-64-42.5178.4178.5-174.5-66.800111.8L84 L86 F99 F100 F106L84-M102 HydrophobicContact CD1-CG 4.46Å; L84-M102 HydrophobicContact CD1-SD 3.94Å; L84-M102 HydrophobicContact CD2-CG 4.22Å; L86-M102 HydrophobicContact CD2-SD 4.08Å; F99-M102 PolarHBondContact O-N 2.8Å; F100-M102 PolarHBondContact O-N 2.79Å; M102-F106 WeakPolarHBondContact O-CB 3.41Å; M102-F106 PolarHBondContact O-N 3.21Å; M102-F106 VanDerWaalsContact O-N 3.1Å
103T98.6Very high98.2Very high2 Ų254.3 Ų54.31%0.01230%0.296CS..Hα-helixtrans-65.5-42.9177.9-560000110.2I62 F99 F100 F106 I107 L131I62-T103 HydrophobicContact CD1-CG2 3.45Å; I62-T103 VanDerWaalsContact CD1-CG2 3.45Å; F99-T103 WeakPolarHBondContact O-CB 3.3Å; F99-T103 PolarHBondContact O-N 2.89Å; F99-T103 PolarHBondContact O-OG1 2.96Å; F100-T103 PolarHBondContact O-N 3.33Å; T103-F106 PolarHBondContact O-N 3.18Å; T103-I107 HydrophobicContact CG2-CD1 3.84Å; T103-I107 HydrophobicContact CG2-CG1 4.5Å; T103-I107 VanDerWaalsContact O-CG1 3.29Å; T103-I107 WeakPolarHBondContact O-CG1 3.26Å; T103-I107 PolarHBondContact O-N 3.04Å; T103-L131 HydrophobicContact CG2-CB 3.94Å; T103-L131 HydrophobicContact CG2-CD1 4.18Å; T103-L131 HydrophobicContact CG2-CD2 4.48Å; T103-L131 HydrophobicContact CG2-CG 4.43Å
104K98.4Very high98.1Very high34 Ų3455.5 Ų55.515%0.14830%0.298CS..Hα-helixtrans-59.4-51.2176.1172.9169176.649.50111.8F100 P101 F106 I107 D108 Y135 E138 T139F100-K104 WeakPolarHBondContact O-CB 3.32Å; F100-K104 PolarHBondContact O-N 2.81Å; P101-K104 PolarHBondContact O-N 3.11Å; K104-F106 VanDerWaalsContact C-N 3.26Å; K104-F106 PolarHBondContact O-N 3.44Å; K104-I107 PolarHBondContact O-N 3.14Å; K104-I107 VanDerWaalsContact O-N 3.13Å; K104-D108 WeakPolarHBondContact CE-OD2 3.48Å; K104-D108 VanDerWaalsContact CG-OD2 3.28Å; K104-D108 WeakPolarHBondContact CG-OD2 3.25Å; K104-D108 IonicContact NZ-OD1 2.89Å; K104-D108 PolarHBondContact NZ-OD1 3.34Å; K104-D108 IonicContact NZ-OD2 2.88Å; K104-D108 PolarHBondContact NZ-OD2 2.85Å; K104-D108 WeakPolarHBondContact O-CB 3.26Å; K104-D108 PolarHBondContact O-N 3.37Å; K104-Y135 HydrophobicContact CB-CD2 4.27Å; K104-Y135 HydrophobicContact CG-CD2 4.11Å; K104-Y135 HydrophobicContact CG-CE2 4.32Å; K104-E138 HydrophobicContact CD-CB 4.24Å; K104-E138 HydrophobicContact CD-CG 3.77Å; K104-E138 WeakPolarHBondContact CD-OE2 3.43Å; K104-T139 PolarHBondContact NZ-OG1 2.91Å
105E98.6Very high98.1Very high133 Ų13354.2 Ų54.262%0.62129%0.294SS*.Hα-helixtrans-57.4-40.9179.2-178.2178.7-162.400112P101 S109P101-E105 WeakPolarHBondContact O-CB 3.43Å; P101-E105 PolarHBondContact O-N 2.81Å; E105-S109 VanDerWaalsContact O-CB 3.26Å; E105-S109 WeakPolarHBondContact O-CB 3.5Å; E105-S109 PolarHBondContact O-N 3.34Å; E105-S109 PolarHBondContact O-OG 2.99Å
106F98.8Very high98.1Very high40 Ų4053.9 Ų53.918%0.17529%0.289CS..Hα-helixtrans-66.2-41177.3-171.3-93.9000112.6H60 I62 L84 M102 T103 K104 C110 V117H60-F106 HydrophobicContact CB-CE1 3.71Å; H60-F106 HydrophobicContact CB-CZ 3.98Å; H60-F106 AromaticContact CD2-CE1 3.96Å; H60-F106 AromaticContact CD2-CE2 3.99Å; H60-F106 AromaticContact CD2-CZ 3.58Å; I62-F106 HydrophobicContact CD1-CD1 3.77Å; I62-F106 HydrophobicContact CD1-CE1 4.38Å; I62-F106 HydrophobicContact CG1-CD1 3.58Å; I62-F106 HydrophobicContact CG1-CE1 3.68Å; L84-F106 HydrophobicContact CB-CD1 4.19Å; L84-F106 HydrophobicContact CB-CD2 3.94Å; L84-F106 HydrophobicContact CB-CE1 4.01Å; L84-F106 HydrophobicContact CB-CE2 3.79Å; L84-F106 HydrophobicContact CB-CG 4.13Å; L84-F106 HydrophobicContact CB-CZ 3.81Å; L84-F106 HydrophobicContact CD2-CB 3.96Å; L84-F106 HydrophobicContact CD2-CD1 4.38Å; L84-F106 HydrophobicContact CD2-CD2 4.31Å; L84-F106 HydrophobicContact CD2-CG 3.98Å; M102-F106 WeakPolarHBondContact O-CB 3.41Å; M102-F106 PolarHBondContact O-N 3.21Å; M102-F106 VanDerWaalsContact O-N 3.1Å; T103-F106 PolarHBondContact O-N 3.18Å; K104-F106 VanDerWaalsContact C-N 3.26Å; K104-F106 PolarHBondContact O-N 3.44Å; F106-C110 WeakPolarHBondContact O-CB 3.42Å; F106-C110 PolarHBondContact O-N 3.06Å; F106-C110 VanDerWaalsContact O-N 3.15Å; F106-V117 HydrophobicContact CE1-CG2 4.4Å
107I98.8Very high98.1Very high0 Ų053.9 Ų53.90%029%0.289CS..Hα-helixtrans-67.2-49.6175.7-65.7166.8000110.2L37 I62 T103 K104 S109 C110 L111 V117 V119 Y135L37-I107 HydrophobicContact CD1-CD1 4.07Å; L37-I107 HydrophobicContact CD1-CG1 4.38Å; L37-I107 HydrophobicContact CD1-CG2 4.38Å; I62-I107 HydrophobicContact CD1-CD1 4.29Å; I62-I107 HydrophobicContact CD1-CG1 3.99Å; T103-I107 HydrophobicContact CG2-CD1 3.84Å; T103-I107 HydrophobicContact CG2-CG1 4.5Å; T103-I107 VanDerWaalsContact O-CG1 3.29Å; T103-I107 WeakPolarHBondContact O-CG1 3.26Å; T103-I107 PolarHBondContact O-N 3.04Å; K104-I107 PolarHBondContact O-N 3.14Å; K104-I107 VanDerWaalsContact O-N 3.13Å; I107-S109 VanDerWaalsContact C-N 3.32Å; I107-S109 PolarHBondContact O-N 2.91Å; I107-C110 WeakPolarHBondContact O-CB 3.18Å; I107-C110 PolarHBondContact O-N 3.16Å; I107-C110 VanDerWaalsContact O-N 3.12Å; I107-L111 HydrophobicContact CG2-CD1 3.76Å; I107-L111 HydrophobicContact CG2-CG 4.15Å; I107-L111 WeakPolarHBondContact O-CG 3.48Å; I107-L111 PolarHBondContact O-N 2.78Å; I107-V117 HydrophobicContact CG1-CG1 4.26Å; I107-V117 HydrophobicContact CG2-CG1 4.11Å; I107-V119 HydrophobicContact CD1-CG2 4.39Å; I107-Y135 HydrophobicContact CB-CD2 3.94Å; I107-Y135 HydrophobicContact CB-CE2 3.72Å; I107-Y135 HydrophobicContact CD1-CD2 3.82Å; I107-Y135 HydrophobicContact CD1-CE2 4.43Å; I107-Y135 HydrophobicContact CD1-CG 3.86Å; I107-Y135 HydrophobicContact CG1-CD2 4.49Å; I107-Y135 HydrophobicContact CG2-CD1 4.39Å; I107-Y135 HydrophobicContact CG2-CD2 3.86Å; I107-Y135 HydrophobicContact CG2-CE1 3.97Å; I107-Y135 HydrophobicContact CG2-CE2 3.34Å; I107-Y135 HydrophobicContact CG2-CG 4.34Å; I107-Y135 VanDerWaalsContact CG2-CZ 3.41Å
108D98.4Very high98.2Very high56 Ų5652.6 Ų52.630%0.29928%0.282SS..Hα-helixtrans-57.1-46.2179.7-74.8-22.2000110.7K104 C110 L111 A112 Y135K104-D108 WeakPolarHBondContact CE-OD2 3.48Å; K104-D108 VanDerWaalsContact CG-OD2 3.28Å; K104-D108 WeakPolarHBondContact CG-OD2 3.25Å; K104-D108 IonicContact NZ-OD1 2.89Å; K104-D108 PolarHBondContact NZ-OD1 3.34Å; K104-D108 IonicContact NZ-OD2 2.88Å; K104-D108 PolarHBondContact NZ-OD2 2.85Å; K104-D108 WeakPolarHBondContact O-CB 3.26Å; K104-D108 PolarHBondContact O-N 3.37Å; D108-C110 VanDerWaalsContact C-N 3.31Å; D108-C110 PolarHBondContact O-N 3.36Å; D108-L111 PolarHBondContact O-N 3.05Å; D108-A112 VanDerWaalsContact O-CB 3.23Å; D108-A112 WeakPolarHBondContact O-CB 3.46Å; D108-A112 PolarHBondContact O-N 3.02Å; D108-Y135 WeakPolarHBondContact OD1-CE2 3.49Å; D108-Y135 PolarHBondContact OD1-OH 2.88Å
109S98.4Very high98.2Very high66 Ų6646 Ų4646%0.46226%0.257SS..Hα-helixtrans-63.1-36.8178.3-60.50000112.7E105 I107 T113E105-S109 VanDerWaalsContact O-CB 3.26Å; E105-S109 WeakPolarHBondContact O-CB 3.5Å; E105-S109 PolarHBondContact O-N 3.34Å; E105-S109 PolarHBondContact O-OG 2.99Å; I107-S109 VanDerWaalsContact C-N 3.32Å; I107-S109 PolarHBondContact O-N 2.91Å; S109-T113 PolarHBondContact O-OG1 3.35Å
110C98.4Very high98.2Very high0 Ų045 Ų450%025%0.253CS..Hα-helixtrans-64.6-54.4174.61750000110.6H60 F106 I107 D108 A112 T113 G115 V117H60-C110 HydrophobicContact CB-CB 4.15Å; H60-C110 PolarHBondContact ND1-SG 3.25Å; F106-C110 WeakPolarHBondContact O-CB 3.42Å; F106-C110 PolarHBondContact O-N 3.06Å; F106-C110 VanDerWaalsContact O-N 3.15Å; I107-C110 WeakPolarHBondContact O-CB 3.18Å; I107-C110 PolarHBondContact O-N 3.16Å; I107-C110 VanDerWaalsContact O-N 3.12Å; D108-C110 VanDerWaalsContact C-N 3.31Å; D108-C110 PolarHBondContact O-N 3.36Å; C110-A112 VanDerWaalsContact C-N 3.32Å; C110-A112 PolarHBondContact O-N 3.05Å; C110-T113 PolarHBondContact O-N 2.88Å; C110-T113 VanDerWaalsContact O-N 3.14Å; C110-T113 PolarHBondContact O-OG1 3.05Å; C110-G115 WeakPolarHBondContact O-CA 3.4Å; C110-G115 PolarHBondContact O-N 3.12Å; C110-G115 VanDerWaalsContact O-N 3.09Å; C110-G115 PolarHBondContact SG-O 3.13Å; C110-G115 VanDerWaalsContact SG-O 3.37Å; C110-V117 HydrophobicContact CB-CB 4.38Å
111L97.7Very high98.2Very high40 Ų4044.9 Ų44.921%0.20925%0.253CS..Hα-helixtrans-67.1-32-174.7-61.9-179.5000112.4L34 I107 D108 T113 D114 G115 Y135L34-L111 HydrophobicContact CD1-CD1 4.18Å; I107-L111 HydrophobicContact CG2-CD1 3.76Å; I107-L111 HydrophobicContact CG2-CG 4.15Å; I107-L111 WeakPolarHBondContact O-CG 3.48Å; I107-L111 PolarHBondContact O-N 2.78Å; D108-L111 PolarHBondContact O-N 3.05Å; L111-T113 PolarHBondContact O-N 3.28Å; L111-T113 VanDerWaalsContact O-N 3.13Å; L111-D114 PolarHBondContact O-N 2.9Å; L111-G115 WeakPolarHBondContact CD2-O 3.48Å; L111-Y135 WeakPolarHBondContact CD1-OH 3.41Å
