A0A096NJG1_PAPAN Loading...

Oncostatin M

AlphaFold DB , UniProt , Accession A0A096NJG1, Species PAPAN (Papio anubis, Olive baboon), Gene OSM, Length 252 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
1M34.2Very low51.5Low249 Ų249133.3 Ų133.3100%1.22770%0.704SS**  0108.60-65.5-158.5-140.500108.1
2G40.2Very low52Low79 Ų79129.1 Ų129.181%0.81469%0.694SS**  trans-91.5125.7179.500000110.4
3V41.9Very low52.3Low127 Ų127127.2 Ų127.277%0.7768%0.682SS**  trans-77.9123.5174.9-176.50000108L5V3-L5 PolarHBondContact O-N 2.75Å
4P51Low52.9Low110 Ų110124.3 Ų124.371%0.71467%0.665SS**  trans-72.4113.7179.927.5-30.8000109.7T6P4-T6 PolarHBondContact O-N 3.16Å
5L54.7Low53.3Low120 Ų120121.8 Ų121.863%0.62865%0.651SS**  trans-65.5117.5166.6-97.883.4000108.6V3V3-L5 PolarHBondContact O-N 2.75Å
6T62.7Low53.4Low92 Ų92118.3 Ų118.356%0.56465%0.645SS**  trans-68.4144.2-179.952.70000110.9P4 R8 T9P4-T6 PolarHBondContact O-N 3.16Å; T6-R8 PolarHBondContact O-N 3Å; T6-T9 PolarHBondContact O-N 2.79Å; T6-T9 PolarHBondContact O-OG1 3.25Å
7R54.3Low53.8Low214 Ų214119.2 Ų119.281%0.80865%0.648SS**Hα-helixtrans-51.1-24.5-178.9-169.5177178-171.70.2114.2L11R7-L11 PolarHBondContact O-N 3.01Å
8R55.2Low53.9Low223 Ų223119.2 Ų119.284%0.84265%0.646SS**Hα-helixtrans-73.1-35.4175.8-75.8-177.9175170.4-1.5113.7T6 S12T6-R8 PolarHBondContact O-N 3Å; R8-S12 WeakPolarHBondContact O-CB 3.42Å; R8-S12 PolarHBondContact O-N 2.81Å; R8-S12 VanDerWaalsContact O-N 3.14Å
9T56Low53.8Low62 Ų62118 Ų11838%0.3864%0.635SS.*Hα-helixtrans-73.1-36177.444.40000111.7T6 S12 L13T6-T9 PolarHBondContact O-N 2.79Å; T6-T9 PolarHBondContact O-OG1 3.25Å; T9-S12 PolarHBondContact O-N 3.32Å; T9-L13 WeakPolarHBondContact O-CD1 3.37Å; T9-L13 PolarHBondContact O-N 3.27Å; T9-L13 VanDerWaalsContact O-N 3.07Å
10L57.9Low53.5Low92 Ų92116.7 Ų116.748%0.48263%0.633SS.*Hα-helixtrans-63-44.6172.6-91.4152.7000112.3S12 L13 I14L10-S12 PolarHBondContact O-N 2.92Å; L10-L13 PolarHBondContact O-N 3.17Å; L10-I14 WeakPolarHBondContact O-CD1 3.41Å; L10-I14 WeakPolarHBondContact O-CG1 3.39Å; L10-I14 PolarHBondContact O-N 3.24Å
11L58.9Low53.2Low98 Ų98115 Ų11551%0.51363%0.63SS.*Hα-helixtrans-64.7-39.6178.1-122.3113.9000112.4R7 I14 L15R7-L11 PolarHBondContact O-N 3.01Å; L11-I14 PolarHBondContact O-N 3.41Å; L11-L15 HydrophobicContact CD2-CD1 4.03Å; L11-L15 VanDerWaalsContact O-CD1 3.32Å; L11-L15 WeakPolarHBondContact O-CD1 3.4Å; L11-L15 PolarHBondContact O-N 3.19Å
12S57.3Low53.3Low83 Ų83109.2 Ų109.258%0.5860%0.601SS**Hα-helixtrans-64.1-42.1177.1-170.50000112.1R8 T9 L10 L15 A16R8-S12 WeakPolarHBondContact O-CB 3.42Å; R8-S12 PolarHBondContact O-N 2.81Å; R8-S12 VanDerWaalsContact O-N 3.14Å; T9-S12 PolarHBondContact O-N 3.32Å; L10-S12 PolarHBondContact O-N 2.92Å; S12-L15 PolarHBondContact O-N 3.36Å; S12-A16 WeakPolarHBondContact O-CB 3.46Å; S12-A16 PolarHBondContact O-N 2.76Å
13L55.6Low53.2Low105 Ų105108.4 Ų108.455%0.5559%0.587SS.*Hα-helixtrans-64.5-39.9174.7-105.3113.2000112.4T9 L10 A16 L17T9-L13 WeakPolarHBondContact O-CD1 3.37Å; T9-L13 PolarHBondContact O-N 3.27Å; T9-L13 VanDerWaalsContact O-N 3.07Å; L10-L13 PolarHBondContact O-N 3.17Å; L13-A16 PolarHBondContact O-N 3.13Å; L13-L17 WeakPolarHBondContact O-CD1 3.43Å; L13-L17 WeakPolarHBondContact O-CG 3.39Å; L13-L17 PolarHBondContact O-N 3.29Å; L13-L17 VanDerWaalsContact O-N 3.07Å
14I60.8Low53.1Low86 Ų86106.2 Ų106.244%0.44158%0.577SS.*Hα-helixtrans-68.3-41.3179.5-67.9164.1000110.8L10 L11 L17 L18L10-I14 WeakPolarHBondContact O-CD1 3.41Å; L10-I14 WeakPolarHBondContact O-CG1 3.39Å; L10-I14 PolarHBondContact O-N 3.24Å; L11-I14 PolarHBondContact O-N 3.41Å; I14-L17 PolarHBondContact O-N 2.9Å; I14-L18 HydrophobicContact CG2-CD1 3.61Å; I14-L18 HydrophobicContact CG2-CG 4.32Å; I14-L18 WeakPolarHBondContact O-CB 3.45Å; I14-L18 VanDerWaalsContact O-CG 3.24Å; I14-L18 WeakPolarHBondContact O-CG 3.24Å; I14-L18 PolarHBondContact O-N 2.82Å
15L58.6Low52.4Low87 Ų87108.1 Ų108.146%0.45558%0.578SS.*Hα-helixtrans-65-37.6173.5-94.4108.8000112.6L11 S12 L17 L18 F19L11-L15 HydrophobicContact CD2-CD1 4.03Å; L11-L15 VanDerWaalsContact O-CD1 3.32Å; L11-L15 WeakPolarHBondContact O-CD1 3.4Å; L11-L15 PolarHBondContact O-N 3.19Å; S12-L15 PolarHBondContact O-N 3.36Å; L15-L17 VanDerWaalsContact C-N 3.29Å; L15-L17 PolarHBondContact O-N 2.87Å; L15-L18 PolarHBondContact O-N 2.92Å; L15-F19 HydrophobicContact CD2-CD2 4.32Å; L15-F19 HydrophobicContact CD2-CE2 4.17Å; L15-F19 HydrophobicContact CG-CE2 4.47Å; L15-F19 WeakPolarHBondContact O-CD2 3.5Å; L15-F19 PolarHBondContact O-N 3.31Å; L15-F19 VanDerWaalsContact O-N 3.11Å
16A55.8Low51.5Low66 Ų66106.5 Ų106.555%0.54558%0.583SS.*Hα-helixtrans-65.1-32.2176.300000112.8S12 L13S12-A16 WeakPolarHBondContact O-CB 3.46Å; S12-A16 PolarHBondContact O-N 2.76Å; L13-A16 PolarHBondContact O-N 3.13Å
17L59.3Low50.5Low134 Ų134105.8 Ų105.870%0.70259%0.586SS**Hα-helixtrans-78.9-32.2176.5-75.6161.9000113.2L13 I14 L15L13-L17 WeakPolarHBondContact O-CD1 3.43Å; L13-L17 WeakPolarHBondContact O-CG 3.39Å; L13-L17 PolarHBondContact O-N 3.29Å; L13-L17 VanDerWaalsContact O-N 3.07Å; I14-L17 PolarHBondContact O-N 2.9Å; L15-L17 VanDerWaalsContact C-N 3.29Å; L15-L17 PolarHBondContact O-N 2.87Å
18L56.4Low50.2Low118 Ų118100 Ų10062%0.61857%0.569SS**Hα-helixtrans-83.6-20.2-178.3-68.8170.6000113.5I14 L15 P20I14-L18 HydrophobicContact CG2-CD1 3.61Å; I14-L18 HydrophobicContact CG2-CG 4.32Å; I14-L18 WeakPolarHBondContact O-CB 3.45Å; I14-L18 VanDerWaalsContact O-CG 3.24Å; I14-L18 WeakPolarHBondContact O-CG 3.24Å; I14-L18 PolarHBondContact O-N 2.82Å; L15-L18 PolarHBondContact O-N 2.92Å; L18-P20 VanDerWaalsContact C-CD 3.44Å
19F52.2Low50.2Low97 Ų9792 Ų9243%0.42556%0.556SS.*  trans-12666.1178.2-58-77.7000112.8L15 S21 M22L15-F19 HydrophobicContact CD2-CD2 4.32Å; L15-F19 HydrophobicContact CD2-CE2 4.17Å; L15-F19 HydrophobicContact CG-CE2 4.47Å; L15-F19 WeakPolarHBondContact O-CD2 3.5Å; L15-F19 PolarHBondContact O-N 3.31Å; L15-F19 VanDerWaalsContact O-N 3.11Å; F19-S21 PolarHBondContact O-N 3.34Å; F19-M22 HydrophobicContact CB-CB 4.48Å; F19-M22 HydrophobicContact CB-CE 4.31Å; F19-M22 HydrophobicContact CG-CE 4.26Å; F19-M22 PolarHBondContact O-N 2.93Å
20P47.9Very low51.2Low92 Ų9295 Ų9560%0.59758%0.579SS**Hα-helixtrans-60.8-16.8174.723.3-31.6000113.2L18 S24L18-P20 VanDerWaalsContact C-CD 3.44Å; P20-S24 PolarHBondContact O-OG 3.22Å
21S45.4Very low52.4Low82 Ų8292.9 Ų92.957%0.57357%0.572SS**Hα-helixtrans-72.8-19.7173.753.60000114.6F19 S24F19-S21 PolarHBondContact O-N 3.34Å; S21-S24 PolarHBondContact O-OG 3Å
22M36.9Very low53.2Low127 Ų12790 Ų9063%0.62656%0.56SS**Hα-helixtrans-90.2-27.8173.6-75.7-150.5-97.800112.6F19 S24 M25 A26F19-M22 HydrophobicContact CB-CB 4.48Å; F19-M22 HydrophobicContact CB-CE 4.31Å; F19-M22 HydrophobicContact CG-CE 4.26Å; F19-M22 PolarHBondContact O-N 2.93Å; M22-S24 PolarHBondContact O-N 3.15Å; M22-M25 PolarHBondContact O-N 3.29Å; M22-A26 PolarHBondContact O-N 3.47Å
23A38.9Very low54.2Low62 Ų6295 Ų9551%0.51257%0.571SS.*Hα-helixtrans-64.7-24.5173.300000112.8A26A23-A26 PolarHBondContact O-N 2.88Å
24S38.6Very low55.7Low81 Ų8195.7 Ų95.757%0.56657%0.571SS**THydrogen-bonded Turntrans-77.5-16.3176.829.10000113.9P20 S21 M22P20-S24 PolarHBondContact O-OG 3.22Å; S21-S24 PolarHBondContact O-OG 3Å; M22-S24 PolarHBondContact O-N 3.15Å
25M37.9Very low57.2Low149 Ų14994.2 Ų94.273%0.73456%0.561SS**THydrogen-bonded Turntrans-88.3-26169.5-70.1-156.3179.300112.9M22 A27 M28M22-M25 PolarHBondContact O-N 3.29Å; M25-A27 VanDerWaalsContact C-N 3.28Å; M25-A27 PolarHBondContact O-N 3.36Å; M25-M28 PolarHBondContact O-N 2.99Å
26A35.6Very low58.8Low87 Ų8796.9 Ų96.972%0.71957%0.565SS**THydrogen-bonded Turntrans-74.6-12.2-176.400000114.6M22 A23M22-A26 PolarHBondContact O-N 3.47Å; A23-A26 PolarHBondContact O-N 2.88Å
27A41.9Very low60.5Low77 Ų7798.1 Ų98.164%0.63656%0.56SS**THydrogen-bonded Turntrans-93.98.1175.800000113.6M25 G29M25-A27 VanDerWaalsContact C-N 3.28Å; M25-A27 PolarHBondContact O-N 3.36Å; A27-G29 PolarHBondContact O-N 3.48Å
28M46.5Very low62.2Low93 Ų9391.8 Ų91.846%0.45853%0.527SS..SBendtrans-81102.7165.1-67.4-171.1-167.400107.6M25 Y151M25-M28 PolarHBondContact O-N 2.99Å; M28-Y151 HydrophobicContact CE-CE1 4.49Å; M28-Y151 HydrophobicContact SD-CD1 4.15Å; M28-Y151 HydrophobicContact SD-CE1 3.56Å; M28-Y151 VanDerWaalsContact SD-CE1 3.56Å
29G56.7Low64.1Low54 Ų5486.4 Ų86.456%0.55750%0.499SS*.PPolyproline II helixtrans-48.7146.5164.800000109.9A27 C31A27-G29 PolarHBondContact O-N 3.48Å; G29-C31 PolarHBondContact O-N 3.35Å
30S75.8Confident66.2Low124 Ų12483.2 Ų83.287%0.86749%0.493SS*.PPolyproline II helixtrans-56.9126.5-177.954.80000110.5S32S30-S32 PolarHBondContact O-N 2.77Å
31C83.6Confident68.5Low49 Ų4982.6 Ų82.633%0.33148%0.482SS..PPolyproline II helixtrans-69.3125.3176.5-71.60000109.9G29 K33 C152G29-C31 PolarHBondContact O-N 3.35Å; C31-K33 PolarHBondContact O-N 3.48Å; C31-C152 WeakPolarHBondContact CA-SG 3.18Å; C31-C152 HydrophobicContact CB-CB 3.61Å; C31-C152 WeakPolarHBondContact CB-SG 3.43Å; C31-C152 WeakPolarHBondContact SG-CA 3.3Å; C31-C152 WeakPolarHBondContact SG-CB 3.33Å; C31-C152 CovalentContact SG-SG 2.04Å; C31-C152 PolarHBondContact SG-SG 3.4Å
32S76.2Confident70.9Confident37 Ų3778.7 Ų78.726%0.25946%0.455SS..PPolyproline II helixtrans-60.9135.5167178.40000109.5S30 E34S30-S32 PolarHBondContact O-N 2.77Å; S32-E34 VanDerWaalsContact C-N 3.27Å; S32-E34 PolarHBondContact OG-N 3.23Å
33K76.8Confident73.8Confident189 Ų18975.1 Ų75.182%0.82244%0.437SS*.SBendtrans-83.8-4.5178-64.7-176.4-179.7-179.50112.9C31 L156C31-K33 PolarHBondContact O-N 3.48Å; K33-L156 WeakPolarHBondContact O-CD2 3.35Å
34E88.8Confident76.6Confident119 Ų11979.2 Ų79.256%0.55644%0.443SS*.  trans-94.5106.2-174.6-69.1-176-160.100112S32 R36 M37 L38S32-E34 VanDerWaalsContact C-N 3.27Å; S32-E34 PolarHBondContact OG-N 3.23Å; E34-R36 VanDerWaalsContact C-N 3.3Å; E34-R36 PolarHBondContact O-N 3.32Å; E34-M37 HydrophobicContact CB-CB 3.92Å; E34-M37 PolarHBondContact O-N 3.27Å; E34-M37 WeakPolarHBondContact OE2-CE 3.02Å; E34-L38 PolarHBondContact O-N 2.71Å
35Y91.1Very high79.4Confident54 Ų5477.8 Ų77.821%0.21243%0.428CS..Hα-helixtrans-50.9-45.9-179.8175.4-92.3000113.4L38 L39 M153 L157 W212Y35-L38 PolarHBondContact O-N 3Å; Y35-L39 HydrophobicContact CE1-CD2 3.89Å; Y35-L39 VanDerWaalsContact O-CB 3.25Å; Y35-L39 WeakPolarHBondContact O-CB 3.26Å; Y35-L39 PolarHBondContact O-N 2.91Å; Y35-M153 HydrophobicContact CD2-CE 4.01Å; Y35-M153 HydrophobicContact CD2-SD 3.57Å; Y35-M153 VanDerWaalsContact CD2-SD 3.57Å; Y35-M153 HydrophobicContact CE2-CE 4.03Å; Y35-M153 HydrophobicContact CE2-SD 3.55Å; Y35-M153 VanDerWaalsContact CE2-SD 3.55Å; Y35-L157 HydrophobicContact CE2-CD2 4.24Å; Y35-W212 PolarHBondContact OH-O 3.49Å
36R92.4Very high82.2Confident143 Ų14370.7 Ų70.754%0.5439%0.393SS..Hα-helixtrans-68.2-39.8-176.2-69.9-68.8-179.4175.1-4.9112.3E34 G40 G213E34-R36 VanDerWaalsContact C-N 3.3Å; E34-R36 PolarHBondContact O-N 3.32Å; R36-G40 PolarHBondContact O-N 3.35Å; R36-G213 PolarHBondContact NH1-O 3.49Å
37M92.7Very high85.1Confident93 Ų9370.6 Ų70.646%0.45838%0.38SS..Hα-helixtrans-64.6-48.8176.7-175.7-174.3-69.400110.5E34 L39 G40 Q41E34-M37 HydrophobicContact CB-CB 3.92Å; E34-M37 PolarHBondContact O-N 3.27Å; E34-M37 WeakPolarHBondContact OE2-CE 3.02Å; M37-L39 PolarHBondContact O-N 3.35Å; M37-G40 PolarHBondContact O-N 3.09Å; M37-Q41 WeakPolarHBondContact O-CG 3.23Å; M37-Q41 PolarHBondContact O-N 2.85Å
38L94.7Very high87.6Confident1 Ų171 Ų711%0.00537%0.371CS..Hα-helixtrans-66-38.9-179.6-173.661.2000112.3E34 Y35 G40 Q41 L42 N149 C152 M153 L156E34-L38 PolarHBondContact O-N 2.71Å; Y35-L38 PolarHBondContact O-N 3Å; L38-G40 VanDerWaalsContact C-N 3.32Å; L38-G40 PolarHBondContact O-N 3.07Å; L38-Q41 WeakPolarHBondContact O-CB 3.37Å; L38-Q41 PolarHBondContact O-N 3.09Å; L38-L42 WeakPolarHBondContact O-CG 3.36Å; L38-L42 PolarHBondContact O-N 3.35Å; L38-N149 HydrophobicContact CD1-CB 3.94Å; L38-C152 HydrophobicContact CD1-CB 4.37Å; L38-C152 HydrophobicContact CD2-CB 3.64Å; L38-M153 HydrophobicContact CB-CE 3.99Å; L38-M153 HydrophobicContact CD2-CB 3.8Å; L38-M153 HydrophobicContact CD2-CE 4.06Å; L38-M153 VanDerWaalsContact CD2-N 3.31Å; L38-M153 HydrophobicContact CD2-SD 4.48Å; L38-M153 HydrophobicContact CG-CB 4.45Å; L38-M153 HydrophobicContact CG-CE 3.92Å; L38-L156 HydrophobicContact CD2-CD1 3.85Å
39L95.9Very high90.1Very high4 Ų467.1 Ų67.12%0.02135%0.352CS..Hα-helixtrans-61.6-41.2173.4179.460.7000111.4Y35 M37 Q41 L42 Q43 M153 F209 W212Y35-L39 HydrophobicContact CE1-CD2 3.89Å; Y35-L39 VanDerWaalsContact O-CB 3.25Å; Y35-L39 WeakPolarHBondContact O-CB 3.26Å; Y35-L39 PolarHBondContact O-N 2.91Å; M37-L39 PolarHBondContact O-N 3.35Å; L39-Q41 VanDerWaalsContact C-N 3.33Å; L39-Q41 PolarHBondContact O-N 3.28Å; L39-L42 PolarHBondContact O-N 3.12Å; L39-Q43 HydrophobicContact CD1-CG 4.32Å; L39-Q43 HydrophobicContact CG-CG 4.49Å; L39-Q43 WeakPolarHBondContact O-CB 2.9Å; L39-Q43 VanDerWaalsContact O-CG 3.25Å; L39-Q43 WeakPolarHBondContact O-CG 3.48Å; L39-Q43 PolarHBondContact O-N 3.31Å; L39-M153 HydrophobicContact CB-CE 3.87Å; L39-F209 HydrophobicContact CD1-CB 4.31Å; L39-F209 HydrophobicContact CD1-CD1 3.9Å; L39-F209 HydrophobicContact CD1-CG 4.48Å; L39-W212 HydrophobicContact CD1-CB 3.89Å; L39-W212 HydrophobicContact CD1-CE3 4.36Å; L39-W212 HydrophobicContact CD2-CB 3.87Å
40G95.6Very high92Very high30 Ų3067.1 Ų67.131%0.30934%0.337SS..Hα-helixtrans-62.5-38.7174.900000112.9R36 M37 L38 K44R36-G40 PolarHBondContact O-N 3.35Å; M37-G40 PolarHBondContact O-N 3.09Å; L38-G40 VanDerWaalsContact C-N 3.32Å; L38-G40 PolarHBondContact O-N 3.07Å; G40-K44 WeakPolarHBondContact O-CB 2.87Å; G40-K44 PolarHBondContact O-N 3.25Å
41Q95.9Very high93.1Very high79 Ų7964 Ų6437%0.36931%0.311SS..Hα-helixtrans-64.1-45.4173.9-70.8176.4-18.300112M37 L38 L39 K44 Q45M37-Q41 WeakPolarHBondContact O-CG 3.23Å; M37-Q41 PolarHBondContact O-N 2.85Å; L38-Q41 WeakPolarHBondContact O-CB 3.37Å; L38-Q41 PolarHBondContact O-N 3.09Å; L39-Q41 VanDerWaalsContact C-N 3.33Å; L39-Q41 PolarHBondContact O-N 3.28Å; Q41-K44 PolarHBondContact O-N 2.76Å; Q41-Q45 WeakPolarHBondContact O-CB 3.39Å; Q41-Q45 WeakPolarHBondContact O-CG 3.35Å; Q41-Q45 PolarHBondContact O-N 3.48Å
