A0A087Y8G8_POEFO Loading...

Proline rich Gla (G-carboxyglutamic acid) 1

AlphaFold DB (A0A3P9PN65), UniProt , Accession A0A087Y8G8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 211 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
1M44.1Very low70.6Confident246 Ų246111.5 Ų111.5100%1.21267%0.671SS**  0106.20-68.3174.5172.600106.6
2G59.4Low70.1Confident74 Ų74113.6 Ų113.676%0.76367%0.668SS**  trans-76.8137.2-176.500000110.6V4G2-V4 PolarHBondContact O-N 3.24Å
3S67.4Low70Confident108 Ų108111.7 Ų111.776%0.75566%0.664SS**  trans-64.8120176.960.50000109.7F5S3-F5 PolarHBondContact O-N 3.5Å; S3-F5 PolarHBondContact OG-O 3.3Å
4V76.7Confident69.6Low134 Ų134111.2 Ų111.281%0.81266%0.662SS**SBendtrans-70.4-13176.9178.70000111.8G2G2-V4 PolarHBondContact O-N 3.24Å
5F75.7Confident68.9Low172 Ų172112.7 Ų112.775%0.75467%0.665SS**SBendtrans-108.5137.7-179.7-62.2-75.5000111.8S3S3-F5 PolarHBondContact O-N 3.5Å; S3-F5 PolarHBondContact OG-O 3.3Å
6L78.9Confident67.7Low116 Ų116119.8 Ų119.861%0.60768%0.677SS**  trans-70.4145.3169.8-69.9170.3000110.2A11L6-A11 HydrophobicContact CB-CB 4.4Å
7P80Confident67Low84 Ų84122.5 Ų122.555%0.54567%0.674SS.*  trans-56.6145.6171.3-20.230.4000111.1N9 S10 A11P7-N9 PolarHBondContact O-N 2.88Å; P7-N9 VanDerWaalsContact O-N 3.11Å; P7-S10 CarbonylContact O-C 3.38Å; P7-S10 WeakPolarHBondContact O-CA 3.42Å; P7-S10 WeakPolarHBondContact O-CB 3.41Å; P7-S10 PolarHBondContact O-N 3.24Å; P7-A11 PolarHBondContact O-N 3.11Å
8A73.1Confident66.3Low62 Ų62124.2 Ų124.251%0.51268%0.681SS.*Hα-helixtrans-48.8-45.2-17500000113S10 A11 H12A8-S10 VanDerWaalsContact C-N 3.28Å; A8-S10 PolarHBondContact O-N 2.85Å; A8-A11 PolarHBondContact O-N 3.16Å; A8-H12 WeakPolarHBondContact O-CB 3.5Å; A8-H12 PolarHBondContact O-CD2 3Å; A8-H12 PolarHBondContact O-N 2.64Å
9N72.3Confident65.3Low144 Ų144130.8 Ų130.877%0.7769%0.694SS**Hα-helixtrans-61.6-35.9179.1-58.5-17.1000112.6P7P7-N9 PolarHBondContact O-N 2.88Å; P7-N9 VanDerWaalsContact O-N 3.11Å
10S74.3Confident64.9Low51 Ų51126.8 Ų126.836%0.35767%0.669SS.*Hα-helixtrans-78-39.9176.5-53.70000111.6P7 A8 H12 S13P7-S10 CarbonylContact O-C 3.38Å; P7-S10 WeakPolarHBondContact O-CA 3.42Å; P7-S10 WeakPolarHBondContact O-CB 3.41Å; P7-S10 PolarHBondContact O-N 3.24Å; A8-S10 VanDerWaalsContact C-N 3.28Å; A8-S10 PolarHBondContact O-N 2.85Å; S10-H12 VanDerWaalsContact C-N 3.32Å; S10-H12 PolarHBondContact O-N 3.13Å; S10-S13 WeakPolarHBondContact O-CB 3.48Å; S10-S13 PolarHBondContact O-N 3.32Å; S10-S13 VanDerWaalsContact O-N 3.13Å; S10-S13 PolarHBondContact O-OG 3.42Å
11A74.4Confident64.1Low35 Ų35125.8 Ų125.829%0.28968%0.679SS.*Hα-helixtrans-61.6-38.7175.500000112.3L6 P7 A8 S13 V14 L15L6-A11 HydrophobicContact CB-CB 4.4Å; P7-A11 PolarHBondContact O-N 3.11Å; A8-A11 PolarHBondContact O-N 3.16Å; A11-S13 PolarHBondContact O-N 2.92Å; A11-V14 PolarHBondContact O-N 2.81Å; A11-V14 VanDerWaalsContact O-N 3.16Å; A11-L15 PolarHBondContact O-N 3.08Å; A11-L15 VanDerWaalsContact O-N 3.08Å
12H65.3Low64.7Low137 Ų137116.4 Ų116.463%0.63463%0.634SS**Hα-helixtrans-65.7-22.6175.3-77.6-60.5000113.9A8 S10A8-H12 WeakPolarHBondContact O-CB 3.5Å; A8-H12 PolarHBondContact O-CD2 3Å; A8-H12 PolarHBondContact O-N 2.64Å; S10-H12 VanDerWaalsContact C-N 3.32Å; S10-H12 PolarHBondContact O-N 3.13Å
13S68.8Low64.6Low89 Ų89120.8 Ų120.862%0.62263%0.632SS**Hα-helixtrans-77.5-23.8174.474.40000113.4S10 A11S10-S13 WeakPolarHBondContact O-CB 3.48Å; S10-S13 PolarHBondContact O-N 3.32Å; S10-S13 VanDerWaalsContact O-N 3.13Å; S10-S13 PolarHBondContact O-OG 3.42Å; A11-S13 PolarHBondContact O-N 2.92Å
14V64.3Low64.2Low105 Ų105123 Ų12364%0.63664%0.635SS**Hα-helixtrans-89.3-42.2179.4-1770000110.9A11 R16A11-V14 PolarHBondContact O-N 2.81Å; A11-V14 VanDerWaalsContact O-N 3.16Å; V14-R16 VanDerWaalsContact C-N 3.34Å; V14-R16 PolarHBondContact O-N 3.23Å
15L58.8Low63.7Low134 Ų134122.5 Ų122.570%0.70263%0.627SS**  trans-92.764.4175.9-62.9178.6000110.9A11 R17A11-L15 PolarHBondContact O-N 3.08Å; A11-L15 VanDerWaalsContact O-N 3.08Å; L15-R17 PolarHBondContact O-N 3.32Å
16R49.5Very low63.4Low226 Ų226117.1 Ų117.185%0.85360%0.604SS**  trans-75.156.8172-155.9176.8172-165.1-4110.2V14 L18V14-R16 VanDerWaalsContact C-N 3.34Å; V14-R16 PolarHBondContact O-N 3.23Å; R16-L18 PolarHBondContact O-N 2.95Å; R16-L18 VanDerWaalsContact O-N 3.11Å
17R55.5Low63.1Low166 Ų166118.2 Ų118.263%0.62661%0.606SS**  trans-72.5103.1173.5-163.4-179.5-82.6-154.2-3.8106.1L15 R19L15-R17 PolarHBondContact O-N 3.32Å; R17-R19 PolarHBondContact O-N 3.27Å
18L55.7Low62.8Low153 Ų153121.9 Ų121.980%0.80162%0.618SS**  trans-49.5130.9169.9-79.3148.2000107.6R16 R20R16-L18 PolarHBondContact O-N 2.95Å; R16-L18 VanDerWaalsContact O-N 3.11Å; L18-R20 PolarHBondContact O-N 3.13Å
19R47.3Very low62.9Low249 Ų249124.4 Ų124.494%0.9462%0.618SS**  trans-58.7105.7177.5-170.8-174.4-92.1169.5-8.5106.6R17R17-R19 PolarHBondContact O-N 3.27Å
20R57.1Low63.4Low50 Ų50124.7 Ų124.719%0.18962%0.618CS.*  trans-62.2136.1176.5-69.5178.4-178.9131.68.6107.6L18 N22 E46L18-R20 PolarHBondContact O-N 3.13Å; R20-N22 VanDerWaalsContact CB-ND2 3.27Å; R20-N22 WeakPolarHBondContact CB-ND2 3.16Å; R20-N22 PolarHBondContact O-N 3.05Å; R20-E46 WeakPolarHBondContact CD-OE1 3.39Å; R20-E46 IonicContact NE-OE1 2.69Å
21A48.8Very low63.8Low107 Ų107123.5 Ų123.588%0.88461%0.614SS**  trans-75.173.7177.300000108.5
22N54.8Low64.5Low49 Ų49125.1 Ų125.126%0.26262%0.618SS.*  trans-102.2131.7-176.5-66.8-16.5000109.5R20 L24 E26 E27R20-N22 VanDerWaalsContact CB-ND2 3.27Å; R20-N22 WeakPolarHBondContact CB-ND2 3.16Å; R20-N22 PolarHBondContact O-N 3.05Å; N22-L24 PolarHBondContact O-N 3.3Å; N22-L24 VanDerWaalsContact O-N 3.15Å; N22-E26 WeakPolarHBondContact CA-OE2 3.45Å; N22-E26 HydrophobicContact CB-CB 4.4Å; N22-E27 WeakPolarHBondContact ND2-CG 3.35Å; N22-E27 PolarHBondContact ND2-OE1 2.84Å
23F58.9Low65.7Low165 Ų165120.5 Ų120.572%0.72460%0.597SS**  trans-75.1103.1170.3179.6-97.1000109.1L25 E26F23-L25 PolarHBondContact O-N 2.69Å; F23-E26 PolarHBondContact N-OE2 3.11Å; F23-E26 WeakPolarHBondContact O-CB 3.5Å; F23-E26 PolarHBondContact O-N 3.14Å
24L58.1Low66.7Low156 Ų156121 Ų12182%0.81759%0.59SS**THydrogen-bonded Turntrans41-43.9164.3-77.8161.6000120.8N22N22-L24 PolarHBondContact O-N 3.3Å; N22-L24 VanDerWaalsContact O-N 3.15Å
25L65.6Low67.9Low123 Ų123117.9 Ų117.964%0.64457%0.567SS**THydrogen-bonded Turntrans-136.57.3-178.2-64175.7000113.9F23 E27 M28F23-L25 PolarHBondContact O-N 2.69Å; L25-E27 PolarHBondContact O-N 2.83Å; L25-M28 HydrophobicContact CD2-SD 4.06Å; L25-M28 WeakPolarHBondContact O-CB 3.49Å; L25-M28 PolarHBondContact O-N 3.25Å
26E70.8Confident69.4Low58 Ų58112.3 Ų112.327%0.27154%0.537SS..G310 helixtrans-56.7-32.6-176.4-175.7158.8-142.200113.9N22 F23 M28 K29N22-E26 WeakPolarHBondContact CA-OE2 3.45Å; N22-E26 HydrophobicContact CB-CB 4.4Å; F23-E26 PolarHBondContact N-OE2 3.11Å; F23-E26 WeakPolarHBondContact O-CB 3.5Å; F23-E26 PolarHBondContact O-N 3.14Å; E26-M28 PolarHBondContact O-N 3.49Å; E26-M28 VanDerWaalsContact O-N 3.15Å; E26-K29 VanDerWaalsContact O-CB 3.25Å; E26-K29 WeakPolarHBondContact O-CB 3.48Å; E26-K29 PolarHBondContact O-N 2.95Å
27E72.7Confident71.3Confident139 Ų139101.6 Ų101.665%0.6550%0.497SS*.G310 helixtrans-66.6-12.2176-62.7-173.617900114.1N22 L25N22-E27 WeakPolarHBondContact ND2-CG 3.35Å; N22-E27 PolarHBondContact ND2-OE1 2.84Å; L25-E27 PolarHBondContact O-N 2.83Å
28M72.3Confident72.8Confident161 Ų161100 Ų10079%0.79349%0.491SS*.G310 helixtrans-86.6-9.9172.5-63.2-174.666.400112.8L25 E26L25-M28 HydrophobicContact CD2-SD 4.06Å; L25-M28 WeakPolarHBondContact O-CB 3.49Å; L25-M28 PolarHBondContact O-N 3.25Å; E26-M28 PolarHBondContact O-N 3.49Å; E26-M28 VanDerWaalsContact O-N 3.15Å
29K75.7Confident74.3Confident116 Ų11699 Ų9950%0.50448%0.482SS..SBendtrans-83148.1-178.4-162.9171.9-177.5-176.50109.8E26 G31 R35E26-K29 VanDerWaalsContact O-CB 3.25Å; E26-K29 WeakPolarHBondContact O-CB 3.48Å; E26-K29 PolarHBondContact O-N 2.95Å; K29-G31 PolarHBondContact O-N 3.48Å; K29-R35 VanDerWaalsContact CE-NE 3.35Å
30L82.5Confident76.2Confident149 Ų14991.4 Ų91.478%0.7846%0.457SS*.PPolyproline II helixtrans-66.5131.6174.1-15976.9000110N32 R35L30-N32 PolarHBondContact O-N 3.47Å; L30-R35 PolarHBondContact O-NH2 3.07Å
31G84.1Confident77.5Confident26 Ų2695.3 Ų95.327%0.26849%0.486SS..PPolyproline II helixtrans-54.2127.5177.500000111.4K29 E36K29-G31 PolarHBondContact O-N 3.48Å; G31-E36 WeakPolarHBondContact CA-OE1 3.27Å