112A97.4Very high98.2Very high87 Ų8744.7 Ų44.772%0.71925%0.249SC*.THydrogen-bonded Turntrans-64.7-13.1175.600000114.1D108 C110D108-A112 VanDerWaalsContact O-CB 3.23Å; D108-A112 WeakPolarHBondContact O-CB 3.46Å; D108-A112 PolarHBondContact O-N 3.02Å; C110-A112 VanDerWaalsContact C-N 3.32Å; C110-A112 PolarHBondContact O-N 3.05Å
113T96.3Very high98.2Very high98 Ų9842.4 Ų42.460%0.60124%0.244SC*.THydrogen-bonded Turntrans-111.821.3178.260.10000112.6S109 C110 L111 G115S109-T113 PolarHBondContact O-OG1 3.35Å; C110-T113 PolarHBondContact O-N 2.88Å; C110-T113 VanDerWaalsContact O-N 3.14Å; C110-T113 PolarHBondContact O-OG1 3.05Å; L111-T113 PolarHBondContact O-N 3.28Å; L111-T113 VanDerWaalsContact O-N 3.13Å; T113-G115 PolarHBondContact O-N 3.34Å
114D95.8Very high98.1Very high159 Ų15942.3 Ų42.385%0.8524%0.244SC*.THydrogen-bonded Turntrans55.816.3-171.8-63.5-44.1000113.7L111L111-D114 PolarHBondContact O-N 2.9Å
115G97.9Very high98.1Very high6 Ų643.1 Ų43.16%0.06225%0.25CC..  trans-77157.1174.800000111.1T59 C110 L111 T113T59-G115 WeakPolarHBondContact OG1-CA 3.42Å; C110-G115 WeakPolarHBondContact O-CA 3.4Å; C110-G115 PolarHBondContact O-N 3.12Å; C110-G115 VanDerWaalsContact O-N 3.09Å; C110-G115 PolarHBondContact SG-O 3.13Å; C110-G115 VanDerWaalsContact SG-O 3.37Å; L111-G115 WeakPolarHBondContact CD2-O 3.48Å; T113-G115 PolarHBondContact O-N 3.34Å
116K98.8Very high98.1Very high69 Ų6937.1 Ų37.130%0.322%0.222SC..EExtended strand (participates in β ladder)trans-117.1145.3174-53179.2175.5-172.80111.9G36 F38 H56 G57 I58 T59 H60G36-K116 CarbonylContact O-C 3.52Å; G36-K116 WeakPolarHBondContact O-CA 3.49Å; G36-K116 WeakPolarHBondContact O-CB 3.21Å; F38-K116 HydrophobicContact CE2-CB 4.41Å; F38-K116 HydrophobicContact CE2-CD 4.25Å; H56-K116 WeakPolarHBondContact O-CD 3.44Å; H56-K116 PolarHBondContact O-NZ 2.81Å; H56-K116 VanDerWaalsContact O-NZ 3.09Å; G57-K116 WeakPolarHBondContact O-CB 3.45Å; I58-K116 HydrophobicContact CD1-CB 4.15Å; T59-K116 PolarHBondContact N-O 3.34Å; T59-K116 PolarHBondContact OG1-N 3.12Å; T59-K116 PolarHBondContact OG1-O 3.41Å; T59-K116 VanDerWaalsContact OG1-O 3.07Å; H60-K116 PolarHBondContact N-O 3.39Å; H60-K116 VanDerWaalsContact N-O 3.11Å
117V98.9Very high98.1Very high0 Ų035.7 Ų35.70%022%0.215CC..EExtended strand (participates in β ladder)trans-120.5134.8-173.154.50000111.3G36 L37 F38 H60 I62 F106 I107 C110 V119G36-V117 PolarHBondContact O-N 3.29Å; L37-V117 HydrophobicContact CB-CG1 4.33Å; L37-V117 HydrophobicContact CD1-CG1 3.59Å; F38-V117 PolarHBondContact N-O 2.71Å; H60-V117 HydrophobicContact CB-CB 4.06Å; H60-V117 HydrophobicContact CB-CG2 4.1Å; H60-V117 VanDerWaalsContact O-CA 3.28Å; H60-V117 WeakPolarHBondContact O-CA 3.26Å; I62-V117 HydrophobicContact CG1-CG2 4.16Å; F106-V117 HydrophobicContact CE1-CG2 4.4Å; I107-V117 HydrophobicContact CG1-CG1 4.26Å; I107-V117 HydrophobicContact CG2-CG1 4.11Å; C110-V117 HydrophobicContact CB-CB 4.38Å; V117-V119 HydrophobicContact CG2-CG2 4.34Å
118L98.9Very high98.1Very high0 Ų035.7 Ų35.70%022%0.216CC..EExtended strand (participates in β ladder)trans-102.9122.5166.2169.462.7000109.6M30 F38 A45 L53 I58 H60 I61 I62 H120M30-L118 HydrophobicContact CB-CD1 3.77Å; M30-L118 HydrophobicContact CG-CD1 4.47Å; M30-L118 HydrophobicContact SD-CD1 3.93Å; M30-L118 HydrophobicContact SD-CD2 4.04Å; M30-L118 HydrophobicContact SD-CG 4.42Å; F38-L118 HydrophobicContact CB-CB 4.45Å; F38-L118 HydrophobicContact CB-CD1 3.95Å; A45-L118 HydrophobicContact CB-CD2 4.18Å; L53-L118 HydrophobicContact CD2-CD2 3.77Å; I58-L118 HydrophobicContact CD1-CB 4.31Å; I58-L118 HydrophobicContact CG2-CB 4.21Å; H60-L118 PolarHBondContact O-N 3.49Å; I61-L118 CarbonylContact C-O 3.54Å; I61-L118 VanDerWaalsContact CA-O 3.3Å; I61-L118 WeakPolarHBondContact CA-O 3.41Å; I61-L118 HydrophobicContact CG1-CB 4.37Å; I62-L118 PolarHBondContact N-O 3.19Å; L118-H120 HydrophobicContact CD1-CB 4.46Å; L118-H120 HydrophobicContact CG-CB 4.37Å
119V98.9Very high98.1Very high0 Ų033 Ų330%020%0.201CC..EExtended strand (participates in β ladder)trans-99.8118.9167.1-169.70000108.1L37 F38 L39 G40 I62 I107 V117 L131 V132L37-V119 HydrophobicContact CD1-CG2 3.74Å; F38-V119 PolarHBondContact O-N 2.98Å; L39-V119 WeakPolarHBondContact CA-O 2.98Å; G40-V119 PolarHBondContact N-O 3.17Å; G40-V119 VanDerWaalsContact N-O 3.11Å; I62-V119 HydrophobicContact CB-CB 4.39Å; I62-V119 HydrophobicContact CB-CG1 4.08Å; I62-V119 HydrophobicContact CB-CG2 4.24Å; I62-V119 HydrophobicContact CD1-CG2 3.98Å; I62-V119 HydrophobicContact CG1-CG2 4.26Å; I62-V119 HydrophobicContact CG2-CG1 4.28Å; I107-V119 HydrophobicContact CD1-CG2 4.39Å; V117-V119 HydrophobicContact CG2-CG2 4.34Å; V119-L131 HydrophobicContact CG1-CB 4.44Å; V119-L131 HydrophobicContact CG1-CD1 4.41Å; V119-V132 HydrophobicContact CB-CG2 3.9Å; V119-V132 HydrophobicContact CG1-CG2 4.16Å; V119-V132 HydrophobicContact CG2-CG2 3.99Å
120H98.8Very high98.1Very high3 Ų329.9 Ų29.91%0.01418%0.179CC..EExtended strand (participates in β ladder)trans-131146.1177.779.282.2000112.7G40 I62 C63 V64 L118G40-H120 VanDerWaalsContact O-CA 3.24Å; G40-H120 WeakPolarHBondContact O-CA 3.24Å; G40-H120 VanDerWaalsContact O-CB 3.3Å; G40-H120 WeakPolarHBondContact O-CB 3.3Å; I62-H120 PolarHBondContact O-N 3.34Å; C63-H120 VanDerWaalsContact SG-CE1 3.52Å; V64-H120 WeakPolarHBondContact CB-O 3.24Å; V64-H120 PolarHBondContact N-O 3.07Å; L118-H120 HydrophobicContact CD1-CB 4.46Å; L118-H120 HydrophobicContact CG-CB 4.37Å
121G98.2Very high98.2Very high1 Ų130 Ų301%0.0118%0.18CC..  trans-110.4-155.916700000110.2G40 P41 Y42 V64 S128G40-G121 PolarHBondContact O-N 2.7Å; P41-G121 CarbonylContact C-O 3.09Å; Y42-G121 WeakPolarHBondContact CA-O 3.48Å; Y42-G121 WeakPolarHBondContact CB-O 3.49Å; Y42-G121 PolarHBondContact N-O 3.44Å; V64-G121 WeakPolarHBondContact O-CA 3.46Å; G121-S128 PolarHBondContact N-OG 3.46Å
122N98.1Very high98.2Very high51 Ų5128 Ų2827%0.27317%0.17SC..SBendtrans-64.5-72.3165.2-173-19.6000110.5P41 Y42 E69 I73P41-N122 CarbonylContact C-O 3.54Å; P41-N122 VanDerWaalsContact CA-O 3.28Å; P41-N122 WeakPolarHBondContact CA-O 3.32Å; P41-N122 VanDerWaalsContact CB-O 3.32Å; P41-N122 WeakPolarHBondContact CB-O 3.19Å; Y42-N122 WeakPolarHBondContact CD1-O 3.1Å; Y42-N122 PolarHBondContact N-O 2.91Å; E69-N122 PolarHBondContact OE1-ND2 2.7Å; I73-N122 HydrophobicContact CD1-CB 3.56Å
123A97.5Very high98.3Very high45 Ų4523.9 Ų23.937%0.37214%0.136SC..SBendtrans-89-9.7-178.900000114.3I125 R155A123-I125 VanDerWaalsContact C-N 3.27Å; A123-I125 HydrophobicContact CB-CB 4.16Å; A123-I125 HydrophobicContact CB-CD1 3.64Å; A123-I125 HydrophobicContact CB-CG1 3.7Å; A123-I125 PolarHBondContact O-N 3.05Å; A123-R155 PolarHBondContact O-NH2 2.96Å
124G97.3Very high98.4Very high1 Ų119.3 Ų19.31%0.0111%0.108CC..SBendtrans66.130.3-170.800000113.1G40 S128 R155G40-G124 WeakPolarHBondContact O-CA 3.28Å; G124-S128 WeakPolarHBondContact CA-OG 3.34Å; G124-R155 PolarHBondContact O-NE 3.23Å
125I98.3Very high98.5Very high51 Ų5112.3 Ų12.326%0.2627%0.069SC..SBendtrans-110-51.3-171.2-68.4-179.7000111.8A123 A129 C157 N159A123-I125 VanDerWaalsContact C-N 3.27Å; A123-I125 HydrophobicContact CB-CB 4.16Å; A123-I125 HydrophobicContact CB-CD1 3.64Å; A123-I125 HydrophobicContact CB-CG1 3.7Å; A123-I125 PolarHBondContact O-N 3.05Å; I125-A129 WeakPolarHBondContact O-CB 3.46Å; I125-C157 WeakPolarHBondContact CG1-O 3.4Å; I125-C157 WeakPolarHBondContact CG2-O 3.33Å; I125-N159 HydrophobicContact CG2-CB 3.8Å; I125-N159 CarbonylContact O-C 3.46Å; I125-N159 PolarHBondContact O-N 2.98Å
126S98.7Very high98.6Very high6 Ų612 Ų124%0.0427%0.066CC..SBendtrans-111.8-79.9-170.2170.20000112.5D90 S128 A129 A130 N159 N161 F164D90-S126 VanDerWaalsContact OD1-CB 3.22Å; D90-S126 WeakPolarHBondContact OD1-CB 3.44Å; D90-S126 PolarHBondContact OD1-OG 3.38Å; D90-S126 VanDerWaalsContact OD2-CB 3.31Å; D90-S126 WeakPolarHBondContact OD2-CB 3.04Å; S126-S128 PolarHBondContact O-N 3.03Å; S126-A129 PolarHBondContact O-N 2.91Å; S126-A129 VanDerWaalsContact O-N 3.12Å; S126-A130 PolarHBondContact O-N 3.4Å; S126-N159 WeakPolarHBondContact CB-O 3.43Å; S126-N161 PolarHBondContact OG-N 2.96Å; S126-N161 VanDerWaalsContact OG-N 3.1Å; S126-F164 WeakPolarHBondContact OG-CD2 3.3Å