42L97.3Very high93.7Very high0 Ų064.1 Ų64.10%031%0.311CS..Hα-helixtrans-59-48.7176.4-74.2167.9000111.3L38 L39 Q45 T46 L146 N149 V150 M153 F209L38-L42 WeakPolarHBondContact O-CG 3.36Å; L38-L42 PolarHBondContact O-N 3.35Å; L39-L42 PolarHBondContact O-N 3.12Å; L42-Q45 PolarHBondContact O-N 3.18Å; L42-T46 VanDerWaalsContact O-CG2 3.28Å; L42-T46 WeakPolarHBondContact O-CG2 3.35Å; L42-T46 PolarHBondContact O-N 3.01Å; L42-T46 PolarHBondContact O-OG1 3.35Å; L42-L146 HydrophobicContact CD2-CD1 3.59Å; L42-N149 HydrophobicContact CD2-CB 3.59Å; L42-N149 HydrophobicContact CG-CB 4.16Å; L42-V150 HydrophobicContact CD2-CG2 3.89Å; L42-M153 HydrophobicContact CD1-CB 3.87Å; L42-M153 HydrophobicContact CD1-CE 3.76Å; L42-M153 HydrophobicContact CD1-CG 4.01Å; L42-F209 HydrophobicContact CB-CD1 4.46Å; L42-F209 HydrophobicContact CB-CD2 4.33Å; L42-F209 HydrophobicContact CB-CE1 4.3Å; L42-F209 HydrophobicContact CB-CE2 4.16Å; L42-F209 HydrophobicContact CB-CG 4.47Å; L42-F209 HydrophobicContact CB-CZ 4.14Å; L42-F209 HydrophobicContact CD1-CD1 4.46Å; L42-F209 HydrophobicContact CD1-CE1 3.76Å; L42-F209 HydrophobicContact CD1-CZ 3.91Å; L42-F209 HydrophobicContact CD2-CE2 4.37Å; L42-F209 HydrophobicContact CD2-CZ 4.04Å; L42-F209 HydrophobicContact CG-CE1 4.48Å; L42-F209 HydrophobicContact CG-CZ 4.26Å
43Q97.4Very high94.7Very high52 Ų5264.7 Ų64.724%0.24331%0.314CS..Hα-helixtrans-57.4-52.1177.1-72.7169.9-17.600111.3L39 Q45 T46 D47 F209L39-Q43 HydrophobicContact CD1-CG 4.32Å; L39-Q43 HydrophobicContact CG-CG 4.49Å; L39-Q43 WeakPolarHBondContact O-CB 2.9Å; L39-Q43 VanDerWaalsContact O-CG 3.25Å; L39-Q43 WeakPolarHBondContact O-CG 3.48Å; L39-Q43 PolarHBondContact O-N 3.31Å; Q43-Q45 PolarHBondContact O-N 2.96Å; Q43-T46 PolarHBondContact O-N 3.25Å; Q43-T46 PolarHBondContact O-OG1 3.07Å; Q43-D47 WeakPolarHBondContact O-CB 3.38Å; Q43-D47 VanDerWaalsContact O-CG 3.28Å; Q43-D47 PolarHBondContact O-N 3.22Å; Q43-F209 HydrophobicContact CG-CB 3.85Å; Q43-F209 PolarHBondContact NE2-O 3.46Å
44K96.9Very high95.6Very high148 Ų14862.3 Ų62.364%0.64330%0.3SS*.Hα-helixtrans-61.2-41.1-179.8-173.5175.3-178.5179.40112.6G40 Q41 D47 L48G40-K44 WeakPolarHBondContact O-CB 2.87Å; G40-K44 PolarHBondContact O-N 3.25Å; Q41-K44 PolarHBondContact O-N 2.76Å; K44-D47 PolarHBondContact O-N 3.47Å; K44-L48 WeakPolarHBondContact O-CG 3.01Å; K44-L48 PolarHBondContact O-N 2.02Å; K44-L48 VanDerWaalsContact O-N 3.14Å
45Q97.1Very high96Very high51 Ų5157.1 Ų57.124%0.23828%0.276CS..Hα-helixtrans-65.6-45.4177-80.1179.6-22.100111.5Q41 L42 Q43 D47 L48 M49 L146 N149Q41-Q45 WeakPolarHBondContact O-CB 3.39Å; Q41-Q45 WeakPolarHBondContact O-CG 3.35Å; Q41-Q45 PolarHBondContact O-N 3.48Å; L42-Q45 PolarHBondContact O-N 3.18Å; Q43-Q45 PolarHBondContact O-N 2.96Å; Q45-D47 VanDerWaalsContact C-N 3.25Å; Q45-D47 PolarHBondContact O-N 3.34Å; Q45-L48 PolarHBondContact O-N 2.97Å; Q45-M49 HydrophobicContact CB-SD 4.33Å; Q45-M49 WeakPolarHBondContact O-CB 3.49Å; Q45-M49 WeakPolarHBondContact O-CG 3.33Å; Q45-M49 PolarHBondContact O-N 3.33Å; Q45-L146 HydrophobicContact CB-CD1 4.22Å; Q45-N149 VanDerWaalsContact CD-ND2 3.29Å; Q45-N149 PolarHBondContact NE2-ND2 3.38Å; Q45-N149 PolarHBondContact OE1-ND2 2.9Å
46T97.4Very high96.3Very high0 Ų055 Ų550%027%0.268CS..Hα-helixtrans-64.7-34.2178.354.50000111.8L42 Q43 L48 M49 Q50 L146 M202 V205 G206 F209L42-T46 VanDerWaalsContact O-CG2 3.28Å; L42-T46 WeakPolarHBondContact O-CG2 3.35Å; L42-T46 PolarHBondContact O-N 3.01Å; L42-T46 PolarHBondContact O-OG1 3.35Å; Q43-T46 PolarHBondContact O-N 3.25Å; Q43-T46 PolarHBondContact O-OG1 3.07Å; T46-L48 VanDerWaalsContact C-N 3.32Å; T46-L48 PolarHBondContact O-N 3.11Å; T46-M49 PolarHBondContact O-N 3.5Å; T46-Q50 PolarHBondContact O-N 2.81Å; T46-Q50 VanDerWaalsContact O-N 3.11Å; T46-L146 HydrophobicContact CG2-CD1 4.3Å; T46-L146 HydrophobicContact CG2-CD2 4.38Å; T46-M202 HydrophobicContact CG2-CE 3.62Å; T46-V205 HydrophobicContact CG2-CB 4.49Å; T46-V205 HydrophobicContact CG2-CG1 3.6Å; T46-G206 WeakPolarHBondContact OG1-CA 3.47Å; T46-F209 HydrophobicContact CG2-CD2 3.89Å; T46-F209 HydrophobicContact CG2-CE2 3.95Å
47D95.5Very high96.5Very high86 Ų8649.6 Ų49.646%0.4625%0.25SS..Hα-helixtrans-67.7-31.6176.3-75-22.2000113Q43 K44 Q45 Q50Q43-D47 WeakPolarHBondContact O-CB 3.38Å; Q43-D47 VanDerWaalsContact O-CG 3.28Å; Q43-D47 PolarHBondContact O-N 3.22Å; K44-D47 PolarHBondContact O-N 3.47Å; Q45-D47 VanDerWaalsContact C-N 3.25Å; Q45-D47 PolarHBondContact O-N 3.34Å; D47-Q50 VanDerWaalsContact CA-NE2 3.31Å; D47-Q50 VanDerWaalsContact O-CG 3.28Å; D47-Q50 WeakPolarHBondContact O-CG 3.28Å; D47-Q50 PolarHBondContact O-NE2 2.89Å; D47-Q50 PolarHBondContact OD1-NE2 3.39Å
48L95.9Very high96.7Very high84 Ų8445.2 Ų45.244%0.4423%0.229SC..Hα-helixtrans-77.5-36.1173.1-70.2169.4000112K44 Q45 T46 Q50 D51K44-L48 WeakPolarHBondContact O-CG 3.01Å; K44-L48 PolarHBondContact O-N 2.02Å; K44-L48 VanDerWaalsContact O-N 3.14Å; Q45-L48 PolarHBondContact O-N 2.97Å; T46-L48 VanDerWaalsContact C-N 3.32Å; T46-L48 PolarHBondContact O-N 3.11Å; L48-Q50 VanDerWaalsContact C-N 3.35Å; L48-D51 WeakPolarHBondContact O-CB 3.46Å; L48-D51 PolarHBondContact O-N 3.5Å
49M97.9Very high96.8Very high13 Ų1345.4 Ų45.46%0.06423%0.229CC..Hα-helixtrans-78.7-17.2-174.3-68.8163.87600113.3Q45 T46 D51 V143 L146 Y198 H199 M202Q45-M49 HydrophobicContact CB-SD 4.33Å; Q45-M49 WeakPolarHBondContact O-CB 3.49Å; Q45-M49 WeakPolarHBondContact O-CG 3.33Å; Q45-M49 PolarHBondContact O-N 3.33Å; T46-M49 PolarHBondContact O-N 3.5Å; M49-D51 VanDerWaalsContact C-N 3.34Å; M49-V143 HydrophobicContact CE-CB 4.49Å; M49-V143 HydrophobicContact CE-CG2 3.84Å; M49-L146 HydrophobicContact CE-CB 4.08Å; M49-L146 HydrophobicContact CE-CD2 3.55Å; M49-L146 HydrophobicContact CE-CG 4.44Å; M49-L146 HydrophobicContact SD-CB 4.08Å; M49-L146 HydrophobicContact SD-CD2 3.73Å; M49-L146 HydrophobicContact SD-CG 4.42Å; M49-Y198 WeakPolarHBondContact CE-OH 3.04Å; M49-H199 PolarHBondContact O-CE1 3.46Å; M49-H199 PolarHBondContact O-ND1 2.95Å; M49-M202 HydrophobicContact CB-CB 4.22Å; M49-M202 HydrophobicContact CB-CE 3.81Å; M49-M202 HydrophobicContact CB-CG 3.97Å; M49-M202 HydrophobicContact CE-CE 3.84Å; M49-M202 HydrophobicContact CE-SD 4.29Å; M49-M202 HydrophobicContact CG-CE 4.48Å; M49-M202 HydrophobicContact SD-CE 3.93Å
50Q97.7Very high96.8Very high53 Ų5345.5 Ų45.525%0.24823%0.23CC..THydrogen-bonded Turntrans-76.8-18.8171.272.5-173.3-33.500113.5T46 D47 L48 T52 H199 M202 H203T46-Q50 PolarHBondContact O-N 2.81Å; T46-Q50 VanDerWaalsContact O-N 3.11Å; D47-Q50 VanDerWaalsContact CA-NE2 3.31Å; D47-Q50 VanDerWaalsContact O-CG 3.28Å; D47-Q50 WeakPolarHBondContact O-CG 3.28Å; D47-Q50 PolarHBondContact O-NE2 2.89Å; D47-Q50 PolarHBondContact OD1-NE2 3.39Å; L48-Q50 VanDerWaalsContact C-N 3.35Å; Q50-T52 PolarHBondContact O-N 3.44Å; Q50-H199 PolarHBondContact O-ND1 3.07Å; Q50-M202 HydrophobicContact CB-CB 4.29Å; Q50-H203 HydrophobicContact CB-CB 4.05Å; Q50-H203 PolarHBondContact OE1-ND1 3.41Å
51D97.8Very high96.8Very high58 Ų5848.1 Ų48.131%0.3123%0.23SC..  trans-71.6114.2-177.7177.61.1000110.8L48 M49 S53 R54 H199L48-D51 WeakPolarHBondContact O-CB 3.46Å; L48-D51 PolarHBondContact O-N 3.5Å; M49-D51 VanDerWaalsContact C-N 3.34Å; D51-S53 PolarHBondContact O-N 3.07Å; D51-S53 VanDerWaalsContact OD1-CB 3.3Å; D51-S53 WeakPolarHBondContact OD1-CB 3.45Å; D51-S53 PolarHBondContact OD1-N 2.84Å; D51-S53 PolarHBondContact OD1-OG 3.45Å; D51-S53 PolarHBondContact OD2-OG 3.03Å; D51-R54 HydrophobicContact CB-CG 3.94Å; D51-R54 WeakPolarHBondContact O-CB 3.4Å; D51-R54 PolarHBondContact O-N 3.16Å; D51-R54 IonicContact OD2-NE 2.63Å; D51-H199 PolarHBondContact O-CE1 3.33Å
52T97.6Very high96.8Very high53 Ų5344.6 Ų44.633%0.32521%0.214SC..G310 helixtrans-64.5-26.3-176.859.10000112.8Q50 R54 L55 L56 D57 H199Q50-T52 PolarHBondContact O-N 3.44Å; T52-R54 PolarHBondContact O-N 3.09Å; T52-R54 VanDerWaalsContact O-N 3.13Å; T52-L55 PolarHBondContact O-N 2.97Å; T52-L56 HydrophobicContact CG2-CD2 3.94Å; T52-L56 PolarHBondContact O-N 3.22Å; T52-D57 WeakPolarHBondContact CB-OD2 3.32Å; T52-D57 PolarHBondContact O-N 3.2Å; T52-D57 PolarHBondContact OG1-OD2 3.43Å; T52-H199 HydrophobicContact CG2-CB 4.18Å
53S96.9Very high96.6Very high48 Ų4845.1 Ų45.134%0.33622%0.216SC..G310 helixtrans-66.6-16.8-178.974.80000112.9D51 D57 P58D51-S53 PolarHBondContact O-N 3.07Å; D51-S53 VanDerWaalsContact OD1-CB 3.3Å; D51-S53 WeakPolarHBondContact OD1-CB 3.45Å; D51-S53 PolarHBondContact OD1-N 2.84Å; D51-S53 PolarHBondContact OD1-OG 3.45Å; D51-S53 PolarHBondContact OD2-OG 3.03Å; S53-D57 WeakPolarHBondContact CA-OD2 3.3Å; S53-D57 PolarHBondContact N-OD2 3.4Å; S53-P58 WeakPolarHBondContact O-CD 3.31Å; S53-P58 WeakPolarHBondContact O-CG 3.45Å
54R95.6Very high96.3Very high140 Ų14044.8 Ų44.853%0.52823%0.227SC..G310 helixtrans-84.2-19.5-179.7-59.7-68.2-177.9162.2-1113.8D51 T52D51-R54 HydrophobicContact CB-CG 3.94Å; D51-R54 WeakPolarHBondContact O-CB 3.4Å; D51-R54 PolarHBondContact O-N 3.16Å; D51-R54 IonicContact OD2-NE 2.63Å; T52-R54 PolarHBondContact O-N 3.09Å; T52-R54 VanDerWaalsContact O-N 3.13Å
55L97Very high96.2Very high10 Ų1037.9 Ų37.95%0.05220%0.197CC..THydrogen-bonded Turntrans-152-58.8-171.9-179.957.2000113.1T52 P58 Y59 L110 L136 A139 L195 Y198T52-L55 PolarHBondContact O-N 2.97Å; L55-P58 WeakPolarHBondContact O-CD 3.38Å; L55-Y59 WeakPolarHBondContact O-CB 3.47Å; L55-Y59 PolarHBondContact O-N 3.3Å; L55-L110 HydrophobicContact CD2-CD2 4.39Å; L55-L136 HydrophobicContact CD1-CD2 3.53Å; L55-L136 WeakPolarHBondContact O-CD2 3.46Å; L55-A139 HydrophobicContact CD1-CB 3.69Å; L55-A139 HydrophobicContact CD2-CB 3.95Å; L55-A139 HydrophobicContact CG-CB 4.44Å; L55-L195 HydrophobicContact CD1-CD1 4.49Å; L55-L195 HydrophobicContact CD1-CD2 4.31Å; L55-L195 HydrophobicContact CD2-CD2 3.7Å; L55-L195 HydrophobicContact CG-CD1 4.29Å; L55-L195 HydrophobicContact CG-CD2 3.83Å; L55-Y198 HydrophobicContact CD2-CD1 3.95Å; L55-Y198 HydrophobicContact CD2-CE1 3.73Å
56L97.4Very high96.1Very high8 Ų839 Ų394%0.04221%0.205CC..Hα-helixtrans-63.6-49.1-178.4174.265.7000113.4T52 Y59 I60 C192 L195 R196 H199T52-L56 HydrophobicContact CG2-CD2 3.94Å; T52-L56 PolarHBondContact O-N 3.22Å; L56-Y59 WeakPolarHBondContact O-CB 3.48Å; L56-Y59 PolarHBondContact O-N 3.42Å; L56-I60 HydrophobicContact CD1-CD1 3.94Å; L56-I60 HydrophobicContact CD1-CG1 4.16Å; L56-I60 HydrophobicContact CG-CD1 3.92Å; L56-I60 HydrophobicContact CG-CG1 4.49Å; L56-I60 WeakPolarHBondContact O-CG1 3.49Å; L56-I60 PolarHBondContact O-N 3.36Å; L56-C192 WeakPolarHBondContact CD1-O 3.41Å; L56-L195 HydrophobicContact CB-CB 4.37Å; L56-L195 HydrophobicContact CD1-CB 3.83Å; L56-R196 HydrophobicContact CD1-CB 4.44Å; L56-R196 HydrophobicContact CD2-CB 3.96Å; L56-R196 HydrophobicContact CD2-CG 4.14Å; L56-H199 VanDerWaalsContact CB-CD2 3.49Å; L56-H199 WeakPolarHBondContact CB-CD2 3.46Å; L56-H199 WeakPolarHBondContact CB-NE2 3.42Å; L56-H199 PolarHBondContact N-NE2 2.85Å
57D96.9Very high95.9Very high31 Ų3143.3 Ų43.317%0.16623%0.227CC..Hα-helixtrans-66.6-42.8-176.4-57.6-42.8000112.2T52 S53 Y59 I60 R61 R71T52-D57 WeakPolarHBondContact CB-OD2 3.32Å; T52-D57 PolarHBondContact O-N 3.2Å; T52-D57 PolarHBondContact OG1-OD2 3.43Å; S53-D57 WeakPolarHBondContact CA-OD2 3.3Å; S53-D57 PolarHBondContact N-OD2 3.4Å; D57-Y59 VanDerWaalsContact C-N 3.32Å; D57-Y59 PolarHBondContact O-N 2.8Å; D57-I60 PolarHBondContact O-N 2.77Å; D57-R61 PolarHBondContact O-N 2.94Å; D57-R61 VanDerWaalsContact O-N 3.09Å; D57-R71 IonicContact OD1-NH2 2.64Å
58P96.8Very high95.7Very high0 Ų043.9 Ų43.90%024%0.236CC..Hα-helixtrans-55.6-42.4167.9-27.735.6000113.7S53 L55 R61 I62 D132 K135 L136S53-P58 WeakPolarHBondContact O-CD 3.31Å; S53-P58 WeakPolarHBondContact O-CG 3.45Å; L55-P58 WeakPolarHBondContact O-CD 3.38Å; P58-R61 PolarHBondContact O-N 3.08Å; P58-I62 WeakPolarHBondContact O-CB 3.39Å; P58-I62 PolarHBondContact O-N 3.42Å; P58-D132 HydrophobicContact CB-CB 3.86Å; P58-K135 HydrophobicContact CB-CB 4.29Å; P58-K135 HydrophobicContact CG-CB 3.96Å; P58-K135 HydrophobicContact CG-CD 3.7Å; P58-K135 HydrophobicContact CG-CG 4.48Å; P58-L136 HydrophobicContact CB-CD2 4.37Å; P58-L136 HydrophobicContact CB-CG 4.21Å
59Y96.8Very high95.4Very high5 Ų547.7 Ų47.72%0.0225%0.249CC..Hα-helixtrans-61.3-45.8176.9-176.9-93.3000111.9L55 L56 D57 R61 Q63 L65 L113 L117 L136 K188 C192 L195L55-Y59 WeakPolarHBondContact O-CB 3.47Å; L55-Y59 PolarHBondContact O-N 3.3Å; L56-Y59 WeakPolarHBondContact O-CB 3.48Å; L56-Y59 PolarHBondContact O-N 3.42Å; D57-Y59 VanDerWaalsContact C-N 3.32Å; D57-Y59 PolarHBondContact O-N 2.8Å; Y59-R61 VanDerWaalsContact C-N 3.32Å; Y59-R61 PolarHBondContact O-N 3.2Å; Y59-Q63 HydrophobicContact CD1-CG 4.28Å; Y59-Q63 HydrophobicContact CD2-CG 4.13Å; Y59-Q63 HydrophobicContact CE1-CG 3.94Å; Y59-Q63 HydrophobicContact CE2-CG 3.8Å; Y59-Q63 HydrophobicContact CG-CG 4.36Å; Y59-Q63 VanDerWaalsContact O-CB 3.28Å; Y59-Q63 WeakPolarHBondContact O-CB 3.44Å; Y59-Q63 WeakPolarHBondContact O-CG 3.45Å; Y59-Q63 PolarHBondContact O-N 2.92Å; Y59-L65 HydrophobicContact CE1-CD1 4.31Å; Y59-L113 HydrophobicContact CE2-CD2 4.13Å; Y59-L117 HydrophobicContact CD2-CD2 4.14Å; Y59-L117 HydrophobicContact CE2-CD2 4.18Å; Y59-L136 HydrophobicContact CD2-CD2 4.38Å; Y59-K188 WeakPolarHBondContact CE1-O 3.44Å; Y59-K188 PolarHBondContact OH-O 3.14Å; Y59-C192 HydrophobicContact CD1-CB 4.22Å; Y59-C192 HydrophobicContact CE1-CB 3.97Å; Y59-C192 VanDerWaalsContact CE1-N 3.34Å; Y59-L195 VanDerWaalsContact CB-CD1 3.48Å; Y59-L195 HydrophobicContact CD1-CD1 3.88Å; Y59-L195 HydrophobicContact CD2-CD1 3.72Å; Y59-L195 HydrophobicContact CE2-CD1 4.42Å; Y59-L195 HydrophobicContact CG-CD1 3.41Å; Y59-L195 VanDerWaalsContact CG-CD1 3.41Å
60I96.3Very high95.1Very high6 Ų648.9 Ų48.93%0.03126%0.255CS..Hα-helixtrans-57.6-47178-74.3171.4000110.4L56 D57 G64 L65 D66 R71 C192L56-I60 HydrophobicContact CD1-CD1 3.94Å; L56-I60 HydrophobicContact CD1-CG1 4.16Å; L56-I60 HydrophobicContact CG-CD1 3.92Å; L56-I60 HydrophobicContact CG-CG1 4.49Å; L56-I60 WeakPolarHBondContact O-CG1 3.49Å; L56-I60 PolarHBondContact O-N 3.36Å; D57-I60 PolarHBondContact O-N 2.77Å; I60-G64 PolarHBondContact O-N 3.31Å; I60-L65 HydrophobicContact CG2-CB 4.08Å; I60-L65 WeakPolarHBondContact O-CA 3.41Å; I60-L65 WeakPolarHBondContact O-CB 3.38Å; I60-L65 PolarHBondContact O-N 2.95Å; I60-D66 HydrophobicContact CG2-CB 3.89Å; I60-D66 PolarHBondContact O-N 3.29Å; I60-R71 HydrophobicContact CG2-CG 4.14Å; I60-C192 WeakPolarHBondContact CG1-SG 3.36Å
61R95.4Very high94.7Very high86 Ų8651.2 Ų51.233%0.32526%0.261SS..Hα-helixtrans-65-53.9179.3-73.5-171.3-63.5-85.50.9112.2D57 P58 Y59 Q63 G64 D66 D132D57-R61 PolarHBondContact O-N 2.94Å; D57-R61 VanDerWaalsContact O-N 3.09Å; P58-R61 PolarHBondContact O-N 3.08Å; Y59-R61 VanDerWaalsContact C-N 3.32Å; Y59-R61 PolarHBondContact O-N 3.2Å; R61-Q63 PolarHBondContact O-N 3.33Å; R61-G64 PolarHBondContact O-N 2.93Å; R61-D66 HydrophobicContact CG-CB 4.14Å; R61-D132 IonicContact CZ-OD1 3.33Å; R61-D132 IonicContact CZ-OD2 2.84Å; R61-D132 IonicContact NE-OD1 3.56Å; R61-D132 PolarHBondContact NE-OD1 3.34Å; R61-D132 IonicContact NE-OD2 3.83Å; R61-D132 PolarHBondContact NE-OD2 3.38Å; R61-D132 IonicContact NH2-OD1 3.32Å; R61-D132 PolarHBondContact NH2-OD1 3.2Å; R61-D132 IonicContact NH2-OD2 3.33Å