32N88.6Confident79.4Confident69 Ų6990.5 Ų90.537%0.36945%0.446SS..  trans-139.7115.7178.6-176.6-44.7000110.9L30 Q34 R35 E36L30-N32 PolarHBondContact O-N 3.47Å; N32-Q34 VanDerWaalsContact C-N 3.29Å; N32-Q34 PolarHBondContact O-N 2.95Å; N32-Q34 VanDerWaalsContact OD1-CB 3.31Å; N32-Q34 WeakPolarHBondContact OD1-CB 3.36Å; N32-Q34 PolarHBondContact OD1-N 3.04Å; N32-R35 HydrophobicContact CB-CB 4.3Å; N32-R35 PolarHBondContact O-N 3.27Å; N32-R35 PolarHBondContact OD1-N 3.33Å; N32-E36 PolarHBondContact N-OE1 2.94Å; N32-E36 WeakPolarHBondContact O-CB 3.42Å; N32-E36 PolarHBondContact O-N 3.03Å
33I90.3Very high81Confident40 Ų4090.7 Ų90.721%0.20545%0.449CS..Hα-helixtrans-64.4-30.2-174.5-153.773.9000114.2C37 R38 A47 A50 F51 F60I33-C37 HydrophobicContact CD1-CB 3.92Å; I33-C37 WeakPolarHBondContact CD1-SG 3.39Å; I33-C37 HydrophobicContact CG1-CB 4.12Å; I33-C37 CarbonylContact O-C 3.52Å; I33-C37 WeakPolarHBondContact O-CA 3.4Å; I33-C37 WeakPolarHBondContact O-CB 3.16Å; I33-C37 PolarHBondContact O-N 3.29Å; I33-C37 VanDerWaalsContact O-N 3.1Å; I33-R38 PolarHBondContact O-N 3.43Å; I33-A47 HydrophobicContact CD1-CB 4.14Å; I33-A50 HydrophobicContact CB-CB 4.28Å; I33-A50 HydrophobicContact CD1-CB 4.05Å; I33-F51 HydrophobicContact CB-CE2 4.46Å; I33-F51 HydrophobicContact CB-CZ 4.22Å; I33-F51 HydrophobicContact CD1-CD2 3.91Å; I33-F51 HydrophobicContact CD1-CE2 3.28Å; I33-F51 HydrophobicContact CD1-CZ 3.84Å; I33-F51 HydrophobicContact CG1-CE2 3.63Å; I33-F51 HydrophobicContact CG1-CZ 3.63Å; I33-F51 HydrophobicContact CG2-CZ 4.36Å; I33-F60 HydrophobicContact CD1-CD1 4.17Å; I33-F60 HydrophobicContact CD1-CE1 3.72Å; I33-F60 HydrophobicContact CD1-CE2 4.03Å; I33-F60 HydrophobicContact CD1-CZ 3.64Å; I33-F60 HydrophobicContact CG1-CD2 4.19Å; I33-F60 HydrophobicContact CG1-CE1 4.13Å; I33-F60 HydrophobicContact CG1-CE2 3.52Å; I33-F60 HydrophobicContact CG1-CZ 3.52Å
34Q89.8Confident82.5Confident101 Ų10187 Ų8747%0.47243%0.431SS..Hα-helixtrans-69.6-47.5178.4177.863.621.700110N32 R38 E39N32-Q34 VanDerWaalsContact C-N 3.29Å; N32-Q34 PolarHBondContact O-N 2.95Å; N32-Q34 VanDerWaalsContact OD1-CB 3.31Å; N32-Q34 WeakPolarHBondContact OD1-CB 3.36Å; N32-Q34 PolarHBondContact OD1-N 3.04Å; Q34-R38 WeakPolarHBondContact O-CA 3.33Å; Q34-R38 VanDerWaalsContact O-CB 3.24Å; Q34-R38 WeakPolarHBondContact O-CB 3.45Å; Q34-R38 PolarHBondContact O-N 2.84Å; Q34-E39 PolarHBondContact NE2-OE1 3.3Å; Q34-E39 WeakPolarHBondContact O-CG 3.27Å; Q34-E39 PolarHBondContact O-N 3.22Å
35R89.6Confident84Confident38 Ų3881.7 Ų81.714%0.14340%0.402CS..Iπ-helixtrans-70.6-54.7179.5-17917913.990.50.3111.5K29 L30 N32 E39 E40K29-R35 VanDerWaalsContact CE-NE 3.35Å; L30-R35 PolarHBondContact O-NH2 3.07Å; N32-R35 HydrophobicContact CB-CB 4.3Å; N32-R35 PolarHBondContact O-N 3.27Å; N32-R35 PolarHBondContact OD1-N 3.33Å; R35-E39 WeakPolarHBondContact O-CB 3.47Å; R35-E40 WeakPolarHBondContact O-CB 3.46Å; R35-E40 WeakPolarHBondContact O-CG 2.97Å; R35-E40 PolarHBondContact O-N 2.78Å
36E89.2Confident85.2Confident17 Ų1777.1 Ų77.18%0.07938%0.377CS..Iπ-helixtrans-75.3-37.9-169.1-72.3157-145.300112.3G31 N32 E40 C42G31-E36 WeakPolarHBondContact CA-OE1 3.27Å; N32-E36 PolarHBondContact N-OE1 2.94Å; N32-E36 WeakPolarHBondContact O-CB 3.42Å; N32-E36 PolarHBondContact O-N 3.03Å; E36-E40 CarbonylContact O-C 3.58Å; E36-E40 WeakPolarHBondContact O-CB 3.5Å; E36-C42 HydrophobicContact CB-CB 4.35Å; E36-C42 VanDerWaalsContact O-CB 3.27Å; E36-C42 WeakPolarHBondContact O-CB 3.19Å; E36-C42 PolarHBondContact O-N 3Å
37C89.7Confident86.2Confident2 Ų274.3 Ų74.31%0.01436%0.364CS..Iπ-helixtrans-115.8-9.8-171.5-60.10000115.4I33 E40 C42 F60 Y64I33-C37 HydrophobicContact CD1-CB 3.92Å; I33-C37 WeakPolarHBondContact CD1-SG 3.39Å; I33-C37 HydrophobicContact CG1-CB 4.12Å; I33-C37 CarbonylContact O-C 3.52Å; I33-C37 WeakPolarHBondContact O-CA 3.4Å; I33-C37 WeakPolarHBondContact O-CB 3.16Å; I33-C37 PolarHBondContact O-N 3.29Å; I33-C37 VanDerWaalsContact O-N 3.1Å; C37-E40 CarbonylContact C-O 3.59Å; C37-E40 WeakPolarHBondContact CA-O 2.99Å; C37-C42 VanDerWaalsContact CA-SG 3.55Å; C37-C42 HydrophobicContact CB-CB 3.94Å; C37-C42 WeakPolarHBondContact CB-SG 3.27Å; C37-C42 WeakPolarHBondContact SG-CB 3.4Å; C37-C42 CovalentContact SG-SG 2.02Å; C37-C42 PolarHBondContact SG-SG 3.37Å; C37-F60 HydrophobicContact CB-CE1 3.89Å; C37-F60 HydrophobicContact CB-CZ 3.55Å; C37-Y64 WeakPolarHBondContact O-CE2 3.37Å
38R88.1Confident87.2Confident132 Ų13271.6 Ų71.650%0.49835%0.348SS..Iπ-helixtrans-107.7-43.3175-61.3-76.3-170.4-116.85.4111.7I33 Q34I33-R38 PolarHBondContact O-N 3.43Å; Q34-R38 WeakPolarHBondContact O-CA 3.33Å; Q34-R38 VanDerWaalsContact O-CB 3.24Å; Q34-R38 WeakPolarHBondContact O-CB 3.45Å; Q34-R38 PolarHBondContact O-N 2.84Å
39E87.6Confident88.1Confident132 Ų13268.3 Ų68.362%0.61733%0.331SS*.Iπ-helixtrans-84.7-34.6176-66.7164.8-161.900111.2Q34 R35Q34-E39 PolarHBondContact NE2-OE1 3.3Å; Q34-E39 WeakPolarHBondContact O-CG 3.27Å; Q34-E39 PolarHBondContact O-N 3.22Å; R35-E39 WeakPolarHBondContact O-CB 3.47Å
40E86.3Confident88.7Confident89 Ų8964 Ų6442%0.41632%0.317SS..SBendtrans-116.9171.9179.9-62.7166.8-16700112R35 E36 C37R35-E40 WeakPolarHBondContact O-CB 3.46Å; R35-E40 WeakPolarHBondContact O-CG 2.97Å; R35-E40 PolarHBondContact O-N 2.78Å; E36-E40 CarbonylContact O-C 3.58Å; E36-E40 WeakPolarHBondContact O-CB 3.5Å; C37-E40 CarbonylContact C-O 3.59Å; C37-E40 WeakPolarHBondContact CA-O 2.99Å
41V84.9Confident89.1Confident132 Ų13260 Ų6080%0.829%0.293SS*.  trans-94.4113.6173.9175.30000108.6Y64V41-Y64 WeakPolarHBondContact CA-OH 3.49Å
42C88.1Confident89.4Confident7 Ų767 Ų675%0.04732%0.319CS..  trans-102.6157.6-177.570.90000114.1E36 C37 E46 Y64E36-C42 HydrophobicContact CB-CB 4.35Å; E36-C42 VanDerWaalsContact O-CB 3.27Å; E36-C42 WeakPolarHBondContact O-CB 3.19Å; E36-C42 PolarHBondContact O-N 3Å; C37-C42 VanDerWaalsContact CA-SG 3.55Å; C37-C42 HydrophobicContact CB-CB 3.94Å; C37-C42 WeakPolarHBondContact CB-SG 3.27Å; C37-C42 WeakPolarHBondContact SG-CB 3.4Å; C37-C42 CovalentContact SG-SG 2.02Å; C37-C42 PolarHBondContact SG-SG 3.37Å; C42-E46 WeakPolarHBondContact CA-OE2 3.23Å; C42-E46 HydrophobicContact CB-CB 4.08Å; C42-E46 WeakPolarHBondContact CB-OE2 3.47Å; C42-Y64 PolarHBondContact N-OH 3.48Å
43T89.1Confident89.6Confident52 Ų5266.8 Ų66.832%0.31932%0.318SS..  trans-84.8159.3167.269.90000111.7E45 E46 A47T43-E45 PolarHBondContact O-N 3.31Å; T43-E45 VanDerWaalsContact O-N 3.14Å; T43-E46 PolarHBondContact N-OE2 3.34Å; T43-E46 PolarHBondContact O-N 2.83Å; T43-E46 VanDerWaalsContact O-N 3.1Å; T43-E46 PolarHBondContact OG1-OE1 2.91Å; T43-A47 PolarHBondContact O-N 3.43Å; T43-A47 VanDerWaalsContact O-N 3.14Å
44Y90.2Very high89.7Confident88 Ų8869.7 Ų69.735%0.34533%0.334SS..Hα-helixtrans-55.2-34177.2-179.8-97.7000112.4A47 R48 T57 W61Y44-A47 PolarHBondContact O-N 3.38Å; Y44-R48 WeakPolarHBondContact O-CB 3.43Å; Y44-R48 PolarHBondContact O-N 2.98Å; Y44-T57 HydrophobicContact CD2-CG2 4.2Å; Y44-T57 HydrophobicContact CE2-CG2 3.73Å; Y44-W61 VanDerWaalsContact CA-CZ3 3.49Å; Y44-W61 HydrophobicContact CD2-CB 3.98Å; Y44-W61 AromaticContact CD2-CD1 3.81Å; Y44-W61 AromaticContact CD2-CD2 3.55Å; Y44-W61 HydrophobicContact CD2-CD2 3.55Å; Y44-W61 AromaticContact CD2-CE2 3.89Å; Y44-W61 HydrophobicContact CD2-CE3 4.02Å; Y44-W61 AromaticContact CD2-CG 3.51Å; Y44-W61 HydrophobicContact CD2-CG 3.51Å; Y44-W61 HydrophobicContact CE2-CB 4.01Å; Y44-W61 HydrophobicContact CE2-CD2 4.44Å; Y44-W61 AromaticContact CE2-CG 3.96Å; Y44-W61 HydrophobicContact CE2-CG 3.96Å; Y44-W61 HydrophobicContact CG-CD2 4.38Å; Y44-W61 VanDerWaalsContact N-CZ3 3.34Å
45E89.6Confident89.8Confident44 Ų4471.4 Ų71.421%0.20634%0.342CS..Hα-helixtrans-70.2-39.7179.3-171.475.5160.700112.3T43 A47 R48 E49T43-E45 PolarHBondContact O-N 3.31Å; T43-E45 VanDerWaalsContact O-N 3.14Å; E45-A47 VanDerWaalsContact C-N 3.32Å; E45-A47 PolarHBondContact O-N 3.34Å; E45-R48 VanDerWaalsContact CD-NH2 3.28Å; E45-R48 CarbonylContact O-C 3.59Å; E45-R48 WeakPolarHBondContact O-CA 3.01Å; E45-R48 WeakPolarHBondContact O-CB 3.46Å; E45-R48 PolarHBondContact O-N 3.13Å; E45-R48 IonicContact OE1-CZ 3.92Å; E45-R48 IonicContact OE1-NE 3.37Å; E45-R48 IonicContact OE1-NH2 3.37Å; E45-R48 PolarHBondContact OE1-NH2 2.88Å; E45-R48 IonicContact OE2-CZ 2.58Å; E45-R48 IonicContact OE2-NE 3.71Å; E45-R48 PolarHBondContact OE2-NE 2.86Å; E45-R48 IonicContact OE2-NH2 2.63Å; E45-E49 WeakPolarHBondContact O-CG 3.45Å; E45-E49 PolarHBondContact O-N 2.77Å