127R98.8Very high98.5Very high10 Ų108.7 Ų8.74%0.0385%0.052CC..Hα-helixtrans-48.8-57.8-176.6-66.8171-78180-5.8114.5V64 E69 I88 D90 A129 A130 L131 F164V64-R127 HydrophobicContact CG1-CB 3.77Å; V64-R127 HydrophobicContact CG1-CG 4.49Å; E69-R127 IonicContact OE1-CZ 3.95Å; E69-R127 IonicContact OE1-NH1 2.78Å; E69-R127 IonicContact OE1-NH2 3.78Å; E69-R127 PolarHBondContact OE1-NH2 2.94Å; E69-R127 IonicContact OE2-CZ 2.7Å; E69-R127 IonicContact OE2-NH1 2.99Å; E69-R127 PolarHBondContact OE2-NH1 3.27Å; E69-R127 IonicContact OE2-NH2 3.95Å; E69-R127 PolarHBondContact OE2-NH2 2.77Å; E69-R127 VanDerWaalsContact OE2-NH2 3.09Å; I88-R127 HydrophobicContact CG2-CB 4.5Å; I88-R127 HydrophobicContact CG2-CG 3.96Å; I88-R127 WeakPolarHBondContact O-CD 3.34Å; I88-R127 PolarHBondContact O-NH1 3.14Å; D90-R127 HydrophobicContact CB-CG 3.93Å; D90-R127 IonicContact OD2-NE 2.71Å; R127-A129 VanDerWaalsContact C-N 3.33Å; R127-A129 PolarHBondContact O-N 3.45Å; R127-A130 PolarHBondContact O-N 2.96Å; R127-L131 PolarHBondContact O-N 2.8Å; R127-F164 HydrophobicContact CB-CE2 4.18Å; R127-F164 HydrophobicContact CG-CE2 3.55Å; R127-F164 HydrophobicContact CG-CZ 3.91Å
128S98.8Very high98.5Very high1 Ų110.3 Ų10.31%0.0076%0.059CC..Hα-helixtrans-69-31.2-178.555.90000112.9L39 G121 G124 S126 L131 V132L39-S128 WeakPolarHBondContact CD1-OG 3.34Å; G121-S128 PolarHBondContact N-OG 3.46Å; G124-S128 WeakPolarHBondContact CA-OG 3.34Å; S126-S128 PolarHBondContact O-N 3.03Å; S128-L131 PolarHBondContact O-N 3.38Å; S128-V132 WeakPolarHBondContact O-CG2 3.41Å; S128-V132 PolarHBondContact O-N 2.91Å
129A98.8Very high98.4Very high0 Ų011.3 Ų11.30%07%0.066CC..Hα-helixtrans-68-41.2175.300000110.8L39 I125 S126 R127 L131 V132 I133 I158 P160L39-A129 HydrophobicContact CD2-CB 4.04Å; I125-A129 WeakPolarHBondContact O-CB 3.46Å; S126-A129 PolarHBondContact O-N 2.91Å; S126-A129 VanDerWaalsContact O-N 3.12Å; R127-A129 VanDerWaalsContact C-N 3.33Å; R127-A129 PolarHBondContact O-N 3.45Å; A129-L131 VanDerWaalsContact C-N 3.33Å; A129-L131 PolarHBondContact O-N 3.48Å; A129-V132 PolarHBondContact O-N 3.07Å; A129-I133 VanDerWaalsContact O-CG1 3.26Å; A129-I133 WeakPolarHBondContact O-CG1 3.26Å; A129-I133 PolarHBondContact O-N 3.46Å; A129-I158 HydrophobicContact CB-CB 3.99Å; A129-I158 HydrophobicContact CB-CG2 3.77Å; A129-P160 HydrophobicContact CB-CG 4.37Å
130A98.8Very high98.2Very high0 Ų012.7 Ų12.70%07%0.072CC..Hα-helixtrans-58.7-43.4175.200000111.8I96 S126 R127 V132 I133 A134 P160 F164 L168I96-A130 HydrophobicContact CD1-CB 4.03Å; S126-A130 PolarHBondContact O-N 3.4Å; R127-A130 PolarHBondContact O-N 2.96Å; A130-V132 PolarHBondContact O-N 3.05Å; A130-I133 PolarHBondContact O-N 2.91Å; A130-A134 WeakPolarHBondContact O-CB 3.18Å; A130-A134 PolarHBondContact O-N 3.11Å; A130-P160 HydrophobicContact CB-CB 4.39Å; A130-F164 HydrophobicContact CB-CB 4.09Å; A130-F164 HydrophobicContact CB-CD2 4.12Å; A130-F164 HydrophobicContact CB-CG 4.36Å; A130-L168 HydrophobicContact CB-CD1 4.24Å; A130-L168 WeakPolarHBondContact O-CD2 3.33Å
131L98.9Very high98Very high1 Ų113.8 Ų13.81%0.0058%0.084CC..Hα-helixtrans-60.9-41.8175.3-63.2-177.8000112.7I62 V64 L86 I96 F99 F100 T103 V119 R127 S128 A129 Y135I62-L131 HydrophobicContact CG2-CD1 4.37Å; V64-L131 HydrophobicContact CG2-CD1 3.52Å; L86-L131 HydrophobicContact CD1-CD1 3.7Å; I96-L131 HydrophobicContact CD1-CD2 4.08Å; I96-L131 HydrophobicContact CD1-CG 4.38Å; I96-L131 HydrophobicContact CG1-CD2 4Å; F99-L131 HydrophobicContact CB-CD2 4.34Å; F100-L131 HydrophobicContact CD1-CD2 3.72Å; F100-L131 HydrophobicContact CE1-CD2 3.9Å; T103-L131 HydrophobicContact CG2-CB 3.94Å; T103-L131 HydrophobicContact CG2-CD1 4.18Å; T103-L131 HydrophobicContact CG2-CD2 4.48Å; T103-L131 HydrophobicContact CG2-CG 4.43Å; V119-L131 HydrophobicContact CG1-CB 4.44Å; V119-L131 HydrophobicContact CG1-CD1 4.41Å; R127-L131 PolarHBondContact O-N 2.8Å; S128-L131 PolarHBondContact O-N 3.38Å; A129-L131 VanDerWaalsContact C-N 3.33Å; A129-L131 PolarHBondContact O-N 3.48Å; L131-Y135 PolarHBondContact O-N 3.11Å
132V98.9Very high97.9Very high0 Ų014.9 Ų14.90%09%0.089CC..Hα-helixtrans-68.4-40177.9170.80000111.7I33 L37 L39 V119 S128 A129 A130 Y135 L136 V151I33-V132 HydrophobicContact CB-CG1 4.41Å; I33-V132 HydrophobicContact CG1-CG1 4.28Å; I33-V132 HydrophobicContact CG2-CG1 3.95Å; L37-V132 HydrophobicContact CD2-CG1 4.14Å; L39-V132 HydrophobicContact CB-CG2 4.41Å; L39-V132 HydrophobicContact CD1-CG2 4.19Å; V119-V132 HydrophobicContact CB-CG2 3.9Å; V119-V132 HydrophobicContact CG1-CG2 4.16Å; V119-V132 HydrophobicContact CG2-CG2 3.99Å; S128-V132 WeakPolarHBondContact O-CG2 3.41Å; S128-V132 PolarHBondContact O-N 2.91Å; A129-V132 PolarHBondContact O-N 3.07Å; A130-V132 PolarHBondContact O-N 3.05Å; V132-Y135 WeakPolarHBondContact O-CB 3.19Å; V132-Y135 PolarHBondContact O-N 3.38Å; V132-L136 HydrophobicContact CG1-CD1 4.42Å; V132-L136 PolarHBondContact O-N 3.43Å; V132-V151 HydrophobicContact CG1-CG1 4.45Å; V132-V151 HydrophobicContact CG1-CG2 4.04Å
133I98.8Very high97.8Very high0 Ų018.8 Ų18.80%010%0.103CC..Hα-helixtrans-63.9-46.5175.5-67.7164000110A129 A130 Y135 L136 M137 Y144 A147 F148 V151 I158 P160 L168A129-I133 VanDerWaalsContact O-CG1 3.26Å; A129-I133 WeakPolarHBondContact O-CG1 3.26Å; A129-I133 PolarHBondContact O-N 3.46Å; A130-I133 PolarHBondContact O-N 2.91Å; I133-Y135 VanDerWaalsContact C-N 3.28Å; I133-Y135 PolarHBondContact O-N 2.95Å; I133-L136 PolarHBondContact O-N 2.87Å; I133-L136 VanDerWaalsContact O-N 3.14Å; I133-M137 HydrophobicContact CG2-CG 4.21Å; I133-M137 HydrophobicContact CG2-SD 3.8Å; I133-M137 VanDerWaalsContact O-CG 3.26Å; I133-M137 WeakPolarHBondContact O-CG 3.06Å; I133-M137 PolarHBondContact O-N 3.46Å; I133-Y144 HydrophobicContact CG2-CD2 4.07Å; I133-Y144 HydrophobicContact CG2-CE2 4.32Å; I133-A147 HydrophobicContact CG2-CB 3.91Å; I133-F148 HydrophobicContact CD1-CB 4.46Å; I133-F148 HydrophobicContact CD1-CD2 3.97Å; I133-V151 HydrophobicContact CG1-CB 4.42Å; I133-V151 HydrophobicContact CG1-CG2 3.94Å; I133-I158 HydrophobicContact CD1-CD1 4.34Å; I133-P160 HydrophobicContact CD1-CG 3.81Å; I133-L168 HydrophobicContact CB-CD1 4.25Å; I133-L168 HydrophobicContact CB-CD2 4.35Å; I133-L168 HydrophobicContact CG2-CD1 3.94Å; I133-L168 HydrophobicContact CG2-CD2 4.09Å
134A98.8Very high97.8Very high2 Ų218.4 Ų18.42%0.0179%0.093CC..Hα-helixtrans-56.7-43.5176.400000111.7F100 A130 M137 E138 L168 Y171F100-A134 HydrophobicContact CB-CB 4.1Å; F100-A134 HydrophobicContact CD1-CB 3.52Å; F100-A134 HydrophobicContact CD2-CB 3.81Å; F100-A134 HydrophobicContact CE1-CB 3.77Å; F100-A134 HydrophobicContact CE2-CB 4.05Å; F100-A134 HydrophobicContact CG-CB 3.55Å; F100-A134 HydrophobicContact CZ-CB 4.02Å; A130-A134 WeakPolarHBondContact O-CB 3.18Å; A130-A134 PolarHBondContact O-N 3.11Å; A134-M137 PolarHBondContact O-N 2.82Å; A134-E138 PolarHBondContact O-N 3.28Å; A134-L168 HydrophobicContact CB-CD2 3.6Å; A134-Y171 HydrophobicContact CB-CD1 4.39Å
135Y98.7Very high97.7Very high11 Ų1127.4 Ų27.44%0.04313%0.126CC..Hα-helixtrans-59.4-46.9175.7175-96000112.2L34 L37 K104 I107 D108 L111 L131 V132 I133 T139 F140L34-Y135 HydrophobicContact CD2-CD1 4.31Å; L34-Y135 HydrophobicContact CD2-CE1 3.8Å; L37-Y135 HydrophobicContact CD2-CD1 3.66Å; L37-Y135 HydrophobicContact CD2-CE1 3.96Å; K104-Y135 HydrophobicContact CB-CD2 4.27Å; K104-Y135 HydrophobicContact CG-CD2 4.11Å; K104-Y135 HydrophobicContact CG-CE2 4.32Å; I107-Y135 HydrophobicContact CB-CD2 3.94Å; I107-Y135 HydrophobicContact CB-CE2 3.72Å; I107-Y135 HydrophobicContact CD1-CD2 3.82Å; I107-Y135 HydrophobicContact CD1-CE2 4.43Å; I107-Y135 HydrophobicContact CD1-CG 3.86Å; I107-Y135 HydrophobicContact CG1-CD2 4.49Å; I107-Y135 HydrophobicContact CG2-CD1 4.39Å; I107-Y135 HydrophobicContact CG2-CD2 3.86Å; I107-Y135 HydrophobicContact CG2-CE1 3.97Å; I107-Y135 HydrophobicContact CG2-CE2 3.34Å; I107-Y135 HydrophobicContact CG2-CG 4.34Å; I107-Y135 VanDerWaalsContact CG2-CZ 3.41Å; D108-Y135 WeakPolarHBondContact OD1-CE2 3.49Å; D108-Y135 PolarHBondContact OD1-OH 2.88Å; L111-Y135 WeakPolarHBondContact CD1-OH 3.41Å; L131-Y135 PolarHBondContact O-N 3.11Å; V132-Y135 WeakPolarHBondContact O-CB 3.19Å; V132-Y135 PolarHBondContact O-N 3.38Å; I133-Y135 VanDerWaalsContact C-N 3.28Å; I133-Y135 PolarHBondContact O-N 2.95Å; Y135-T139 WeakPolarHBondContact CE2-OG1 3.37Å; Y135-T139 WeakPolarHBondContact O-CB 3.2Å; Y135-T139 PolarHBondContact O-N 3.39Å; Y135-T139 PolarHBondContact O-OG1 3.42Å; Y135-F140 HydrophobicContact CE1-CE2 4.36Å