62I94.3Very high94.3Very high4 Ų454 Ų542%0.02127%0.272CS..Hα-helixtrans-65.6-26.3-173.6-151.7172.7000112.7P58 L117 P118 L123 L128 L133 L136P58-I62 WeakPolarHBondContact O-CB 3.39Å; P58-I62 PolarHBondContact O-N 3.42Å; I62-L117 HydrophobicContact CG2-CD2 4Å; I62-P118 HydrophobicContact CG1-CG 4.18Å; I62-L123 HydrophobicContact CD1-CD2 3.9Å; I62-L123 HydrophobicContact CG1-CD2 4.12Å; I62-L128 HydrophobicContact CG1-CB 4.46Å; I62-L128 HydrophobicContact CG1-CD1 4.06Å; I62-L128 WeakPolarHBondContact O-CD1 3.37Å; I62-L133 HydrophobicContact CD1-CB 3.87Å; I62-L133 HydrophobicContact CD1-CD1 4.15Å; I62-L136 HydrophobicContact CB-CD1 4.49Å; I62-L136 HydrophobicContact CD1-CD1 4.19Å; I62-L136 HydrophobicContact CG2-CD1 3.67Å
63Q93.6Very high94.1Very high11 Ų1157 Ų575%0.05128%0.282CS..THydrogen-bonded Turntrans-88.1-2.5178.2-68.2-69.312.900114Y59 R61 L65 H116 K188Y59-Q63 HydrophobicContact CD1-CG 4.28Å; Y59-Q63 HydrophobicContact CD2-CG 4.13Å; Y59-Q63 HydrophobicContact CE1-CG 3.94Å; Y59-Q63 HydrophobicContact CE2-CG 3.8Å; Y59-Q63 HydrophobicContact CG-CG 4.36Å; Y59-Q63 VanDerWaalsContact O-CB 3.28Å; Y59-Q63 WeakPolarHBondContact O-CB 3.44Å; Y59-Q63 WeakPolarHBondContact O-CG 3.45Å; Y59-Q63 PolarHBondContact O-N 2.92Å; R61-Q63 PolarHBondContact O-N 3.33Å; Q63-L65 HydrophobicContact CB-CD1 4.25Å; Q63-L65 HydrophobicContact CB-CG 4.04Å; Q63-H116 PolarHBondContact NE2-O 2.85Å; Q63-K188 HydrophobicContact CB-CD 4.23Å; Q63-K188 HydrophobicContact CB-CG 4.36Å; Q63-K188 HydrophobicContact CG-CG 4.47Å; Q63-K188 PolarHBondContact O-NZ 3.05Å
64G92.2Very high93.8Very high46 Ų4654.8 Ų54.847%0.47427%0.267SS..THydrogen-bonded Turntrans74.526.2-177.800000113.6I60 R61I60-G64 PolarHBondContact O-N 3.31Å; R61-G64 PolarHBondContact O-N 2.93Å
65L94.7Very high93.6Very high2 Ų256 Ų561%0.0127%0.272CS..  trans-95.70.5179.7-56179000112.9Y59 I60 Q63 I67 L70 R71 F185 K188 L189 C192Y59-L65 HydrophobicContact CE1-CD1 4.31Å; I60-L65 HydrophobicContact CG2-CB 4.08Å; I60-L65 WeakPolarHBondContact O-CA 3.41Å; I60-L65 WeakPolarHBondContact O-CB 3.38Å; I60-L65 PolarHBondContact O-N 2.95Å; Q63-L65 HydrophobicContact CB-CD1 4.25Å; Q63-L65 HydrophobicContact CB-CG 4.04Å; L65-I67 PolarHBondContact O-N 3.44Å; L65-L70 HydrophobicContact CD2-CD1 4.16Å; L65-R71 WeakPolarHBondContact O-CG 3.33Å; L65-F185 HydrophobicContact CD2-CE2 4.49Å; L65-K188 HydrophobicContact CD1-CB 4.21Å; L65-K188 HydrophobicContact CD2-CB 4.3Å; L65-L189 HydrophobicContact CD1-CD2 4.48Å; L65-L189 HydrophobicContact CD2-CD2 4.12Å; L65-C192 HydrophobicContact CD1-CB 3.97Å
66D94.1Very high93.3Very high74 Ų7457.7 Ų57.740%0.39628%0.279SS..  trans-76.848.1-177.4-158.118.3000113I60 R61 R71I60-D66 HydrophobicContact CG2-CB 3.89Å; I60-D66 PolarHBondContact O-N 3.29Å; R61-D66 HydrophobicContact CG-CB 4.14Å; D66-R71 WeakPolarHBondContact OD1-CD 3.38Å; D66-R71 IonicContact OD1-CZ 3.37Å; D66-R71 IonicContact OD1-NE 2.76Å; D66-R71 IonicContact OD1-NH1 3.47Å; D66-R71 PolarHBondContact OD1-NH1 3.37Å
67I93.4Very high92.9Very high92 Ų9260.3 Ų60.347%0.47230%0.299SS..SBendtrans-120.1130.8175.7-59.3170.7000106L65 K69 L70 R71L65-I67 PolarHBondContact O-N 3.44Å; I67-K69 VanDerWaalsContact C-N 3.3Å; I67-K69 PolarHBondContact O-N 3.37Å; I67-K69 VanDerWaalsContact O-N 3.11Å; I67-L70 HydrophobicContact CB-CB 4.49Å; I67-L70 HydrophobicContact CB-CD1 4.4Å; I67-L70 HydrophobicContact CB-CG 4.35Å; I67-L70 HydrophobicContact CD1-CD1 4.19Å; I67-L70 PolarHBondContact O-N 2.86Å; I67-R71 PolarHBondContact O-N 3.34Å
68P91.4Very high92.5Very high98 Ų9865.2 Ų65.264%0.63633%0.332SS*.Hα-helixtrans-47.8-47.7-172.3-31.735.4000114.5L70 R71 E72P68-L70 VanDerWaalsContact C-N 3.3Å; P68-L70 PolarHBondContact O-N 3.11Å; P68-R71 PolarHBondContact O-N 3.31Å; P68-E72 PolarHBondContact O-N 2.64Å
69K90.4Very high92.3Very high164 Ų16468.9 Ų68.971%0.71337%0.37SS*.Hα-helixtrans-59.6-35.4178.3-65.9-176.8178.6-179.30113.4I67 H73I67-K69 VanDerWaalsContact C-N 3.3Å; I67-K69 PolarHBondContact O-N 3.37Å; I67-K69 VanDerWaalsContact O-N 3.11Å; K69-H73 PolarHBondContact O-CE1 3.2Å; K69-H73 PolarHBondContact O-ND1 3.36Å
70L90.4Very high92.1Very high37 Ų3771 Ų7119%0.19439%0.388CS..Hα-helixtrans-80.1-36.8179-63.8-174.2000111.8L65 I67 P68 E72 H73 C74 F185L65-L70 HydrophobicContact CD2-CD1 4.16Å; I67-L70 HydrophobicContact CB-CB 4.49Å; I67-L70 HydrophobicContact CB-CD1 4.4Å; I67-L70 HydrophobicContact CB-CG 4.35Å; I67-L70 HydrophobicContact CD1-CD1 4.19Å; I67-L70 PolarHBondContact O-N 2.86Å; P68-L70 VanDerWaalsContact C-N 3.3Å; P68-L70 PolarHBondContact O-N 3.11Å; L70-E72 PolarHBondContact O-N 3.25Å; L70-H73 WeakPolarHBondContact O-CB 3.46Å; L70-H73 PolarHBondContact O-N 2.76Å; L70-C74 PolarHBondContact O-N 3.1Å; L70-F185 HydrophobicContact CD1-CE2 4.18Å; L70-F185 HydrophobicContact CD1-CZ 4.48Å; L70-F185 HydrophobicContact CD2-CE2 4.21Å; L70-F185 HydrophobicContact CD2-CZ 3.67Å
71R90Very high92.2Very high103 Ų10371.2 Ų71.239%0.38939%0.389SS..Hα-helixtrans-60-32.2176-66.2-175.173.3155.3-2.1112.4D57 I60 L65 D66 I67 P68 H73 C74D57-R71 IonicContact OD1-NH2 2.64Å; I60-R71 HydrophobicContact CG2-CG 4.14Å; L65-R71 WeakPolarHBondContact O-CG 3.33Å; D66-R71 WeakPolarHBondContact OD1-CD 3.38Å; D66-R71 IonicContact OD1-CZ 3.37Å; D66-R71 IonicContact OD1-NE 2.76Å; D66-R71 IonicContact OD1-NH1 3.47Å; D66-R71 PolarHBondContact OD1-NH1 3.37Å; I67-R71 PolarHBondContact O-N 3.34Å; P68-R71 PolarHBondContact O-N 3.31Å; R71-H73 PolarHBondContact O-N 2.84Å; R71-C74 WeakPolarHBondContact O-CB 3.42Å; R71-C74 PolarHBondContact O-N 3.35Å
72E90.3Very high92.3Very high116 Ų11668.3 Ų68.354%0.54238%0.381SS..THydrogen-bonded Turntrans-63.6-24.6174.8-72.5175.3-163.300113.7P68 L70 R75P68-E72 PolarHBondContact O-N 2.64Å; L70-E72 PolarHBondContact O-N 3.25Å; E72-R75 VanDerWaalsContact O-CG 3.26Å; E72-R75 WeakPolarHBondContact O-CG 3.43Å; E72-R75 PolarHBondContact O-NE 2.95Å
73H91.8Very high92.4Very high115 Ų11570.1 Ų70.153%0.53239%0.394SS..THydrogen-bonded Turntrans-86.8-14177.7-66.381.8000112.8K69 L70 R71 R75 L189K69-H73 PolarHBondContact O-CE1 3.2Å; K69-H73 PolarHBondContact O-ND1 3.36Å; L70-H73 WeakPolarHBondContact O-CB 3.46Å; L70-H73 PolarHBondContact O-N 2.76Å; R71-H73 PolarHBondContact O-N 2.84Å; H73-R75 PolarHBondContact O-N 3.4Å; H73-L189 HydrophobicContact CB-CD2 4.09Å
74C92Very high92.6Very high2 Ų272.3 Ų72.31%0.01441%0.405CS..  trans-73.864.9169.2-67.70000110.5L70 R71 C192 R196L70-C74 PolarHBondContact O-N 3.1Å; R71-C74 WeakPolarHBondContact O-CB 3.42Å; R71-C74 PolarHBondContact O-N 3.35Å; C74-C192 HydrophobicContact CB-CB 3.88Å; C74-C192 WeakPolarHBondContact CB-SG 3.44Å; C74-C192 WeakPolarHBondContact SG-CB 3.2Å; C74-C192 CovalentContact SG-SG 2.02Å; C74-C192 PolarHBondContact SG-SG 3.38Å; C74-R196 WeakPolarHBondContact O-CD 3.48Å; C74-R196 PolarHBondContact O-NH1 3.46Å
75R90.7Very high92.8Very high166 Ų16677.9 Ų77.963%0.62642%0.418SS*.PPolyproline II helixtrans-103.6146176.3-62.8-175-173.7-165.4-0.4109.3E72 H73 S77 S193E72-R75 VanDerWaalsContact O-CG 3.26Å; E72-R75 WeakPolarHBondContact O-CG 3.43Å; E72-R75 PolarHBondContact O-NE 2.95Å; H73-R75 PolarHBondContact O-N 3.4Å; R75-S77 PolarHBondContact O-N 2.74Å; R75-S193 WeakPolarHBondContact O-CA 3.36Å; R75-S193 WeakPolarHBondContact O-CB 3.25Å; R75-S193 PolarHBondContact O-OG 2.74Å; R75-S193 VanDerWaalsContact O-OG 3.09Å
76E91.3Very high92.9Very high45 Ų4581.6 Ų81.621%0.2144%0.441CS..PPolyproline II helixtrans-61133172.1174.6177.3-166.800110.3G197 R200E76-G197 VanDerWaalsContact CD-CA 3.45Å; E76-R200 VanDerWaalsContact CD-NH2 3.33Å; E76-R200 IonicContact OE1-CZ 2.74Å; E76-R200 VanDerWaalsContact OE1-CZ 3.32Å; E76-R200 IonicContact OE1-NE 3.8Å; E76-R200 PolarHBondContact OE1-NE 2.77Å; E76-R200 IonicContact OE1-NH2 3.82Å; E76-R200 PolarHBondContact OE1-NH2 3.29Å; E76-R200 IonicContact OE2-CZ 3.64Å; E76-R200 IonicContact OE2-NE 2.62Å; E76-R200 PolarHBondContact OE2-NE 3Å; E76-R200 IonicContact OE2-NH2 3.48Å; E76-R200 PolarHBondContact OE2-NH2 3.35Å
77S88.6Confident93.1Very high64 Ų6478 Ų7845%0.44842%0.422SS..PPolyproline II helixtrans-70.2126.4170.6-55.90000110.3R75 G79 A80R75-S77 PolarHBondContact O-N 2.74Å; S77-G79 PolarHBondContact O-N 3.02Å; S77-A80 VanDerWaalsContact O-CB 3.23Å; S77-A80 WeakPolarHBondContact O-CB 3.33Å; S77-A80 PolarHBondContact O-N 3.28Å; S77-A80 VanDerWaalsContact O-N 3.12Å
78P89.3Confident93.2Very high134 Ų13478.9 Ų78.987%0.8742%0.419SS*.THydrogen-bonded Turntrans-53.1133.1178.5-27.434.9000112.2A80P78-A80 PolarHBondContact O-N 2.89Å
79G90.9Very high93.4Very high77 Ų7777.5 Ų77.579%0.79442%0.423SS*.THydrogen-bonded Turntrans75.9-0.6178.400000115.9S77 F81S77-G79 PolarHBondContact O-N 3.02Å; G79-F81 VanDerWaalsContact C-N 3.26Å; G79-F81 PolarHBondContact O-N 3.11Å
80A92.9Very high93.5Very high48 Ų4872.3 Ų72.340%0.39740%0.403SS..SBendtrans-62.8-33.9177.200000112.8S77 P78S77-A80 VanDerWaalsContact O-CB 3.23Å; S77-A80 WeakPolarHBondContact O-CB 3.33Å; S77-A80 PolarHBondContact O-N 3.28Å; S77-A80 VanDerWaalsContact O-N 3.12Å; P78-A80 PolarHBondContact O-N 2.89Å
81F97.8Very high93.6Very high11 Ų1173.1 Ų73.15%0.04842%0.42CS..SBendtrans-129.6147.9176.7-66.4-90.8000111.9G79 T102 V106 F194 Y198 R200 F201G79-F81 VanDerWaalsContact C-N 3.26Å; G79-F81 PolarHBondContact O-N 3.11Å; F81-T102 HydrophobicContact CD1-CG2 3.85Å; F81-T102 HydrophobicContact CE1-CG2 4.17Å; F81-V106 HydrophobicContact CE1-CG2 3.74Å; F81-V106 HydrophobicContact CZ-CG2 4.26Å; F81-F194 HydrophobicContact CE1-CE2 4.49Å; F81-F194 HydrophobicContact CE2-CD2 4.08Å; F81-F194 HydrophobicContact CE2-CE2 4.31Å; F81-F194 WeakPolarHBondContact CE2-O 3.44Å; F81-F194 AromaticContact CZ-CD2 3.81Å; F81-F194 HydrophobicContact CZ-CD2 3.81Å; F81-F194 AromaticContact CZ-CE2 3.58Å; F81-F194 HydrophobicContact CZ-CE2 3.58Å; F81-F194 HydrophobicContact CZ-CZ 4.39Å; F81-Y198 VanDerWaalsContact CE2-N 3.3Å; F81-R200 PolarHBondContact O-NH2 3.05Å; F81-F201 HydrophobicContact CB-CB 3.82Å; F81-F201 HydrophobicContact CB-CD2 4.22Å; F81-F201 HydrophobicContact CB-CG 4.21Å; F81-F201 HydrophobicContact CD1-CB 3.69Å; F81-F201 HydrophobicContact CD1-CD1 4.01Å; F81-F201 HydrophobicContact CD1-CD2 4.27Å; F81-F201 AromaticContact CD1-CG 3.72Å; F81-F201 HydrophobicContact CD1-CG 3.72Å; F81-F201 HydrophobicContact CE1-CB 4.46Å; F81-F201 HydrophobicContact CE1-CD1 4.43Å; F81-F201 HydrophobicContact CG-CB 3.85Å; F81-F201 HydrophobicContact CG-CG 4.28Å
82P97.6Very high93.8Very high25 Ų2573.5 Ų73.516%0.16242%0.421CS..  trans-51.8141.2174.1-26.134.5000112.5L87 T98 R200 F201P82-L87 HydrophobicContact CB-CD1 4.45Å; P82-L87 HydrophobicContact CB-CD2 3.89Å; P82-L87 HydrophobicContact CB-CG 3.94Å; P82-L87 HydrophobicContact CG-CD2 4.45Å; P82-T98 HydrophobicContact CG-CG2 4.19Å; P82-R200 PolarHBondContact O-NH1 2.81Å; P82-F201 HydrophobicContact CB-CE2 4.47Å; P82-F201 HydrophobicContact CG-CE2 4.19Å
83S96.9Very high93.9Very high43 Ų4372.9 Ų72.930%0.30141%0.414SS..  trans-71.4158.9172.978.70000111.3E85 T86 L87S83-E85 VanDerWaalsContact C-N 3.26Å; S83-E85 PolarHBondContact O-N 3.3Å; S83-T86 PolarHBondContact O-N 3.09Å; S83-T86 WeakPolarHBondContact OG-CB 3.44Å; S83-T86 PolarHBondContact OG-N 3.18Å; S83-T86 PolarHBondContact OG-OG1 3.36Å; S83-L87 WeakPolarHBondContact O-CG 3.24Å; S83-L87 PolarHBondContact O-N 3.43Å
84E97.6Very high94.1Very high57 Ų5768.4 Ų68.427%0.26640%0.399SS..Hα-helixtrans-58.5-41.9173.1-173.3173.5140.700111.7L87 R88E84-L87 PolarHBondContact O-N 3.13Å; E84-R88 HydrophobicContact CG-CG 4.28Å; E84-R88 WeakPolarHBondContact O-CB 3.39Å; E84-R88 VanDerWaalsContact O-CG 3.32Å; E84-R88 WeakPolarHBondContact O-CG 3.38Å; E84-R88 PolarHBondContact O-N 3.37Å; E84-R88 IonicContact OE1-CZ 3.5Å; E84-R88 IonicContact OE1-NE 2.99Å; E84-R88 PolarHBondContact OE1-NE 2.91Å; E84-R88 IonicContact OE1-NH2 2.67Å; E84-R88 PolarHBondContact OE1-NH2 3.44Å
85E97Very high94.4Very high163 Ų16368.3 Ų68.376%0.76240%0.398SS*.Hα-helixtrans-59.5-48.3177-177.5179.3-177.700111.3S83 L87 R88 G89S83-E85 VanDerWaalsContact C-N 3.26Å; S83-E85 PolarHBondContact O-N 3.3Å; E85-L87 VanDerWaalsContact C-N 3.29Å; E85-L87 PolarHBondContact O-N 3.1Å; E85-R88 PolarHBondContact O-N 3.27Å; E85-G89 PolarHBondContact O-N 2.93Å
86T97.3Very high94.7Very high79 Ų7960.7 Ų60.749%0.48537%0.37SS..Hα-helixtrans-56-46.4174.6-54.30000110.5S83 G89 L90S83-T86 PolarHBondContact O-N 3.09Å; S83-T86 WeakPolarHBondContact OG-CB 3.44Å; S83-T86 PolarHBondContact OG-N 3.18Å; S83-T86 PolarHBondContact OG-OG1 3.36Å; T86-G89 PolarHBondContact O-N 3.33Å; T86-L90 WeakPolarHBondContact O-CG 3.47Å; T86-L90 PolarHBondContact O-N 2.84Å
87L98Very high95Very high0 Ų064.1 Ų64.10%039%0.386CS..Hα-helixtrans-66.6-37.3-179.8-68.5171.6000113.1P82 S83 E84 E85 L90 F95 T98 F201 V205 V208P82-L87 HydrophobicContact CB-CD1 4.45Å; P82-L87 HydrophobicContact CB-CD2 3.89Å; P82-L87 HydrophobicContact CB-CG 3.94Å; P82-L87 HydrophobicContact CG-CD2 4.45Å; S83-L87 WeakPolarHBondContact O-CG 3.24Å; S83-L87 PolarHBondContact O-N 3.43Å; E84-L87 PolarHBondContact O-N 3.13Å; E85-L87 VanDerWaalsContact C-N 3.29Å; E85-L87 PolarHBondContact O-N 3.1Å; L87-L90 HydrophobicContact CD2-CD1 4.18Å; L87-L90 WeakPolarHBondContact O-CB 3.19Å; L87-L90 PolarHBondContact O-N 3.17Å; L87-F95 HydrophobicContact CB-CD2 4.19Å; L87-F95 HydrophobicContact CB-CE2 4.14Å; L87-F95 HydrophobicContact CD2-CD2 4.11Å; L87-F95 HydrophobicContact CD2-CE2 4.15Å; L87-T98 HydrophobicContact CD2-CG2 4.22Å; L87-F201 HydrophobicContact CD1-CD2 4.08Å; L87-F201 HydrophobicContact CD1-CE2 3.85Å; L87-F201 HydrophobicContact CD2-CE2 4.23Å; L87-V205 HydrophobicContact CD1-CG2 4.02Å; L87-V208 HydrophobicContact CB-CG2 4.03Å
88R95.8Very high95.5Very high109 Ų10963.1 Ų63.141%0.41138%0.377SS..Hα-helixtrans-68.9-34.2176.7-75.5179-179.4-74.2-1.3112.4E84 E85 L90 V208E84-R88 HydrophobicContact CG-CG 4.28Å; E84-R88 WeakPolarHBondContact O-CB 3.39Å; E84-R88 VanDerWaalsContact O-CG 3.32Å; E84-R88 WeakPolarHBondContact O-CG 3.38Å; E84-R88 PolarHBondContact O-N 3.37Å; E84-R88 IonicContact OE1-CZ 3.5Å; E84-R88 IonicContact OE1-NE 2.99Å; E84-R88 PolarHBondContact OE1-NE 2.91Å; E84-R88 IonicContact OE1-NH2 2.67Å; E84-R88 PolarHBondContact OE1-NH2 3.44Å; E85-R88 PolarHBondContact O-N 3.27Å; R88-L90 PolarHBondContact O-N 2.94Å; R88-V208 HydrophobicContact CG-CG2 3.89Å
89G94.4Very high95.9Very high70 Ų7056.7 Ų56.772%0.72234%0.336SS*.THydrogen-bonded Turntrans-68.6-13.9175.500000113.5E85 T86E85-G89 PolarHBondContact O-N 2.93Å; T86-G89 PolarHBondContact O-N 3.33Å