46E89.6Confident89.9Confident27 Ų2775.7 Ų75.713%0.12636%0.362CS..Hα-helixtrans-63.1-41.9175.1-74.4143.3-140.900110.6R20 C42 T43 R48 E49 A50R20-E46 WeakPolarHBondContact CD-OE1 3.39Å; R20-E46 IonicContact NE-OE1 2.69Å; C42-E46 WeakPolarHBondContact CA-OE2 3.23Å; C42-E46 HydrophobicContact CB-CB 4.08Å; C42-E46 WeakPolarHBondContact CB-OE2 3.47Å; T43-E46 PolarHBondContact N-OE2 3.34Å; T43-E46 PolarHBondContact O-N 2.83Å; T43-E46 VanDerWaalsContact O-N 3.1Å; T43-E46 PolarHBondContact OG1-OE1 2.91Å; E46-R48 VanDerWaalsContact C-N 3.27Å; E46-R48 PolarHBondContact O-N 3.1Å; E46-E49 PolarHBondContact O-N 2.73Å; E46-A50 WeakPolarHBondContact O-CB 3.37Å; E46-A50 PolarHBondContact O-N 2.85Å
47A91.9Very high90.1Very high0 Ų074.9 Ų74.90%036%0.358CS..Hα-helixtrans-62.5-33.9172.400000112.4I33 T43 Y44 E45 F51 T57 F60 W61I33-A47 HydrophobicContact CD1-CB 4.14Å; T43-A47 PolarHBondContact O-N 3.43Å; T43-A47 VanDerWaalsContact O-N 3.14Å; Y44-A47 PolarHBondContact O-N 3.38Å; E45-A47 VanDerWaalsContact C-N 3.32Å; E45-A47 PolarHBondContact O-N 3.34Å; A47-F51 WeakPolarHBondContact O-CD2 3.4Å; A47-F51 PolarHBondContact O-N 3.14Å; A47-T57 HydrophobicContact CB-CG2 3.92Å; A47-T57 PolarHBondContact O-OG1 2.58Å; A47-F60 HydrophobicContact CB-CD1 4.23Å; A47-F60 HydrophobicContact CB-CE1 4.24Å; A47-W61 HydrophobicContact CB-CE3 4.33Å
48R93.8Very high90.3Very high81 Ų8180.6 Ų80.631%0.30638%0.383SS..Hα-helixtrans-69.2-42.2175.1-166.3-173.265.772.87.2111.8Y44 E45 E46 F51 E52 T57Y44-R48 WeakPolarHBondContact O-CB 3.43Å; Y44-R48 PolarHBondContact O-N 2.98Å; E45-R48 VanDerWaalsContact CD-NH2 3.28Å; E45-R48 CarbonylContact O-C 3.59Å; E45-R48 WeakPolarHBondContact O-CA 3.01Å; E45-R48 WeakPolarHBondContact O-CB 3.46Å; E45-R48 PolarHBondContact O-N 3.13Å; E45-R48 IonicContact OE1-CZ 3.92Å; E45-R48 IonicContact OE1-NE 3.37Å; E45-R48 IonicContact OE1-NH2 3.37Å; E45-R48 PolarHBondContact OE1-NH2 2.88Å; E45-R48 IonicContact OE2-CZ 2.58Å; E45-R48 IonicContact OE2-NE 3.71Å; E45-R48 PolarHBondContact OE2-NE 2.86Å; E45-R48 IonicContact OE2-NH2 2.63Å; E46-R48 VanDerWaalsContact C-N 3.27Å; E46-R48 PolarHBondContact O-N 3.1Å; R48-F51 PolarHBondContact O-N 2.02Å; R48-E52 WeakPolarHBondContact O-CA 3.48Å; R48-E52 PolarHBondContact O-N 3.3Å; R48-T57 WeakPolarHBondContact CA-OG1 3.38Å; R48-T57 HydrophobicContact CB-CG2 4.08Å
49E90.8Very high90.5Very high92 Ų9282.9 Ų82.943%0.4339%0.391SS..Hα-helixtrans-65.1-37.6176.8-72172.4-168.700111.5E45 E46E45-E49 WeakPolarHBondContact O-CG 3.45Å; E45-E49 PolarHBondContact O-N 2.77Å; E46-E49 PolarHBondContact O-N 2.73Å
50A90.1Very high90.8Very high27 Ų2777.6 Ų77.622%0.22337%0.366CS..Hα-helixtrans-72-30.1178.300000114.6I33 E46I33-A50 HydrophobicContact CB-CB 4.28Å; I33-A50 HydrophobicContact CD1-CB 4.05Å; E46-A50 WeakPolarHBondContact O-CB 3.37Å; E46-A50 PolarHBondContact O-N 2.85Å
51F90.8Very high91.2Very high63 Ų6376.6 Ų76.628%0.27636%0.359SS..Hα-helixtrans-98-18.3-179.7-75.5-63.3000114.3I33 A47 R48 N53 K56 T57 F60I33-F51 HydrophobicContact CB-CE2 4.46Å; I33-F51 HydrophobicContact CB-CZ 4.22Å; I33-F51 HydrophobicContact CD1-CD2 3.91Å; I33-F51 HydrophobicContact CD1-CE2 3.28Å; I33-F51 HydrophobicContact CD1-CZ 3.84Å; I33-F51 HydrophobicContact CG1-CE2 3.63Å; I33-F51 HydrophobicContact CG1-CZ 3.63Å; I33-F51 HydrophobicContact CG2-CZ 4.36Å; A47-F51 WeakPolarHBondContact O-CD2 3.4Å; A47-F51 PolarHBondContact O-N 3.14Å; R48-F51 PolarHBondContact O-N 2.02Å; F51-N53 PolarHBondContact O-N 3.43Å; F51-K56 HydrophobicContact CB-CB 4.32Å; F51-K56 HydrophobicContact CD1-CB 4.33Å; F51-K56 HydrophobicContact CG-CB 4.29Å; F51-T57 WeakPolarHBondContact CB-OG1 3.48Å; F51-F60 HydrophobicContact CD2-CB 4.48Å; F51-F60 HydrophobicContact CE2-CB 3.64Å; F51-F60 AromaticContact CE2-CD1 3.88Å; F51-F60 HydrophobicContact CE2-CD1 3.88Å; F51-F60 AromaticContact CE2-CD2 3.74Å; F51-F60 HydrophobicContact CE2-CD2 3.74Å; F51-F60 HydrophobicContact CE2-CE2 4.34Å; F51-F60 AromaticContact CE2-CG 3.47Å; F51-F60 HydrophobicContact CE2-CG 3.47Å; F51-F60 VanDerWaalsContact CE2-CG 3.47Å; F51-F60 HydrophobicContact CZ-CB 4.09Å; F51-F60 AromaticContact CZ-CD2 3.74Å; F51-F60 HydrophobicContact CZ-CD2 3.74Å; F51-F60 HydrophobicContact CZ-CE2 4.33Å; F51-F60 AromaticContact CZ-CG 3.93Å; F51-F60 HydrophobicContact CZ-CG 3.93Å
52E90.4Very high91.5Very high173 Ų17375.7 Ų75.781%0.80835%0.346SS*.SBendtrans50.618.4-173-60.2-177176.700114.1R48R48-E52 WeakPolarHBondContact O-CA 3.48Å; R48-E52 PolarHBondContact O-N 3.3Å
53N91.9Very high91.6Very high66 Ų6679.1 Ų79.135%0.35336%0.361SS..  trans-148.7117.5-172.3-175.7-67.6000111.6F51 E55 K56 T57F51-N53 PolarHBondContact O-N 3.43Å; N53-E55 VanDerWaalsContact C-N 3.35Å; N53-E55 PolarHBondContact O-N 3.29Å; N53-E55 WeakPolarHBondContact OD1-CB 3.25Å; N53-E55 PolarHBondContact OD1-N 2.89Å; N53-K56 HydrophobicContact CB-CB 4.31Å; N53-K56 HydrophobicContact CB-CD 4.32Å; N53-K56 HydrophobicContact CB-CG 4.38Å; N53-K56 PolarHBondContact O-N 2.65Å; N53-K56 PolarHBondContact OD1-N 3.47Å; N53-K56 VanDerWaalsContact OD1-N 3.13Å; N53-T57 PolarHBondContact O-N 2.83Å; N53-T57 PolarHBondContact O-OG1 2.63Å; N53-T57 VanDerWaalsContact O-OG1 3.04Å
54D91.8Very high91.6Very high100 Ų10077.9 Ų77.954%0.53535%0.351SS..Hα-helixtrans-63.3-35.7-173.7-61.2-32.8000113.6K58D54-K58 WeakPolarHBondContact O-CB 2.95Å; D54-K58 PolarHBondContact O-N 3.37Å
55E92.9Very high91.5Very high138 Ų13876.4 Ų76.465%0.64535%0.351SS*.Hα-helixtrans-69.3-41.5-179.8-63.6-168.5175.900111.8N53 R59N53-E55 VanDerWaalsContact C-N 3.35Å; N53-E55 PolarHBondContact O-N 3.29Å; N53-E55 WeakPolarHBondContact OD1-CB 3.25Å; N53-E55 PolarHBondContact OD1-N 2.89Å; E55-R59 WeakPolarHBondContact O-CG 3.34Å; E55-R59 PolarHBondContact O-N 3.2Å
56K91.3Very high91.3Very high128 Ų12881 Ų8156%0.55737%0.366SS*.Hα-helixtrans-66.9-44.6176.5-71.5-175.8-179.9175.70110.9F51 N53 K58 R59 F60F51-K56 HydrophobicContact CB-CB 4.32Å; F51-K56 HydrophobicContact CD1-CB 4.33Å; F51-K56 HydrophobicContact CG-CB 4.29Å; N53-K56 HydrophobicContact CB-CB 4.31Å; N53-K56 HydrophobicContact CB-CD 4.32Å; N53-K56 HydrophobicContact CB-CG 4.38Å; N53-K56 PolarHBondContact O-N 2.65Å; N53-K56 PolarHBondContact OD1-N 3.47Å; N53-K56 VanDerWaalsContact OD1-N 3.13Å; K56-K58 VanDerWaalsContact C-N 3.32Å; K56-K58 PolarHBondContact O-N 2.98Å; K56-R59 PolarHBondContact O-N 3.44Å; K56-F60 WeakPolarHBondContact O-CB 3.15Å; K56-F60 PolarHBondContact O-N 2.8Å
57T93.6Very high91Very high0 Ų086.3 Ų86.30%039%0.391CS..Hα-helixtrans-60.6-42.2177.3-57.50000111.4Y44 A47 R48 F51 N53 F60 W61Y44-T57 HydrophobicContact CD2-CG2 4.2Å; Y44-T57 HydrophobicContact CE2-CG2 3.73Å; A47-T57 HydrophobicContact CB-CG2 3.92Å; A47-T57 PolarHBondContact O-OG1 2.58Å; R48-T57 WeakPolarHBondContact CA-OG1 3.38Å; R48-T57 HydrophobicContact CB-CG2 4.08Å; F51-T57 WeakPolarHBondContact CB-OG1 3.48Å; N53-T57 PolarHBondContact O-N 2.83Å; N53-T57 PolarHBondContact O-OG1 2.63Å; N53-T57 VanDerWaalsContact O-OG1 3.04Å; T57-F60 PolarHBondContact O-N 2.73Å; T57-W61 WeakPolarHBondContact O-CB 3.34Å; T57-W61 PolarHBondContact O-N 2.99Å
58K93.3Very high90.3Very high122 Ų12289.6 Ų89.653%0.5341%0.414SS..Hα-helixtrans-60.4-48.7178.3-174.2178.4177.5-176.70112.3D54 K56 F60 W61 E62D54-K58 WeakPolarHBondContact O-CB 2.95Å; D54-K58 PolarHBondContact O-N 3.37Å; K56-K58 VanDerWaalsContact C-N 3.32Å; K56-K58 PolarHBondContact O-N 2.98Å; K58-F60 VanDerWaalsContact C-N 3.35Å; K58-F60 PolarHBondContact O-N 3.15Å; K58-W61 PolarHBondContact O-N 2.77Å; K58-E62 WeakPolarHBondContact CE-OE1 3.27Å; K58-E62 WeakPolarHBondContact O-CG 3.4Å; K58-E62 PolarHBondContact O-N 2.85Å
59R93.4Very high89.1Confident179 Ų17988.6 Ų88.668%0.67542%0.419SS*.Hα-helixtrans-62-43.8178.5-67.3179.6-170.4-177.75.9111.7E55 K56 W61 E63E55-R59 WeakPolarHBondContact O-CG 3.34Å; E55-R59 PolarHBondContact O-N 3.2Å; K56-R59 PolarHBondContact O-N 3.44Å; R59-W61 VanDerWaalsContact C-N 3.34Å; R59-E63 PolarHBondContact O-N 3.39Å