136L98.3Very high97.7Very high0 Ų029 Ų290%014%0.135CC..Hα-helixtrans-63-44.6178.1-77.7168.1000112.1L12 I33 L34 V132 I133 F140 M142 A147 Y150 V151L12-L136 HydrophobicContact CD2-CD2 4.24Å; I33-L136 HydrophobicContact CG2-CD1 4.13Å; L34-L136 HydrophobicContact CD2-CD2 3.67Å; V132-L136 HydrophobicContact CG1-CD1 4.42Å; V132-L136 PolarHBondContact O-N 3.43Å; I133-L136 PolarHBondContact O-N 2.87Å; I133-L136 VanDerWaalsContact O-N 3.14Å; L136-F140 HydrophobicContact CD2-CD2 3.76Å; L136-F140 HydrophobicContact CD2-CE2 3.86Å; L136-F140 WeakPolarHBondContact O-CB 3.15Å; L136-F140 PolarHBondContact O-N 2.81Å; L136-M142 HydrophobicContact CB-SD 4.22Å; L136-M142 HydrophobicContact CD2-SD 4.47Å; L136-A147 HydrophobicContact CB-CB 4.13Å; L136-Y150 HydrophobicContact CD1-CD1 3.82Å; L136-Y150 HydrophobicContact CD1-CE1 4.39Å; L136-Y150 HydrophobicContact CD2-CD1 4.35Å; L136-Y150 HydrophobicContact CD2-CE1 4.28Å; L136-V151 HydrophobicContact CD1-CG2 3.25Å
137M98.3Very high97.7Very high0 Ų028.7 Ų28.70%013%0.133CC..Hα-helixtrans-57.4-53.8178.8-69.2173.361.100111.1I133 A134 G141 M142 Y144 A147 L168 E172 Y175I133-M137 HydrophobicContact CG2-CG 4.21Å; I133-M137 HydrophobicContact CG2-SD 3.8Å; I133-M137 VanDerWaalsContact O-CG 3.26Å; I133-M137 WeakPolarHBondContact O-CG 3.06Å; I133-M137 PolarHBondContact O-N 3.46Å; A134-M137 PolarHBondContact O-N 2.82Å; M137-G141 CarbonylContact O-C 3.56Å; M137-G141 WeakPolarHBondContact O-CA 3.41Å; M137-G141 PolarHBondContact O-N 3.12Å; M137-M142 WeakPolarHBondContact CA-O 3.39Å; M137-M142 WeakPolarHBondContact CB-O 3.35Å; M137-M142 WeakPolarHBondContact CG-O 3.35Å; M137-M142 PolarHBondContact O-N 3.24Å; M137-Y144 HydrophobicContact SD-CD2 4.35Å; M137-A147 HydrophobicContact CG-CB 3.66Å; M137-L168 WeakPolarHBondContact CE-O 3.23Å; M137-L168 HydrophobicContact SD-CB 4.19Å; M137-L168 HydrophobicContact SD-CD2 4.07Å; M137-E172 HydrophobicContact CE-CB 3.99Å; M137-Y175 HydrophobicContact CB-CE1 4.14Å; M137-Y175 PolarHBondContact O-OH 3.48Å
138E97.6Very high97.6Very high33 Ų3329.9 Ų29.915%0.15414%0.139CC..Hα-helixtrans-71.7-34.7-176.5-175.5174.4-171.200112.9K104 A134 Y171 Y175K104-E138 HydrophobicContact CD-CB 4.24Å; K104-E138 HydrophobicContact CD-CG 3.77Å; K104-E138 WeakPolarHBondContact CD-OE2 3.43Å; A134-E138 PolarHBondContact O-N 3.28Å; E138-Y171 HydrophobicContact CB-CE1 4.11Å; E138-Y171 VanDerWaalsContact CD-OH 3.28Å; E138-Y171 WeakPolarHBondContact OE2-CE1 3.3Å; E138-Y171 VanDerWaalsContact OE2-CZ 3.23Å; E138-Y171 PolarHBondContact OE2-OH 3.36Å; E138-Y175 HydrophobicContact CB-CD1 3.94Å; E138-Y175 HydrophobicContact CB-CD2 4.5Å; E138-Y175 HydrophobicContact CB-CE1 4.15Å; E138-Y175 HydrophobicContact CB-CG 4.15Å; E138-Y175 HydrophobicContact CG-CD1 4.16Å; E138-Y175 HydrophobicContact CG-CD2 4.2Å; E138-Y175 HydrophobicContact CG-CG 3.87Å
139T96.6Very high97.6Very high22 Ų2231.9 Ų31.914%0.13515%0.153CC..Hα-helixtrans-80.2-37.8-175.1-53.70000112.4P10 K104 Y135P10-T139 WeakPolarHBondContact CD-O 3.37Å; P10-T139 WeakPolarHBondContact CG-O 3.43Å; K104-T139 PolarHBondContact NZ-OG1 2.91Å; Y135-T139 WeakPolarHBondContact CE2-OG1 3.37Å; Y135-T139 WeakPolarHBondContact O-CB 3.2Å; Y135-T139 PolarHBondContact O-N 3.39Å; Y135-T139 PolarHBondContact O-OG1 3.42Å
140F95.8Very high97.4Very high29 Ų2932.8 Ų32.813%0.12716%0.156CC..Hα-helixtrans-1136.1-174.8-59.2-82.8000113.2F9 P10 L12 L34 Y135 L136 M142F9-F140 WeakPolarHBondContact CB-O 3.42Å; P10-F140 HydrophobicContact CB-CD1 4.44Å; P10-F140 HydrophobicContact CG-CD1 3.98Å; P10-F140 HydrophobicContact CG-CE1 4.22Å; P10-F140 WeakPolarHBondContact O-CD1 3.36Å; L12-F140 HydrophobicContact CD2-CB 4.21Å; L12-F140 HydrophobicContact CD2-CD1 3.88Å; L12-F140 HydrophobicContact CD2-CD2 3.92Å; L12-F140 HydrophobicContact CD2-CE1 4.22Å; L12-F140 HydrophobicContact CD2-CE2 4.26Å; L12-F140 HydrophobicContact CD2-CG 3.72Å; L12-F140 HydrophobicContact CD2-CZ 4.4Å; L12-F140 HydrophobicContact CG-CD1 4.33Å; L12-F140 HydrophobicContact CG-CG 4.41Å; L34-F140 HydrophobicContact CD2-CE2 3.81Å; L34-F140 HydrophobicContact CD2-CZ 4.24Å; Y135-F140 HydrophobicContact CE1-CE2 4.36Å; L136-F140 HydrophobicContact CD2-CD2 3.76Å; L136-F140 HydrophobicContact CD2-CE2 3.86Å; L136-F140 WeakPolarHBondContact O-CB 3.15Å; L136-F140 PolarHBondContact O-N 2.81Å; F140-M142 HydrophobicContact CB-CG 3.92Å; F140-M142 HydrophobicContact CB-SD 4.25Å; F140-M142 PolarHBondContact O-N 3.42Å
141G94.8Very high97.4Very high26 Ų2632.8 Ų32.827%0.26816%0.156SC..THydrogen-bonded Turntrans63.627179.500000113.2F9 M137F9-G141 VanDerWaalsContact CG-CA 3.42Å; M137-G141 CarbonylContact O-C 3.56Å; M137-G141 WeakPolarHBondContact O-CA 3.41Å; M137-G141 PolarHBondContact O-N 3.12Å
142M95.1Very high97.2Very high23 Ų2335.7 Ų35.711%0.11317%0.17CC..  trans-78.6138.7-178.7-63.2178.179.800110L12 L136 M137 F140 D146 A147 Y150L12-M142 HydrophobicContact CD1-CE 4Å; L12-M142 HydrophobicContact CD1-SD 4.04Å; L12-M142 HydrophobicContact CD2-SD 4.01Å; L12-M142 HydrophobicContact CG-SD 4.37Å; L136-M142 HydrophobicContact CB-SD 4.22Å; L136-M142 HydrophobicContact CD2-SD 4.47Å; M137-M142 WeakPolarHBondContact CA-O 3.39Å; M137-M142 WeakPolarHBondContact CB-O 3.35Å; M137-M142 WeakPolarHBondContact CG-O 3.35Å; M137-M142 PolarHBondContact O-N 3.24Å; F140-M142 HydrophobicContact CB-CG 3.92Å; F140-M142 HydrophobicContact CB-SD 4.25Å; F140-M142 PolarHBondContact O-N 3.42Å; M142-D146 VanDerWaalsContact CE-C 3.48Å; M142-D146 HydrophobicContact CE-CB 4.01Å; M142-D146 WeakPolarHBondContact CE-O 3.05Å; M142-A147 HydrophobicContact CB-CB 3.96Å; M142-A147 HydrophobicContact CE-CB 4.38Å; M142-A147 HydrophobicContact SD-CB 4.32Å; M142-Y150 HydrophobicContact CE-CG 4.33Å
143K95.8Very high97Very high133 Ų13342.5 Ų42.558%0.57820%0.202SC*.  trans-65.6154.4165.5-65.4-176178.2-179.70109.5R145 D146 A147K143-R145 VanDerWaalsContact C-N 3.26Å; K143-R145 PolarHBondContact O-N 3.01Å; K143-R145 VanDerWaalsContact O-N 3.16Å; K143-D146 PolarHBondContact O-N 3.4Å; K143-A147 PolarHBondContact O-N 3.39Å
144Y97.3Very high96.8Very high37 Ų3744.4 Ų44.415%0.14521%0.209CC..Hα-helixtrans-47.8-47.9178.1165.4-102.3000112.9I133 M137 D146 A147 F148 V165 L168 Q169I133-Y144 HydrophobicContact CG2-CD2 4.07Å; I133-Y144 HydrophobicContact CG2-CE2 4.32Å; M137-Y144 HydrophobicContact SD-CD2 4.35Å; Y144-D146 VanDerWaalsContact C-N 3.33Å; Y144-D146 PolarHBondContact O-N 2.88Å; Y144-A147 PolarHBondContact O-N 2.89Å; Y144-F148 HydrophobicContact CE2-CB 4.2Å; Y144-F148 HydrophobicContact CE2-CD2 4.42Å; Y144-F148 VanDerWaalsContact O-CB 3.23Å; Y144-F148 WeakPolarHBondContact O-CB 3.37Å; Y144-F148 PolarHBondContact O-N 3.37Å; Y144-F148 WeakPolarHBondContact OH-CD2 3.14Å; Y144-V165 HydrophobicContact CD1-CG1 4.38Å; Y144-V165 HydrophobicContact CE1-CG1 3.7Å; Y144-V165 HydrophobicContact CE2-CG1 4.23Å; Y144-V165 HydrophobicContact CE2-CG2 4.43Å; Y144-V165 VanDerWaalsContact OH-CG2 3.3Å; Y144-V165 WeakPolarHBondContact OH-CG2 3.48Å; Y144-L168 HydrophobicContact CD2-CB 3.84Å; Y144-L168 HydrophobicContact CD2-CD1 3.87Å; Y144-L168 HydrophobicContact CD2-CG 4.46Å; Y144-L168 HydrophobicContact CE2-CB 4.35Å; Y144-L168 HydrophobicContact CE2-CD1 3.65Å; Y144-Q169 HydrophobicContact CD1-CG 4.43Å; Y144-Q169 HydrophobicContact CG-CG 4.29Å
145R97.1Very high96.6Very high190 Ų19044.3 Ų44.372%0.71721%0.208SC*.Hα-helixtrans-59.9-43.5-177.5-178-178.9172.8-172.5-3.7111.9K143 S149K143-R145 VanDerWaalsContact C-N 3.26Å; K143-R145 PolarHBondContact O-N 3.01Å; K143-R145 VanDerWaalsContact O-N 3.16Å; R145-S149 PolarHBondContact O-N 2.82Å; R145-S149 PolarHBondContact O-OG 3.07Å; R145-S149 VanDerWaalsContact O-OG 3.07Å
146D97.1Very high96.4Very high84 Ų8449.7 Ų49.745%0.44923%0.232SC..Hα-helixtrans-73-41.9-176.6-55.4-35.3000110.4M142 K143 Y144 S149 Y150M142-D146 VanDerWaalsContact CE-C 3.48Å; M142-D146 HydrophobicContact CE-CB 4.01Å; M142-D146 WeakPolarHBondContact CE-O 3.05Å; K143-D146 PolarHBondContact O-N 3.4Å; Y144-D146 VanDerWaalsContact C-N 3.33Å; Y144-D146 PolarHBondContact O-N 2.88Å; D146-S149 PolarHBondContact O-N 3.18Å; D146-Y150 WeakPolarHBondContact O-CB 3.49Å; D146-Y150 PolarHBondContact O-N 3.18Å