90L93.3Very high96.3Very high55 Ų5555.8 Ų55.829%0.28831%0.312SS..SBendtrans-80.5130.8175-59.9170.5000110.6T86 L87 R88 F95 T98T86-L90 WeakPolarHBondContact O-CG 3.47Å; T86-L90 PolarHBondContact O-N 2.84Å; L87-L90 HydrophobicContact CD2-CD1 4.18Å; L87-L90 WeakPolarHBondContact O-CB 3.19Å; L87-L90 PolarHBondContact O-N 3.17Å; R88-L90 PolarHBondContact O-N 2.94Å; L90-F95 HydrophobicContact CB-CB 3.98Å; L90-T98 HydrophobicContact CD1-CG2 4.04Å; L90-T98 WeakPolarHBondContact CD1-OG1 3.4Å
91G91.6Very high96.5Very high53 Ų5356 Ų5655%0.54631%0.314SS..  trans-59.6163.1162.400000111.5R93 G94 F95G91-R93 VanDerWaalsContact C-N 3.33Å; G91-R93 PolarHBondContact O-N 2.96Å; G91-R93 VanDerWaalsContact O-N 3.17Å; G91-G94 PolarHBondContact O-N 3.48Å; G91-F95 PolarHBondContact O-N 3.24Å
92R94.5Very high96.5Very high112 Ų11255.5 Ų55.542%0.42331%0.312SS..Hα-helixtrans-50.8-47.2-171.6-67.4-173175.2170.3-2.3114.1F95 L96 L157 W212R92-F95 PolarHBondContact O-N 2.99Å; R92-L96 WeakPolarHBondContact O-CG 3.42Å; R92-L96 PolarHBondContact O-N 3.22Å; R92-L96 VanDerWaalsContact O-N 3.08Å; R92-L157 HydrophobicContact CB-CD1 3.89Å; R92-W212 HydrophobicContact CB-CH2 3.61Å; R92-W212 HydrophobicContact CB-CZ2 3.71Å; R92-W212 HydrophobicContact CB-CZ3 4.32Å; R92-W212 HydrophobicContact CG-CD2 4.33Å; R92-W212 HydrophobicContact CG-CH2 3.85Å; R92-W212 HydrophobicContact CG-CZ2 3.63Å; R92-W212 HydrophobicContact CG-CZ3 4.31Å
93R93.3Very high96.6Very high103 Ų10354.3 Ų54.339%0.38930%0.304SS..Hα-helixtrans-62.6-50.2177.8-178.8-175.5-65.3-74.2-6.4111.9G91 F95 L96 Q97 D158G91-R93 VanDerWaalsContact C-N 3.33Å; G91-R93 PolarHBondContact O-N 2.96Å; G91-R93 VanDerWaalsContact O-N 3.17Å; R93-F95 VanDerWaalsContact C-N 3.26Å; R93-F95 PolarHBondContact O-N 3.1Å; R93-L96 PolarHBondContact O-N 3.35Å; R93-Q97 WeakPolarHBondContact O-CG 3.33Å; R93-Q97 PolarHBondContact O-N 3.35Å; R93-D158 IonicContact CZ-OD1 2.81Å; R93-D158 IonicContact NH1-OD1 3.42Å; R93-D158 PolarHBondContact NH1-OD1 3.34Å; R93-D158 IonicContact NH1-OD2 3.71Å; R93-D158 PolarHBondContact NH1-OD2 3.05Å; R93-D158 IonicContact NH2-OD1 2.77Å; R93-D158 PolarHBondContact NH2-OD1 3.23Å
94G95.4Very high96.6Very high21 Ų2152.8 Ų52.822%0.21630%0.295CS..Hα-helixtrans-61.2-36.7179.200000112.4G91 T98G91-G94 PolarHBondContact O-N 3.48Å; G94-T98 VanDerWaalsContact O-CB 3.31Å; G94-T98 WeakPolarHBondContact O-CB 3.4Å; G94-T98 PolarHBondContact O-N 3.49Å; G94-T98 PolarHBondContact O-OG1 3.04Å
95F98.1Very high96.6Very high0 Ų056.6 Ų56.60%031%0.307CS..Hα-helixtrans-62.5-51.1173.9173.4-100000111.9L87 L90 G91 R92 R93 Q97 T98 L99 V205 V208 F209 W212L87-F95 HydrophobicContact CB-CD2 4.19Å; L87-F95 HydrophobicContact CB-CE2 4.14Å; L87-F95 HydrophobicContact CD2-CD2 4.11Å; L87-F95 HydrophobicContact CD2-CE2 4.15Å; L90-F95 HydrophobicContact CB-CB 3.98Å; G91-F95 PolarHBondContact O-N 3.24Å; R92-F95 PolarHBondContact O-N 2.99Å; R93-F95 VanDerWaalsContact C-N 3.26Å; R93-F95 PolarHBondContact O-N 3.1Å; F95-Q97 VanDerWaalsContact C-N 3.34Å; F95-Q97 PolarHBondContact O-N 3.24Å; F95-T98 PolarHBondContact O-N 3.11Å; F95-L99 HydrophobicContact CE1-CD2 4.25Å; F95-L99 HydrophobicContact CZ-CD2 4.41Å; F95-L99 VanDerWaalsContact O-CB 3.27Å; F95-L99 WeakPolarHBondContact O-CB 3.44Å; F95-L99 PolarHBondContact O-N 3.26Å; F95-V205 HydrophobicContact CZ-CB 4.47Å; F95-V205 HydrophobicContact CZ-CG1 3.97Å; F95-V208 HydrophobicContact CD1-CG1 4.25Å; F95-V208 HydrophobicContact CD2-CB 4.31Å; F95-V208 HydrophobicContact CD2-CG1 3.78Å; F95-V208 HydrophobicContact CD2-CG2 4.42Å; F95-V208 HydrophobicContact CE1-CB 4.5Å; F95-V208 HydrophobicContact CE1-CG1 4.02Å; F95-V208 HydrophobicContact CE2-CB 3.61Å; F95-V208 HydrophobicContact CE2-CG1 3.54Å; F95-V208 HydrophobicContact CE2-CG2 3.85Å; F95-V208 HydrophobicContact CG-CG1 4.12Å; F95-V208 HydrophobicContact CZ-CB 3.71Å; F95-V208 HydrophobicContact CZ-CG1 3.65Å; F95-V208 HydrophobicContact CZ-CG2 4.43Å; F95-F209 HydrophobicContact CD1-CE1 4.39Å; F95-F209 HydrophobicContact CE1-CD1 4.02Å; F95-F209 HydrophobicContact CE1-CD2 4.37Å; F95-F209 AromaticContact CE1-CE1 3.57Å; F95-F209 HydrophobicContact CE1-CE1 3.57Å; F95-F209 AromaticContact CE1-CE2 3.97Å; F95-F209 HydrophobicContact CE1-CE2 3.97Å; F95-F209 HydrophobicContact CE1-CG 4.4Å; F95-F209 AromaticContact CE1-CZ 3.55Å; F95-F209 HydrophobicContact CE1-CZ 3.55Å; F95-F209 HydrophobicContact CZ-CD2 4.39Å; F95-F209 HydrophobicContact CZ-CE1 4.46Å; F95-F209 HydrophobicContact CZ-CE2 4.19Å; F95-F209 HydrophobicContact CZ-CZ 4.23Å; F95-W212 HydrophobicContact CB-CZ2 4.31Å; F95-W212 AromaticContact CD1-CH2 3.94Å; F95-W212 HydrophobicContact CD1-CH2 3.94Å; F95-W212 AromaticContact CD1-CZ2 3.46Å; F95-W212 HydrophobicContact CD1-CZ2 3.46Å; F95-W212 VanDerWaalsContact CD1-CZ2 3.46Å; F95-W212 HydrophobicContact CE1-CZ2 4.1Å; F95-W212 HydrophobicContact CG-CZ2 4.17Å
96L97.9Very high96.7Very high5 Ų548.9 Ų48.93%0.02627%0.271CS..Hα-helixtrans-63.6-38.2179.2-65172.7000112.3R92 R93 N100 V150 M153 A154 L157 F209 W212R92-L96 WeakPolarHBondContact O-CG 3.42Å; R92-L96 PolarHBondContact O-N 3.22Å; R92-L96 VanDerWaalsContact O-N 3.08Å; R93-L96 PolarHBondContact O-N 3.35Å; L96-N100 WeakPolarHBondContact O-CB 3.49Å; L96-N100 PolarHBondContact O-N 3.25Å; L96-V150 HydrophobicContact CB-CG1 4.13Å; L96-V150 HydrophobicContact CD2-CG1 4.06Å; L96-M153 HydrophobicContact CD1-CB 4.27Å; L96-M153 HydrophobicContact CD1-CG 3.88Å; L96-M153 HydrophobicContact CD2-CG 4.3Å; L96-A154 HydrophobicContact CD1-CB 4.16Å; L96-L157 HydrophobicContact CD1-CD1 3.67Å; L96-F209 HydrophobicContact CD2-CE1 4.05Å; L96-F209 HydrophobicContact CD2-CZ 4.1Å; L96-W212 HydrophobicContact CD1-CH2 4.03Å; L96-W212 HydrophobicContact CD1-CZ3 4.33Å; L96-W212 HydrophobicContact CD2-CH2 3.93Å; L96-W212 HydrophobicContact CD2-CZ3 4.32Å; L96-W212 HydrophobicContact CG-CH2 3.8Å; L96-W212 HydrophobicContact CG-CZ3 4.45Å
97Q97.1Very high96.7Very high117 Ų11746 Ų4655%0.54725%0.252SS..Hα-helixtrans-63.4-48.4175.5-73.4174.6-14.600111.5R93 F95 L99 N100 A101R93-Q97 WeakPolarHBondContact O-CG 3.33Å; R93-Q97 PolarHBondContact O-N 3.35Å; F95-Q97 VanDerWaalsContact C-N 3.34Å; F95-Q97 PolarHBondContact O-N 3.24Å; Q97-L99 VanDerWaalsContact C-N 3.34Å; Q97-L99 PolarHBondContact O-N 2.99Å; Q97-N100 PolarHBondContact O-N 3.4Å; Q97-A101 WeakPolarHBondContact O-CB 3.31Å; Q97-A101 PolarHBondContact O-N 3.11Å
98T98.2Very high96.6Very high43 Ų4353 Ų5326%0.26429%0.285SS..Hα-helixtrans-62.9-41.7178.2-60.10000111.3P82 L87 L90 G94 F95 T102P82-T98 HydrophobicContact CG-CG2 4.19Å; L87-T98 HydrophobicContact CD2-CG2 4.22Å; L90-T98 HydrophobicContact CD1-CG2 4.04Å; L90-T98 WeakPolarHBondContact CD1-OG1 3.4Å; G94-T98 VanDerWaalsContact O-CB 3.31Å; G94-T98 WeakPolarHBondContact O-CB 3.4Å; G94-T98 PolarHBondContact O-N 3.49Å; G94-T98 PolarHBondContact O-OG1 3.04Å; F95-T98 PolarHBondContact O-N 3.11Å; T98-T102 VanDerWaalsContact O-CB 3.31Å; T98-T102 WeakPolarHBondContact O-CB 3.38Å; T98-T102 PolarHBondContact O-N 3.45Å; T98-T102 PolarHBondContact O-OG1 3.07Å
99L98.6Very high96.6Very high0 Ų051.7 Ų51.70%028%0.28CS..Hα-helixtrans-61.2-52.1175.317757.4000110.9F95 Q97 A101 T102 L103 V150 F201 V205 F209F95-L99 HydrophobicContact CE1-CD2 4.25Å; F95-L99 HydrophobicContact CZ-CD2 4.41Å; F95-L99 VanDerWaalsContact O-CB 3.27Å; F95-L99 WeakPolarHBondContact O-CB 3.44Å; F95-L99 PolarHBondContact O-N 3.26Å; Q97-L99 VanDerWaalsContact C-N 3.34Å; Q97-L99 PolarHBondContact O-N 2.99Å; L99-A101 VanDerWaalsContact C-N 3.34Å; L99-A101 PolarHBondContact O-N 3.01Å; L99-T102 PolarHBondContact O-N 3.38Å; L99-L103 HydrophobicContact CD1-CD1 3.83Å; L99-L103 HydrophobicContact CD1-CD2 4.31Å; L99-L103 HydrophobicContact CD1-CG 3.88Å; L99-L103 HydrophobicContact CG-CD1 3.93Å; L99-L103 HydrophobicContact CG-CG 4.38Å; L99-L103 VanDerWaalsContact O-CG 3.3Å; L99-L103 WeakPolarHBondContact O-CG 3.34Å; L99-L103 PolarHBondContact O-N 3.43Å; L99-V150 HydrophobicContact CD2-CG2 3.54Å; L99-V150 HydrophobicContact CG-CG2 4.12Å; L99-F201 HydrophobicContact CD1-CE1 3.84Å; L99-F201 HydrophobicContact CD1-CZ 3.65Å; L99-V205 HydrophobicContact CD1-CG1 3.96Å; L99-V205 HydrophobicContact CD1-CG2 3.81Å; L99-V205 HydrophobicContact CD2-CG1 3.89Å; L99-F209 HydrophobicContact CD2-CE2 3.79Å; L99-F209 HydrophobicContact CD2-CZ 3.73Å
100N98.1Very high96.7Very high57 Ų5748.7 Ų48.731%0.30525%0.247SC..Hα-helixtrans-60.7-41.8-179.6-175.537.6000112.3L96 Q97 G104 R147 V150L96-N100 WeakPolarHBondContact O-CB 3.49Å; L96-N100 PolarHBondContact O-N 3.25Å; Q97-N100 PolarHBondContact O-N 3.4Å; N100-G104 PolarHBondContact O-N 3.36Å; N100-R147 PolarHBondContact OD1-NE 3.05Å; N100-R147 PolarHBondContact OD1-NH2 3.26Å; N100-R147 VanDerWaalsContact OD1-NH2 3.15Å; N100-V150 HydrophobicContact CB-CG1 4.06Å
101A97.8Very high96.8Very high52 Ų5247.4 Ų47.443%0.4325%0.245SC..Hα-helixtrans-64.1-42.1176.100000111.9Q97 L99 G104 R105Q97-A101 WeakPolarHBondContact O-CB 3.31Å; Q97-A101 PolarHBondContact O-N 3.11Å; L99-A101 VanDerWaalsContact C-N 3.34Å; L99-A101 PolarHBondContact O-N 3.01Å; A101-G104 PolarHBondContact O-N 3.36Å; A101-R105 PolarHBondContact O-N 2.97Å; A101-R105 VanDerWaalsContact O-N 3.1Å
102T98.5Very high96.8Very high1 Ų147.6 Ų47.61%0.00623%0.234CC..Hα-helixtrans-67.2-43.6178.5-55.50000111.5F81 T98 L99 G104 R105 V106 F201F81-T102 HydrophobicContact CD1-CG2 3.85Å; F81-T102 HydrophobicContact CE1-CG2 4.17Å; T98-T102 VanDerWaalsContact O-CB 3.31Å; T98-T102 WeakPolarHBondContact O-CB 3.38Å; T98-T102 PolarHBondContact O-N 3.45Å; T98-T102 PolarHBondContact O-OG1 3.07Å; L99-T102 PolarHBondContact O-N 3.38Å; T102-G104 VanDerWaalsContact C-N 3.26Å; T102-G104 PolarHBondContact O-N 3.2Å; T102-R105 PolarHBondContact O-N 2.78Å; T102-R105 VanDerWaalsContact O-N 3.13Å; T102-R105 PolarHBondContact OG1-NH2 2.98Å; T102-V106 WeakPolarHBondContact O-CG2 3.31Å; T102-V106 PolarHBondContact O-N 3.31Å; T102-F201 HydrophobicContact CG2-CD1 4.25Å; T102-F201 HydrophobicContact CG2-CE1 3.72Å; T102-F201 HydrophobicContact CG2-CE2 4.06Å; T102-F201 HydrophobicContact CG2-CZ 3.61Å
103L98.4Very high96.8Very high0 Ų043 Ų430%022%0.217CC..Hα-helixtrans-62.5-33.7173.1-65.2173.9000112L99 V106 L107 V143 L146 R147 M202L99-L103 HydrophobicContact CD1-CD1 3.83Å; L99-L103 HydrophobicContact CD1-CD2 4.31Å; L99-L103 HydrophobicContact CD1-CG 3.88Å; L99-L103 HydrophobicContact CG-CD1 3.93Å; L99-L103 HydrophobicContact CG-CG 4.38Å; L99-L103 VanDerWaalsContact O-CG 3.3Å; L99-L103 WeakPolarHBondContact O-CG 3.34Å; L99-L103 PolarHBondContact O-N 3.43Å; L103-V106 PolarHBondContact O-N 3.31Å; L103-L107 WeakPolarHBondContact O-CG 3.32Å; L103-L107 PolarHBondContact O-N 2.88Å; L103-V143 HydrophobicContact CB-CG1 4.04Å; L103-V143 HydrophobicContact CD2-CG1 4.09Å; L103-L146 HydrophobicContact CD1-CB 4.42Å; L103-L146 HydrophobicContact CD1-CD2 3.63Å; L103-L146 HydrophobicContact CD1-CG 3.82Å; L103-L146 HydrophobicContact CD2-CD2 4.05Å; L103-L146 HydrophobicContact CG-CD2 4.49Å; L103-R147 HydrophobicContact CB-CG 3.61Å; L103-R147 HydrophobicContact CD1-CG 3.68Å; L103-R147 HydrophobicContact CG-CG 4.3Å; L103-M202 HydrophobicContact CD2-SD 4.15Å
104G97.6Very high96.7Very high11 Ų1141.1 Ų41.111%0.11321%0.213CC..Hα-helixtrans-58.4-48.3170.600000112.3N100 A101 T102 L107 H108N100-G104 PolarHBondContact O-N 3.36Å; A101-G104 PolarHBondContact O-N 3.36Å; T102-G104 VanDerWaalsContact C-N 3.26Å; T102-G104 PolarHBondContact O-N 3.2Å; G104-L107 PolarHBondContact O-N 3.33Å; G104-H108 PolarHBondContact O-N 2.87Å; G104-H108 PolarHBondContact O-ND1 3.45Å
105R97.6Very high96.3Very high138 Ų13847.4 Ų47.452%0.52124%0.236SC..Hα-helixtrans-63.1-40.9174.8-65.4-168.3-61.2-83.5-1112A101 T102 L107 H108 R109A101-R105 PolarHBondContact O-N 2.97Å; A101-R105 VanDerWaalsContact O-N 3.1Å; T102-R105 PolarHBondContact O-N 2.78Å; T102-R105 VanDerWaalsContact O-N 3.13Å; T102-R105 PolarHBondContact OG1-NH2 2.98Å; R105-L107 VanDerWaalsContact C-N 3.33Å; R105-L107 PolarHBondContact O-N 3.38Å; R105-H108 PolarHBondContact O-N 3.48Å; R105-R109 PolarHBondContact O-N 3.1Å; R105-R109 VanDerWaalsContact O-N 3.09Å
106V98.1Very high95.8Very high1 Ų151.4 Ų51.41%0.00626%0.255CS..Hα-helixtrans-58.1-44.5176.3168.20000111.3F81 T102 L103 H108 R109 L110 V143 F194 Y198F81-V106 HydrophobicContact CE1-CG2 3.74Å; F81-V106 HydrophobicContact CZ-CG2 4.26Å; T102-V106 WeakPolarHBondContact O-CG2 3.31Å; T102-V106 PolarHBondContact O-N 3.31Å; L103-V106 PolarHBondContact O-N 3.31Å; V106-H108 VanDerWaalsContact C-N 3.3Å; V106-H108 PolarHBondContact O-N 3.41Å; V106-R109 PolarHBondContact O-N 3.33Å; V106-L110 HydrophobicContact CG1-CD1 3.74Å; V106-L110 HydrophobicContact CG1-CG 4.05Å; V106-L110 WeakPolarHBondContact O-CB 3.47Å; V106-L110 WeakPolarHBondContact O-CG 3.33Å; V106-L110 PolarHBondContact O-N 2.9Å; V106-V143 HydrophobicContact CG1-CG2 4.21Å; V106-F194 HydrophobicContact CB-CZ 4.32Å; V106-F194 HydrophobicContact CG1-CZ 4.17Å; V106-F194 HydrophobicContact CG2-CE2 4.37Å; V106-F194 HydrophobicContact CG2-CZ 4.18Å; V106-Y198 HydrophobicContact CG1-CD2 3.9Å; V106-Y198 HydrophobicContact CG1-CE2 3.9Å; V106-Y198 HydrophobicContact CG2-CD2 3.87Å; V106-Y198 HydrophobicContact CG2-CE2 4.39Å
107L98Very high95.5Very high17 Ų1752.3 Ų52.39%0.08926%0.26CS..Hα-helixtrans-59.7-39.1177.7-74.3166.2000113L103 G104 R105 A111 R140 V143 L144L103-L107 WeakPolarHBondContact O-CG 3.32Å; L103-L107 PolarHBondContact O-N 2.88Å; G104-L107 PolarHBondContact O-N 3.33Å; R105-L107 VanDerWaalsContact C-N 3.33Å; R105-L107 PolarHBondContact O-N 3.38Å; L107-A111 WeakPolarHBondContact O-CB 3.31Å; L107-A111 PolarHBondContact O-N 3.48Å; L107-R140 HydrophobicContact CD2-CB 4.49Å; L107-R140 HydrophobicContact CD2-CG 3.78Å; L107-V143 HydrophobicContact CD1-CG1 4.11Å; L107-V143 HydrophobicContact CD2-CB 3.88Å; L107-V143 HydrophobicContact CD2-CG1 3.66Å; L107-V143 HydrophobicContact CG-CB 4.37Å; L107-V143 HydrophobicContact CG-CG1 3.59Å; L107-L144 HydrophobicContact CD1-CD2 3.74Å; L107-L144 HydrophobicContact CD1-CG 4.39Å; L107-L144 HydrophobicContact CD2-CD2 4.22Å; L107-L144 HydrophobicContact CD2-CG 4.02Å
108H96.4Very high95.1Very high147 Ų14748.2 Ų48.268%0.68124%0.243SC*.Hα-helixtrans-66.7-44.2177.5-70.470.6000110.9G104 R105 V106 A111 D112G104-H108 PolarHBondContact O-N 2.87Å; G104-H108 PolarHBondContact O-ND1 3.45Å; R105-H108 PolarHBondContact O-N 3.48Å; V106-H108 VanDerWaalsContact C-N 3.3Å; V106-H108 PolarHBondContact O-N 3.41Å; H108-A111 PolarHBondContact O-N 3.25Å; H108-D112 PolarHBondContact O-N 3.24Å; H108-D112 VanDerWaalsContact O-N 3.08Å