60F93.6Very high87.6Confident21 Ų2188.6 Ų88.69%0.09243%0.428CS..Hα-helixtrans-62.4-42.4175.3172.5-89.3000111.9I33 C37 A47 F51 K56 T57 K58 E63 Y64I33-F60 HydrophobicContact CD1-CD1 4.17Å; I33-F60 HydrophobicContact CD1-CE1 3.72Å; I33-F60 HydrophobicContact CD1-CE2 4.03Å; I33-F60 HydrophobicContact CD1-CZ 3.64Å; I33-F60 HydrophobicContact CG1-CD2 4.19Å; I33-F60 HydrophobicContact CG1-CE1 4.13Å; I33-F60 HydrophobicContact CG1-CE2 3.52Å; I33-F60 HydrophobicContact CG1-CZ 3.52Å; C37-F60 HydrophobicContact CB-CE1 3.89Å; C37-F60 HydrophobicContact CB-CZ 3.55Å; A47-F60 HydrophobicContact CB-CD1 4.23Å; A47-F60 HydrophobicContact CB-CE1 4.24Å; F51-F60 HydrophobicContact CD2-CB 4.48Å; F51-F60 HydrophobicContact CE2-CB 3.64Å; F51-F60 AromaticContact CE2-CD1 3.88Å; F51-F60 HydrophobicContact CE2-CD1 3.88Å; F51-F60 AromaticContact CE2-CD2 3.74Å; F51-F60 HydrophobicContact CE2-CD2 3.74Å; F51-F60 HydrophobicContact CE2-CE2 4.34Å; F51-F60 AromaticContact CE2-CG 3.47Å; F51-F60 HydrophobicContact CE2-CG 3.47Å; F51-F60 VanDerWaalsContact CE2-CG 3.47Å; F51-F60 HydrophobicContact CZ-CB 4.09Å; F51-F60 AromaticContact CZ-CD2 3.74Å; F51-F60 HydrophobicContact CZ-CD2 3.74Å; F51-F60 HydrophobicContact CZ-CE2 4.33Å; F51-F60 AromaticContact CZ-CG 3.93Å; F51-F60 HydrophobicContact CZ-CG 3.93Å; K56-F60 WeakPolarHBondContact O-CB 3.15Å; K56-F60 PolarHBondContact O-N 2.8Å; T57-F60 PolarHBondContact O-N 2.73Å; K58-F60 VanDerWaalsContact C-N 3.35Å; K58-F60 PolarHBondContact O-N 3.15Å; F60-E63 WeakPolarHBondContact O-CB 3.12Å; F60-E63 PolarHBondContact O-N 3.38Å; F60-Y64 HydrophobicContact CE1-CD2 4.41Å; F60-Y64 HydrophobicContact CE1-CG 4.19Å; F60-Y64 HydrophobicContact CZ-CD2 4.36Å; F60-Y64 VanDerWaalsContact O-CB 3.27Å; F60-Y64 WeakPolarHBondContact O-CB 3.4Å; F60-Y64 PolarHBondContact O-N 3.1Å
61W93.9Very high85.8Confident69 Ų6994 Ų9426%0.26146%0.461SS..Hα-helixtrans-68.5-40.4-175.8-172.5-103.8000112.2Y44 A47 T57 K58 R59 E63 Y64 V65Y44-W61 VanDerWaalsContact CA-CZ3 3.49Å; Y44-W61 HydrophobicContact CD2-CB 3.98Å; Y44-W61 AromaticContact CD2-CD1 3.81Å; Y44-W61 AromaticContact CD2-CD2 3.55Å; Y44-W61 HydrophobicContact CD2-CD2 3.55Å; Y44-W61 AromaticContact CD2-CE2 3.89Å; Y44-W61 HydrophobicContact CD2-CE3 4.02Å; Y44-W61 AromaticContact CD2-CG 3.51Å; Y44-W61 HydrophobicContact CD2-CG 3.51Å; Y44-W61 HydrophobicContact CE2-CB 4.01Å; Y44-W61 HydrophobicContact CE2-CD2 4.44Å; Y44-W61 AromaticContact CE2-CG 3.96Å; Y44-W61 HydrophobicContact CE2-CG 3.96Å; Y44-W61 HydrophobicContact CG-CD2 4.38Å; Y44-W61 VanDerWaalsContact N-CZ3 3.34Å; A47-W61 HydrophobicContact CB-CE3 4.33Å; T57-W61 WeakPolarHBondContact O-CB 3.34Å; T57-W61 PolarHBondContact O-N 2.99Å; K58-W61 PolarHBondContact O-N 2.77Å; R59-W61 VanDerWaalsContact C-N 3.34Å; W61-E63 VanDerWaalsContact C-N 3.29Å; W61-E63 PolarHBondContact O-N 3Å; W61-Y64 AromaticContact CE3-CD1 3.98Å; W61-Y64 HydrophobicContact CE3-CD1 3.98Å; W61-Y64 HydrophobicContact CH2-CD1 4.33Å; W61-Y64 HydrophobicContact CH2-CE1 4.32Å; W61-Y64 AromaticContact CZ3-CD1 3.83Å; W61-Y64 HydrophobicContact CZ3-CD1 3.83Å; W61-Y64 HydrophobicContact CZ3-CE1 4.03Å; W61-Y64 PolarHBondContact O-N 3.37Å; W61-V65 HydrophobicContact CD2-CG2 4.19Å; W61-V65 HydrophobicContact CG-CG2 4.3Å; W61-V65 HydrophobicContact CZ2-CG2 4.18Å; W61-V65 WeakPolarHBondContact O-CB 3.39Å; W61-V65 VanDerWaalsContact O-CG2 3.27Å; W61-V65 WeakPolarHBondContact O-CG2 3.5Å; W61-V65 PolarHBondContact O-N 2.92Å
62E91.8Very high84Confident112 Ų11293.9 Ų93.952%0.52348%0.476SS..Hα-helixtrans-58-44.1173.3-72.6170.6-172.500111.3K58 R66K58-E62 WeakPolarHBondContact CE-OE1 3.27Å; K58-E62 WeakPolarHBondContact O-CG 3.4Å; K58-E62 PolarHBondContact O-N 2.85Å; E62-R66 WeakPolarHBondContact O-CB 2.96Å; E62-R66 PolarHBondContact O-N 3.4Å; E62-R66 VanDerWaalsContact O-N 3.13Å
63E90.1Very high81.8Confident79 Ų7988.2 Ų88.237%0.36946%0.464SS..Hα-helixtrans-64.1-48.6174.6-17563.6-158.300112R59 F60 W61 V65 R66 E67R59-E63 PolarHBondContact O-N 3.39Å; F60-E63 WeakPolarHBondContact O-CB 3.12Å; F60-E63 PolarHBondContact O-N 3.38Å; W61-E63 VanDerWaalsContact C-N 3.29Å; W61-E63 PolarHBondContact O-N 3Å; E63-V65 PolarHBondContact O-N 2.87Å; E63-R66 PolarHBondContact O-N 3.25Å; E63-R66 IonicContact OE1-CZ 3.63Å; E63-R66 IonicContact OE1-NH1 3.67Å; E63-R66 IonicContact OE1-NH2 2.83Å; E63-R66 PolarHBondContact OE1-NH2 3.26Å; E63-R66 IonicContact OE2-CZ 3.51Å; E63-R66 IonicContact OE2-NE 3.5Å; E63-R66 IonicContact OE2-NH2 3.58Å; E63-R66 PolarHBondContact OE2-NH2 2.91Å; E63-E67 WeakPolarHBondContact O-CB 3.49Å; E63-E67 PolarHBondContact O-N 3.49Å
64Y89Confident79.6Confident26 Ų2692.3 Ų92.310%0.10249%0.486CS..Hα-helixtrans-61.5-44.6-178.1176.8-103.7000111.8C37 V41 C42 F60 W61 R66 E67 S68C37-Y64 WeakPolarHBondContact O-CE2 3.37Å; V41-Y64 WeakPolarHBondContact CA-OH 3.49Å; C42-Y64 PolarHBondContact N-OH 3.48Å; F60-Y64 HydrophobicContact CE1-CD2 4.41Å; F60-Y64 HydrophobicContact CE1-CG 4.19Å; F60-Y64 HydrophobicContact CZ-CD2 4.36Å; F60-Y64 VanDerWaalsContact O-CB 3.27Å; F60-Y64 WeakPolarHBondContact O-CB 3.4Å; F60-Y64 PolarHBondContact O-N 3.1Å; W61-Y64 AromaticContact CE3-CD1 3.98Å; W61-Y64 HydrophobicContact CE3-CD1 3.98Å; W61-Y64 HydrophobicContact CH2-CD1 4.33Å; W61-Y64 HydrophobicContact CH2-CE1 4.32Å; W61-Y64 AromaticContact CZ3-CD1 3.83Å; W61-Y64 HydrophobicContact CZ3-CD1 3.83Å; W61-Y64 HydrophobicContact CZ3-CE1 4.03Å; W61-Y64 PolarHBondContact O-N 3.37Å; Y64-R66 VanDerWaalsContact C-N 3.33Å; Y64-E67 PolarHBondContact O-N 3.46Å; Y64-S68 VanDerWaalsContact O-CB 3.23Å; Y64-S68 WeakPolarHBondContact O-CB 3.49Å; Y64-S68 PolarHBondContact O-N 3.43Å; Y64-S68 PolarHBondContact O-OG 3.25Å
65V87.9Confident77.5Confident58 Ų5894.3 Ų94.335%0.35250%0.496SS..Hα-helixtrans-64.4-40.8176.5171.40000110.4W61 E63 S68 S69W61-V65 HydrophobicContact CD2-CG2 4.19Å; W61-V65 HydrophobicContact CG-CG2 4.3Å; W61-V65 HydrophobicContact CZ2-CG2 4.18Å; W61-V65 WeakPolarHBondContact O-CB 3.39Å; W61-V65 VanDerWaalsContact O-CG2 3.27Å; W61-V65 WeakPolarHBondContact O-CG2 3.5Å; W61-V65 PolarHBondContact O-N 2.92Å; E63-V65 PolarHBondContact O-N 2.87Å; V65-S68 WeakPolarHBondContact CA-OG 3.09Å; V65-S68 PolarHBondContact O-OG 3.21Å; V65-S69 WeakPolarHBondContact O-CA 3.03Å; V65-S69 WeakPolarHBondContact O-CB 3.2Å; V65-S69 PolarHBondContact O-N 3.15Å; V65-S69 PolarHBondContact O-OG 3.19Å
66R85.8Confident75.5Confident139 Ų13992.9 Ų92.953%0.52550%0.501SS..Hα-helixtrans-66.6-35.6177.9-174.9178.157.469.4-17.3113E62 E63 Y64E62-R66 WeakPolarHBondContact O-CB 2.96Å; E62-R66 PolarHBondContact O-N 3.4Å; E62-R66 VanDerWaalsContact O-N 3.13Å; E63-R66 PolarHBondContact O-N 3.25Å; E63-R66 IonicContact OE1-CZ 3.63Å; E63-R66 IonicContact OE1-NH1 3.67Å; E63-R66 IonicContact OE1-NH2 2.83Å; E63-R66 PolarHBondContact OE1-NH2 3.26Å; E63-R66 IonicContact OE2-CZ 3.51Å; E63-R66 IonicContact OE2-NE 3.5Å; E63-R66 IonicContact OE2-NH2 3.58Å; E63-R66 PolarHBondContact OE2-NH2 2.91Å; Y64-R66 VanDerWaalsContact C-N 3.33Å
67E83.5Confident73.5Confident140 Ų14095.2 Ų95.265%0.65452%0.517SS*.Hα-helixtrans-77.7-43.8177.8-172.262.3-153.400111.6E63 Y64 S69E63-E67 WeakPolarHBondContact O-CB 3.49Å; E63-E67 PolarHBondContact O-N 3.49Å; Y64-E67 PolarHBondContact O-N 3.46Å; E67-S69 VanDerWaalsContact C-N 3.28Å; E67-S69 PolarHBondContact O-N 2.63Å
68S75.9Confident71.1Confident68 Ų68100.1 Ų100.148%0.47655%0.546SS..Hα-helixtrans-71.5-22.5177.758.90000113.2Y64 V65 P70Y64-S68 VanDerWaalsContact O-CB 3.23Å; Y64-S68 WeakPolarHBondContact O-CB 3.49Å; Y64-S68 PolarHBondContact O-N 3.43Å; Y64-S68 PolarHBondContact O-OG 3.25Å; V65-S68 WeakPolarHBondContact CA-OG 3.09Å; V65-S68 PolarHBondContact O-OG 3.21Å; S68-P70 WeakPolarHBondContact O-CD 3.2Å
69S68.6Low68.9Low60 Ų6095.9 Ų95.942%0.4254%0.538SS..SBendtrans-104.796.2174.3-46.80000108.8V65 E67V65-S69 WeakPolarHBondContact O-CA 3.03Å; V65-S69 WeakPolarHBondContact O-CB 3.2Å; V65-S69 PolarHBondContact O-N 3.15Å; V65-S69 PolarHBondContact O-OG 3.19Å; E67-S69 VanDerWaalsContact C-N 3.28Å; E67-S69 PolarHBondContact O-N 2.63Å
70P59.5Low67Low93 Ų9388.6 Ų88.660%0.60452%0.518SS*.  trans-55.4144-179.420.6-31000110.9S68 G72S68-P70 WeakPolarHBondContact O-CD 3.2Å; P70-G72 PolarHBondContact O-N 3.07Å
71P52.7Low65.3Low141 Ų14190.4 Ų90.492%0.91654%0.537SS*.SBendtrans-72.675.2177.630.1-32.4000108.7
72G52Low63.7Low59 Ų5994.2 Ų94.261%0.60856%0.557SS**SBendtrans166.371.7-166.500000111.1P70P70-G72 PolarHBondContact O-N 3.07Å
73G45.1Very low62.7Low54 Ų5491.5 Ų91.556%0.55755%0.551SS**  trans66.997.6147.700000116D75G73-D75 PolarHBondContact O-N 3.01Å
74L45.4Very low62Low152 Ų15292.4 Ų92.480%0.79656%0.558SS**THydrogen-bonded Turntrans-60.837.3159.2-161.782.6000113.1
75D47.3Very low61.6Low143 Ų14399.9 Ų99.977%0.76559%0.587SS**THydrogen-bonded Turntrans-109.1-16.7174.7-71-36.4000112.5G73G73-D75 PolarHBondContact O-N 3.01Å
76S50.5Low61.3Low107 Ų107102.9 Ų102.975%0.74860%0.601SS**SBendtrans-94.4-23.3-175.7-80.40000115.4
77M50.9Low61.3Low178 Ų178100 Ų10088%0.87760%0.595SS**SBendtrans-99.1-28.3-176.5-160.1160.7149.200113.7
78V43.3Very low61.5Low102 Ų10297.2 Ų97.262%0.61859%0.587SS**Hα-helixtrans-81.5-25.7167.6174.60000111.3G80V78-G80 VanDerWaalsContact C-N 3.26Å; V78-G80 PolarHBondContact O-N 3.36Å