147A98Very high96.3Very high0 Ų051 Ų510%024%0.241CC..Hα-helixtrans-63.8-41.7175.100000111.7I133 L136 M137 M142 K143 Y144 Y150 V151I133-A147 HydrophobicContact CG2-CB 3.91Å; L136-A147 HydrophobicContact CB-CB 4.13Å; M137-A147 HydrophobicContact CG-CB 3.66Å; M142-A147 HydrophobicContact CB-CB 3.96Å; M142-A147 HydrophobicContact CE-CB 4.38Å; M142-A147 HydrophobicContact SD-CB 4.32Å; K143-A147 PolarHBondContact O-N 3.39Å; Y144-A147 PolarHBondContact O-N 2.89Å; A147-Y150 PolarHBondContact O-N 3.21Å; A147-V151 VanDerWaalsContact O-CG2 3.3Å; A147-V151 WeakPolarHBondContact O-CG2 3.46Å; A147-V151 PolarHBondContact O-N 2.87Å; A147-V151 VanDerWaalsContact O-N 3.11Å
148F98.3Very high96.3Very high35 Ų3551.3 Ų51.315%0.15424%0.242CC..Hα-helixtrans-59.5-52.3174.6176.2-87.3000111.1I133 Y144 Y150 V151 Q152 I158I133-F148 HydrophobicContact CD1-CB 4.46Å; I133-F148 HydrophobicContact CD1-CD2 3.97Å; Y144-F148 HydrophobicContact CE2-CB 4.2Å; Y144-F148 HydrophobicContact CE2-CD2 4.42Å; Y144-F148 VanDerWaalsContact O-CB 3.23Å; Y144-F148 WeakPolarHBondContact O-CB 3.37Å; Y144-F148 PolarHBondContact O-N 3.37Å; Y144-F148 WeakPolarHBondContact OH-CD2 3.14Å; F148-Y150 VanDerWaalsContact C-N 3.31Å; F148-Y150 PolarHBondContact O-N 2.83Å; F148-V151 PolarHBondContact O-N 2.97Å; F148-Q152 HydrophobicContact CE1-CB 4.3Å; F148-Q152 WeakPolarHBondContact O-CB 2.99Å; F148-Q152 PolarHBondContact O-N 2.99Å; F148-I158 HydrophobicContact CD2-CD1 4.11Å; F148-I158 HydrophobicContact CE2-CD1 4.02Å; F148-I158 HydrophobicContact CE2-CG1 4.11Å; F148-I158 HydrophobicContact CZ-CD1 4.48Å; F148-I158 HydrophobicContact CZ-CG1 4.33Å
149S97.3Very high96.4Very high43 Ų4355 Ų5530%0.30126%0.264SS..Hα-helixtrans-58.2-44.3178.8-63.80000111.7R145 D146 V151 Q152 E153R145-S149 PolarHBondContact O-N 2.82Å; R145-S149 PolarHBondContact O-OG 3.07Å; R145-S149 VanDerWaalsContact O-OG 3.07Å; D146-S149 PolarHBondContact O-N 3.18Å; S149-V151 PolarHBondContact O-N 3.08Å; S149-Q152 PolarHBondContact O-N 3.05Å; S149-Q152 VanDerWaalsContact O-N 3.11Å; S149-E153 WeakPolarHBondContact O-CG 3.37Å; S149-E153 PolarHBondContact O-N 3.32Å
150Y96.3Very high96.4Very high20 Ų2054.2 Ų54.28%0.07826%0.259CS..Hα-helixtrans-59.1-43.2179.4-177.4-87.8000113L12 T15 I33 L136 M142 D146 A147 F148 R154L12-Y150 HydrophobicContact CD1-CD2 3.87Å; L12-Y150 HydrophobicContact CD1-CE2 3.74Å; L12-Y150 HydrophobicContact CD2-CE2 4.26Å; L12-Y150 HydrophobicContact CG-CE2 4.49Å; T15-Y150 WeakPolarHBondContact CG2-OH 3.46Å; I33-Y150 HydrophobicContact CG2-CD1 4.3Å; I33-Y150 HydrophobicContact CG2-CE1 4.09Å; I33-Y150 VanDerWaalsContact O-CE1 3.24Å; I33-Y150 WeakPolarHBondContact O-CE1 3.26Å; I33-Y150 PolarHBondContact O-OH 3.34Å; L136-Y150 HydrophobicContact CD1-CD1 3.82Å; L136-Y150 HydrophobicContact CD1-CE1 4.39Å; L136-Y150 HydrophobicContact CD2-CD1 4.35Å; L136-Y150 HydrophobicContact CD2-CE1 4.28Å; M142-Y150 HydrophobicContact CE-CG 4.33Å; D146-Y150 WeakPolarHBondContact O-CB 3.49Å; D146-Y150 PolarHBondContact O-N 3.18Å; A147-Y150 PolarHBondContact O-N 3.21Å; F148-Y150 VanDerWaalsContact C-N 3.31Å; F148-Y150 PolarHBondContact O-N 2.83Å; Y150-R154 VanDerWaalsContact CE2-CZ 3.42Å; Y150-R154 VanDerWaalsContact CE2-NH2 3.33Å; Y150-R154 PolarHBondContact O-NH1 3Å
151V97.3Very high96.6Very high0 Ų054.1 Ų54.10%026%0.259CS..Hα-helixtrans-71.3-38.7175.8-175.50000110.2I33 L39 V132 I133 L136 A147 F148 S149 E153 R154 R155 I158I33-V151 HydrophobicContact CD1-CG1 3.96Å; I33-V151 HydrophobicContact CG1-CG1 4.44Å; I33-V151 HydrophobicContact CG2-CG1 4.45Å; I33-V151 HydrophobicContact CG2-CG2 3.95Å; L39-V151 HydrophobicContact CD2-CG1 3.72Å; V132-V151 HydrophobicContact CG1-CG1 4.45Å; V132-V151 HydrophobicContact CG1-CG2 4.04Å; I133-V151 HydrophobicContact CG1-CB 4.42Å; I133-V151 HydrophobicContact CG1-CG2 3.94Å; L136-V151 HydrophobicContact CD1-CG2 3.25Å; A147-V151 VanDerWaalsContact O-CG2 3.3Å; A147-V151 WeakPolarHBondContact O-CG2 3.46Å; A147-V151 PolarHBondContact O-N 2.87Å; A147-V151 VanDerWaalsContact O-N 3.11Å; F148-V151 PolarHBondContact O-N 2.97Å; S149-V151 PolarHBondContact O-N 3.08Å; V151-E153 PolarHBondContact O-N 3.01Å; V151-R154 PolarHBondContact O-N 3.17Å; V151-R154 VanDerWaalsContact O-N 3.16Å; V151-R155 PolarHBondContact O-N 3.27Å; V151-I158 HydrophobicContact CB-CD1 3.64Å; V151-I158 HydrophobicContact CG1-CD1 3.65Å; V151-I158 HydrophobicContact CG1-CG2 4.06Å
152Q96.3Very high96.8Very high62 Ų6257.7 Ų57.729%0.2928%0.276SS..Hα-helixtrans-64.1-40.1-179-172.5176.153.600112.1F148 S149 R154 R155 F156 I158F148-Q152 HydrophobicContact CE1-CB 4.3Å; F148-Q152 WeakPolarHBondContact O-CB 2.99Å; F148-Q152 PolarHBondContact O-N 2.99Å; S149-Q152 PolarHBondContact O-N 3.05Å; S149-Q152 VanDerWaalsContact O-N 3.11Å; Q152-R154 PolarHBondContact O-N 3.49Å; Q152-R155 CarbonylContact O-C 3.47Å; Q152-R155 PolarHBondContact O-N 2.93Å; Q152-F156 HydrophobicContact CG-CD2 4.49Å; Q152-F156 WeakPolarHBondContact O-CA 3.48Å; Q152-F156 PolarHBondContact O-N 3.02Å; Q152-I158 HydrophobicContact CB-CD1 3.87Å; Q152-I158 HydrophobicContact CB-CG1 3.96Å; Q152-I158 HydrophobicContact CG-CG1 4.28Å
153E93.7Very high96.9Very high142 Ų14257 Ų5766%0.66427%0.274SS*.Hα-helixtrans-58-30.5175.4-74.5168.8-176.300112.6S149 V151S149-E153 WeakPolarHBondContact O-CG 3.37Å; S149-E153 PolarHBondContact O-N 3.32Å; V151-E153 PolarHBondContact O-N 3.01Å
154R93.6Very high97.1Very high40 Ų4050.6 Ų50.615%0.15125%0.247CC..Hα-helixtrans-94.8-29.3-179.8-68.4163.4-176.66110.7112.7T15 Q31 I33 Y150 V151 Q152T15-R154 VanDerWaalsContact CG2-NH2 3.32Å; T15-R154 PolarHBondContact OG1-NH2 3.49Å; T15-R154 VanDerWaalsContact OG1-NH2 3.14Å; Q31-R154 WeakPolarHBondContact CG-O 3.2Å; I33-R154 HydrophobicContact CD1-CB 3.81Å; I33-R154 WeakPolarHBondContact O-CD 3.42Å; I33-R154 PolarHBondContact O-NE 3.06Å; Y150-R154 VanDerWaalsContact CE2-CZ 3.42Å; Y150-R154 VanDerWaalsContact CE2-NH2 3.33Å; Y150-R154 PolarHBondContact O-NH1 3Å; V151-R154 PolarHBondContact O-N 3.17Å; V151-R154 VanDerWaalsContact O-N 3.16Å; Q152-R154 PolarHBondContact O-N 3.49Å
155R95.4Very high97.1Very high1 Ų150.1 Ų50.10%0.00425%0.247CC..SBendtrans-137.586.9174.7-174.3174.3176.379.92.3109.7R27 D29 I33 A123 G124 V151 Q152 C157 I158R27-R155 PolarHBondContact O-NH1 3.32Å; R27-R155 PolarHBondContact O-NH2 3.2Å; D29-R155 PolarHBondContact O-NH1 3.39Å; I33-R155 HydrophobicContact CD1-CB 4.36Å; A123-R155 PolarHBondContact O-NH2 2.96Å; G124-R155 PolarHBondContact O-NE 3.23Å; V151-R155 PolarHBondContact O-N 3.27Å; Q152-R155 CarbonylContact O-C 3.47Å; Q152-R155 PolarHBondContact O-N 2.93Å; R155-C157 PolarHBondContact O-N 3.19Å; R155-I158 HydrophobicContact CB-CG2 4.13Å; R155-I158 HydrophobicContact CG-CG2 4.03Å; R155-I158 WeakPolarHBondContact O-CG2 3.49Å; R155-I158 PolarHBondContact O-N 3.17Å; R155-I158 VanDerWaalsContact O-N 3.15Å
156F95.1Very high97.2Very high123 Ų12346.4 Ų46.454%0.53924%0.238SC..THydrogen-bonded Turntrans-53.4-30.5-172.8-172.7-105.3000115.2W22 Q152 I158W22-F156 HydrophobicContact CD2-CB 3.98Å; W22-F156 HydrophobicContact CD2-CD1 4.39Å; W22-F156 HydrophobicContact CD2-CG 4.43Å; W22-F156 HydrophobicContact CE3-CD1 4.37Å; W22-F156 HydrophobicContact CG-CB 4.01Å; W22-F156 HydrophobicContact CH2-CD1 4.07Å; W22-F156 HydrophobicContact CZ2-CB 4.26Å; W22-F156 HydrophobicContact CZ2-CD1 4.16Å; W22-F156 HydrophobicContact CZ3-CD1 4.22Å; Q152-F156 HydrophobicContact CG-CD2 4.49Å; Q152-F156 WeakPolarHBondContact O-CA 3.48Å; Q152-F156 PolarHBondContact O-N 3.02Å; F156-I158 VanDerWaalsContact C-N 3.32Å; F156-I158 PolarHBondContact O-N 3.26Å
157C96.1Very high97.2Very high29 Ų2943.3 Ų43.320%0.19622%0.221CC..THydrogen-bonded Turntrans-83.95-174.7680000115.1I125 R155I125-C157 WeakPolarHBondContact CG1-O 3.4Å; I125-C157 WeakPolarHBondContact CG2-O 3.33Å; R155-C157 PolarHBondContact O-N 3.19Å
158I98.4Very high97.3Very high5 Ų543.3 Ų43.33%0.02622%0.221CC..  trans-62.7143175.266.7171.3000110.7L39 A129 I133 F148 V151 Q152 R155 F156L39-I158 HydrophobicContact CD2-CG2 3.78Å; A129-I158 HydrophobicContact CB-CB 3.99Å; A129-I158 HydrophobicContact CB-CG2 3.77Å; I133-I158 HydrophobicContact CD1-CD1 4.34Å; F148-I158 HydrophobicContact CD2-CD1 4.11Å; F148-I158 HydrophobicContact CE2-CD1 4.02Å; F148-I158 HydrophobicContact CE2-CG1 4.11Å; F148-I158 HydrophobicContact CZ-CD1 4.48Å; F148-I158 HydrophobicContact CZ-CG1 4.33Å; V151-I158 HydrophobicContact CB-CD1 3.64Å; V151-I158 HydrophobicContact CG1-CD1 3.65Å; V151-I158 HydrophobicContact CG1-CG2 4.06Å; Q152-I158 HydrophobicContact CB-CD1 3.87Å; Q152-I158 HydrophobicContact CB-CG1 3.96Å; Q152-I158 HydrophobicContact CG-CG1 4.28Å; R155-I158 HydrophobicContact CB-CG2 4.13Å; R155-I158 HydrophobicContact CG-CG2 4.03Å; R155-I158 WeakPolarHBondContact O-CG2 3.49Å; R155-I158 PolarHBondContact O-N 3.17Å; R155-I158 VanDerWaalsContact O-N 3.15Å; F156-I158 VanDerWaalsContact C-N 3.32Å; F156-I158 PolarHBondContact O-N 3.26Å