109R96.1Very high94.5Very high82 Ų8253.1 Ų53.131%0.30926%0.261SS..Hα-helixtrans-70.8-33.6179.1-168.363.4170-159.3-0112.5R105 V106 D112 L113 E190 F194R105-R109 PolarHBondContact O-N 3.1Å; R105-R109 VanDerWaalsContact O-N 3.09Å; V106-R109 PolarHBondContact O-N 3.33Å; R109-D112 IonicContact NH1-OD2 3.22Å; R109-D112 PolarHBondContact O-N 3.47Å; R109-L113 VanDerWaalsContact O-CG 3.32Å; R109-L113 WeakPolarHBondContact O-CG 3.35Å; R109-L113 PolarHBondContact O-N 2.95Å; R109-E190 IonicContact NH2-OE2 2.67Å; R109-E190 PolarHBondContact NH2-OE2 3.38Å; R109-F194 HydrophobicContact CB-CD2 4.36Å; R109-F194 HydrophobicContact CB-CE1 3.96Å; R109-F194 HydrophobicContact CB-CE2 3.76Å; R109-F194 HydrophobicContact CB-CZ 3.55Å; R109-F194 HydrophobicContact CG-CD1 3.76Å; R109-F194 HydrophobicContact CG-CD2 3.76Å; R109-F194 HydrophobicContact CG-CE1 3.69Å; R109-F194 HydrophobicContact CG-CE2 3.69Å; R109-F194 HydrophobicContact CG-CG 3.79Å; R109-F194 HydrophobicContact CG-CZ 3.66Å
110L96.6Very high93.9Very high7 Ų755.9 Ų55.94%0.03728%0.284CS..Hα-helixtrans-63.2-43.5171.5-75175.1000111.3L55 V106 D112 L113 E114 A139 V143 F194 L195L55-L110 HydrophobicContact CD2-CD2 4.39Å; V106-L110 HydrophobicContact CG1-CD1 3.74Å; V106-L110 HydrophobicContact CG1-CG 4.05Å; V106-L110 WeakPolarHBondContact O-CB 3.47Å; V106-L110 WeakPolarHBondContact O-CG 3.33Å; V106-L110 PolarHBondContact O-N 2.9Å; L110-D112 VanDerWaalsContact C-N 3.31Å; L110-D112 PolarHBondContact O-N 2.94Å; L110-L113 PolarHBondContact O-N 3.09Å; L110-E114 WeakPolarHBondContact O-CB 3.33Å; L110-E114 VanDerWaalsContact O-CG 3.3Å; L110-E114 WeakPolarHBondContact O-CG 3.3Å; L110-E114 PolarHBondContact O-N 2.85Å; L110-A139 HydrophobicContact CD1-CB 3.97Å; L110-A139 HydrophobicContact CD2-CB 4.12Å; L110-V143 HydrophobicContact CD1-CG2 4.1Å; L110-F194 HydrophobicContact CD2-CE1 4.4Å; L110-L195 HydrophobicContact CD2-CD2 4Å
111A94.6Very high93.2Very high29 Ų2961.5 Ų61.524%0.2431%0.308CS..Hα-helixtrans-62-39.4176.400000112.3L107 H108 Q115L107-A111 WeakPolarHBondContact O-CB 3.31Å; L107-A111 PolarHBondContact O-N 3.48Å; H108-A111 PolarHBondContact O-N 3.25Å; A111-Q115 WeakPolarHBondContact O-CG 2.93Å; A111-Q115 PolarHBondContact O-N 2.83Å
112D92.8Very high92.6Very high57 Ų5762.7 Ų62.731%0.30531%0.308SS..Hα-helixtrans-63.6-44.4172.9177.450.7000111.8H108 R109 L110 E114 Q115 H116H108-D112 PolarHBondContact O-N 3.24Å; H108-D112 VanDerWaalsContact O-N 3.08Å; R109-D112 IonicContact NH1-OD2 3.22Å; R109-D112 PolarHBondContact O-N 3.47Å; L110-D112 VanDerWaalsContact C-N 3.31Å; L110-D112 PolarHBondContact O-N 2.94Å; D112-E114 PolarHBondContact O-N 3.32Å; D112-Q115 PolarHBondContact O-N 2.94Å; D112-H116 PolarHBondContact O-ND1 3.22Å; D112-H116 IonicContact OD1-CE1 3.91Å; D112-H116 PolarHBondContact OD1-CE1 3.18Å; D112-H116 IonicContact OD1-ND1 2.77Å
113L92.9Very high91.9Very high14 Ų1462.9 Ų62.97%0.07331%0.308CS..Hα-helixtrans-63.6-41.8176.4-70.8174.4000112.6Y59 R109 L110 Q115 H116 L117 F194 L195Y59-L113 HydrophobicContact CE2-CD2 4.13Å; R109-L113 VanDerWaalsContact O-CG 3.32Å; R109-L113 WeakPolarHBondContact O-CG 3.35Å; R109-L113 PolarHBondContact O-N 2.95Å; L110-L113 PolarHBondContact O-N 3.09Å; L113-Q115 VanDerWaalsContact C-N 3.25Å; L113-Q115 PolarHBondContact O-N 3.48Å; L113-H116 CarbonylContact O-C 3.55Å; L113-H116 PolarHBondContact O-N 2.85Å; L113-L117 PolarHBondContact O-N 2.93Å; L113-F194 HydrophobicContact CD1-CD1 3.74Å; L113-F194 HydrophobicContact CD1-CE1 4.03Å; L113-L195 HydrophobicContact CD1-CD2 4.26Å; L113-L195 HydrophobicContact CD1-CG 4.23Å
114E91.3Very high91Very high64 Ų6471.5 Ų71.530%0.29935%0.349SS..Hα-helixtrans-57.2-36.8178-78.2169.2-16700112.1L110 D112 H116 L117L110-E114 WeakPolarHBondContact O-CB 3.33Å; L110-E114 VanDerWaalsContact O-CG 3.3Å; L110-E114 WeakPolarHBondContact O-CG 3.3Å; L110-E114 PolarHBondContact O-N 2.85Å; D112-E114 PolarHBondContact O-N 3.32Å; E114-H116 PolarHBondContact O-N 3.04Å; E114-L117 PolarHBondContact O-N 3.13Å
115Q88.6Confident90.3Very high153 Ų15382 Ų8272%0.71539%0.385SS*.Hα-helixtrans-64.2-22176.7-70.3175.15.100113.5A111 D112 L113A111-Q115 WeakPolarHBondContact O-CG 2.93Å; A111-Q115 PolarHBondContact O-N 2.83Å; D112-Q115 PolarHBondContact O-N 2.94Å; L113-Q115 VanDerWaalsContact C-N 3.25Å; L113-Q115 PolarHBondContact O-N 3.48Å
116H87.6Confident89.6Confident84 Ų8479 Ų7939%0.38939%0.385SS..THydrogen-bonded Turntrans-109.79.1-176.1-58.996.9000112.8Q63 D112 L113 E114 R187Q63-H116 PolarHBondContact NE2-O 2.85Å; D112-H116 PolarHBondContact O-ND1 3.22Å; D112-H116 IonicContact OD1-CE1 3.91Å; D112-H116 PolarHBondContact OD1-CE1 3.18Å; D112-H116 IonicContact OD1-ND1 2.77Å; L113-H116 CarbonylContact O-C 3.55Å; L113-H116 PolarHBondContact O-N 2.85Å; E114-H116 PolarHBondContact O-N 3.04Å; H116-R187 PolarHBondContact CD2-NH1 3.34Å; H116-R187 PolarHBondContact NE2-NH1 3.07Å
117L90.4Very high88.8Confident25 Ų2582.3 Ų82.313%0.13142%0.42CS..SBendtrans-78.5148171.9-70.5177.6000110.8Y59 I62 L113 E114 K119 L133 L136Y59-L117 HydrophobicContact CD2-CD2 4.14Å; Y59-L117 HydrophobicContact CE2-CD2 4.18Å; I62-L117 HydrophobicContact CG2-CD2 4Å; L113-L117 PolarHBondContact O-N 2.93Å; E114-L117 PolarHBondContact O-N 3.13Å; L117-K119 PolarHBondContact O-N 3.23Å; L117-L133 HydrophobicContact CB-CD1 4.41Å; L117-L133 HydrophobicContact CD1-CD1 4.13Å; L117-L136 HydrophobicContact CD1-CB 4.07Å; L117-L136 HydrophobicContact CD1-CD1 3.89Å; L117-L136 HydrophobicContact CD2-CD1 3.84Å
118P88Confident88.3Confident31 Ų3183.9 Ų83.920%0.20143%0.428CS..PPolyproline II helixtrans-56.6138.7169.3-2435.4000111.1I62 L123 L128I62-P118 HydrophobicContact CG1-CG 4.18Å; P118-L123 HydrophobicContact CB-CD2 3.76Å; P118-L128 HydrophobicContact CB-CD1 4.12Å; P118-L128 HydrophobicContact CG-CD1 3.88Å
119K87.3Confident87.9Confident146 Ų14680.4 Ų80.464%0.63541%0.414SS*.PPolyproline II helixtrans-76.3151177.8-61.7178.4179.5175.20109.8L117 Q121 D122 L123L117-K119 PolarHBondContact O-N 3.23Å; K119-Q121 PolarHBondContact O-N 3.22Å; K119-Q121 VanDerWaalsContact O-N 3.11Å; K119-D122 WeakPolarHBondContact O-CB 3.34Å; K119-D122 PolarHBondContact O-N 2.68Å; K119-L123 PolarHBondContact O-N 2.98Å
120A85.4Confident87.7Confident58 Ų5880.5 Ų80.548%0.47942%0.42SS..Hα-helixtrans-51.8-38.6-179.700000113.5D122 L123 I130 L133A120-D122 VanDerWaalsContact C-N 3.27Å; A120-D122 PolarHBondContact O-N 2.92Å; A120-L123 PolarHBondContact O-N 3.26Å; A120-I130 HydrophobicContact CB-CD1 4.24Å; A120-L133 HydrophobicContact CB-CD2 4.09Å
121Q83.3Confident87.5Confident174 Ų17484.5 Ų84.581%0.81344%0.438SS*.Hα-helixtrans-66.2-27.3178.4-62.8171.88.400113.1K119K119-Q121 PolarHBondContact O-N 3.22Å; K119-Q121 VanDerWaalsContact O-N 3.11Å
122D84.4Confident87.4Confident78 Ų7883.4 Ų83.442%0.41743%0.429SS..Hα-helixtrans-90.2-12.5-178.1-58-40.4000112.2K119 A120 S126K119-D122 WeakPolarHBondContact O-CB 3.34Å; K119-D122 PolarHBondContact O-N 2.68Å; A120-D122 VanDerWaalsContact C-N 3.27Å; A120-D122 PolarHBondContact O-N 2.92Å; D122-S126 VanDerWaalsContact O-CB 3.24Å; D122-S126 WeakPolarHBondContact O-CB 3.36Å; D122-S126 PolarHBondContact O-N 2.97Å; D122-S126 VanDerWaalsContact O-N 3.07Å; D122-S126 PolarHBondContact O-OG 2.85Å
123L85.1Confident87.4Confident4 Ų481.2 Ų81.22%0.02142%0.417CS..Hα-helixtrans-67.2-46.9-175.5-65.2179.6000112.4I62 P118 K119 A120 R125 S126 G127 L128 I130 L133I62-L123 HydrophobicContact CD1-CD2 3.9Å; I62-L123 HydrophobicContact CG1-CD2 4.12Å; P118-L123 HydrophobicContact CB-CD2 3.76Å; K119-L123 PolarHBondContact O-N 2.98Å; A120-L123 PolarHBondContact O-N 3.26Å; L123-R125 VanDerWaalsContact C-N 3.33Å; L123-R125 PolarHBondContact O-N 3.21Å; L123-S126 CarbonylContact O-C 3.45Å; L123-S126 PolarHBondContact O-N 3.37Å; L123-S126 VanDerWaalsContact O-N 3.09Å; L123-G127 PolarHBondContact O-N 3.15Å; L123-L128 HydrophobicContact CB-CB 4.27Å; L123-L128 HydrophobicContact CD2-CB 3.61Å; L123-L128 HydrophobicContact CD2-CD1 3.93Å; L123-L128 HydrophobicContact CD2-CG 4.43Å; L123-L128 PolarHBondContact O-N 3.34Å; L123-I130 HydrophobicContact CD1-CB 4.36Å; L123-I130 HydrophobicContact CD1-CD1 3.6Å; L123-L133 HydrophobicContact CD1-CB 4.03Å; L123-L133 HydrophobicContact CD1-CD2 3.77Å
124E79.1Confident87.4Confident181 Ų18185.6 Ų85.685%0.84644%0.437SS*.THydrogen-bonded Turntrans-61.6-44-178.7-172.9176.1-168.800110.9S126 G127E124-S126 VanDerWaalsContact C-N 3.26Å; E124-S126 PolarHBondContact O-N 3.37Å; E124-G127 PolarHBondContact O-N 2.89Å
125R81.9Confident87.6Confident232 Ų23285.5 Ų85.588%0.87544%0.436SS*.THydrogen-bonded Turntrans-64.6-31.1175.8-171.1177.3-177.3134.82.4112.9L123L123-R125 VanDerWaalsContact C-N 3.33Å; L123-R125 PolarHBondContact O-N 3.21Å
126S83.1Confident87.9Confident74 Ų7478.6 Ų78.652%0.51740%0.403SS..THydrogen-bonded Turntrans-93.10.1-178.1-52.90000113.3D122 L123 E124 L128D122-S126 VanDerWaalsContact O-CB 3.24Å; D122-S126 WeakPolarHBondContact O-CB 3.36Å; D122-S126 PolarHBondContact O-N 2.97Å; D122-S126 VanDerWaalsContact O-N 3.07Å; D122-S126 PolarHBondContact O-OG 2.85Å; L123-S126 CarbonylContact O-C 3.45Å; L123-S126 PolarHBondContact O-N 3.37Å; L123-S126 VanDerWaalsContact O-N 3.09Å; E124-S126 VanDerWaalsContact C-N 3.26Å; E124-S126 PolarHBondContact O-N 3.37Å; S126-L128 PolarHBondContact O-N 2.89Å
127G82.1Confident88.2Confident72 Ų7279.8 Ų79.874%0.74241%0.409SS*.THydrogen-bonded Turntrans64.724.5-176.300000114.1L123 E124L123-G127 PolarHBondContact O-N 3.15Å; E124-G127 PolarHBondContact O-N 2.89Å
128L86.9Confident88.4Confident50 Ų5083.4 Ų83.426%0.26243%0.427SS..  trans-94.3150.1-177.4-63.8177.5000111.6I62 P118 L123 S126I62-L128 HydrophobicContact CG1-CB 4.46Å; I62-L128 HydrophobicContact CG1-CD1 4.06Å; I62-L128 WeakPolarHBondContact O-CD1 3.37Å; P118-L128 HydrophobicContact CB-CD1 4.12Å; P118-L128 HydrophobicContact CG-CD1 3.88Å; L123-L128 HydrophobicContact CB-CB 4.27Å; L123-L128 HydrophobicContact CD2-CB 3.61Å; L123-L128 HydrophobicContact CD2-CD1 3.93Å; L123-L128 HydrophobicContact CD2-CG 4.43Å; L123-L128 PolarHBondContact O-N 3.34Å; S126-L128 PolarHBondContact O-N 2.89Å
129N88.4Confident88.8Confident73 Ų7382.2 Ų82.239%0.3942%0.42SS..  trans-83.5124.9-175.4-172.3-7.1000112.1E131 D132N129-E131 VanDerWaalsContact C-N 3.29Å; N129-E131 PolarHBondContact O-N 2.99Å; N129-E131 VanDerWaalsContact OD1-CB 3.3Å; N129-E131 WeakPolarHBondContact OD1-CB 3.36Å; N129-E131 PolarHBondContact OD1-N 2.99Å; N129-D132 PolarHBondContact O-N 3.36Å
130I91.6Very high89.2Confident85 Ų8580.9 Ų80.944%0.43641%0.411SS..Hα-helixtrans-61.9-34.1175.2-170.864.8000112.8A120 L123 D132 L133 E134A120-I130 HydrophobicContact CB-CD1 4.24Å; L123-I130 HydrophobicContact CD1-CB 4.36Å; L123-I130 HydrophobicContact CD1-CD1 3.6Å; I130-D132 PolarHBondContact O-N 2.98Å; I130-L133 HydrophobicContact CD1-CD2 4.29Å; I130-L133 WeakPolarHBondContact O-CB 3.31Å; I130-L133 PolarHBondContact O-N 3.36Å; I130-E134 PolarHBondContact O-N 3.34Å
131E92.4Very high89.7Confident90 Ų9081.4 Ų81.442%0.42141%0.409SS..Hα-helixtrans-62-32.4178.9-166.6-164.4154.900111.5N129 E134 K135N129-E131 VanDerWaalsContact C-N 3.29Å; N129-E131 PolarHBondContact O-N 2.99Å; N129-E131 VanDerWaalsContact OD1-CB 3.3Å; N129-E131 WeakPolarHBondContact OD1-CB 3.36Å; N129-E131 PolarHBondContact OD1-N 2.99Å; E131-E134 PolarHBondContact O-N 3.08Å; E131-K135 WeakPolarHBondContact O-CG 3.3Å; E131-K135 PolarHBondContact O-N 3.23Å; E131-K135 WeakPolarHBondContact OE1-CE 3.19Å; E131-K135 IonicContact OE1-NZ 2.68Å; E131-K135 PolarHBondContact OE1-NZ 3.28Å
132D93.7Very high90.4Very high6 Ų676.8 Ų76.83%0.03239%0.39CS..Hα-helixtrans-68.6-40175.7-75.2-27.5000111.1P58 R61 N129 I130 K135 L136P58-D132 HydrophobicContact CB-CB 3.86Å; R61-D132 IonicContact CZ-OD1 3.33Å; R61-D132 IonicContact CZ-OD2 2.84Å; R61-D132 IonicContact NE-OD1 3.56Å; R61-D132 PolarHBondContact NE-OD1 3.34Å; R61-D132 IonicContact NE-OD2 3.83Å; R61-D132 PolarHBondContact NE-OD2 3.38Å; R61-D132 IonicContact NH2-OD1 3.32Å; R61-D132 PolarHBondContact NH2-OD1 3.2Å; R61-D132 IonicContact NH2-OD2 3.33Å; N129-D132 PolarHBondContact O-N 3.36Å; I130-D132 PolarHBondContact O-N 2.98Å; D132-K135 PolarHBondContact O-N 3.41Å; D132-L136 WeakPolarHBondContact O-CD1 3.49Å; D132-L136 WeakPolarHBondContact O-CG 3.32Å; D132-L136 PolarHBondContact O-N 3.48Å; D132-L136 VanDerWaalsContact O-N 3.11Å
133L93.1Very high91Very high11 Ų1173 Ų736%0.05837%0.37CS..Hα-helixtrans-64.5-42.7175-175.862.2000111.6I62 L117 A120 L123 I130 K135 L136 Q137I62-L133 HydrophobicContact CD1-CB 3.87Å; I62-L133 HydrophobicContact CD1-CD1 4.15Å; L117-L133 HydrophobicContact CB-CD1 4.41Å; L117-L133 HydrophobicContact CD1-CD1 4.13Å; A120-L133 HydrophobicContact CB-CD2 4.09Å; L123-L133 HydrophobicContact CD1-CB 4.03Å; L123-L133 HydrophobicContact CD1-CD2 3.77Å; I130-L133 HydrophobicContact CD1-CD2 4.29Å; I130-L133 WeakPolarHBondContact O-CB 3.31Å; I130-L133 PolarHBondContact O-N 3.36Å; L133-K135 PolarHBondContact O-N 3.45Å; L133-L136 WeakPolarHBondContact O-CB 3.42Å; L133-L136 PolarHBondContact O-N 3.08Å; L133-Q137 WeakPolarHBondContact O-CG 3.45Å; L133-Q137 PolarHBondContact O-N 2.92Å
134E92.8Very high91.6Very high106 Ų10676.3 Ų76.350%0.49539%0.387SS..Hα-helixtrans-61.7-43.2177.4-69.6177.9164.600111.8I130 E131 L136 Q137 M138I130-E134 PolarHBondContact O-N 3.34Å; E131-E134 PolarHBondContact O-N 3.08Å; E134-L136 VanDerWaalsContact C-N 3.32Å; E134-L136 PolarHBondContact O-N 3.41Å; E134-Q137 PolarHBondContact O-N 3.2Å; E134-M138 WeakPolarHBondContact O-CG 3.46Å; E134-M138 PolarHBondContact O-N 3.29Å
135K94.5Very high92.4Very high62 Ų6268.7 Ų68.727%0.2736%0.357SS..Hα-helixtrans-58.6-43.9174.1-75.9170.7-174160.60111.8P58 E131 D132 L133 Q137 M138P58-K135 HydrophobicContact CB-CB 4.29Å; P58-K135 HydrophobicContact CG-CB 3.96Å; P58-K135 HydrophobicContact CG-CD 3.7Å; P58-K135 HydrophobicContact CG-CG 4.48Å; E131-K135 WeakPolarHBondContact O-CG 3.3Å; E131-K135 PolarHBondContact O-N 3.23Å; E131-K135 WeakPolarHBondContact OE1-CE 3.19Å; E131-K135 IonicContact OE1-NZ 2.68Å; E131-K135 PolarHBondContact OE1-NZ 3.28Å; D132-K135 PolarHBondContact O-N 3.41Å; L133-K135 PolarHBondContact O-N 3.45Å; K135-Q137 VanDerWaalsContact C-N 3.34Å; K135-Q137 PolarHBondContact O-N 3.03Å; K135-M138 PolarHBondContact O-N 3.44Å