79G47.5Very low62.3Low34 Ų3497 Ų9735%0.35159%0.585SS.*Hα-helixtrans-68.3-21.4168.400000113.9S83G79-S83 WeakPolarHBondContact O-CB 3.47Å; G79-S83 PolarHBondContact O-N 3.45Å
80G53.3Low63.4Low26 Ų26100.2 Ų100.227%0.26860%0.596SS.*Hα-helixtrans-65.8-46.517800000113V78 Q82 S83 L84V78-G80 VanDerWaalsContact C-N 3.26Å; V78-G80 PolarHBondContact O-N 3.36Å; G80-Q82 PolarHBondContact O-N 2.86Å; G80-S83 PolarHBondContact O-N 3.26Å; G80-L84 WeakPolarHBondContact O-CB 3.44Å; G80-L84 WeakPolarHBondContact O-CD1 3.41Å; G80-L84 WeakPolarHBondContact O-CG 3.17Å; G80-L84 PolarHBondContact O-N 3.01Å
81A56.3Low65.1Low59 Ų59101.1 Ų101.149%0.48860%0.595SS.*Hα-helixtrans-65.5-41-179.100000112Y85A81-Y85 WeakPolarHBondContact O-CD2 3.28Å; A81-Y85 WeakPolarHBondContact O-CE2 3.49Å; A81-Y85 PolarHBondContact O-N 3.33Å
82Q60.3Low67.1Low148 Ų14899.1 Ų99.169%0.69258%0.576SS**Hα-helixtrans-76.6-34.4-179.9-156.8155.1-15.200112.9G80 Y85G80-Q82 PolarHBondContact O-N 2.86Å; Q82-Y85 PolarHBondContact O-N 2.89Å
83S72.5Confident69.2Low55 Ų55100.3 Ų100.339%0.38557%0.571SS.*Hα-helixtrans-66.7-37.6172.5-174.20000111.8G79 G80 Y85 L86 I87G79-S83 WeakPolarHBondContact O-CB 3.47Å; G79-S83 PolarHBondContact O-N 3.45Å; G80-S83 PolarHBondContact O-N 3.26Å; S83-Y85 VanDerWaalsContact C-N 3.29Å; S83-Y85 PolarHBondContact O-N 3.02Å; S83-L86 PolarHBondContact O-N 2.93Å; S83-I87 WeakPolarHBondContact O-CB 3.36Å; S83-I87 VanDerWaalsContact O-CG1 3.28Å; S83-I87 WeakPolarHBondContact O-CG1 3.49Å; S83-I87 PolarHBondContact O-N 3.38Å; S83-I87 WeakPolarHBondContact OG-CD1 3.49Å
84L75.1Confident71.7Confident99 Ų9999.1 Ų99.152%0.51856%0.56SS.*Hα-helixtrans-61.7-34.7174-73.7168.3000112.5G80 L86 I87 V88G80-L84 WeakPolarHBondContact O-CB 3.44Å; G80-L84 WeakPolarHBondContact O-CD1 3.41Å; G80-L84 WeakPolarHBondContact O-CG 3.17Å; G80-L84 PolarHBondContact O-N 3.01Å; L84-L86 PolarHBondContact O-N 3.26Å; L84-I87 PolarHBondContact O-N 2.89Å; L84-V88 HydrophobicContact CD2-CG2 4.43Å; L84-V88 WeakPolarHBondContact O-CB 3.31Å; L84-V88 WeakPolarHBondContact O-CG2 3.38Å; L84-V88 PolarHBondContact O-N 3.25Å
85Y80.4Confident74.1Confident182 Ų18297.6 Ų97.671%0.71455%0.552SS**Hα-helixtrans-66.9-16.5173.8-75.1-71.7000114.2A81 Q82 S83 P89A81-Y85 WeakPolarHBondContact O-CD2 3.28Å; A81-Y85 WeakPolarHBondContact O-CE2 3.49Å; A81-Y85 PolarHBondContact O-N 3.33Å; Q82-Y85 PolarHBondContact O-N 2.89Å; S83-Y85 VanDerWaalsContact C-N 3.29Å; S83-Y85 PolarHBondContact O-N 3.02Å; Y85-P89 WeakPolarHBondContact O-CD 3.2Å; Y85-P89 WeakPolarHBondContact O-CG 3.24Å
86L81.3Confident76.5Confident122 Ų12295.3 Ų95.364%0.63954%0.539SS*.Hα-helixtrans-97.6-40.8172.6-63.7178.7000111.3S83 L84 L90S83-L86 PolarHBondContact O-N 2.93Å; L84-L86 PolarHBondContact O-N 3.26Å; L86-L90 WeakPolarHBondContact O-CB 3.39Å; L86-L90 WeakPolarHBondContact O-CD1 3.24Å; L86-L90 WeakPolarHBondContact O-CG 3.08Å; L86-L90 PolarHBondContact O-N 2.91Å
87I85.4Confident78.8Confident77 Ų7794.6 Ų94.640%0.39553%0.529SS..Hα-helixtrans-68.5-45.3-178.9-65.4166.2000111.1S83 L84 L90 L91S83-I87 WeakPolarHBondContact O-CB 3.36Å; S83-I87 VanDerWaalsContact O-CG1 3.28Å; S83-I87 WeakPolarHBondContact O-CG1 3.49Å; S83-I87 PolarHBondContact O-N 3.38Å; S83-I87 WeakPolarHBondContact OG-CD1 3.49Å; L84-I87 PolarHBondContact O-N 2.89Å; I87-L90 PolarHBondContact O-N 2.93Å; I87-L91 HydrophobicContact CG2-CD1 3.83Å; I87-L91 HydrophobicContact CG2-CG 4.19Å; I87-L91 WeakPolarHBondContact O-CG 3.32Å; I87-L91 PolarHBondContact O-N 3.26Å
88V89.1Confident81Confident82 Ų8290.8 Ų90.850%0.49751%0.511SS..Hα-helixtrans-63.1-47.1-176.71730000111.9L84 L90 L91 L92L84-V88 HydrophobicContact CD2-CG2 4.43Å; L84-V88 WeakPolarHBondContact O-CB 3.31Å; L84-V88 WeakPolarHBondContact O-CG2 3.38Å; L84-V88 PolarHBondContact O-N 3.25Å; V88-L90 PolarHBondContact O-N 2.87Å; V88-L91 PolarHBondContact O-N 3.36Å; V88-L92 WeakPolarHBondContact O-CB 3.42Å; V88-L92 PolarHBondContact O-N 2.97Å
89P92.1Very high83.6Confident65 Ų6588.3 Ų88.342%0.42250%0.502SS..Hα-helixtrans-63.8-37.3174-26.538.3000113.6Y85 L92 V93Y85-P89 WeakPolarHBondContact O-CD 3.2Å; Y85-P89 WeakPolarHBondContact O-CG 3.24Å; P89-L92 PolarHBondContact O-N 3.42Å; P89-V93 WeakPolarHBondContact O-CB 3.35Å; P89-V93 VanDerWaalsContact O-CG2 3.24Å; P89-V93 WeakPolarHBondContact O-CG2 3.29Å; P89-V93 PolarHBondContact O-N 3.47Å
90L92.4Very high85.9Confident126 Ų12690.9 Ų90.966%0.6651%0.51SS*.Hα-helixtrans-64.5-42.3177.5-75.4172.4000112.1L86 I87 V88 G94L86-L90 WeakPolarHBondContact O-CB 3.39Å; L86-L90 WeakPolarHBondContact O-CD1 3.24Å; L86-L90 WeakPolarHBondContact O-CG 3.08Å; L86-L90 PolarHBondContact O-N 2.91Å; I87-L90 PolarHBondContact O-N 2.93Å; V88-L90 PolarHBondContact O-N 2.87Å; L90-G94 PolarHBondContact O-N 2.92Å
91L94.1Very high88Confident112 Ų11292.3 Ų92.359%0.58652%0.52SS*.Hα-helixtrans-65.9-42.4175.1-67.7178.8000111.4I87 V88 G94 L95I87-L91 HydrophobicContact CG2-CD1 3.83Å; I87-L91 HydrophobicContact CG2-CG 4.19Å; I87-L91 WeakPolarHBondContact O-CG 3.32Å; I87-L91 PolarHBondContact O-N 3.26Å; V88-L91 PolarHBondContact O-N 3.36Å; L91-G94 PolarHBondContact O-N 3.25Å; L91-L95 VanDerWaalsContact O-CG 3.31Å; L91-L95 WeakPolarHBondContact O-CG 3.25Å; L91-L95 PolarHBondContact O-N 3.06Å
92L94.9Very high89.9Confident99 Ų9993.8 Ų93.852%0.51852%0.518SS..Hα-helixtrans-63.2-45178.2-172.6144.9000111.7V88 P89 L95 I96V88-L92 WeakPolarHBondContact O-CB 3.42Å; V88-L92 PolarHBondContact O-N 2.97Å; P89-L92 PolarHBondContact O-N 3.42Å; L92-L95 PolarHBondContact O-N 2.96Å; L92-I96 HydrophobicContact CD2-CD1 3.57Å; L92-I96 HydrophobicContact CG-CD1 4.48Å; L92-I96 VanDerWaalsContact O-CG1 3.29Å; L92-I96 WeakPolarHBondContact O-CG1 3.34Å; L92-I96 PolarHBondContact O-N 3.39Å
93V96.8Very high91.6Very high84 Ų8490.6 Ų90.651%0.50951%0.509SS..Hα-helixtrans-63.5-42.8174.8172.40000110.9P89 L95 I96 V97P89-V93 WeakPolarHBondContact O-CB 3.35Å; P89-V93 VanDerWaalsContact O-CG2 3.24Å; P89-V93 WeakPolarHBondContact O-CG2 3.29Å; P89-V93 PolarHBondContact O-N 3.47Å; V93-L95 PolarHBondContact O-N 3.3Å; V93-I96 PolarHBondContact O-N 2.95Å; V93-V97 HydrophobicContact CG1-CG2 4.44Å; V93-V97 WeakPolarHBondContact O-CG2 3.33Å; V93-V97 PolarHBondContact O-N 3.26Å
94G96.6Very high92.7Very high30 Ų3090.5 Ų90.531%0.30951%0.512SS..Hα-helixtrans-58.3-45.9175.800000112.7L90 L91 I96 V97 I98L90-G94 PolarHBondContact O-N 2.92Å; L91-G94 PolarHBondContact O-N 3.25Å; G94-I96 PolarHBondContact O-N 2.9Å; G94-V97 PolarHBondContact O-N 2.86Å; G94-I98 VanDerWaalsContact O-CG1 3.25Å; G94-I98 WeakPolarHBondContact O-CG1 3.37Å; G94-I98 PolarHBondContact O-N 3.46Å
95L96.8Very high93.7Very high120 Ų12095.1 Ų95.163%0.62852%0.523SS*.Hα-helixtrans-63.1-39.4176.9-70.2176.8000112.4L91 L92 V93 I98 A99L91-L95 VanDerWaalsContact O-CG 3.31Å; L91-L95 WeakPolarHBondContact O-CG 3.25Å; L91-L95 PolarHBondContact O-N 3.06Å; L92-L95 PolarHBondContact O-N 2.96Å; V93-L95 PolarHBondContact O-N 3.3Å; L95-I98 PolarHBondContact O-N 3.46Å; L95-A99 WeakPolarHBondContact O-CB 3.4Å; L95-A99 PolarHBondContact O-N 3.36Å
96I97.4Very high94.3Very high95 Ų9594 Ų9449%0.48752%0.517SS..Hα-helixtrans-62.9-46.8175.2-68.2169.2000110.6L92 V93 G94 I98 A99 V100L92-I96 HydrophobicContact CD2-CD1 3.57Å; L92-I96 HydrophobicContact CG-CD1 4.48Å; L92-I96 VanDerWaalsContact O-CG1 3.29Å; L92-I96 WeakPolarHBondContact O-CG1 3.34Å; L92-I96 PolarHBondContact O-N 3.39Å; V93-I96 PolarHBondContact O-N 2.95Å; G94-I96 PolarHBondContact O-N 2.9Å; I96-I98 VanDerWaalsContact C-N 3.34Å; I96-I98 PolarHBondContact O-N 3.29Å; I96-A99 PolarHBondContact O-N 2.93Å; I96-V100 HydrophobicContact CG2-CG2 4.47Å; I96-V100 WeakPolarHBondContact O-CG2 3.31Å; I96-V100 PolarHBondContact O-N 3.47Å
97V97.7Very high94.7Very high92 Ų9292.1 Ų92.156%0.55851%0.513SS*.Hα-helixtrans-61.5-43178.5172.40000111V93 G94 V100 A101V93-V97 HydrophobicContact CG1-CG2 4.44Å; V93-V97 WeakPolarHBondContact O-CG2 3.33Å; V93-V97 PolarHBondContact O-N 3.26Å; G94-V97 PolarHBondContact O-N 2.86Å; V97-V100 PolarHBondContact O-N 3.27Å; V97-A101 WeakPolarHBondContact O-CB 3.34Å; V97-A101 PolarHBondContact O-N 3.44Å