159N98.3Very high97.2Very high112 Ų11246.3 Ų46.360%0.59924%0.235SC*.  trans-164.677.7176.3-168.129.4000109.1I125 S126 N161I125-N159 HydrophobicContact CG2-CB 3.8Å; I125-N159 CarbonylContact O-C 3.46Å; I125-N159 PolarHBondContact O-N 2.98Å; S126-N159 WeakPolarHBondContact CB-O 3.43Å; N159-N161 PolarHBondContact O-N 3.25Å
160P98.6Very high97.1Very high5 Ų549.6 Ų49.63%0.03225%0.246CC..  trans-51.4139.1170.1-23.335.2000111A129 A130 I133 F164 V165A129-P160 HydrophobicContact CB-CG 4.37Å; A130-P160 HydrophobicContact CB-CB 4.39Å; I133-P160 HydrophobicContact CD1-CG 3.81Å; P160-F164 HydrophobicContact CB-CB 4.2Å; P160-V165 HydrophobicContact CB-CG2 4.17Å
161N98.6Very high97.1Very high27 Ų2748.8 Ų48.814%0.14424%0.243CC..  trans-64.2159.5174.976.259.8000110.9D90 N91 P92 S126 N159 G163 F164 V165D90-N161 PolarHBondContact OD1-ND2 2.76Å; D90-N161 VanDerWaalsContact OD1-ND2 3.15Å; N91-N161 PolarHBondContact O-ND2 3.13Å; P92-N161 WeakPolarHBondContact CA-OD1 3.44Å; S126-N161 PolarHBondContact OG-N 2.96Å; S126-N161 VanDerWaalsContact OG-N 3.1Å; N159-N161 PolarHBondContact O-N 3.25Å; N161-G163 VanDerWaalsContact C-N 3.26Å; N161-G163 PolarHBondContact O-N 2.79Å; N161-G163 WeakPolarHBondContact OD1-CA 3.43Å; N161-G163 PolarHBondContact OD1-N 3.46Å; N161-F164 WeakPolarHBondContact ND2-CD2 3.29Å; N161-F164 WeakPolarHBondContact ND2-CE2 3.42Å; N161-F164 WeakPolarHBondContact ND2-CG 3.37Å; N161-F164 VanDerWaalsContact ND2-CZ 3.35Å; N161-F164 WeakPolarHBondContact ND2-CZ 3.43Å; N161-F164 WeakPolarHBondContact O-CB 3.28Å; N161-F164 PolarHBondContact O-N 2.96Å; N161-F164 PolarHBondContact OD1-N 2.87Å; N161-V165 PolarHBondContact O-N 2.92Å
162V98.4Very high96.9Very high100 Ų10051.1 Ų51.161%0.60625%0.253SS*.Hα-helixtrans-57-35-174.2-63.20000114P92 V165 H166P92-V162 HydrophobicContact CB-CG2 4.11Å; P92-V162 HydrophobicContact CG-CG2 4.07Å; V162-V165 PolarHBondContact O-N 3.19Å; V162-H166 PolarHBondContact O-CD2 3.49Å; V162-H166 PolarHBondContact O-N 3.03Å
163G98.6Very high96.6Very high8 Ų851.4 Ų51.48%0.08227%0.266CS..Hα-helixtrans-69.5-35.7177.700000112.7P92 N161 H166 Q167P92-G163 WeakPolarHBondContact O-CA 3.46Å; N161-G163 VanDerWaalsContact C-N 3.26Å; N161-G163 PolarHBondContact O-N 2.79Å; N161-G163 WeakPolarHBondContact OD1-CA 3.43Å; N161-G163 PolarHBondContact OD1-N 3.46Å; G163-H166 PolarHBondContact O-N 2.9Å; G163-Q167 WeakPolarHBondContact O-CB 3.17Å; G163-Q167 WeakPolarHBondContact O-CG 3.43Å; G163-Q167 PolarHBondContact O-N 2.87Å; G163-Q167 PolarHBondContact O-NE2 2.8Å
164F98.6Very high96.5Very high0 Ų048.1 Ų48.10%025%0.253CS..Hα-helixtrans-69.6-36.8172.5-64-12.8000112.1I88 A89 E94 I96 S126 R127 A130 P160 N161 H166 Q167 L168I88-F164 HydrophobicContact CG2-CZ 4.22Å; A89-F164 WeakPolarHBondContact O-CZ 3.44Å; E94-F164 HydrophobicContact CB-CE1 4.02Å; E94-F164 HydrophobicContact CB-CZ 4.4Å; E94-F164 HydrophobicContact CG-CE1 4.36Å; I96-F164 HydrophobicContact CB-CD1 3.91Å; I96-F164 HydrophobicContact CB-CE1 3.72Å; I96-F164 HydrophobicContact CB-CZ 4.33Å; I96-F164 HydrophobicContact CD1-CD1 4.36Å; I96-F164 HydrophobicContact CD1-CD2 4.22Å; I96-F164 HydrophobicContact CD1-CE1 4.16Å; I96-F164 HydrophobicContact CD1-CE2 4.03Å; I96-F164 HydrophobicContact CD1-CG 4.39Å; I96-F164 HydrophobicContact CD1-CZ 3.98Å; I96-F164 HydrophobicContact CG2-CB 4.35Å; I96-F164 HydrophobicContact CG2-CD1 3.32Å; I96-F164 HydrophobicContact CG2-CE1 3.7Å; I96-F164 HydrophobicContact CG2-CG 3.92Å; S126-F164 WeakPolarHBondContact OG-CD2 3.3Å; R127-F164 HydrophobicContact CB-CE2 4.18Å; R127-F164 HydrophobicContact CG-CE2 3.55Å; R127-F164 HydrophobicContact CG-CZ 3.91Å; A130-F164 HydrophobicContact CB-CB 4.09Å; A130-F164 HydrophobicContact CB-CD2 4.12Å; A130-F164 HydrophobicContact CB-CG 4.36Å; P160-F164 HydrophobicContact CB-CB 4.2Å; N161-F164 WeakPolarHBondContact ND2-CD2 3.29Å; N161-F164 WeakPolarHBondContact ND2-CE2 3.42Å; N161-F164 WeakPolarHBondContact ND2-CG 3.37Å; N161-F164 VanDerWaalsContact ND2-CZ 3.35Å; N161-F164 WeakPolarHBondContact ND2-CZ 3.43Å; N161-F164 WeakPolarHBondContact O-CB 3.28Å; N161-F164 PolarHBondContact O-N 2.96Å; N161-F164 PolarHBondContact OD1-N 2.87Å; F164-H166 VanDerWaalsContact C-N 3.34Å; F164-Q167 PolarHBondContact O-N 3.14Å; F164-L168 WeakPolarHBondContact O-CB 3.11Å; F164-L168 VanDerWaalsContact O-CG 3.25Å; F164-L168 WeakPolarHBondContact O-CG 3.44Å; F164-L168 PolarHBondContact O-N 3.15Å
165V98.5Very high96.3Very high26 Ų2646.3 Ų46.316%0.15825%0.246CC..Hα-helixtrans-59.3-46.5173.8175.30000110.8Y144 P160 N161 V162 L168 Q169Y144-V165 HydrophobicContact CD1-CG1 4.38Å; Y144-V165 HydrophobicContact CE1-CG1 3.7Å; Y144-V165 HydrophobicContact CE2-CG1 4.23Å; Y144-V165 HydrophobicContact CE2-CG2 4.43Å; Y144-V165 VanDerWaalsContact OH-CG2 3.3Å; Y144-V165 WeakPolarHBondContact OH-CG2 3.48Å; P160-V165 HydrophobicContact CB-CG2 4.17Å; N161-V165 PolarHBondContact O-N 2.92Å; V162-V165 PolarHBondContact O-N 3.19Å; V165-L168 WeakPolarHBondContact O-CB 3.36Å; V165-L168 PolarHBondContact O-N 2.99Å; V165-Q169 WeakPolarHBondContact O-CG 3.31Å; V165-Q169 PolarHBondContact O-N 2.81Å; V165-Q169 VanDerWaalsContact O-N 3.13Å
166H98.3Very high96.1Very high112 Ų11248.9 Ų48.952%0.51926%0.259SS..Hα-helixtrans-62.1-45.9177.5-68.1-165.1000111.3V162 G163 F164 L168 Q169 E170V162-H166 PolarHBondContact O-CD2 3.49Å; V162-H166 PolarHBondContact O-N 3.03Å; G163-H166 PolarHBondContact O-N 2.9Å; F164-H166 VanDerWaalsContact C-N 3.34Å; H166-L168 VanDerWaalsContact C-N 3.3Å; H166-L168 PolarHBondContact O-N 3.29Å; H166-Q169 WeakPolarHBondContact O-CB 3.42Å; H166-Q169 PolarHBondContact O-N 3.19Å; H166-Q169 VanDerWaalsContact O-N 3.12Å; H166-E170 WeakPolarHBondContact O-CG 3.28Å; H166-E170 PolarHBondContact O-N 3.16Å
167Q98.6Very high95.9Very high20 Ų2045.4 Ų45.49%0.09325%0.254CS..Hα-helixtrans-62.7-32.8177.3-78.7176.472.100113.5E94 I96 I97 G163 F164 Y171E94-Q167 PolarHBondContact O-NE2 3.46Å; I96-Q167 HydrophobicContact CG2-CB 4.29Å; I97-Q167 HydrophobicContact CB-CB 4.18Å; I97-Q167 HydrophobicContact CB-CG 4.35Å; I97-Q167 WeakPolarHBondContact CD1-O 3.35Å; I97-Q167 HydrophobicContact CG2-CG 4.42Å; G163-Q167 WeakPolarHBondContact O-CB 3.17Å; G163-Q167 WeakPolarHBondContact O-CG 3.43Å; G163-Q167 PolarHBondContact O-N 2.87Å; G163-Q167 PolarHBondContact O-NE2 2.8Å; F164-Q167 PolarHBondContact O-N 3.14Å; Q167-Y171 WeakPolarHBondContact O-CB 3.4Å; Q167-Y171 PolarHBondContact O-N 3.49Å
168L98.4Very high95.5Very high0 Ų049.6 Ų49.60%027%0.268CS..Hα-helixtrans-65.8-42.5172.9-75.5164.8000111.6F100 A130 I133 A134 M137 Y144 F164 V165 H166 Y171 E172F100-L168 HydrophobicContact CE1-CD2 4.44Å; F100-L168 HydrophobicContact CE2-CD2 4.01Å; F100-L168 HydrophobicContact CZ-CD2 3.74Å; F100-L168 HydrophobicContact CZ-CG 4.17Å; A130-L168 HydrophobicContact CB-CD1 4.24Å; A130-L168 WeakPolarHBondContact O-CD2 3.33Å; I133-L168 HydrophobicContact CB-CD1 4.25Å; I133-L168 HydrophobicContact CB-CD2 4.35Å; I133-L168 HydrophobicContact CG2-CD1 3.94Å; I133-L168 HydrophobicContact CG2-CD2 4.09Å; A134-L168 HydrophobicContact CB-CD2 3.6Å; M137-L168 WeakPolarHBondContact CE-O 3.23Å; M137-L168 HydrophobicContact SD-CB 4.19Å; M137-L168 HydrophobicContact SD-CD2 4.07Å; Y144-L168 HydrophobicContact CD2-CB 3.84Å; Y144-L168 HydrophobicContact CD2-CD1 3.87Å; Y144-L168 HydrophobicContact CD2-CG 4.46Å; Y144-L168 HydrophobicContact CE2-CB 4.35Å; Y144-L168 HydrophobicContact CE2-CD1 3.65Å; F164-L168 WeakPolarHBondContact O-CB 3.11Å; F164-L168 VanDerWaalsContact O-CG 3.25Å; F164-L168 WeakPolarHBondContact O-CG 3.44Å; F164-L168 PolarHBondContact O-N 3.15Å; V165-L168 WeakPolarHBondContact O-CB 3.36Å; V165-L168 PolarHBondContact O-N 2.99Å; H166-L168 VanDerWaalsContact C-N 3.3Å; H166-L168 PolarHBondContact O-N 3.29Å; L168-Y171 WeakPolarHBondContact O-CB 3.22Å; L168-Y171 PolarHBondContact O-N 2.88Å; L168-E172 PolarHBondContact O-N 2.87Å
169Q96.6Very high94.9Very high97 Ų9751.7 Ų51.745%0.45328%0.28SS..Hα-helixtrans-65.9-40176.2-66.4170.3-3200111.6Y144 V165 H166 Y171 E172Y144-Q169 HydrophobicContact CD1-CG 4.43Å; Y144-Q169 HydrophobicContact CG-CG 4.29Å; V165-Q169 WeakPolarHBondContact O-CG 3.31Å; V165-Q169 PolarHBondContact O-N 2.81Å; V165-Q169 VanDerWaalsContact O-N 3.13Å; H166-Q169 WeakPolarHBondContact O-CB 3.42Å; H166-Q169 PolarHBondContact O-N 3.19Å; H166-Q169 VanDerWaalsContact O-N 3.12Å; Q169-Y171 VanDerWaalsContact C-N 3.31Å; Q169-Y171 PolarHBondContact O-N 2.99Å; Q169-E172 WeakPolarHBondContact O-CB 3.46Å; Q169-E172 PolarHBondContact O-N 3.11Å