136L94.8Very high93.1Very high8 Ų857.7 Ų57.74%0.04232%0.316CS..Hα-helixtrans-62-41.3177.6-68.5167.8000111.9L55 P58 Y59 I62 L117 D132 L133 E134 M138 A139L55-L136 HydrophobicContact CD1-CD2 3.53Å; L55-L136 WeakPolarHBondContact O-CD2 3.46Å; P58-L136 HydrophobicContact CB-CD2 4.37Å; P58-L136 HydrophobicContact CB-CG 4.21Å; Y59-L136 HydrophobicContact CD2-CD2 4.38Å; I62-L136 HydrophobicContact CB-CD1 4.49Å; I62-L136 HydrophobicContact CD1-CD1 4.19Å; I62-L136 HydrophobicContact CG2-CD1 3.67Å; L117-L136 HydrophobicContact CD1-CB 4.07Å; L117-L136 HydrophobicContact CD1-CD1 3.89Å; L117-L136 HydrophobicContact CD2-CD1 3.84Å; D132-L136 WeakPolarHBondContact O-CD1 3.49Å; D132-L136 WeakPolarHBondContact O-CG 3.32Å; D132-L136 PolarHBondContact O-N 3.48Å; D132-L136 VanDerWaalsContact O-N 3.11Å; L133-L136 WeakPolarHBondContact O-CB 3.42Å; L133-L136 PolarHBondContact O-N 3.08Å; E134-L136 VanDerWaalsContact C-N 3.32Å; E134-L136 PolarHBondContact O-N 3.41Å; L136-M138 PolarHBondContact O-N 3.04Å; L136-A139 VanDerWaalsContact O-CB 3.25Å; L136-A139 WeakPolarHBondContact O-CB 3.43Å; L136-A139 PolarHBondContact O-N 3.49Å; L136-A139 VanDerWaalsContact O-N 3.1Å
137Q93.1Very high93.8Very high110 Ų11057.8 Ų57.851%0.51431%0.305SS..Hα-helixtrans-63.8-24178.5-72.2172.2-5.400113.2L133 E134 K135 A139 P141L133-Q137 WeakPolarHBondContact O-CG 3.45Å; L133-Q137 PolarHBondContact O-N 2.92Å; E134-Q137 PolarHBondContact O-N 3.2Å; K135-Q137 VanDerWaalsContact C-N 3.34Å; K135-Q137 PolarHBondContact O-N 3.03Å; Q137-A139 VanDerWaalsContact C-N 3.29Å; Q137-A139 PolarHBondContact O-N 3.02Å; Q137-P141 WeakPolarHBondContact O-CD 3.3Å
138M95.1Very high94.5Very high100 Ų10057.8 Ų57.849%0.49329%0.288SS..THydrogen-bonded Turntrans-75.8-14.3176.4-65.6-56.7-62.900113.7E134 K135 L136 R140 P141 N142E134-M138 WeakPolarHBondContact O-CG 3.46Å; E134-M138 PolarHBondContact O-N 3.29Å; K135-M138 PolarHBondContact O-N 3.44Å; L136-M138 PolarHBondContact O-N 3.04Å; M138-R140 PolarHBondContact O-N 3.49Å; M138-P141 WeakPolarHBondContact O-CD 3.32Å; M138-N142 VanDerWaalsContact O-CB 3.31Å; M138-N142 WeakPolarHBondContact O-CB 3.45Å; M138-N142 PolarHBondContact O-N 3.02Å; M138-N142 VanDerWaalsContact O-N 3.08Å; M138-N142 PolarHBondContact O-ND2 3.46Å; M138-N142 VanDerWaalsContact O-ND2 3.08Å
139A95.9Very high94.9Very high7 Ų756.6 Ų56.66%0.05828%0.282CS..Hα-helixtrans-60.2-50.4-176.100000112.3L55 L110 L136 Q137 N142 V143L55-A139 HydrophobicContact CD1-CB 3.69Å; L55-A139 HydrophobicContact CD2-CB 3.95Å; L55-A139 HydrophobicContact CG-CB 4.44Å; L110-A139 HydrophobicContact CD1-CB 3.97Å; L110-A139 HydrophobicContact CD2-CB 4.12Å; L136-A139 VanDerWaalsContact O-CB 3.25Å; L136-A139 WeakPolarHBondContact O-CB 3.43Å; L136-A139 PolarHBondContact O-N 3.49Å; L136-A139 VanDerWaalsContact O-N 3.1Å; Q137-A139 VanDerWaalsContact C-N 3.29Å; Q137-A139 PolarHBondContact O-N 3.02Å; A139-N142 PolarHBondContact O-N 2.97Å; A139-V143 VanDerWaalsContact O-CG2 3.31Å; A139-V143 WeakPolarHBondContact O-CG2 3.28Å; A139-V143 PolarHBondContact O-N 3.01Å
140R96.6Very high95.3Very high118 Ų11853.3 Ų53.345%0.44526%0.264SS..Hα-helixtrans-65.6-48.6-177-177.8178.8-179.8-170.9-1.4112.8L107 M138 N142 V143 L144L107-R140 HydrophobicContact CD2-CB 4.49Å; L107-R140 HydrophobicContact CD2-CG 3.78Å; M138-R140 PolarHBondContact O-N 3.49Å; R140-N142 VanDerWaalsContact C-N 3.33Å; R140-N142 PolarHBondContact O-N 3.34Å; R140-V143 PolarHBondContact O-N 3.39Å; R140-L144 HydrophobicContact CG-CD1 4.25Å; R140-L144 WeakPolarHBondContact O-CG 3.46Å; R140-L144 PolarHBondContact O-N 3.46Å
141P96.3Very high95.5Very high68 Ų6853.9 Ų53.944%0.44226%0.262SS..Hα-helixtrans-56-42.6172.2-26.234000113.7Q137 M138 L144 G145Q137-P141 WeakPolarHBondContact O-CD 3.3Å; M138-P141 WeakPolarHBondContact O-CD 3.32Å; P141-L144 PolarHBondContact O-N 3.14Å; P141-G145 PolarHBondContact O-N 3.25Å
142N96.9Very high95.6Very high77 Ų7750 Ų5041%0.41225%0.245SC..Hα-helixtrans-64-43.8179.4-72.6-22000112M138 A139 R140 G145 L146M138-N142 VanDerWaalsContact O-CB 3.31Å; M138-N142 WeakPolarHBondContact O-CB 3.45Å; M138-N142 PolarHBondContact O-N 3.02Å; M138-N142 VanDerWaalsContact O-N 3.08Å; M138-N142 PolarHBondContact O-ND2 3.46Å; M138-N142 VanDerWaalsContact O-ND2 3.08Å; A139-N142 PolarHBondContact O-N 2.97Å; R140-N142 VanDerWaalsContact C-N 3.33Å; R140-N142 PolarHBondContact O-N 3.34Å; N142-G145 PolarHBondContact O-N 3.18Å; N142-L146 PolarHBondContact O-N 3.32Å
143V97.9Very high95.6Very high0 Ų049.8 Ų49.80%024%0.243CC..Hα-helixtrans-64.8-40.9176.8173.80000111.3M49 L103 V106 L107 L110 A139 R140 L146 R147 Y198M49-V143 HydrophobicContact CE-CB 4.49Å; M49-V143 HydrophobicContact CE-CG2 3.84Å; L103-V143 HydrophobicContact CB-CG1 4.04Å; L103-V143 HydrophobicContact CD2-CG1 4.09Å; V106-V143 HydrophobicContact CG1-CG2 4.21Å; L107-V143 HydrophobicContact CD1-CG1 4.11Å; L107-V143 HydrophobicContact CD2-CB 3.88Å; L107-V143 HydrophobicContact CD2-CG1 3.66Å; L107-V143 HydrophobicContact CG-CB 4.37Å; L107-V143 HydrophobicContact CG-CG1 3.59Å; L110-V143 HydrophobicContact CD1-CG2 4.1Å; A139-V143 VanDerWaalsContact O-CG2 3.31Å; A139-V143 WeakPolarHBondContact O-CG2 3.28Å; A139-V143 PolarHBondContact O-N 3.01Å; R140-V143 PolarHBondContact O-N 3.39Å; V143-L146 PolarHBondContact O-N 3.07Å; V143-R147 WeakPolarHBondContact O-CG 3.35Å; V143-R147 PolarHBondContact O-N 3.48Å; V143-Y198 HydrophobicContact CG2-CE2 4.42Å
144L97.2Very high95.6Very high72 Ų7250.6 Ų50.638%0.37725%0.252SS..Hα-helixtrans-62-44.9174.3-72.1169000111.8L107 R140 P141 L146 R147 N148L107-L144 HydrophobicContact CD1-CD2 3.74Å; L107-L144 HydrophobicContact CD1-CG 4.39Å; L107-L144 HydrophobicContact CD2-CD2 4.22Å; L107-L144 HydrophobicContact CD2-CG 4.02Å; R140-L144 HydrophobicContact CG-CD1 4.25Å; R140-L144 WeakPolarHBondContact O-CG 3.46Å; R140-L144 PolarHBondContact O-N 3.46Å; P141-L144 PolarHBondContact O-N 3.14Å; L144-L146 VanDerWaalsContact C-N 3.32Å; L144-L146 PolarHBondContact O-N 3.21Å; L144-R147 PolarHBondContact O-N 2.77Å; L144-N148 PolarHBondContact O-N 3.32Å
145G96.1Very high95.5Very high22 Ų2248.8 Ų48.823%0.22724%0.243CC..Hα-helixtrans-58.5-42.4175.700000112.6P141 N142 N148 N149P141-G145 PolarHBondContact O-N 3.25Å; N142-G145 PolarHBondContact O-N 3.18Å; G145-N148 PolarHBondContact O-N 3.06Å; G145-N149 PolarHBondContact O-N 2.94Å
146L97.6Very high95.3Very high0 Ų047.6 Ų47.60%024%0.239CC..Hα-helixtrans-64.1-43.9174.7179.562.9000111.9L42 Q45 T46 M49 L103 N142 V143 L144 N148 N149 V150 M202L42-L146 HydrophobicContact CD2-CD1 3.59Å; Q45-L146 HydrophobicContact CB-CD1 4.22Å; T46-L146 HydrophobicContact CG2-CD1 4.3Å; T46-L146 HydrophobicContact CG2-CD2 4.38Å; M49-L146 HydrophobicContact CE-CB 4.08Å; M49-L146 HydrophobicContact CE-CD2 3.55Å; M49-L146 HydrophobicContact CE-CG 4.44Å; M49-L146 HydrophobicContact SD-CB 4.08Å; M49-L146 HydrophobicContact SD-CD2 3.73Å; M49-L146 HydrophobicContact SD-CG 4.42Å; L103-L146 HydrophobicContact CD1-CB 4.42Å; L103-L146 HydrophobicContact CD1-CD2 3.63Å; L103-L146 HydrophobicContact CD1-CG 3.82Å; L103-L146 HydrophobicContact CD2-CD2 4.05Å; L103-L146 HydrophobicContact CG-CD2 4.49Å; N142-L146 PolarHBondContact O-N 3.32Å; V143-L146 PolarHBondContact O-N 3.07Å; L144-L146 VanDerWaalsContact C-N 3.32Å; L144-L146 PolarHBondContact O-N 3.21Å; L146-N148 VanDerWaalsContact C-N 3.27Å; L146-N148 PolarHBondContact O-N 3.24Å; L146-N149 PolarHBondContact O-N 2.83Å; L146-N149 VanDerWaalsContact O-N 3.15Å; L146-V150 HydrophobicContact CD1-CG2 4.31Å; L146-V150 HydrophobicContact CG-CG2 4.33Å; L146-V150 WeakPolarHBondContact O-CG2 3.27Å; L146-V150 PolarHBondContact O-N 2.67Å; L146-M202 HydrophobicContact CD2-CE 3.46Å; L146-M202 VanDerWaalsContact CD2-CE 3.46Å; L146-M202 HydrophobicContact CD2-SD 4.38Å
147R97.6Very high95Very high76 Ų7647.7 Ų47.729%0.28724%0.24SC..Hα-helixtrans-60-38.5177.8-72.7-175.874.1-158.1-1.5112.3N100 L103 V143 L144 V150 Y151N100-R147 PolarHBondContact OD1-NE 3.05Å; N100-R147 PolarHBondContact OD1-NH2 3.26Å; N100-R147 VanDerWaalsContact OD1-NH2 3.15Å; L103-R147 HydrophobicContact CB-CG 3.61Å; L103-R147 HydrophobicContact CD1-CG 3.68Å; L103-R147 HydrophobicContact CG-CG 4.3Å; V143-R147 WeakPolarHBondContact O-CG 3.35Å; V143-R147 PolarHBondContact O-N 3.48Å; L144-R147 PolarHBondContact O-N 2.77Å; R147-V150 PolarHBondContact O-N 3.27Å; R147-Y151 PolarHBondContact O-N 2.98Å
148N96Very high94.4Very high73 Ų7345.2 Ų45.239%0.3923%0.23SC..Hα-helixtrans-62.2-45.3174.8-69.1-13.2000111.3L144 G145 L146 V150 Y151 C152L144-N148 PolarHBondContact O-N 3.32Å; G145-N148 PolarHBondContact O-N 3.06Å; L146-N148 VanDerWaalsContact C-N 3.27Å; L146-N148 PolarHBondContact O-N 3.24Å; N148-V150 VanDerWaalsContact C-N 3.35Å; N148-V150 PolarHBondContact O-N 3.14Å; N148-Y151 WeakPolarHBondContact O-CB 3.42Å; N148-Y151 PolarHBondContact O-N 3.25Å; N148-C152 PolarHBondContact O-N 2.93Å; N148-C152 PolarHBondContact O-SG 3.39Å; N148-C152 VanDerWaalsContact O-SG 3.33Å
149N95.9Very high93Very high25 Ų2545.7 Ų45.713%0.13424%0.235CC..Hα-helixtrans-65.2-37.5176.7-73.4-17000112.7L38 L42 Q45 G145 L146 C152 M153L38-N149 HydrophobicContact CD1-CB 3.94Å; L42-N149 HydrophobicContact CD2-CB 3.59Å; L42-N149 HydrophobicContact CG-CB 4.16Å; Q45-N149 VanDerWaalsContact CD-ND2 3.29Å; Q45-N149 PolarHBondContact NE2-ND2 3.38Å; Q45-N149 PolarHBondContact OE1-ND2 2.9Å; G145-N149 PolarHBondContact O-N 2.94Å; L146-N149 PolarHBondContact O-N 2.83Å; L146-N149 VanDerWaalsContact O-N 3.15Å; N149-C152 PolarHBondContact O-N 2.7Å; N149-M153 WeakPolarHBondContact O-CB 3.17Å; N149-M153 PolarHBondContact O-N 3.36Å
150V96.5Very high91.3Very high3 Ų349 Ų492%0.01826%0.258CS..Hα-helixtrans-62.5-43.1174.1168.30000111L42 L96 L99 N100 L146 R147 N148 M153 A154L42-V150 HydrophobicContact CD2-CG2 3.89Å; L96-V150 HydrophobicContact CB-CG1 4.13Å; L96-V150 HydrophobicContact CD2-CG1 4.06Å; L99-V150 HydrophobicContact CD2-CG2 3.54Å; L99-V150 HydrophobicContact CG-CG2 4.12Å; N100-V150 HydrophobicContact CB-CG1 4.06Å; L146-V150 HydrophobicContact CD1-CG2 4.31Å; L146-V150 HydrophobicContact CG-CG2 4.33Å; L146-V150 WeakPolarHBondContact O-CG2 3.27Å; L146-V150 PolarHBondContact O-N 2.67Å; R147-V150 PolarHBondContact O-N 3.27Å; N148-V150 VanDerWaalsContact C-N 3.35Å; N148-V150 PolarHBondContact O-N 3.14Å; V150-M153 PolarHBondContact O-N 2.87Å; V150-A154 PolarHBondContact O-N 3.25Å
151Y94.9Very high89.2Confident97 Ų9747.6 Ų47.638%0.3826%0.259SS..Hα-helixtrans-60.8-48.8174.4171.6-97.8000111.6M28 R147 N148 M153 A154 Q155M28-Y151 HydrophobicContact CE-CE1 4.49Å; M28-Y151 HydrophobicContact SD-CD1 4.15Å; M28-Y151 HydrophobicContact SD-CE1 3.56Å; M28-Y151 VanDerWaalsContact SD-CE1 3.56Å; R147-Y151 PolarHBondContact O-N 2.98Å; N148-Y151 WeakPolarHBondContact O-CB 3.42Å; N148-Y151 PolarHBondContact O-N 3.25Å; Y151-M153 VanDerWaalsContact C-N 3.27Å; Y151-M153 PolarHBondContact O-N 3.45Å; Y151-A154 WeakPolarHBondContact O-CB 3.5Å; Y151-A154 PolarHBondContact O-N 3.17Å; Y151-A154 VanDerWaalsContact O-N 3.15Å; Y151-Q155 HydrophobicContact CD1-CG 4.41Å; Y151-Q155 HydrophobicContact CE1-CG 3.95Å; Y151-Q155 HydrophobicContact CE2-CG 4.24Å; Y151-Q155 WeakPolarHBondContact O-CG 3.45Å; Y151-Q155 PolarHBondContact O-N 3.42Å; Y151-Q155 PolarHBondContact OH-NE2 3.4Å
152C94.2Very high86.8Confident10 Ų1052.7 Ų52.77%0.06828%0.279CS..Hα-helixtrans-60.1-37.8177.5-66.60000112.3C31 L38 N148 N149 Q155 L156C31-C152 WeakPolarHBondContact CA-SG 3.18Å; C31-C152 HydrophobicContact CB-CB 3.61Å; C31-C152 WeakPolarHBondContact CB-SG 3.43Å; C31-C152 WeakPolarHBondContact SG-CA 3.3Å; C31-C152 WeakPolarHBondContact SG-CB 3.33Å; C31-C152 CovalentContact SG-SG 2.04Å; C31-C152 PolarHBondContact SG-SG 3.4Å; L38-C152 HydrophobicContact CD1-CB 4.37Å; L38-C152 HydrophobicContact CD2-CB 3.64Å; N148-C152 PolarHBondContact O-N 2.93Å; N148-C152 PolarHBondContact O-SG 3.39Å; N148-C152 VanDerWaalsContact O-SG 3.33Å; N149-C152 PolarHBondContact O-N 2.7Å; C152-Q155 PolarHBondContact O-N 3.11Å; C152-L156 PolarHBondContact O-N 3.3Å
153M94.8Very high84.2Confident0 Ų054.8 Ų54.80%030%0.295CS..Hα-helixtrans-68.9-38.2177.7-177.759.976.400111.2Y35 L38 L39 L42 L96 N149 V150 Y151 Q155 L156 L157 W212Y35-M153 HydrophobicContact CD2-CE 4.01Å; Y35-M153 HydrophobicContact CD2-SD 3.57Å; Y35-M153 VanDerWaalsContact CD2-SD 3.57Å; Y35-M153 HydrophobicContact CE2-CE 4.03Å; Y35-M153 HydrophobicContact CE2-SD 3.55Å; Y35-M153 VanDerWaalsContact CE2-SD 3.55Å; L38-M153 HydrophobicContact CB-CE 3.99Å; L38-M153 HydrophobicContact CD2-CB 3.8Å; L38-M153 HydrophobicContact CD2-CE 4.06Å; L38-M153 VanDerWaalsContact CD2-N 3.31Å; L38-M153 HydrophobicContact CD2-SD 4.48Å; L38-M153 HydrophobicContact CG-CB 4.45Å; L38-M153 HydrophobicContact CG-CE 3.92Å; L39-M153 HydrophobicContact CB-CE 3.87Å; L42-M153 HydrophobicContact CD1-CB 3.87Å; L42-M153 HydrophobicContact CD1-CE 3.76Å; L42-M153 HydrophobicContact CD1-CG 4.01Å; L96-M153 HydrophobicContact CD1-CB 4.27Å; L96-M153 HydrophobicContact CD1-CG 3.88Å; L96-M153 HydrophobicContact CD2-CG 4.3Å; N149-M153 WeakPolarHBondContact O-CB 3.17Å; N149-M153 PolarHBondContact O-N 3.36Å; V150-M153 PolarHBondContact O-N 2.87Å; Y151-M153 VanDerWaalsContact C-N 3.27Å; Y151-M153 PolarHBondContact O-N 3.45Å; M153-Q155 VanDerWaalsContact C-N 3.35Å; M153-L156 PolarHBondContact O-N 3.05Å; M153-L157 WeakPolarHBondContact O-CG 3.44Å; M153-L157 PolarHBondContact O-N 2.98Å; M153-L157 VanDerWaalsContact O-N 3.12Å; M153-W212 HydrophobicContact CG-CZ3 4.1Å
154A93.4Very high81.4Confident28 Ų2863.5 Ų63.523%0.23134%0.335CS..Hα-helixtrans-61-45.317400000111.1L96 V150 Y151 L156 L157 D158L96-A154 HydrophobicContact CD1-CB 4.16Å; V150-A154 PolarHBondContact O-N 3.25Å; Y151-A154 WeakPolarHBondContact O-CB 3.5Å; Y151-A154 PolarHBondContact O-N 3.17Å; Y151-A154 VanDerWaalsContact O-N 3.15Å; A154-L156 VanDerWaalsContact C-N 3.3Å; A154-L156 PolarHBondContact O-N 3.08Å; A154-L157 PolarHBondContact O-N 2.93Å; A154-D158 VanDerWaalsContact O-CG 3.26Å; A154-D158 PolarHBondContact O-N 3.03Å
155Q91.1Very high79Confident68 Ų6865.1 Ų65.132%0.31835%0.35SS..Hα-helixtrans-59.3-39.7175.5-69.1-65.1-23.700112.4Y151 C152 M153 L157 D158 N159Y151-Q155 HydrophobicContact CD1-CG 4.41Å; Y151-Q155 HydrophobicContact CE1-CG 3.95Å; Y151-Q155 HydrophobicContact CE2-CG 4.24Å; Y151-Q155 WeakPolarHBondContact O-CG 3.45Å; Y151-Q155 PolarHBondContact O-N 3.42Å; Y151-Q155 PolarHBondContact OH-NE2 3.4Å; C152-Q155 PolarHBondContact O-N 3.11Å; M153-Q155 VanDerWaalsContact C-N 3.35Å; Q155-L157 PolarHBondContact O-N 3.46Å; Q155-D158 PolarHBondContact O-N 2.67Å; Q155-N159 PolarHBondContact O-N 2.62Å; Q155-N159 VanDerWaalsContact O-N 3.09Å; Q155-N159 PolarHBondContact O-ND2 3.28Å
156L90.1Very high76.3Confident37 Ų3770.7 Ų70.719%0.19438%0.38CS..Hα-helixtrans-64-39.9176.6-78.8178.7000113.1K33 L38 C152 M153 A154 S160K33-L156 WeakPolarHBondContact O-CD2 3.35Å; L38-L156 HydrophobicContact CD2-CD1 3.85Å; C152-L156 PolarHBondContact O-N 3.3Å; M153-L156 PolarHBondContact O-N 3.05Å; A154-L156 VanDerWaalsContact C-N 3.3Å; A154-L156 PolarHBondContact O-N 3.08Å; L156-S160 PolarHBondContact O-N 3.5Å; L156-S160 PolarHBondContact O-OG 2.67Å