98I97.4Very high94.8Very high97 Ų9793.5 Ų93.550%0.49752%0.518SS..Hα-helixtrans-62.6-45.1176.7-68.8164.9000110.8G94 L95 I96 V100 A101 I102G94-I98 VanDerWaalsContact O-CG1 3.25Å; G94-I98 WeakPolarHBondContact O-CG1 3.37Å; G94-I98 PolarHBondContact O-N 3.46Å; L95-I98 PolarHBondContact O-N 3.46Å; I96-I98 VanDerWaalsContact C-N 3.34Å; I96-I98 PolarHBondContact O-N 3.29Å; I98-V100 PolarHBondContact O-N 2.92Å; I98-A101 PolarHBondContact O-N 3.43Å; I98-I102 HydrophobicContact CG2-CD1 3.67Å; I98-I102 HydrophobicContact CG2-CG1 4.32Å; I98-I102 WeakPolarHBondContact O-CB 3.47Å; I98-I102 VanDerWaalsContact O-CG1 3.26Å; I98-I102 WeakPolarHBondContact O-CG1 3.29Å; I98-I102 PolarHBondContact O-N 2.78Å
99A97.4Very high94.6Very high51 Ų5192.5 Ų92.542%0.42152%0.515SS..Hα-helixtrans-62.2-42177.500000112.1L95 I96 I102 T103L95-A99 WeakPolarHBondContact O-CB 3.4Å; L95-A99 PolarHBondContact O-N 3.36Å; I96-A99 PolarHBondContact O-N 2.93Å; A99-I102 PolarHBondContact O-N 3.44Å; A99-T103 WeakPolarHBondContact O-CB 3.37Å; A99-T103 VanDerWaalsContact O-CG2 3.29Å; A99-T103 WeakPolarHBondContact O-CG2 3.19Å; A99-T103 PolarHBondContact O-N 3.35Å; A99-T103 PolarHBondContact O-OG1 3.36Å
100V97.4Very high94Very high87 Ų8797.8 Ų97.853%0.52753%0.526SS..Hα-helixtrans-64.7-42.2175174.30000111.1I96 V97 I98 T103 A104I96-V100 HydrophobicContact CG2-CG2 4.47Å; I96-V100 WeakPolarHBondContact O-CG2 3.31Å; I96-V100 PolarHBondContact O-N 3.47Å; V97-V100 PolarHBondContact O-N 3.27Å; I98-V100 PolarHBondContact O-N 2.92Å; V100-T103 WeakPolarHBondContact CA-OG1 3.37Å; V100-T103 PolarHBondContact O-N 3.31Å; V100-T103 PolarHBondContact O-OG1 3.23Å; V100-A104 WeakPolarHBondContact O-CB 3.48Å; V100-A104 PolarHBondContact O-N 3.35Å
101A96.5Very high93.2Very high56 Ų5696.8 Ų96.846%0.46352%0.516SS..Hα-helixtrans-63.6-43.2176.300000111.7V97 I98 W105V97-A101 WeakPolarHBondContact O-CB 3.34Å; V97-A101 PolarHBondContact O-N 3.44Å; I98-A101 PolarHBondContact O-N 3.43Å; A101-W105 WeakPolarHBondContact O-CB 3.32Å; A101-W105 PolarHBondContact O-N 3.48Å
102I96.8Very high91.9Very high90 Ų90100.1 Ų100.146%0.46252%0.521SS..Hα-helixtrans-64.4-45.5176.7-68.5167.7000110.6I98 A99 W105 R106I98-I102 HydrophobicContact CG2-CD1 3.67Å; I98-I102 HydrophobicContact CG2-CG1 4.32Å; I98-I102 WeakPolarHBondContact O-CB 3.47Å; I98-I102 VanDerWaalsContact O-CG1 3.26Å; I98-I102 WeakPolarHBondContact O-CG1 3.29Å; I98-I102 PolarHBondContact O-N 2.78Å; A99-I102 PolarHBondContact O-N 3.44Å; I102-W105 PolarHBondContact O-N 3.36Å; I102-R106 HydrophobicContact CG2-CG 4.09Å; I102-R106 VanDerWaalsContact O-CB 3.26Å; I102-R106 WeakPolarHBondContact O-CB 3.26Å; I102-R106 WeakPolarHBondContact O-CG 3.2Å; I102-R106 PolarHBondContact O-N 2.84Å
103T95.8Very high90.4Very high82 Ų8299.6 Ų99.650%0.50353%0.526SS..Hα-helixtrans-66.2-43.8178.952.20000111.6A99 V100 W105 R106 C107A99-T103 WeakPolarHBondContact O-CB 3.37Å; A99-T103 VanDerWaalsContact O-CG2 3.29Å; A99-T103 WeakPolarHBondContact O-CG2 3.19Å; A99-T103 PolarHBondContact O-N 3.35Å; A99-T103 PolarHBondContact O-OG1 3.36Å; V100-T103 WeakPolarHBondContact CA-OG1 3.37Å; V100-T103 PolarHBondContact O-N 3.31Å; V100-T103 PolarHBondContact O-OG1 3.23Å; T103-W105 PolarHBondContact O-N 2.78Å; T103-R106 PolarHBondContact O-N 2.94Å; T103-C107 VanDerWaalsContact O-CB 3.26Å; T103-C107 WeakPolarHBondContact O-CB 3.19Å; T103-C107 PolarHBondContact O-N 3.41Å; T103-C107 PolarHBondContact O-SG 2.85Å
104A95.4Very high88.8Confident53 Ų53103.4 Ų103.444%0.43854%0.538SS..Hα-helixtrans-61.5-42.8173.400000111.7V100 C107 H108V100-A104 WeakPolarHBondContact O-CB 3.48Å; V100-A104 PolarHBondContact O-N 3.35Å; A104-C107 PolarHBondContact O-N 3.31Å; A104-H108 WeakPolarHBondContact O-CB 3.08Å; A104-H108 PolarHBondContact O-N 3.42Å
105W95.8Very high86.9Confident196 Ų196109.2 Ų109.274%0.74255%0.551SS**Hα-helixtrans-63-45.2175.3-177.7-80.3000111.7A101 I102 T103 H108 S109A101-W105 WeakPolarHBondContact O-CB 3.32Å; A101-W105 PolarHBondContact O-N 3.48Å; I102-W105 PolarHBondContact O-N 3.36Å; T103-W105 PolarHBondContact O-N 2.78Å; W105-H108 PolarHBondContact O-N 3.3Å; W105-S109 WeakPolarHBondContact O-CB 3.11Å; W105-S109 PolarHBondContact O-N 3.14Å
106R92.9Very high84.7Confident158 Ų158107.6 Ų107.660%0.59655%0.549SS*.Hα-helixtrans-65.6-41.1177.9-71.1-75.5-169.3127.85.4110.9I102 T103 R110I102-R106 HydrophobicContact CG2-CG 4.09Å; I102-R106 VanDerWaalsContact O-CB 3.26Å; I102-R106 WeakPolarHBondContact O-CB 3.26Å; I102-R106 WeakPolarHBondContact O-CG 3.2Å; I102-R106 PolarHBondContact O-N 2.84Å; T103-R106 PolarHBondContact O-N 2.94Å; R106-R110 VanDerWaalsContact O-CB 3.32Å; R106-R110 WeakPolarHBondContact O-CB 3.42Å; R106-R110 WeakPolarHBondContact O-CG 3.21Å; R106-R110 PolarHBondContact O-N 2.94Å
107C90.5Very high82.5Confident83 Ų83108.2 Ų108.256%0.56156%0.559SS**Hα-helixtrans-65.2-43.3174.1-74.90000111.4T103 A104 K111T103-C107 VanDerWaalsContact O-CB 3.26Å; T103-C107 WeakPolarHBondContact O-CB 3.19Å; T103-C107 PolarHBondContact O-N 3.41Å; T103-C107 PolarHBondContact O-SG 2.85Å; A104-C107 PolarHBondContact O-N 3.31Å; C107-K111 WeakPolarHBondContact O-CB 3.26Å; C107-K111 PolarHBondContact O-N 2.89Å
108H87.8Confident80.4Confident106 Ų106107.7 Ų107.749%0.49157%0.573SS.*Hα-helixtrans-70.2-36.1178-171.5-95.6000112.1A104 W105 K111 R112A104-H108 WeakPolarHBondContact O-CB 3.08Å; A104-H108 PolarHBondContact O-N 3.42Å; W105-H108 PolarHBondContact O-N 3.3Å; H108-K111 CarbonylContact O-C 3.08Å; H108-K111 PolarHBondContact O-N 3.03Å; H108-R112 WeakPolarHBondContact O-CB 3.2Å; H108-R112 PolarHBondContact O-N 3.47Å
109S84.1Confident78.1Confident61 Ų61111 Ų11143%0.42759%0.591SS.*Hα-helixtrans-68.2-44.2175.9179.70000110.9W105 K111 R112 S113W105-S109 WeakPolarHBondContact O-CB 3.11Å; W105-S109 PolarHBondContact O-N 3.14Å; S109-K111 VanDerWaalsContact C-N 3.32Å; S109-K111 PolarHBondContact O-N 2.83Å; S109-R112 PolarHBondContact O-N 3.18Å; S109-S113 VanDerWaalsContact O-CB 3.23Å; S109-S113 WeakPolarHBondContact O-CB 3.32Å; S109-S113 PolarHBondContact O-N 3.25Å
110R79.5Confident75.7Confident175 Ų175112 Ų11266%0.6661%0.605SS**Hα-helixtrans-60.2-43170.4-73.1174.4-177.7-126.83.2111.2R106 S113 Q114R106-R110 VanDerWaalsContact O-CB 3.32Å; R106-R110 WeakPolarHBondContact O-CB 3.42Å; R106-R110 WeakPolarHBondContact O-CG 3.21Å; R106-R110 PolarHBondContact O-N 2.94Å; R110-S113 PolarHBondContact O-N 3.06Å; R110-Q114 WeakPolarHBondContact O-CB 3.26Å; R110-Q114 WeakPolarHBondContact O-CG 3.21Å; R110-Q114 PolarHBondContact O-N 2.96Å
111K76.4Confident73Confident106 Ų106116.5 Ų116.546%0.46162%0.62SS.*Hα-helixtrans-68.5-34.1177.3-164.6177-164.2-177.90112.7C107 H108 S109 R115C107-K111 WeakPolarHBondContact O-CB 3.26Å; C107-K111 PolarHBondContact O-N 2.89Å; H108-K111 CarbonylContact O-C 3.08Å; H108-K111 PolarHBondContact O-N 3.03Å; S109-K111 VanDerWaalsContact C-N 3.32Å; S109-K111 PolarHBondContact O-N 2.83Å; K111-R115 WeakPolarHBondContact O-CB 3.13Å; K111-R115 WeakPolarHBondContact O-CG 3.49Å; K111-R115 PolarHBondContact O-N 3.01Å
112R66.1Low70.9Confident182 Ų182118.6 Ų118.669%0.68763%0.632SS**Hα-helixtrans-74.4-36.8175.7-172175.9-176.7-178.11.3110.9H108 S109 R115 S116H108-R112 WeakPolarHBondContact O-CB 3.2Å; H108-R112 PolarHBondContact O-N 3.47Å; S109-R112 PolarHBondContact O-N 3.18Å; R112-R115 CarbonylContact O-C 3.43Å; R112-R115 PolarHBondContact O-N 3.08Å; R112-S116 PolarHBondContact O-N 3.02Å; R112-S116 VanDerWaalsContact O-N 3.15Å; R112-S116 PolarHBondContact O-OG 3.19Å
113S63.5Low68.5Low88 Ų88121.6 Ų121.662%0.61564%0.644SS**Hα-helixtrans-64.8-38.1171.1175.50000111.7S109 R110S109-S113 VanDerWaalsContact O-CB 3.23Å; S109-S113 WeakPolarHBondContact O-CB 3.32Å; S109-S113 PolarHBondContact O-N 3.25Å; R110-S113 PolarHBondContact O-N 3.06Å
114Q62.3Low65.9Low164 Ų164127 Ų12777%0.76666%0.663SS**Hα-helixtrans-75.6-30.3172.4-73.1-176.49.500113.6R110 S116R110-Q114 WeakPolarHBondContact O-CB 3.26Å; R110-Q114 WeakPolarHBondContact O-CG 3.21Å; R110-Q114 PolarHBondContact O-N 2.96Å; Q114-S116 PolarHBondContact O-N 2.73Å
115R57.2Low63.4Low151 Ų151130.7 Ų130.757%0.5768%0.675SS**THydrogen-bonded Turntrans-83.914.7173.5-74.3171.8172.5170.9-12.3113.4K111 R112 P117K111-R115 WeakPolarHBondContact O-CB 3.13Å; K111-R115 WeakPolarHBondContact O-CG 3.49Å; K111-R115 PolarHBondContact O-N 3.01Å; R112-R115 CarbonylContact O-C 3.43Å; R112-R115 PolarHBondContact O-N 3.08Å; R115-P117 WeakPolarHBondContact O-CD 3.16Å
116S51Low61.1Low86 Ų86130.4 Ų130.460%0.60168%0.682SS**  trans-89.179.5154.7-60.90000107.7R112 Q114 G118R112-S116 PolarHBondContact O-N 3.02Å; R112-S116 VanDerWaalsContact O-N 3.15Å; R112-S116 PolarHBondContact O-OG 3.19Å; Q114-S116 PolarHBondContact O-N 2.73Å; S116-G118 PolarHBondContact O-N 3.33Å
117P50.6Low59.1Low108 Ų108128.7 Ų128.770%0.70169%0.689SS**  trans-63126.4157.229.5-28.2000105.7R115 L119R115-P117 WeakPolarHBondContact O-CD 3.16Å; P117-L119 PolarHBondContact O-N 2.69Å