170E96.3Very high94.4Very high113 Ų11349.2 Ų49.253%0.52827%0.268SS..Hα-helixtrans-64.1-37.1173.9-71.7173.3-178.400112.2I97 H166 E172 A173 I174I97-E170 HydrophobicContact CD1-CB 4.19Å; H166-E170 WeakPolarHBondContact O-CG 3.28Å; H166-E170 PolarHBondContact O-N 3.16Å; E170-E172 VanDerWaalsContact C-N 3.26Å; E170-E172 PolarHBondContact O-N 3.25Å; E170-A173 PolarHBondContact O-N 2.87Å; E170-I174 PolarHBondContact O-N 3.48Å
171Y95.8Very high93.8Very high3 Ų353.9 Ų53.91%0.01229%0.292CS..Hα-helixtrans-62.3-33.3180-168.1-123.1000113.1I97 F100 P101 A134 E138 Q167 L168 Q169 A173 I174 Y175I97-Y171 HydrophobicContact CD1-CD2 4.08Å; I97-Y171 HydrophobicContact CG1-CD2 3.75Å; I97-Y171 HydrophobicContact CG1-CG 4.32Å; F100-Y171 HydrophobicContact CB-CD1 4.29Å; F100-Y171 HydrophobicContact CB-CD2 4.35Å; F100-Y171 HydrophobicContact CB-CE1 3.77Å; F100-Y171 HydrophobicContact CB-CE2 3.82Å; F100-Y171 AromaticContact CD2-CD1 3.65Å; F100-Y171 HydrophobicContact CD2-CD1 3.65Å; F100-Y171 AromaticContact CD2-CD2 3.66Å; F100-Y171 HydrophobicContact CD2-CD2 3.66Å; F100-Y171 HydrophobicContact CD2-CE1 4.04Å; F100-Y171 HydrophobicContact CD2-CE2 4.03Å; F100-Y171 AromaticContact CD2-CG 3.46Å; F100-Y171 HydrophobicContact CD2-CG 3.46Å; F100-Y171 VanDerWaalsContact CD2-CG 3.46Å; F100-Y171 HydrophobicContact CE2-CD1 4.38Å; F100-Y171 HydrophobicContact CE2-CG 4.07Å; F100-Y171 HydrophobicContact CG-CD1 4.36Å; F100-Y171 HydrophobicContact CG-CE1 4.32Å; F100-Y171 HydrophobicContact CG-CE2 4.47Å; F100-Y171 HydrophobicContact CG-CG 4.46Å; P101-Y171 HydrophobicContact CG-CE2 4.35Å; A134-Y171 HydrophobicContact CB-CD1 4.39Å; E138-Y171 HydrophobicContact CB-CE1 4.11Å; E138-Y171 VanDerWaalsContact CD-OH 3.28Å; E138-Y171 WeakPolarHBondContact OE2-CE1 3.3Å; E138-Y171 VanDerWaalsContact OE2-CZ 3.23Å; E138-Y171 PolarHBondContact OE2-OH 3.36Å; Q167-Y171 WeakPolarHBondContact O-CB 3.4Å; Q167-Y171 PolarHBondContact O-N 3.49Å; L168-Y171 WeakPolarHBondContact O-CB 3.22Å; L168-Y171 PolarHBondContact O-N 2.88Å; Q169-Y171 VanDerWaalsContact C-N 3.31Å; Q169-Y171 PolarHBondContact O-N 2.99Å; Y171-A173 PolarHBondContact O-N 3.04Å; Y171-I174 HydrophobicContact CD2-CB 4.49Å; Y171-I174 PolarHBondContact O-N 3.04Å; Y171-I174 VanDerWaalsContact O-N 3.12Å; Y171-Y175 AromaticContact CD1-CD1 3.7Å; Y171-Y175 HydrophobicContact CD1-CD1 3.7Å; Y171-Y175 HydrophobicContact CD1-CE1 4.24Å; Y171-Y175 AromaticContact CE1-CD1 3.87Å; Y171-Y175 HydrophobicContact CE1-CD1 3.87Å; Y171-Y175 HydrophobicContact CG-CD1 4.27Å; Y171-Y175 WeakPolarHBondContact O-CD1 3.28Å; Y171-Y175 PolarHBondContact O-N 3.06Å
172E92.1Very high93.1Very high48 Ų4861.1 Ų61.122%0.22432%0.322CS..Hα-helixtrans-53.9-51.4175.8-175.2170.7-134.100112.2M137 L168 Q169 E170 I174 Y175 L176M137-E172 HydrophobicContact CE-CB 3.99Å; L168-E172 PolarHBondContact O-N 2.87Å; Q169-E172 WeakPolarHBondContact O-CB 3.46Å; Q169-E172 PolarHBondContact O-N 3.11Å; E170-E172 VanDerWaalsContact C-N 3.26Å; E170-E172 PolarHBondContact O-N 3.25Å; E172-I174 VanDerWaalsContact C-N 3.28Å; E172-I174 PolarHBondContact O-N 3.4Å; E172-Y175 HydrophobicContact CB-CE1 4.14Å; E172-Y175 HydrophobicContact CG-CE1 4.37Å; E172-Y175 PolarHBondContact O-N 3.2Å; E172-L176 HydrophobicContact CG-CD1 3.81Å; E172-L176 HydrophobicContact CG-CG 4.45Å; E172-L176 WeakPolarHBondContact O-CB 3.25Å; E172-L176 WeakPolarHBondContact O-CG 3.33Å; E172-L176 PolarHBondContact O-N 2.7Å
173A91.1Very high92.2Very high68 Ų6860.5 Ų60.556%0.56231%0.314SS*.Hα-helixtrans-61.4-38.6177.800000112.1E170 Y171 A177E170-A173 PolarHBondContact O-N 2.87Å; Y171-A173 PolarHBondContact O-N 3.04Å; A173-A177 WeakPolarHBondContact O-CB 3.21Å; A173-A177 PolarHBondContact O-N 2.89Å; A173-A177 VanDerWaalsContact O-N 3.09Å
174I91Very high91.2Very high73 Ų7364.1 Ų64.137%0.37433%0.33SS..Hα-helixtrans-66.1-50.3-178.2-66.3166.8000111.3I97 E170 Y171 E172 K178I97-I174 HydrophobicContact CD1-CD1 3.68Å; E170-I174 PolarHBondContact O-N 3.48Å; Y171-I174 HydrophobicContact CD2-CB 4.49Å; Y171-I174 PolarHBondContact O-N 3.04Å; Y171-I174 VanDerWaalsContact O-N 3.12Å; E172-I174 VanDerWaalsContact C-N 3.28Å; E172-I174 PolarHBondContact O-N 3.4Å; I174-K178 HydrophobicContact CG2-CD 4.42Å; I174-K178 WeakPolarHBondContact O-CG 3.21Å; I174-K178 PolarHBondContact O-N 2.99Å
175Y90.3Very high89.6Confident3 Ų366.3 Ų66.31%0.01235%0.345CS..Hα-helixtrans-73.5-34.5-177.374.8-113.3000111.8F9 M137 E138 Y171 E172 A177 K178 L179F9-Y175 HydrophobicContact CZ-CE2 4.31Å; M137-Y175 HydrophobicContact CB-CE1 4.14Å; M137-Y175 PolarHBondContact O-OH 3.48Å; E138-Y175 HydrophobicContact CB-CD1 3.94Å; E138-Y175 HydrophobicContact CB-CD2 4.5Å; E138-Y175 HydrophobicContact CB-CE1 4.15Å; E138-Y175 HydrophobicContact CB-CG 4.15Å; E138-Y175 HydrophobicContact CG-CD1 4.16Å; E138-Y175 HydrophobicContact CG-CD2 4.2Å; E138-Y175 HydrophobicContact CG-CG 3.87Å; Y171-Y175 AromaticContact CD1-CD1 3.7Å; Y171-Y175 HydrophobicContact CD1-CD1 3.7Å; Y171-Y175 HydrophobicContact CD1-CE1 4.24Å; Y171-Y175 AromaticContact CE1-CD1 3.87Å; Y171-Y175 HydrophobicContact CE1-CD1 3.87Å; Y171-Y175 HydrophobicContact CG-CD1 4.27Å; Y171-Y175 WeakPolarHBondContact O-CD1 3.28Å; Y171-Y175 PolarHBondContact O-N 3.06Å; E172-Y175 HydrophobicContact CB-CE1 4.14Å; E172-Y175 HydrophobicContact CG-CE1 4.37Å; E172-Y175 PolarHBondContact O-N 3.2Å; Y175-A177 VanDerWaalsContact C-N 3.34Å; Y175-A177 PolarHBondContact O-N 3.09Å; Y175-K178 PolarHBondContact O-N 2.86Å; Y175-L179 HydrophobicContact CD2-CD1 3.99Å; Y175-L179 VanDerWaalsContact O-CG 3.31Å; Y175-L179 WeakPolarHBondContact O-CG 3.43Å; Y175-L179 PolarHBondContact O-N 2.6Å
176L90.8Very high87.7Confident54 Ų5471 Ų7128%0.28338%0.375SS..Hα-helixtrans-63.1-41.2175.5-71.2175.1000111.6L7 F9 E172 L179 T180L7-L176 HydrophobicContact CD1-CD2 3.67Å; F9-L176 HydrophobicContact CE2-CD2 4.4Å; F9-L176 HydrophobicContact CZ-CD2 3.95Å; E172-L176 HydrophobicContact CG-CD1 3.81Å; E172-L176 HydrophobicContact CG-CG 4.45Å; E172-L176 WeakPolarHBondContact O-CB 3.25Å; E172-L176 WeakPolarHBondContact O-CG 3.33Å; E172-L176 PolarHBondContact O-N 2.7Å; L176-L179 PolarHBondContact O-N 3.1Å; L176-T180 WeakPolarHBondContact O-CB 3.32Å; L176-T180 PolarHBondContact O-N 3.5Å; L176-T180 PolarHBondContact O-OG1 3.15Å
177A89.6Confident85.7Confident51 Ų5171.4 Ų71.442%0.42138%0.38SS..Hα-helixtrans-61.2-4517400000111.5A173 Y175 T180 I181A173-A177 WeakPolarHBondContact O-CB 3.21Å; A173-A177 PolarHBondContact O-N 2.89Å; A173-A177 VanDerWaalsContact O-N 3.09Å; Y175-A177 VanDerWaalsContact C-N 3.34Å; Y175-A177 PolarHBondContact O-N 3.09Å; A177-T180 PolarHBondContact O-N 2.86Å; A177-I181 VanDerWaalsContact O-CG1 3.3Å; A177-I181 WeakPolarHBondContact O-CG1 3.33Å; A177-I181 PolarHBondContact O-N 3.47Å
178K87.9Confident83.7Confident116 Ų11674.5 Ų74.550%0.50440%0.395SS..Hα-helixtrans-61.1-45.8176.9-73.2175.3179.6178.80112.5I174 Y175 I181 K182I174-K178 HydrophobicContact CG2-CD 4.42Å; I174-K178 WeakPolarHBondContact O-CG 3.21Å; I174-K178 PolarHBondContact O-N 2.99Å; Y175-K178 PolarHBondContact O-N 2.86Å; K178-I181 PolarHBondContact O-N 2.86Å; K178-K182 WeakPolarHBondContact O-CB 3.41Å; K178-K182 PolarHBondContact O-N 2.78Å
179L87.1Confident81.6Confident50 Ų5078.6 Ų78.626%0.26242%0.416SS..Hα-helixtrans-65.4-40.7178.5-67.6173.1000111.3L7 F9 Y175 L176 K182 M183L7-L179 HydrophobicContact CD2-CB 3.45Å; L7-L179 VanDerWaalsContact CD2-CB 3.45Å; L7-L179 HydrophobicContact CD2-CD1 4.18Å; L7-L179 HydrophobicContact CD2-CG 4.41Å; F9-L179 HydrophobicContact CE1-CD1 3.75Å; F9-L179 HydrophobicContact CZ-CD1 3.83Å; Y175-L179 HydrophobicContact CD2-CD1 3.99Å; Y175-L179 VanDerWaalsContact O-CG 3.31Å; Y175-L179 WeakPolarHBondContact O-CG 3.43Å; Y175-L179 PolarHBondContact O-N 2.6Å; L176-L179 PolarHBondContact O-N 3.1Å; L179-K182 WeakPolarHBondContact O-CB 3.42Å; L179-K182 PolarHBondContact O-N 2.93Å; L179-M183 WeakPolarHBondContact O-CG 3.43Å; L179-M183 PolarHBondContact O-N 2.94Å