157L87.4Confident73.8Confident11 Ų1180.4 Ų80.46%0.05842%0.422CS..Hα-helixtrans-71.1-34.6177.4-63.7176.8000111.9Y35 R92 L96 M153 A154 Q155 N159 S160 D161 W212Y35-L157 HydrophobicContact CE2-CD2 4.24Å; R92-L157 HydrophobicContact CB-CD1 3.89Å; L96-L157 HydrophobicContact CD1-CD1 3.67Å; M153-L157 WeakPolarHBondContact O-CG 3.44Å; M153-L157 PolarHBondContact O-N 2.98Å; M153-L157 VanDerWaalsContact O-N 3.12Å; A154-L157 PolarHBondContact O-N 2.93Å; Q155-L157 PolarHBondContact O-N 3.46Å; L157-N159 VanDerWaalsContact C-N 3.34Å; L157-S160 PolarHBondContact O-N 3.37Å; L157-S160 PolarHBondContact O-OG 3.25Å; L157-S160 VanDerWaalsContact O-OG 3.04Å; L157-D161 WeakPolarHBondContact O-CB 3.45Å; L157-D161 PolarHBondContact O-N 2.92Å; L157-D161 VanDerWaalsContact O-N 3.12Å; L157-W212 HydrophobicContact CD1-CH2 4.37Å; L157-W212 HydrophobicContact CD1-CZ3 4.21Å
158D81.3Confident71.2Confident57 Ų5781.1 Ų81.131%0.30545%0.445SS..Hα-helixtrans-67.2-36.2177.1-69.42.4000112.1R93 A154 Q155R93-D158 IonicContact CZ-OD1 2.81Å; R93-D158 IonicContact NH1-OD1 3.42Å; R93-D158 PolarHBondContact NH1-OD1 3.34Å; R93-D158 IonicContact NH1-OD2 3.71Å; R93-D158 PolarHBondContact NH1-OD2 3.05Å; R93-D158 IonicContact NH2-OD1 2.77Å; R93-D158 PolarHBondContact NH2-OD1 3.23Å; A154-D158 VanDerWaalsContact O-CG 3.26Å; A154-D158 PolarHBondContact O-N 3.03Å; Q155-D158 PolarHBondContact O-N 2.67Å
159N65.1Low68.4Low110 Ų11081.2 Ų81.259%0.58846%0.463SS*.Hα-helixtrans-80-21.6178.6-69.9-57.3000113.2Q155 L157Q155-N159 PolarHBondContact O-N 2.62Å; Q155-N159 VanDerWaalsContact O-N 3.09Å; Q155-N159 PolarHBondContact O-ND2 3.28Å; L157-N159 VanDerWaalsContact C-N 3.34Å
160S59.7Low65.8Low77 Ų7791.8 Ų91.854%0.53850%0.501SS..Hα-helixtrans-83-30.6174.866.60000112.8L156 L157L156-S160 PolarHBondContact O-N 3.5Å; L156-S160 PolarHBondContact O-OG 2.67Å; L157-S160 PolarHBondContact O-N 3.37Å; L157-S160 PolarHBondContact O-OG 3.25Å; L157-S160 VanDerWaalsContact O-OG 3.04Å
161D53.6Low63.4Low89 Ų8994.8 Ų94.848%0.47653%0.532SS..  trans-100.680.7-179.4-63-11.6000108.9L157 T163L157-D161 WeakPolarHBondContact O-CB 3.45Å; L157-D161 PolarHBondContact O-N 2.92Å; L157-D161 VanDerWaalsContact O-N 3.12Å; D161-T163 PolarHBondContact O-N 3.36Å
162M45.5Very low60.8Low174 Ų17496.4 Ų96.486%0.85755%0.552SS**  trans-70.265166.2-81.9-73.9177.800110.2
163T42.4Very low58.5Low121 Ų121101.7 Ų101.774%0.74259%0.587SS**SBendtrans-134128.9162.617.80000108.4D161D161-T163 PolarHBondContact O-N 3.36Å
164E39.8Very low56.2Low183 Ų183110.1 Ų110.186%0.85563%0.626SS**PPolyproline II helixtrans-50.6136.6-174.5-151.2175.5-17200112T166E164-T166 PolarHBondContact O-N 3.4Å
165P45.4Very low53.9Low106 Ų106113.8 Ų113.869%0.68865%0.647SS**PPolyproline II helixtrans-75117.4-17528.5-32.2000110.7K167P165-K167 PolarHBondContact O-N 3.01Å
166T39.2Very low52.2Low139 Ų139116.4 Ų116.485%0.85367%0.67SS**PPolyproline II helixtrans-62.8118.2161-45.80000108.4E164 A168E164-T166 PolarHBondContact O-N 3.4Å; T166-A168 PolarHBondContact O-N 3.35Å
167K45.3Very low49.8Very low205 Ų205120.3 Ų120.389%0.89170%0.696SS**  trans-62.998.7176.3-73.9-175.6178.7175.40109.8P165P165-K167 PolarHBondContact O-N 3.01Å
168A43.8Very low47.8Very low91 Ų91125.6 Ų125.675%0.75273%0.731SS**  trans-69.813116300000109T166 R170T166-A168 PolarHBondContact O-N 3.35Å; A168-R170 PolarHBondContact O-N 2.88Å
169G37.1Very low46.4Very low75 Ų75128 Ų12877%0.77375%0.748SS**  trans-52.7132-176.400000112.4G171G169-G171 VanDerWaalsContact C-N 3.33Å; G169-G171 PolarHBondContact O-N 3.18Å
170R42.3Very low45.9Very low247 Ų247128 Ų12893%0.93275%0.753SS**  trans-72.488.7175.6-156.5-178.1-144.4-1495.8107.9A168 T172A168-R170 PolarHBondContact O-N 2.88Å; R170-T172 PolarHBondContact O-N 3.15Å; R170-T172 VanDerWaalsContact O-N 3.16Å
171G44.9Very low45.9Very low66 Ų66131.3 Ų131.368%0.6877%0.771SS**  trans-63.1112165.300000108.5G169 P173G169-G171 VanDerWaalsContact C-N 3.33Å; G169-G171 PolarHBondContact O-N 3.18Å; G171-P173 WeakPolarHBondContact O-CD 3.46Å
172T39.8Very low46.7Very low130 Ų130128.6 Ų128.680%0.79876%0.759SS**  trans-58.8122.9172.8-4.60000108.4R170 Q174R170-T172 PolarHBondContact O-N 3.15Å; R170-T172 VanDerWaalsContact O-N 3.16Å; T172-Q174 PolarHBondContact O-N 3.41Å; T172-Q174 VanDerWaalsContact O-N 3.07Å
173P47.1Very low48.7Very low122 Ų122125.1 Ų125.179%0.79274%0.744SS**  trans-62.2114.3168.9-17.430.3000107.9G171G171-P173 WeakPolarHBondContact O-CD 3.46Å
174Q45.8Very low50.9Low177 Ų177123.7 Ų123.783%0.82774%0.735SS**PPolyproline II helixtrans-64129.8173.6-162.9153.9-47.600108.2T172T172-Q174 PolarHBondContact O-N 3.41Å; T172-Q174 VanDerWaalsContact O-N 3.07Å
175P46Very low53.3Low104 Ų104119.7 Ų119.768%0.67572%0.715SS**PPolyproline II helixtrans-57.9139.3175.3-19.529.9000109.5T177P175-T177 PolarHBondContact O-N 2.97Å
176P54Low55.5Low123 Ų123118.6 Ų118.680%0.79970%0.7SS**PPolyproline II helixtrans-60129.1172.624.9-30.6000108.8
177T40.3Very low58Low119 Ų119116.5 Ų116.573%0.7368%0.677SS**PPolyproline II helixtrans-56.6133.1169.9-38.80000108.2P175 T179P175-T177 PolarHBondContact O-N 2.97Å; T177-T179 PolarHBondContact O-N 3.18Å
178P45.2Very low60.3Low123 Ų123109.6 Ų109.680%0.79965%0.647SS**  trans-60.6114179.222.5-30.5000109.1
179T53.4Low62.8Low108 Ų108106 Ų10666%0.66362%0.615SS**  trans-63.5149.6170.117.20000109.5T177T177-T179 PolarHBondContact O-N 3.18Å
180P53.7Low65.5Low108 Ų108104.8 Ų104.870%0.70159%0.589SS**  trans-52.9153.7172.8-17.229000110.1S182P180-S182 VanDerWaalsContact C-N 3.3Å; P180-S182 PolarHBondContact O-N 3.33Å
181T58.5Low68Low147 Ų14793 Ų9390%0.90255%0.545SS*.  trans-60.891.8174.442.80000110.1
182S71.8Confident70.5Confident33 Ų3389.9 Ų89.923%0.23151%0.512CS..  trans-62.9133.6169.3-72.20000108.8P180 R187 E190P180-S182 VanDerWaalsContact C-N 3.3Å; P180-S182 PolarHBondContact O-N 3.33Å; S182-R187 PolarHBondContact O-NE 2.89Å; S182-R187 VanDerWaalsContact O-NE 3.16Å; S182-E190 PolarHBondContact OG-OE1 3.25Å
183D86.6Confident73.2Confident101 Ų10184.4 Ų84.454%0.5448%0.479SS..  trans-60.1167.4172.868.954.5000111.3F185 Q186 R187D183-F185 PolarHBondContact O-N 3.28Å; D183-F185 WeakPolarHBondContact OD1-CA 3.46Å; D183-F185 WeakPolarHBondContact OD1-CB 3.33Å; D183-F185 PolarHBondContact OD1-N 3.33Å; D183-Q186 PolarHBondContact O-N 2.89Å; D183-Q186 PolarHBondContact OD1-N 2.8Å; D183-R187 PolarHBondContact O-N 3.23Å
184V88.5Confident75.6Confident90 Ų9080.1 Ų80.155%0.54545%0.448SS..Hα-helixtrans-58.8-37.7-175.51770000111.6K188V184-K188 WeakPolarHBondContact O-CG 3.4Å; V184-K188 PolarHBondContact O-N 3.36Å
185F90.2Very high78.1Confident99 Ų9971.7 Ų71.743%0.43441%0.409SS..Hα-helixtrans-70.4-44.7-178.2176-100.3000111.1L65 L70 D183 R187 K188 L189L65-F185 HydrophobicContact CD2-CE2 4.49Å; L70-F185 HydrophobicContact CD1-CE2 4.18Å; L70-F185 HydrophobicContact CD1-CZ 4.48Å; L70-F185 HydrophobicContact CD2-CE2 4.21Å; L70-F185 HydrophobicContact CD2-CZ 3.67Å; D183-F185 PolarHBondContact O-N 3.28Å; D183-F185 WeakPolarHBondContact OD1-CA 3.46Å; D183-F185 WeakPolarHBondContact OD1-CB 3.33Å; D183-F185 PolarHBondContact OD1-N 3.33Å; F185-R187 VanDerWaalsContact C-N 3.31Å; F185-R187 PolarHBondContact O-N 3Å; F185-K188 WeakPolarHBondContact O-CB 3.28Å; F185-K188 PolarHBondContact O-N 3.31Å; F185-K188 VanDerWaalsContact O-N 3.13Å; F185-L189 HydrophobicContact CD1-CD1 4.15Å; F185-L189 HydrophobicContact CE1-CD1 3.54Å; F185-L189 HydrophobicContact CE1-CG 4.28Å; F185-L189 HydrophobicContact CZ-CD1 3.95Å; F185-L189 HydrophobicContact CZ-CG 4.37Å; F185-L189 PolarHBondContact O-N 2.9Å; F185-L189 VanDerWaalsContact O-N 3.17Å
186Q91.5Very high80.5Confident83 Ų8372.3 Ų72.339%0.38840%0.398SS..Hα-helixtrans-61.8-40176.5-173.463.113.100111.7D183 K188 L189 E190D183-Q186 PolarHBondContact O-N 2.89Å; D183-Q186 PolarHBondContact OD1-N 2.8Å; Q186-K188 VanDerWaalsContact C-N 3.3Å; Q186-K188 PolarHBondContact O-N 3.3Å; Q186-L189 PolarHBondContact O-N 2.67Å; Q186-L189 VanDerWaalsContact O-N 3.15Å; Q186-E190 WeakPolarHBondContact O-CG 3.41Å; Q186-E190 PolarHBondContact O-N 3.26Å
187R92.1Very high82.6Confident96 Ų9666.5 Ų66.536%0.36236%0.36SS..Hα-helixtrans-60.9-36.5174.6-77-173.3-78.7153-6.3113.1H116 S182 D183 F185 E190 G191H116-R187 PolarHBondContact CD2-NH1 3.34Å; H116-R187 PolarHBondContact NE2-NH1 3.07Å; S182-R187 PolarHBondContact O-NE 2.89Å; S182-R187 VanDerWaalsContact O-NE 3.16Å; D183-R187 PolarHBondContact O-N 3.23Å; F185-R187 VanDerWaalsContact C-N 3.31Å; F185-R187 PolarHBondContact O-N 3Å; R187-E190 PolarHBondContact O-N 2.83Å; R187-G191 PolarHBondContact O-N 2.88Å
188K94.4Very high85.4Confident60 Ų6061.1 Ų61.126%0.26133%0.326SS..Hα-helixtrans-63.7-44173.7-67.9174.7174.3-156.50111.5Y59 Q63 L65 V184 F185 Q186 G191 C192Y59-K188 WeakPolarHBondContact CE1-O 3.44Å; Y59-K188 PolarHBondContact OH-O 3.14Å; Q63-K188 HydrophobicContact CB-CD 4.23Å; Q63-K188 HydrophobicContact CB-CG 4.36Å; Q63-K188 HydrophobicContact CG-CG 4.47Å; Q63-K188 PolarHBondContact O-NZ 3.05Å; L65-K188 HydrophobicContact CD1-CB 4.21Å; L65-K188 HydrophobicContact CD2-CB 4.3Å; V184-K188 WeakPolarHBondContact O-CG 3.4Å; V184-K188 PolarHBondContact O-N 3.36Å; F185-K188 WeakPolarHBondContact O-CB 3.28Å; F185-K188 PolarHBondContact O-N 3.31Å; F185-K188 VanDerWaalsContact O-N 3.13Å; Q186-K188 VanDerWaalsContact C-N 3.3Å; Q186-K188 PolarHBondContact O-N 3.3Å; K188-G191 PolarHBondContact O-N 3.18Å; K188-C192 PolarHBondContact O-N 3.48Å
189L94.8Very high87.9Confident15 Ų1555.6 Ų55.68%0.07929%0.29CS..Hα-helixtrans-65.1-41.2176.9-69178.6000112.3L65 H73 F185 Q186 G191 C192 S193L65-L189 HydrophobicContact CD1-CD2 4.48Å; L65-L189 HydrophobicContact CD2-CD2 4.12Å; H73-L189 HydrophobicContact CB-CD2 4.09Å; F185-L189 HydrophobicContact CD1-CD1 4.15Å; F185-L189 HydrophobicContact CE1-CD1 3.54Å; F185-L189 HydrophobicContact CE1-CG 4.28Å; F185-L189 HydrophobicContact CZ-CD1 3.95Å; F185-L189 HydrophobicContact CZ-CG 4.37Å; F185-L189 PolarHBondContact O-N 2.9Å; F185-L189 VanDerWaalsContact O-N 3.17Å; Q186-L189 PolarHBondContact O-N 2.67Å; Q186-L189 VanDerWaalsContact O-N 3.15Å; L189-G191 VanDerWaalsContact C-N 3.35Å; L189-C192 WeakPolarHBondContact O-CB 3.39Å; L189-C192 PolarHBondContact O-N 3.32Å; L189-S193 WeakPolarHBondContact O-CB 3.44Å; L189-S193 PolarHBondContact O-N 2.88Å; L189-S193 PolarHBondContact O-OG 3.3Å
190E94.4Very high90.1Very high50 Ų5054.1 Ų54.123%0.23427%0.272CS..Hα-helixtrans-61.6-42.5173.8-73.8176.8-154.400111.9R109 S182 Q186 R187 C192 S193 F194R109-E190 IonicContact NH2-OE2 2.67Å; R109-E190 PolarHBondContact NH2-OE2 3.38Å; S182-E190 PolarHBondContact OG-OE1 3.25Å; Q186-E190 WeakPolarHBondContact O-CG 3.41Å; Q186-E190 PolarHBondContact O-N 3.26Å; R187-E190 PolarHBondContact O-N 2.83Å; E190-C192 VanDerWaalsContact C-N 3.34Å; E190-C192 PolarHBondContact O-N 3.02Å; E190-S193 PolarHBondContact O-N 2.95Å; E190-F194 WeakPolarHBondContact O-CB 3.04Å; E190-F194 PolarHBondContact O-N 2.95Å
191G95.6Very high92.2Very high0 Ų049 Ų490%024%0.239CC..Hα-helixtrans-60.5-44175.300000112.2R187 K188 L189 F194 L195R187-G191 PolarHBondContact O-N 2.88Å; K188-G191 PolarHBondContact O-N 3.18Å; L189-G191 VanDerWaalsContact C-N 3.35Å; G191-F194 PolarHBondContact O-N 3.37Å; G191-L195 WeakPolarHBondContact O-CG 3.43Å; G191-L195 PolarHBondContact O-N 3.14Å
192C96.1Very high94.1Very high0 Ų042 Ų420%020%0.196CC..Hα-helixtrans-62-45.2176-162.80000112.4L56 Y59 I60 L65 C74 K188 L189 E190 F194 L195 R196L56-C192 WeakPolarHBondContact CD1-O 3.41Å; Y59-C192 HydrophobicContact CD1-CB 4.22Å; Y59-C192 HydrophobicContact CE1-CB 3.97Å; Y59-C192 VanDerWaalsContact CE1-N 3.34Å; I60-C192 WeakPolarHBondContact CG1-SG 3.36Å; L65-C192 HydrophobicContact CD1-CB 3.97Å; C74-C192 HydrophobicContact CB-CB 3.88Å; C74-C192 WeakPolarHBondContact CB-SG 3.44Å; C74-C192 WeakPolarHBondContact SG-CB 3.2Å; C74-C192 CovalentContact SG-SG 2.02Å; C74-C192 PolarHBondContact SG-SG 3.38Å; K188-C192 PolarHBondContact O-N 3.48Å; L189-C192 WeakPolarHBondContact O-CB 3.39Å; L189-C192 PolarHBondContact O-N 3.32Å; E190-C192 VanDerWaalsContact C-N 3.34Å; E190-C192 PolarHBondContact O-N 3.02Å; C192-F194 PolarHBondContact O-N 3.37Å; C192-L195 PolarHBondContact O-N 3.44Å; C192-R196 PolarHBondContact O-N 2.63Å
193S96.7Very high95.4Very high14 Ų1444.5 Ų44.510%0.09820%0.204CC..Hα-helixtrans-61.4-43.4177.7-610000111.9R75 L189 E190 R196 G197R75-S193 WeakPolarHBondContact O-CA 3.36Å; R75-S193 WeakPolarHBondContact O-CB 3.25Å; R75-S193 PolarHBondContact O-OG 2.74Å; R75-S193 VanDerWaalsContact O-OG 3.09Å; L189-S193 WeakPolarHBondContact O-CB 3.44Å; L189-S193 PolarHBondContact O-N 2.88Å; L189-S193 PolarHBondContact O-OG 3.3Å; E190-S193 PolarHBondContact O-N 2.95Å; S193-R196 PolarHBondContact O-N 3.12Å; S193-G197 PolarHBondContact O-N 3.27Å
194F97.6Very high96Very high32 Ų3239.9 Ų39.914%0.1418%0.179CC..Hα-helixtrans-60.5-50173.9163.3-99.6000111.9F81 V106 R109 L110 L113 E190 G191 C192 R196 G197 Y198F81-F194 HydrophobicContact CE1-CE2 4.49Å; F81-F194 HydrophobicContact CE2-CD2 4.08Å; F81-F194 HydrophobicContact CE2-CE2 4.31Å; F81-F194 WeakPolarHBondContact CE2-O 3.44Å; F81-F194 AromaticContact CZ-CD2 3.81Å; F81-F194 HydrophobicContact CZ-CD2 3.81Å; F81-F194 AromaticContact CZ-CE2 3.58Å; F81-F194 HydrophobicContact CZ-CE2 3.58Å; F81-F194 HydrophobicContact CZ-CZ 4.39Å; V106-F194 HydrophobicContact CB-CZ 4.32Å; V106-F194 HydrophobicContact CG1-CZ 4.17Å; V106-F194 HydrophobicContact CG2-CE2 4.37Å; V106-F194 HydrophobicContact CG2-CZ 4.18Å; R109-F194 HydrophobicContact CB-CD2 4.36Å; R109-F194 HydrophobicContact CB-CE1 3.96Å; R109-F194 HydrophobicContact CB-CE2 3.76Å; R109-F194 HydrophobicContact CB-CZ 3.55Å; R109-F194 HydrophobicContact CG-CD1 3.76Å; R109-F194 HydrophobicContact CG-CD2 3.76Å; R109-F194 HydrophobicContact CG-CE1 3.69Å; R109-F194 HydrophobicContact CG-CE2 3.69Å; R109-F194 HydrophobicContact CG-CG 3.79Å; R109-F194 HydrophobicContact CG-CZ 3.66Å; L110-F194 HydrophobicContact CD2-CE1 4.4Å; L113-F194 HydrophobicContact CD1-CD1 3.74Å; L113-F194 HydrophobicContact CD1-CE1 4.03Å; E190-F194 WeakPolarHBondContact O-CB 3.04Å; E190-F194 PolarHBondContact O-N 2.95Å; G191-F194 PolarHBondContact O-N 3.37Å; C192-F194 PolarHBondContact O-N 3.37Å; F194-R196 VanDerWaalsContact C-N 3.3Å; F194-R196 PolarHBondContact O-N 3.37Å; F194-G197 PolarHBondContact O-N 2.97Å; F194-Y198 PolarHBondContact O-N 2.93Å