118G53Low57.5Low81 Ų81132.6 Ų132.684%0.83570%0.703SS**  trans-53.7108.2164.800000108.3S116S116-G118 PolarHBondContact O-N 3.33Å
119L49.1Very low55.6Low167 Ų167133.4 Ų133.487%0.87472%0.72SS**  trans-97.795.5155.7-166.468.9000105.5P117 H121P117-L119 PolarHBondContact O-N 2.69Å; L119-H121 PolarHBondContact O-N 2.76Å
120G49Very low54.1Low71 Ų71137.2 Ų137.273%0.73274%0.741SS**  trans-55.8120.6164.900000109.2
121H39.5Very low52.7Low182 Ų182134.8 Ų134.884%0.84375%0.745SS**  trans-125.496.1142.2-163.867.2000107.9L119 H123L119-H121 PolarHBondContact O-N 2.76Å; H121-H123 PolarHBondContact O-N 3.35Å
122S52.7Low50.9Low101 Ų101135.5 Ų135.571%0.70676%0.764SS**  trans-6.797.8152.61800000116.1
123H46.4Very low50.3Low152 Ų152133.7 Ų133.770%0.70477%0.765SS**  trans-16465.8142-137.9-88000111.9H121H121-H123 PolarHBondContact O-N 3.35Å
124H41.5Very low49.4Very low195 Ų195136.5 Ų136.590%0.90377%0.773SS**  trans-111.7109.9167.4-80.1-64.7000110.3H126H124-H126 PolarHBondContact O-N 2.83Å
125N42.1Very low48.6Very low131 Ų131137.3 Ų137.370%0.70178%0.777SS**  trans-47.9127.2173.1-60.2-69.5000111.2V127N125-V127 PolarHBondContact O-N 3.42Å
126H47.4Very low47.5Very low191 Ų191142 Ų14288%0.88480%0.795SS**THydrogen-bonded Turntrans-73.548.4-176.7-169.8-73000113.2H124H124-H126 PolarHBondContact O-N 2.83Å
127V52.4Low46.8Very low122 Ų122141 Ų14174%0.73980%0.798SS**THydrogen-bonded Turntrans-128.7-22.6179.6-171.70000114.3N125N125-V127 PolarHBondContact O-N 3.42Å
128L56Low46Very low164 Ų164147.8 Ų147.886%0.85981%0.809SS**SBendtrans-14977.3-171-63.7171.3000113
129S48.5Very low45.3Very low123 Ų123150.8 Ų150.886%0.8681%0.806SS**  trans-171.577.7149-162.60000110.1
130V51.7Low44.6Very low141 Ų141152.4 Ų152.486%0.85580%0.802SS**  trans-102.3144.9160.3-178.40000106.6
131V50.4Low44Very low124 Ų124156.4 Ų156.475%0.75280%0.802SS**  trans99.482.3175.7-164.80000114.3
132S39.3Very low43.9Very low122 Ų122157.2 Ų157.285%0.85381%0.805SS**  trans-116.8110.6133.3-164.10000106.7
133M53.4Low43Very low143 Ų143155.5 Ų155.570%0.70480%0.803SS**  trans-59149.1150.7-69-176.457.200106.4
134D44.9Very low42.3Very low148 Ų148155.9 Ų155.979%0.79181%0.811SS**  -156114.458.2-42.3-56000110.3
135Q44.8Very low41.8Very low180 Ų180155.4 Ų155.484%0.84181%0.809SS**  trans-93.5114.9158.4-177.990.348.300105.2
136W32.9Very low41.4Very low251 Ų251154.4 Ų154.495%0.95181%0.812SS**  trans171.6130.4141.6-105.257.8000112.8
137G36.8Very low40.7Very low65 Ų65154 Ų15467%0.6781%0.811SS**  trans108.777.1139.600000118.7
138R34.9Very low39.8Very low249 Ų249155.1 Ų155.194%0.9481%0.812SS**  174.1112.3116.3-100.3-166-75.3-139.1-0.8111.6
139D38.1Very low38.6Very low144 Ų144151.5 Ų151.577%0.7780%0.8SS**  trans-80.7163159-73.7-51.2000111.5
140Y34.5Very low37.8Very low201 Ų201153 Ų15379%0.78880%0.797SS**  trans118.5124.7160.8-68.6-54.9000114.1
141H36.1Very low36.9Very low156 Ų156154.5 Ų154.572%0.72279%0.794SS**  cis-151.5140.11.7-95.5-78.2000107.6
142H37.6Very low36.1Very low198 Ų198153.2 Ų153.292%0.91779%0.791SS**  trans-105123.2158-109.743.4000107.8
143G33Very low36Very low65 Ų65152.6 Ų152.667%0.6779%0.787SS**  trans-80.1154.4173.800000111.9
144D32Very low36.1Very low161 Ų161151.7 Ų151.786%0.86179%0.792SS**  trans76.298.8165.7-65.3-15.7000119.7
145Q30.6Very low35.4Very low184 Ų184149.3 Ų149.386%0.8679%0.792SS**  -165.8109.4123.4-106.416661.500108.3
146S34Very low35Very low110 Ų110151.8 Ų151.877%0.76980%0.795SS**  63.1108.298.9-61.90000115.1
147E33.1Very low35.5Very low183 Ų183145.7 Ų145.786%0.85579%0.788SS**  trans52.8116.1150.1-56.6-152.2105.300120.8
148L33.4Very low35.3Very low146 Ų146145.9 Ų145.976%0.76479%0.79SS**  163.2137.692.7-152.292.5000111.4
149S30Very low35.5Very low87 Ų87139.5 Ų139.561%0.60878%0.784SS**  trans72.7103.6149.865.80000122.2
150I33.1Very low35.2Very low156 Ų156140.8 Ų140.880%0.879%0.785SS**  73.3117.3110.9-66.5164.1000120.1
151H31.3Very low35.7Very low171 Ų171138 Ų13879%0.79278%0.782SS**  trans99.8112.5141.7-112.1-104.6000120.8
152S34.2Very low35.5Very low97 Ų97137.5 Ų137.568%0.67879%0.79SS**  trans78.8107.3136.8-66.20000121.9
153S37.5Very low35.7Very low110 Ų110136.5 Ų136.577%0.76979%0.791SS**  trans-66.1169.2135.8-62.30000110.3
154P54.5Low35.8Very low124 Ų124137 Ų13781%0.80580%0.796SS**  cis-147.8-173.224.639.5-16.6000117
155A32Very low36.6Very low97 Ų97141.3 Ų141.380%0.80280%0.8SS**  trans110.412215000000118.6
156Y34.3Very low37.1Very low232 Ų232136 Ų13691%0.9180%0.795SS**  trans-79.2147.3153.8-82.6-85.5000108.9
157P45.2Very low37.9Very low123 Ų123136.9 Ų136.980%0.79980%0.801SS**  -151.8167.891.237.3-18.4000115.7
158G30.8Very low38.8Very low69 Ų69132.4 Ų132.471%0.71180%0.795SS**  trans93.6103.8135.900000119.2
159S39.1Very low40.1Very low116 Ų116128.6 Ų128.681%0.81179%0.791SS**  trans-18.2131.2146.747.70000118
160E32.5Very low42.2Very low170 Ų170131.8 Ų131.879%0.79480%0.802SS**  175.5124.2107.9-96.1-165.415300113.7
161I45.3Very low44.1Very low143 Ų143129.5 Ų129.573%0.73380%0.797SS**  trans28.4117.614854.6159.5000122.1
162T31.6Very low46Very low145 Ų145127 Ų12789%0.8980%0.795SS**  -160.7106.5120.31.90000113.4
163L42.6Very low47.9Very low178 Ų178126.2 Ų126.293%0.93279%0.789SS**  trans26.1115139.9-161.870.4000120.2
164G33.6Very low49.8Very low75 Ų75123.8 Ų123.877%0.77377%0.772SS**  trans-17236.9170.300000117.6G166G164-G166 PolarHBondContact O-N 2.8Å
165R50.7Low50.6Low252 Ų252125.7 Ų125.795%0.95176%0.764SS**  trans40.875.9151.6-157.6173.3-171.8167.11.3117.8
166G39.3Very low52.6Low73 Ų73125.1 Ų125.175%0.75375%0.745SS**  trans-102.5128.8157.600000110G164 A168G164-G166 PolarHBondContact O-N 2.8Å; G166-A168 PolarHBondContact O-N 2.91Å; G166-A168 VanDerWaalsContact O-N 3.07Å
167S51.9Low54.5Low127 Ų127120.9 Ų120.989%0.88873%0.733SS**  trans-48.4106.8-175.6-163.10000112.5G169S167-G169 PolarHBondContact O-N 3.31Å
168A52.6Low55.9Low89 Ų89118.7 Ų118.774%0.73673%0.725SS**  trans-68.4110.8165.700000107.3G166G166-A168 PolarHBondContact O-N 2.91Å; G166-A168 VanDerWaalsContact O-N 3.07Å
169G60.2Low58Low66 Ų66120.6 Ų120.668%0.6872%0.723SS**PPolyproline II helixtrans-64.1136.8156.800000107.3S167S167-G169 PolarHBondContact O-N 3.31Å
170D73.1Confident59.2Low155 Ų155116.7 Ų116.783%0.82970%0.701SS**PPolyproline II helixtrans-53134.2177.8-68.9-40.7000109.4
171P74.4Confident60.2Low107 Ų107115.4 Ų115.470%0.69570%0.695SS**PPolyproline II helixtrans-59.9150.2173.726.8-33000109.2
172P70.9Confident60.9Low118 Ų118114 Ų11477%0.76669%0.693SS**PPolyproline II helixtrans-54.9141175.124.6-33.3000109.6S174P172-S174 PolarHBondContact O-N 2.77Å
173P74.3Confident61.8Low82 Ų82113.9 Ų113.953%0.53269%0.687SS.*PPolyproline II helixtrans-58.1142.5-176.123.7-33.3000110.2E177P173-E177 HydrophobicContact CB-CB 4.28Å; P173-E177 HydrophobicContact CB-CG 4.26Å
174S76.6Confident62.2Low59 Ų59110.1 Ų110.141%0.41367%0.671SS.*PPolyproline II helixtrans-61.1150.9174.1-179.10000109.7P172 E176 E177 A178P172-S174 PolarHBondContact O-N 2.77Å; S174-E176 PolarHBondContact O-N 3.12Å; S174-E176 VanDerWaalsContact O-N 3.08Å; S174-E176 WeakPolarHBondContact OG-CG 3.23Å; S174-E177 WeakPolarHBondContact O-CA 3.17Å; S174-E177 WeakPolarHBondContact O-CB 3.47Å; S174-E177 PolarHBondContact O-N 3.36Å; S174-A178 PolarHBondContact O-N 3.28Å
175Y70.6Confident63Low163 Ų163114.1 Ų114.164%0.63967%0.67SS**Hα-helixtrans-53.5-35.9-179.577.6-86000111.9E177 A178 V179Y175-E177 VanDerWaalsContact C-N 3.33Å; Y175-E177 PolarHBondContact O-N 2.81Å; Y175-A178 PolarHBondContact O-N 3.42Å; Y175-V179 WeakPolarHBondContact O-CG1 3.37Å; Y175-V179 VanDerWaalsContact O-CG2 3.29Å; Y175-V179 WeakPolarHBondContact O-CG2 3.43Å; Y175-V179 PolarHBondContact O-N 2.79Å; Y175-V179 VanDerWaalsContact O-N 3.11Å
176E75.3Confident63.3Low86 Ų86108.2 Ų108.240%0.40266%0.656SS.*Hα-helixtrans-75.6-17.2-179.530.3-156.7141.800114S174S174-E176 PolarHBondContact O-N 3.12Å; S174-E176 VanDerWaalsContact O-N 3.08Å; S174-E176 WeakPolarHBondContact OG-CG 3.23Å
177E74.5Confident63.8Low143 Ų143112.3 Ų112.367%0.66866%0.655SS**Hα-helixtrans-84.6-38168.4-173.3178.917900111.2P173 S174 Y175 G180P173-E177 HydrophobicContact CB-CB 4.28Å; P173-E177 HydrophobicContact CB-CG 4.26Å; S174-E177 WeakPolarHBondContact O-CA 3.17Å; S174-E177 WeakPolarHBondContact O-CB 3.47Å; S174-E177 PolarHBondContact O-N 3.36Å; Y175-E177 VanDerWaalsContact C-N 3.33Å; Y175-E177 PolarHBondContact O-N 2.81Å; E177-G180 PolarHBondContact O-N 3.45Å