180T88.1Confident79.4Confident59 Ų5976.2 Ų76.236%0.36242%0.418SS..Hα-helixtrans-60.9-47.3176.6-55.60000111.2L176 A177 K182 M183 M184L176-T180 WeakPolarHBondContact O-CB 3.32Å; L176-T180 PolarHBondContact O-N 3.5Å; L176-T180 PolarHBondContact O-OG1 3.15Å; A177-T180 PolarHBondContact O-N 2.86Å; T180-K182 VanDerWaalsContact C-N 3.27Å; T180-K182 PolarHBondContact O-N 3.06Å; T180-M183 PolarHBondContact O-N 2.93Å; T180-M183 VanDerWaalsContact O-N 3.13Å; T180-M184 HydrophobicContact CG2-CE 4.19Å; T180-M184 WeakPolarHBondContact O-CG 3.48Å; T180-M184 PolarHBondContact O-N 3.01Å; T180-M184 VanDerWaalsContact O-N 3.08Å
181I86Confident77.3Confident104 Ų10479.8 Ų79.853%0.53343%0.426SS..Hα-helixtrans-60.6-38.7176.5-68.4164000111.1A177 K178 M183 M184A177-I181 VanDerWaalsContact O-CG1 3.3Å; A177-I181 WeakPolarHBondContact O-CG1 3.33Å; A177-I181 PolarHBondContact O-N 3.47Å; K178-I181 PolarHBondContact O-N 2.86Å; I181-M183 VanDerWaalsContact C-N 3.29Å; I181-M183 PolarHBondContact O-N 3.49Å; I181-M184 PolarHBondContact O-N 3.13Å
182K83.2Confident75.1Confident179 Ų17984.4 Ų84.478%0.77846%0.459SS*.Hα-helixtrans-67.6-28.7178.3-170.7177.3178.9-177.60113K178 L179 T180K178-K182 WeakPolarHBondContact O-CB 3.41Å; K178-K182 PolarHBondContact O-N 2.78Å; L179-K182 WeakPolarHBondContact O-CB 3.42Å; L179-K182 PolarHBondContact O-N 2.93Å; T180-K182 VanDerWaalsContact C-N 3.27Å; T180-K182 PolarHBondContact O-N 3.06Å
183M79.2Confident73.2Confident86 Ų8690.6 Ų90.642%0.42449%0.486SS..Hα-helixtrans-83.2-24.8177.3-70.4-177.772.200113.2L7 L179 T180 I181L7-M183 HydrophobicContact CD2-SD 3.34Å; L7-M183 WeakPolarHBondContact CD2-SD 3.32Å; L7-M183 HydrophobicContact CG-SD 3.98Å; L179-M183 WeakPolarHBondContact O-CG 3.43Å; L179-M183 PolarHBondContact O-N 2.94Å; T180-M183 PolarHBondContact O-N 2.93Å; T180-M183 VanDerWaalsContact O-N 3.13Å; I181-M183 VanDerWaalsContact C-N 3.29Å; I181-M183 PolarHBondContact O-N 3.49Å
184M78.1Confident71.2Confident85 Ų8591.3 Ų91.342%0.41949%0.486SS..SBendtrans-66.8133.1175.4-73.5175161.400110.7T180 I181T180-M184 HydrophobicContact CG2-CE 4.19Å; T180-M184 WeakPolarHBondContact O-CG 3.48Å; T180-M184 PolarHBondContact O-N 3.01Å; T180-M184 VanDerWaalsContact O-N 3.08Å; I181-M184 PolarHBondContact O-N 3.13Å
185S64Low69.1Low46 Ų4695.3 Ų95.332%0.32251%0.508SS..  trans-65.8151172.967.80000110.2I187 E188S185-I187 PolarHBondContact O-N 2.78Å; S185-E188 PolarHBondContact N-OE2 3.25Å; S185-E188 PolarHBondContact O-N 2.92Å; S185-E188 WeakPolarHBondContact OG-CG 3.49Å; S185-E188 PolarHBondContact OG-N 2.84Å; S185-E188 PolarHBondContact OG-OE2 3.03Å
186P59.8Low67.1Low123 Ų123104.5 Ų104.580%0.79955%0.551SS**Hα-helixtrans-54.4-23.5175-25.433.1000113.8
187I56.1Low65Low121 Ų121107 Ų10762%0.62158%0.58SS**Hα-helixtrans-75-32.1-179.5-66.7165.9000111.9S185S185-I187 PolarHBondContact O-N 2.78Å
188E55.6Low62.5Low85 Ų85108 Ų10840%0.39760%0.595SS.*Hα-helixtrans-77.5-35.5-179.1-72.6164.7135.400112S185 G190 R191 S192S185-E188 PolarHBondContact N-OE2 3.25Å; S185-E188 PolarHBondContact O-N 2.92Å; S185-E188 WeakPolarHBondContact OG-CG 3.49Å; S185-E188 PolarHBondContact OG-N 2.84Å; S185-E188 PolarHBondContact OG-OE2 3.03Å; E188-G190 VanDerWaalsContact C-N 3.28Å; E188-G190 PolarHBondContact O-N 3.39Å; E188-R191 PolarHBondContact O-N 3.21Å; E188-S192 PolarHBondContact O-N 3.44Å
189L56.1Low60.1Low87 Ų87111.2 Ų111.246%0.45561%0.614SS.*Hα-helixtrans-62-37.9176-157.473.5000111.3R191 F193L189-R191 PolarHBondContact O-N 2.84Å; L189-F193 HydrophobicContact CD1-CE2 4.48Å; L189-F193 HydrophobicContact CG-CE2 4.46Å; L189-F193 VanDerWaalsContact O-CD2 3.3Å; L189-F193 WeakPolarHBondContact O-CD2 3.23Å
190G49.9Very low57.8Low47 Ų47114.9 Ų114.949%0.48564%0.64SS.*Hα-helixtrans-69.6-28177.400000114.7E188 S194E188-G190 VanDerWaalsContact C-N 3.28Å; E188-G190 PolarHBondContact O-N 3.39Å; G190-S194 PolarHBondContact O-OG 3.3Å
191R52.4Low55.3Low187 Ų187115.6 Ų115.671%0.70666%0.66SS**Hα-helixtrans-80.8-36.2179.6-78.4-173.4179.9-176.41.7113.2E188 L189 F193 S194E188-R191 PolarHBondContact O-N 3.21Å; L189-R191 PolarHBondContact O-N 2.84Å; R191-F193 PolarHBondContact O-N 3.07Å; R191-S194 WeakPolarHBondContact CA-OG 3.45Å; R191-S194 PolarHBondContact O-N 3.07Å; R191-S194 PolarHBondContact O-OG 3.24Å
192S50Low53.3Low100 Ų100116.6 Ų116.670%0.69968%0.676SS**Hα-helixtrans-67-23.5179.5-71.30000113.7E188E188-S192 PolarHBondContact O-N 3.44Å
193F51.6Low51.3Low179 Ų179119.5 Ų119.579%0.78568%0.682SS**THydrogen-bonded Turntrans-93.4-4.9176.8-73.2-72.1000114.9L189 R191L189-F193 HydrophobicContact CD1-CE2 4.48Å; L189-F193 HydrophobicContact CG-CE2 4.46Å; L189-F193 VanDerWaalsContact O-CD2 3.3Å; L189-F193 WeakPolarHBondContact O-CD2 3.23Å; R191-F193 PolarHBondContact O-N 3.07Å
194S48.7Very low49.6Very low82 Ų82125.6 Ų125.657%0.57371%0.706SS**  trans-104.514.4-173.537.40000115.4G190 R191G190-S194 PolarHBondContact O-OG 3.3Å; R191-S194 WeakPolarHBondContact CA-OG 3.45Å; R191-S194 PolarHBondContact O-N 3.07Å; R191-S194 PolarHBondContact O-OG 3.24Å
195L47.7Very low47.5Very low157 Ų157133.1 Ų133.182%0.82273%0.73SS**SBendtrans-104.174.9171.4-78.8164.3000111.8
196Q47Very low46.2Very low197 Ų197136.5 Ų136.592%0.92175%0.753SS**  trans17471.9142.8-98174.94.700109.8
197A46.5Very low45Very low107 Ų107138.8 Ų138.888%0.88476%0.758SS**  trans-141.891.1164.400000109.8
198G38.3Very low44.3Very low72 Ų72142.1 Ų142.174%0.74277%0.771SS**  trans163119.5171.800000108.8
199M36.3Very low43.5Very low182 Ų182146.4 Ų146.490%0.89779%0.791SS**  cis-152.3154.231.3-72.2-113.2-173.400110.9G201M199-G201 PolarHBondContact O-N 3.33Å
200P38.5Very low42.7Very low127 Ų127149.3 Ų149.383%0.82581%0.807SS**  trans-82.1101.8167.932.4-28000109.7S202P200-S202 PolarHBondContact O-N 3.3Å
201G37.1Very low42.1Very low75 Ų75155.6 Ų155.677%0.77382%0.824SS**  trans-77.9110.7171.100000111.2M199 R203M199-G201 PolarHBondContact O-N 3.33Å; G201-R203 PolarHBondContact O-N 3.43Å
202S44.4Very low41.3Very low124 Ų124153.3 Ų153.387%0.86783%0.826SS**  trans-62118168.5-62.40000111.2P200P200-S202 PolarHBondContact O-N 3.3Å
203R39.5Very low40.6Very low241 Ų241158.2 Ų158.291%0.90984%0.835SS**  trans-138.8109153.7-82.8-170.7174.8170.9-2.1110.4G201G201-R203 PolarHBondContact O-N 3.43Å
204K43.3Very low39.8Very low213 Ų213153.3 Ų153.393%0.92684%0.835SS**  trans-46.9131.6162.7-82.7173.6166.2177.90110.1
205R35.7Very low39.3Very low243 Ų243154.3 Ų154.392%0.91785%0.848SS**  trans-129.9123.5152.9-93.6-175.1-79.7-176.5-2.5107.9
206S35.6Very low38.9Very low117 Ų117155.9 Ų155.982%0.81885%0.854SS**  trans-68.4145.8178.438.50000111.1
207L35.1Very low38.5Very low172 Ų172154.9 Ų154.990%0.90185%0.849SS**  trans-77.4126.8166.9-74.1154.1000108.8
208E40.5Very low38.3Very low191 Ų191156.8 Ų156.889%0.89385%0.849SS**  trans-142137.1147.1-70.8-170.1166.300108.2
209E39.7Very low38.3Very low175 Ų175159.4 Ų159.482%0.81885%0.851SS**  trans-68.8156.9179.7-60.6156.3150.900109.3
210D38.3Very low38.3Very low147 Ų147155.4 Ų155.479%0.78685%0.847SS**  -175.2165.176.6-91-41.9000111.9
211E37.1Very low38.4Very low179 Ų179156 Ų15684%0.83685%0.848SS**  trans-53.5154.2-176.7-54.5170.1148.600116.1
212D37Very low38.7Very low139 Ų139161.5 Ų161.574%0.74385%0.854SS**  178.3130.7111.9-156.921.7000114.5
213F35.1Very low38.7Very low203 Ų203163.3 Ų163.389%0.8985%0.854SS**  trans40.1134.6153.7-92-126.2000126
214G34.8Very low39.3Very low77 Ų77161 Ų16179%0.79488%0.875SS**  trans156.477.8144.800000116.8
215A37.6Very low39.1Very low102 Ų102158.5 Ų158.584%0.84387%0.872SS**  trans-73139171.300000112.8
216M38.5Very low39.3Very low191 Ų191154 Ų15494%0.94187%0.87SS**  179.1138.5119-113.5173.9171.600113.6
217Q39.5Very low39.5Very low175 Ų175156.1 Ų156.182%0.81887%0.873SS**  trans-69146.9177.7-123.51670.400112.6
218V41.3Very low39.7Very low148 Ų148155.1 Ų155.190%0.89787%0.871SS**  trans-144.6124.1148.1-95.70000110.7
219T38.3Very low39.7Very low126 Ų126152.9 Ų152.977%0.77387%0.87SS**  trans-84.7153.8-176.837.10000113.5
220A37.7Very low39.7Very low98 Ų98151.4 Ų151.481%0.8187%0.873SS**  trans-33.9136.6171.600000117.6
221T41.2Very low39.8Very low140 Ų140151.7 Ų151.786%0.85988%0.88SS**PPolyproline II helixtrans-94.7124.5159.911.40000110
222Q41.4Very low40Very low190 Ų190149.6 Ų149.689%0.88888%0.883SS**PPolyproline II helixtrans-86.9135.1162.9-76.2178.4-12.400109
223N46Very low40.2Very low162 Ų162150.5 Ų150.587%0.86690%0.895SS**PPolyproline II helixtrans-85.8141.2169.8-84.6-9.5000110.5
224S51.1Low40.7Very low194 Ų194145.7 Ų145.7100%1.35790%0.895SS**  trans-94.60150.1-56.70000109.2

Retrieved 224 of 224 residues in 137.5 ms (Link to these results)

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