178A74.6Confident64.1Low77 Ų77111.7 Ų111.764%0.63665%0.646SS**Hα-helixtrans-72.5-30.6-178.400000113.9S174 Y175 G180S174-A178 PolarHBondContact O-N 3.28Å; Y175-A178 PolarHBondContact O-N 3.42Å; A178-G180 VanDerWaalsContact C-N 3.35Å
179V73.6Confident64.5Low108 Ų108115.4 Ų115.466%0.65565%0.649SS**SBendtrans-85.2-11177.1-60.40000113.1Y175Y175-V179 WeakPolarHBondContact O-CG1 3.37Å; Y175-V179 VanDerWaalsContact O-CG2 3.29Å; Y175-V179 WeakPolarHBondContact O-CG2 3.43Å; Y175-V179 PolarHBondContact O-N 2.79Å; Y175-V179 VanDerWaalsContact O-N 3.11Å
180G64.3Low65Low35 Ų35116.8 Ų116.836%0.36165%0.646SS.*  trans66.8137.2-173.100000111.9E177 A178 T182E177-G180 PolarHBondContact O-N 3.45Å; A178-G180 VanDerWaalsContact C-N 3.35Å; G180-T182 VanDerWaalsContact C-N 3.33Å; G180-T182 PolarHBondContact O-N 2.89Å
181H53.8Low64.5Low143 Ų143114.9 Ų114.966%0.66264%0.641SS**  trans-66.497.2165.3-89.761.8000108.3D183H181-D183 PolarHBondContact O-N 3.01Å
182T59.7Low63.9Low113 Ų113114.3 Ų114.369%0.69364%0.638SS**  trans-77.681.8161.457.10000107.3G180 V184G180-T182 VanDerWaalsContact C-N 3.33Å; G180-T182 PolarHBondContact O-N 2.89Å; T182-V184 PolarHBondContact O-N 3.34Å
183D51.2Low63.9Low142 Ų142114.3 Ų114.376%0.75963%0.628SS**  trans-71.944.1158.5-65.2-29.7000109.7H181 Q185H181-D183 PolarHBondContact O-N 3.01Å; D183-Q185 VanDerWaalsContact C-N 3.29Å; D183-Q185 PolarHBondContact O-N 2.88Å
184V51.9Low63.3Low100 Ų100118.4 Ų118.461%0.60663%0.634SS**  trans-83.692.7160.6-174.90000103.6T182 I186T182-V184 PolarHBondContact O-N 3.34Å; V184-I186 HydrophobicContact CB-CG1 4.4Å; V184-I186 HydrophobicContact CG1-CG1 3.8Å; V184-I186 PolarHBondContact O-N 2.77Å
185Q50.1Low62.9Low159 Ų159119.4 Ų119.474%0.74363%0.632SS**  trans-56.893155.4-175.6163.1-40.900105.6D183 E187D183-Q185 VanDerWaalsContact C-N 3.29Å; D183-Q185 PolarHBondContact O-N 2.88Å; Q185-E187 PolarHBondContact O-N 3.39Å
186I55.6Low62.6Low127 Ų127116.4 Ų116.465%0.65163%0.627SS**  trans-69.484.1169.3-59171.8000103.5V184 T188V184-I186 HydrophobicContact CB-CG1 4.4Å; V184-I186 HydrophobicContact CG1-CG1 3.8Å; V184-I186 PolarHBondContact O-N 2.77Å; I186-T188 PolarHBondContact O-N 3.15Å; I186-T188 PolarHBondContact O-OG1 3.34Å
187E51.1Low62.1Low159 Ų159117.3 Ų117.374%0.74363%0.633SS**  trans-60.992.8162.3-163.9143.2119.900104.7Q185 E189Q185-E187 PolarHBondContact O-N 3.39Å; E187-E189 PolarHBondContact O-N 3.4Å
188T57.8Low61.7Low115 Ų115113.8 Ų113.871%0.70662%0.621SS**  trans-76.786.1-176.7-44.30000103.9I186 P190I186-T188 PolarHBondContact O-N 3.15Å; I186-T188 PolarHBondContact O-OG1 3.34Å; T188-P190 WeakPolarHBondContact O-CD 2.83Å
189E60.1Low61.2Low167 Ų167115.5 Ų115.578%0.7862%0.62SS**PPolyproline II helixtrans-58.9123.6173-157-162-179.800106.7E187E187-E189 PolarHBondContact O-N 3.4Å
190P71.4Confident60.6Low95 Ų95114 Ų11462%0.61761%0.614SS**PPolyproline II helixtrans-56.9142.3176.922.7-32.7000109.2T188T188-P190 WeakPolarHBondContact O-CD 2.83Å
191P62.1Low60.2Low114 Ų114115.1 Ų115.174%0.7462%0.617SS**PPolyproline II helixtrans-54.7139.7-179.322.9-32.8000109.9Q193P191-Q193 PolarHBondContact O-N 2.86Å
192P62.5Low60.4Low95 Ų95111.2 Ų111.262%0.61761%0.605SS**PPolyproline II helixtrans-56.6134.4-173.921.3-32.6000110.8I197P192-I197 HydrophobicContact CG-CD1 4.4Å
193Q71.8Confident60.3Low119 Ų119108.1 Ų108.156%0.55660%0.596SS**PPolyproline II helixtrans-61.9140.5176.2-79.5-104.262.200109.9P191 E195 D196P191-Q193 PolarHBondContact O-N 2.86Å; Q193-E195 HydrophobicContact CB-CG 3.96Å; Q193-E195 WeakPolarHBondContact CB-OE1 3.4Å; Q193-E195 PolarHBondContact NE2-OE1 2.92Å; Q193-E195 VanDerWaalsContact NE2-OE1 3.12Å; Q193-E195 PolarHBondContact O-N 2.76Å; Q193-E195 VanDerWaalsContact O-N 3.08Å; Q193-D196 PolarHBondContact O-N 3.22Å
194Y60.7Low60.4Low168 Ų168111.4 Ų111.466%0.65960%0.598SS**Hα-helixtrans-59-30.2-17299.7-82.1000112.2D196 I197 V198Y194-D196 VanDerWaalsContact C-N 3.29Å; Y194-D196 PolarHBondContact O-N 2.78Å; Y194-I197 PolarHBondContact O-N 3.29Å; Y194-V198 HydrophobicContact CD2-CG2 3.96Å; Y194-V198 HydrophobicContact CE2-CG2 4.16Å; Y194-V198 WeakPolarHBondContact O-CG2 3.5Å; Y194-V198 PolarHBondContact O-N 3.06Å
195E68.6Low60.4Low80 Ų80113.4 Ų113.437%0.37460%0.603SS.*Hα-helixtrans-60-32.9177.953-116.4-163.900114.1Q193 N199Q193-E195 HydrophobicContact CB-CG 3.96Å; Q193-E195 WeakPolarHBondContact CB-OE1 3.4Å; Q193-E195 PolarHBondContact NE2-OE1 2.92Å; Q193-E195 VanDerWaalsContact NE2-OE1 3.12Å; Q193-E195 PolarHBondContact O-N 2.76Å; Q193-E195 VanDerWaalsContact O-N 3.08Å; E195-N199 WeakPolarHBondContact O-CB 3.45Å; E195-N199 PolarHBondContact O-N 3.21Å
196D64.2Low60.7Low99 Ų99110.9 Ų110.953%0.52960%0.604SS.*Hα-helixtrans-76.7-31.8-178.7-66.7-38.6000112.1Q193 Y194 S200Q193-D196 PolarHBondContact O-N 3.22Å; Y194-D196 VanDerWaalsContact C-N 3.29Å; Y194-D196 PolarHBondContact O-N 2.78Å; D196-S200 WeakPolarHBondContact O-CB 3.29Å; D196-S200 PolarHBondContact O-N 3.49Å
197I64.5Low60.5Low106 Ų106108 Ų10854%0.54461%0.605SS.*Hα-helixtrans-69.1-41.6175.7-54.1172.1000109.7P192 Y194 S201P192-I197 HydrophobicContact CG-CD1 4.4Å; Y194-I197 PolarHBondContact O-N 3.29Å; I197-S201 PolarHBondContact O-N 3.11Å; I197-S201 VanDerWaalsContact O-N 3.14Å; I197-S201 PolarHBondContact O-OG 2.9Å
198V65.6Low60.4Low68 Ų68103.8 Ų103.841%0.41260%0.604SS.*Hα-helixtrans-69.3-41.3178.8-179.10000111Y194 S201 S202Y194-V198 HydrophobicContact CD2-CG2 3.96Å; Y194-V198 HydrophobicContact CE2-CG2 4.16Å; Y194-V198 WeakPolarHBondContact O-CG2 3.5Å; Y194-V198 PolarHBondContact O-N 3.06Å; V198-S201 PolarHBondContact O-N 3.32Å; V198-S201 PolarHBondContact O-OG 3.06Å; V198-S202 PolarHBondContact O-N 3.21Å; V198-S202 PolarHBondContact O-OG 2.92Å
199N64Low60.2Low113 Ų113107 Ų10760%0.60461%0.612SS**Hα-helixtrans-70.3-35.7177.3-84.6-3.5000113.2E195 S201 S202 G203E195-N199 WeakPolarHBondContact O-CB 3.45Å; E195-N199 PolarHBondContact O-N 3.21Å; N199-S201 VanDerWaalsContact C-N 3.35Å; N199-S202 PolarHBondContact O-N 3.49Å; N199-G203 PolarHBondContact O-N 3.08Å
200S61.4Low59.7Low76 Ų76110.7 Ų110.753%0.53162%0.618SS.*Hα-helixtrans-68.1-34.9176.5-1640000112.1D196 R204D196-S200 WeakPolarHBondContact O-CB 3.29Å; D196-S200 PolarHBondContact O-N 3.49Å; S200-R204 PolarHBondContact O-N 3.07Å
201S57.3Low58.3Low60 Ų60119.8 Ų119.842%0.4265%0.648SS.*Hα-helixtrans-69.6-37.3171.772.80000112.7I197 V198 N199 I205I197-S201 PolarHBondContact O-N 3.11Å; I197-S201 VanDerWaalsContact O-N 3.14Å; I197-S201 PolarHBondContact O-OG 2.9Å; V198-S201 PolarHBondContact O-N 3.32Å; V198-S201 PolarHBondContact O-OG 3.06Å; N199-S201 VanDerWaalsContact C-N 3.35Å; S201-I205 VanDerWaalsContact O-CG1 3.32Å; S201-I205 WeakPolarHBondContact O-CG1 3.39Å; S201-I205 PolarHBondContact O-N 3.42Å
202S58Low58.1Low60 Ų60120.1 Ų120.142%0.4264%0.643SS.*Hα-helixtrans-71.5-36.4176.2-61.30000112.5V198 N199 I205 S206V198-S202 PolarHBondContact O-N 3.21Å; V198-S202 PolarHBondContact O-OG 2.92Å; N199-S202 PolarHBondContact O-N 3.49Å; S202-I205 PolarHBondContact O-N 2.87Å; S202-S206 PolarHBondContact O-N 3.25Å
203G56.2Low57.9Low49 Ų49121.4 Ų121.451%0.50565%0.645SS.*Hα-helixtrans-68.4-34.5176.200000113.7N199 I205 G207N199-G203 PolarHBondContact O-N 3.08Å; G203-I205 VanDerWaalsContact C-N 3.33Å; G203-G207 PolarHBondContact O-N 3.48Å
204R53.2Low57.1Low211 Ų211121.5 Ų121.580%0.79665%0.65SS**Hα-helixtrans-70.7-27.4173-81.7-173.4-173.6-160.71.8113.3S200S200-R204 PolarHBondContact O-N 3.07Å
205I53Low56.9Low141 Ų141118.8 Ų118.872%0.72365%0.649SS**Hα-helixtrans-79.2-29.6177.7-66171.2000111.4S201 S202 G203S201-I205 VanDerWaalsContact O-CG1 3.32Å; S201-I205 WeakPolarHBondContact O-CG1 3.39Å; S201-I205 PolarHBondContact O-N 3.42Å; S202-I205 PolarHBondContact O-N 2.87Å; G203-I205 VanDerWaalsContact C-N 3.33Å
206S54.7Low56.2Low107 Ų107121.2 Ų121.275%0.74867%0.666SS**Hα-helixtrans-84.8-8.2175.1-80.10000115.7S202S202-S206 PolarHBondContact O-N 3.25Å
207G51.5Low55.6Low67 Ų67122.7 Ų122.769%0.69168%0.675SS**THydrogen-bonded Turntrans-87-10.417900000115.8G203G203-G207 PolarHBondContact O-N 3.48Å
208G50.5Low55Low70 Ų70123.9 Ų123.972%0.72269%0.685SS**SBendtrans-91.92.2-171.100000116.8
209Q53.2Low54.2Low183 Ų183128.2 Ų128.286%0.85571%0.706SS**  trans-138.789.2173.9-90-164.4-65.200110.7
210R48.5Very low53.4Low244 Ų244129.4 Ų129.492%0.92171%0.714SS**  trans-158.2113.5148.4-109.4176.6-159.3-177.16.9110.4
211K42.6Very low52.6Low285 Ų285134.3 Ų134.3100%1.23973%0.731SS**  trans79.10171.5-69.4-177.8174.5-178.90117.1

Retrieved 211 of 211 residues in 308.2 ms (Link to these results)