195L97.9Very high96.5Very high1 Ų135.6 Ų35.61%0.00515%0.153CC..Hα-helixtrans-63.6-36.8-179.2-70.9-179.6000112L55 L56 Y59 L110 L113 G191 C192 Y198 H199L55-L195 HydrophobicContact CD1-CD1 4.49Å; L55-L195 HydrophobicContact CD1-CD2 4.31Å; L55-L195 HydrophobicContact CD2-CD2 3.7Å; L55-L195 HydrophobicContact CG-CD1 4.29Å; L55-L195 HydrophobicContact CG-CD2 3.83Å; L56-L195 HydrophobicContact CB-CB 4.37Å; L56-L195 HydrophobicContact CD1-CB 3.83Å; Y59-L195 VanDerWaalsContact CB-CD1 3.48Å; Y59-L195 HydrophobicContact CD1-CD1 3.88Å; Y59-L195 HydrophobicContact CD2-CD1 3.72Å; Y59-L195 HydrophobicContact CE2-CD1 4.42Å; Y59-L195 HydrophobicContact CG-CD1 3.41Å; Y59-L195 VanDerWaalsContact CG-CD1 3.41Å; L110-L195 HydrophobicContact CD2-CD2 4Å; L113-L195 HydrophobicContact CD1-CD2 4.26Å; L113-L195 HydrophobicContact CD1-CG 4.23Å; G191-L195 WeakPolarHBondContact O-CG 3.43Å; G191-L195 PolarHBondContact O-N 3.14Å; C192-L195 PolarHBondContact O-N 3.44Å; L195-Y198 WeakPolarHBondContact O-CB 3.48Å; L195-Y198 PolarHBondContact O-N 3.04Å; L195-H199 PolarHBondContact O-CD2 2.91Å; L195-H199 PolarHBondContact O-N 3.41Å
196R97.9Very high96.8Very high117 Ų11731.1 Ų31.144%0.44214%0.135SC..Hα-helixtrans-63.2-44.9173.9-169.6167.9-174.2169.51.6112.2L56 C74 C192 S193 F194 Y198 H199 R200L56-R196 HydrophobicContact CD1-CB 4.44Å; L56-R196 HydrophobicContact CD2-CB 3.96Å; L56-R196 HydrophobicContact CD2-CG 4.14Å; C74-R196 WeakPolarHBondContact O-CD 3.48Å; C74-R196 PolarHBondContact O-NH1 3.46Å; C192-R196 PolarHBondContact O-N 2.63Å; S193-R196 PolarHBondContact O-N 3.12Å; F194-R196 VanDerWaalsContact C-N 3.3Å; F194-R196 PolarHBondContact O-N 3.37Å; R196-Y198 VanDerWaalsContact C-N 3.3Å; R196-Y198 PolarHBondContact O-N 3Å; R196-H199 PolarHBondContact O-N 3.36Å; R196-R200 PolarHBondContact O-N 3.15Å; R196-R200 VanDerWaalsContact O-N 3.1Å
197G98.1Very high97.1Very high0 Ų032.1 Ų32.10%014%0.135CC..Hα-helixtrans-61.2-39.1173.900000112.6E76 S193 F194 R200 F201E76-G197 VanDerWaalsContact CD-CA 3.45Å; S193-G197 PolarHBondContact O-N 3.27Å; F194-G197 PolarHBondContact O-N 2.97Å; G197-R200 PolarHBondContact O-N 3.32Å; G197-F201 VanDerWaalsContact O-CB 3.31Å; G197-F201 WeakPolarHBondContact O-CB 3.42Å; G197-F201 PolarHBondContact O-N 3.34Å
198Y98.4Very high97.4Very high6 Ų627.9 Ų27.92%0.02412%0.12CC..Hα-helixtrans-60.6-47.1175.4165.6-103.9000112.2M49 L55 F81 V106 V143 F194 L195 R196 R200 F201 M202M49-Y198 WeakPolarHBondContact CE-OH 3.04Å; L55-Y198 HydrophobicContact CD2-CD1 3.95Å; L55-Y198 HydrophobicContact CD2-CE1 3.73Å; F81-Y198 VanDerWaalsContact CE2-N 3.3Å; V106-Y198 HydrophobicContact CG1-CD2 3.9Å; V106-Y198 HydrophobicContact CG1-CE2 3.9Å; V106-Y198 HydrophobicContact CG2-CD2 3.87Å; V106-Y198 HydrophobicContact CG2-CE2 4.39Å; V143-Y198 HydrophobicContact CG2-CE2 4.42Å; F194-Y198 PolarHBondContact O-N 2.93Å; L195-Y198 WeakPolarHBondContact O-CB 3.48Å; L195-Y198 PolarHBondContact O-N 3.04Å; R196-Y198 VanDerWaalsContact C-N 3.3Å; R196-Y198 PolarHBondContact O-N 3Å; Y198-R200 PolarHBondContact O-N 3.21Å; Y198-F201 WeakPolarHBondContact O-CB 3.26Å; Y198-F201 PolarHBondContact O-N 3.17Å; Y198-M202 HydrophobicContact CD2-CG 3.98Å; Y198-M202 HydrophobicContact CD2-SD 4.45Å; Y198-M202 HydrophobicContact CE1-CG 4.16Å; Y198-M202 HydrophobicContact CE2-CG 3.52Å; Y198-M202 HydrophobicContact CE2-SD 3.77Å; Y198-M202 WeakPolarHBondContact O-CG 3.45Å; Y198-M202 PolarHBondContact O-N 3.38Å
199H98.5Very high97.5Very high8 Ų825 Ų254%0.03711%0.107CC..Hα-helixtrans-63-42.3177.1-74.1-67.2000112.4M49 Q50 D51 T52 L56 L195 R196 F201 M202 H203M49-H199 PolarHBondContact O-CE1 3.46Å; M49-H199 PolarHBondContact O-ND1 2.95Å; Q50-H199 PolarHBondContact O-ND1 3.07Å; D51-H199 PolarHBondContact O-CE1 3.33Å; T52-H199 HydrophobicContact CG2-CB 4.18Å; L56-H199 VanDerWaalsContact CB-CD2 3.49Å; L56-H199 WeakPolarHBondContact CB-CD2 3.46Å; L56-H199 WeakPolarHBondContact CB-NE2 3.42Å; L56-H199 PolarHBondContact N-NE2 2.85Å; L195-H199 PolarHBondContact O-CD2 2.91Å; L195-H199 PolarHBondContact O-N 3.41Å; R196-H199 PolarHBondContact O-N 3.36Å; H199-F201 VanDerWaalsContact C-N 3.32Å; H199-F201 PolarHBondContact O-N 2.91Å; H199-M202 PolarHBondContact O-N 2.94Å; H199-H203 PolarHBondContact O-N 3.38Å
200R98.3Very high97.5Very high77 Ų7725.9 Ų25.929%0.29111%0.114SC..Hα-helixtrans-58.9-45.2174-169.5-83.4-72.2176.4-3111.1E76 F81 P82 R196 G197 Y198 H203 S204E76-R200 VanDerWaalsContact CD-NH2 3.33Å; E76-R200 IonicContact OE1-CZ 2.74Å; E76-R200 VanDerWaalsContact OE1-CZ 3.32Å; E76-R200 IonicContact OE1-NE 3.8Å; E76-R200 PolarHBondContact OE1-NE 2.77Å; E76-R200 IonicContact OE1-NH2 3.82Å; E76-R200 PolarHBondContact OE1-NH2 3.29Å; E76-R200 IonicContact OE2-CZ 3.64Å; E76-R200 IonicContact OE2-NE 2.62Å; E76-R200 PolarHBondContact OE2-NE 3Å; E76-R200 IonicContact OE2-NH2 3.48Å; E76-R200 PolarHBondContact OE2-NH2 3.35Å; F81-R200 PolarHBondContact O-NH2 3.05Å; P82-R200 PolarHBondContact O-NH1 2.81Å; R196-R200 PolarHBondContact O-N 3.15Å; R196-R200 VanDerWaalsContact O-N 3.1Å; G197-R200 PolarHBondContact O-N 3.32Å; Y198-R200 PolarHBondContact O-N 3.21Å; R200-H203 WeakPolarHBondContact O-CB 3.43Å; R200-H203 PolarHBondContact O-N 2.04Å; R200-S204 PolarHBondContact O-N 2.81Å; R200-S204 VanDerWaalsContact O-N 3.1Å; R200-S204 PolarHBondContact O-OG 3.48Å
201F98.6Very high97.5Very high0 Ų027.8 Ų27.80%012%0.122CC..Hα-helixtrans-59.8-46.6175.5169.7-107.9000112.1F81 P82 L87 L99 T102 G197 Y198 H199 H203 S204 V205F81-F201 HydrophobicContact CB-CB 3.82Å; F81-F201 HydrophobicContact CB-CD2 4.22Å; F81-F201 HydrophobicContact CB-CG 4.21Å; F81-F201 HydrophobicContact CD1-CB 3.69Å; F81-F201 HydrophobicContact CD1-CD1 4.01Å; F81-F201 HydrophobicContact CD1-CD2 4.27Å; F81-F201 AromaticContact CD1-CG 3.72Å; F81-F201 HydrophobicContact CD1-CG 3.72Å; F81-F201 HydrophobicContact CE1-CB 4.46Å; F81-F201 HydrophobicContact CE1-CD1 4.43Å; F81-F201 HydrophobicContact CG-CB 3.85Å; F81-F201 HydrophobicContact CG-CG 4.28Å; P82-F201 HydrophobicContact CB-CE2 4.47Å; P82-F201 HydrophobicContact CG-CE2 4.19Å; L87-F201 HydrophobicContact CD1-CD2 4.08Å; L87-F201 HydrophobicContact CD1-CE2 3.85Å; L87-F201 HydrophobicContact CD2-CE2 4.23Å; L99-F201 HydrophobicContact CD1-CE1 3.84Å; L99-F201 HydrophobicContact CD1-CZ 3.65Å; T102-F201 HydrophobicContact CG2-CD1 4.25Å; T102-F201 HydrophobicContact CG2-CE1 3.72Å; T102-F201 HydrophobicContact CG2-CE2 4.06Å; T102-F201 HydrophobicContact CG2-CZ 3.61Å; G197-F201 VanDerWaalsContact O-CB 3.31Å; G197-F201 WeakPolarHBondContact O-CB 3.42Å; G197-F201 PolarHBondContact O-N 3.34Å; Y198-F201 WeakPolarHBondContact O-CB 3.26Å; Y198-F201 PolarHBondContact O-N 3.17Å; H199-F201 VanDerWaalsContact C-N 3.32Å; H199-F201 PolarHBondContact O-N 2.91Å; F201-H203 VanDerWaalsContact C-N 3.3Å; F201-H203 PolarHBondContact O-N 3.12Å; F201-S204 WeakPolarHBondContact O-CB 3.25Å; F201-S204 PolarHBondContact O-N 3.5Å; F201-S204 VanDerWaalsContact O-N 3.14Å; F201-V205 HydrophobicContact CD1-CG2 4.3Å; F201-V205 HydrophobicContact CD2-CG2 4.12Å; F201-V205 HydrophobicContact CE1-CG2 3.87Å; F201-V205 HydrophobicContact CE2-CG2 3.68Å; F201-V205 HydrophobicContact CG-CG2 4.41Å; F201-V205 HydrophobicContact CZ-CG2 3.54Å; F201-V205 VanDerWaalsContact O-CG2 3.3Å; F201-V205 WeakPolarHBondContact O-CG2 3.46Å; F201-V205 PolarHBondContact O-N 2.88Å
202M98.8Very high97.3Very high0 Ų028.8 Ų28.80%013%0.126CC..Hα-helixtrans-63.1-36178.3-68.7-49.6-56.800112.5T46 M49 Q50 L103 L146 Y198 H199 V205 G206T46-M202 HydrophobicContact CG2-CE 3.62Å; M49-M202 HydrophobicContact CB-CB 4.22Å; M49-M202 HydrophobicContact CB-CE 3.81Å; M49-M202 HydrophobicContact CB-CG 3.97Å; M49-M202 HydrophobicContact CE-CE 3.84Å; M49-M202 HydrophobicContact CE-SD 4.29Å; M49-M202 HydrophobicContact CG-CE 4.48Å; M49-M202 HydrophobicContact SD-CE 3.93Å; Q50-M202 HydrophobicContact CB-CB 4.29Å; L103-M202 HydrophobicContact CD2-SD 4.15Å; L146-M202 HydrophobicContact CD2-CE 3.46Å; L146-M202 VanDerWaalsContact CD2-CE 3.46Å; L146-M202 HydrophobicContact CD2-SD 4.38Å; Y198-M202 HydrophobicContact CD2-CG 3.98Å; Y198-M202 HydrophobicContact CD2-SD 4.45Å; Y198-M202 HydrophobicContact CE1-CG 4.16Å; Y198-M202 HydrophobicContact CE2-CG 3.52Å; Y198-M202 HydrophobicContact CE2-SD 3.77Å; Y198-M202 WeakPolarHBondContact O-CG 3.45Å; Y198-M202 PolarHBondContact O-N 3.38Å; H199-M202 PolarHBondContact O-N 2.94Å; M202-V205 PolarHBondContact O-N 3.49Å; M202-G206 PolarHBondContact O-N 2.78Å
203H98.5Very high96.4Very high86 Ų8629.7 Ų29.740%0.39814%0.135SC..Hα-helixtrans-58.4-50.9170.3178.574.5000111.5Q50 H199 R200 F201 V205 G206 R207Q50-H203 HydrophobicContact CB-CB 4.05Å; Q50-H203 PolarHBondContact OE1-ND1 3.41Å; H199-H203 PolarHBondContact O-N 3.38Å; R200-H203 WeakPolarHBondContact O-CB 3.43Å; R200-H203 PolarHBondContact O-N 2.04Å; F201-H203 VanDerWaalsContact C-N 3.3Å; F201-H203 PolarHBondContact O-N 3.12Å; H203-V205 VanDerWaalsContact C-N 3.32Å; H203-V205 PolarHBondContact O-N 2.95Å; H203-G206 PolarHBondContact O-N 3.04Å; H203-R207 WeakPolarHBondContact O-CG 3.36Å; H203-R207 PolarHBondContact O-N 3.49Å
204S98.6Very high94.9Very high4 Ų434.5 Ų34.53%0.02816%0.156CC..Hα-helixtrans-60.5-40.3177.7-59.60000112.5R200 F201 R207 V208R200-S204 PolarHBondContact O-N 2.81Å; R200-S204 VanDerWaalsContact O-N 3.1Å; R200-S204 PolarHBondContact O-OG 3.48Å; F201-S204 WeakPolarHBondContact O-CB 3.25Å; F201-S204 PolarHBondContact O-N 3.5Å; F201-S204 VanDerWaalsContact O-N 3.14Å; S204-R207 WeakPolarHBondContact O-CB 3.49Å; S204-R207 PolarHBondContact O-N 3.18Å; S204-V208 PolarHBondContact O-N 3.32Å
205V98.6Very high92.5Very high0 Ų035.2 Ų35.20%017%0.165CC..Hα-helixtrans-61.9-47.7175.8169.10000111.1T46 L87 F95 L99 F201 M202 H203 R207 V208 F209T46-V205 HydrophobicContact CG2-CB 4.49Å; T46-V205 HydrophobicContact CG2-CG1 3.6Å; L87-V205 HydrophobicContact CD1-CG2 4.02Å; F95-V205 HydrophobicContact CZ-CB 4.47Å; F95-V205 HydrophobicContact CZ-CG1 3.97Å; L99-V205 HydrophobicContact CD1-CG1 3.96Å; L99-V205 HydrophobicContact CD1-CG2 3.81Å; L99-V205 HydrophobicContact CD2-CG1 3.89Å; F201-V205 HydrophobicContact CD1-CG2 4.3Å; F201-V205 HydrophobicContact CD2-CG2 4.12Å; F201-V205 HydrophobicContact CE1-CG2 3.87Å; F201-V205 HydrophobicContact CE2-CG2 3.68Å; F201-V205 HydrophobicContact CG-CG2 4.41Å; F201-V205 HydrophobicContact CZ-CG2 3.54Å; F201-V205 VanDerWaalsContact O-CG2 3.3Å; F201-V205 WeakPolarHBondContact O-CG2 3.46Å; F201-V205 PolarHBondContact O-N 2.88Å; M202-V205 PolarHBondContact O-N 3.49Å; H203-V205 VanDerWaalsContact C-N 3.32Å; H203-V205 PolarHBondContact O-N 2.95Å; V205-R207 PolarHBondContact O-N 3.24Å; V205-V208 PolarHBondContact O-N 3.19Å; V205-V208 VanDerWaalsContact O-N 3.14Å; V205-F209 HydrophobicContact CG1-CD2 3.73Å; V205-F209 HydrophobicContact CG1-CE2 3.51Å; V205-F209 WeakPolarHBondContact O-CD2 3.48Å; V205-F209 PolarHBondContact O-N 2.76Å
206G97.9Very high90Very high4 Ų441.4 Ų41.44%0.04121%0.205CC..Hα-helixtrans-58.6-37.5175.400000111.8T46 M202 H203 V208 F209 S210T46-G206 WeakPolarHBondContact OG1-CA 3.47Å; M202-G206 PolarHBondContact O-N 2.78Å; H203-G206 PolarHBondContact O-N 3.04Å; G206-V208 PolarHBondContact O-N 3.03Å; G206-F209 PolarHBondContact O-N 3.03Å; G206-S210 WeakPolarHBondContact O-CB 3.25Å; G206-S210 PolarHBondContact O-N 3.46Å
207R97.8Very high87.4Confident104 Ų10443.4 Ų43.439%0.39223%0.225SC..Hα-helixtrans-64.7-39.1175.5-69.5-8650.3170.6-2.3113.4H203 S204 V205 S210H203-R207 WeakPolarHBondContact O-CG 3.36Å; H203-R207 PolarHBondContact O-N 3.49Å; S204-R207 WeakPolarHBondContact O-CB 3.49Å; S204-R207 PolarHBondContact O-N 3.18Å; V205-R207 PolarHBondContact O-N 3.24Å; R207-S210 PolarHBondContact NH2-OG 3Å; R207-S210 PolarHBondContact O-OG 2.98Å
208V97.4Very high84.8Confident8 Ų853.9 Ų53.95%0.04826%0.264CS..Hα-helixtrans-65-49.1172.7176.40000110.9L87 R88 F95 S204 V205 G206 S210 K211L87-V208 HydrophobicContact CB-CG2 4.03Å; R88-V208 HydrophobicContact CG-CG2 3.89Å; F95-V208 HydrophobicContact CD1-CG1 4.25Å; F95-V208 HydrophobicContact CD2-CB 4.31Å; F95-V208 HydrophobicContact CD2-CG1 3.78Å; F95-V208 HydrophobicContact CD2-CG2 4.42Å; F95-V208 HydrophobicContact CE1-CB 4.5Å; F95-V208 HydrophobicContact CE1-CG1 4.02Å; F95-V208 HydrophobicContact CE2-CB 3.61Å; F95-V208 HydrophobicContact CE2-CG1 3.54Å; F95-V208 HydrophobicContact CE2-CG2 3.85Å; F95-V208 HydrophobicContact CG-CG1 4.12Å; F95-V208 HydrophobicContact CZ-CB 3.71Å; F95-V208 HydrophobicContact CZ-CG1 3.65Å; F95-V208 HydrophobicContact CZ-CG2 4.43Å; S204-V208 PolarHBondContact O-N 3.32Å; V205-V208 PolarHBondContact O-N 3.19Å; V205-V208 VanDerWaalsContact O-N 3.14Å; G206-V208 PolarHBondContact O-N 3.03Å; V208-S210 VanDerWaalsContact C-N 3.3Å; V208-S210 PolarHBondContact O-N 3.21Å; V208-K211 PolarHBondContact O-N 3.09Å; V208-K211 VanDerWaalsContact O-N 3.07Å
209F97.1Very high82.1Confident0 Ų057.6 Ų57.60%029%0.291CS..Hα-helixtrans-62.1-34.2179.7-77.7-53.5000113.6L39 L42 Q43 T46 F95 L96 L99 V205 G206 K211 W212L39-F209 HydrophobicContact CD1-CB 4.31Å; L39-F209 HydrophobicContact CD1-CD1 3.9Å; L39-F209 HydrophobicContact CD1-CG 4.48Å; L42-F209 HydrophobicContact CB-CD1 4.46Å; L42-F209 HydrophobicContact CB-CD2 4.33Å; L42-F209 HydrophobicContact CB-CE1 4.3Å; L42-F209 HydrophobicContact CB-CE2 4.16Å; L42-F209 HydrophobicContact CB-CG 4.47Å; L42-F209 HydrophobicContact CB-CZ 4.14Å; L42-F209 HydrophobicContact CD1-CD1 4.46Å; L42-F209 HydrophobicContact CD1-CE1 3.76Å; L42-F209 HydrophobicContact CD1-CZ 3.91Å; L42-F209 HydrophobicContact CD2-CE2 4.37Å; L42-F209 HydrophobicContact CD2-CZ 4.04Å; L42-F209 HydrophobicContact CG-CE1 4.48Å; L42-F209 HydrophobicContact CG-CZ 4.26Å; Q43-F209 HydrophobicContact CG-CB 3.85Å; Q43-F209 PolarHBondContact NE2-O 3.46Å; T46-F209 HydrophobicContact CG2-CD2 3.89Å; T46-F209 HydrophobicContact CG2-CE2 3.95Å; F95-F209 HydrophobicContact CD1-CE1 4.39Å; F95-F209 HydrophobicContact CE1-CD1 4.02Å; F95-F209 HydrophobicContact CE1-CD2 4.37Å; F95-F209 AromaticContact CE1-CE1 3.57Å; F95-F209 HydrophobicContact CE1-CE1 3.57Å; F95-F209 AromaticContact CE1-CE2 3.97Å; F95-F209 HydrophobicContact CE1-CE2 3.97Å; F95-F209 HydrophobicContact CE1-CG 4.4Å; F95-F209 AromaticContact CE1-CZ 3.55Å; F95-F209 HydrophobicContact CE1-CZ 3.55Å; F95-F209 HydrophobicContact CZ-CD2 4.39Å; F95-F209 HydrophobicContact CZ-CE1 4.46Å; F95-F209 HydrophobicContact CZ-CE2 4.19Å; F95-F209 HydrophobicContact CZ-CZ 4.23Å; L96-F209 HydrophobicContact CD2-CE1 4.05Å; L96-F209 HydrophobicContact CD2-CZ 4.1Å; L99-F209 HydrophobicContact CD2-CE2 3.79Å; L99-F209 HydrophobicContact CD2-CZ 3.73Å; V205-F209 HydrophobicContact CG1-CD2 3.73Å; V205-F209 HydrophobicContact CG1-CE2 3.51Å; V205-F209 WeakPolarHBondContact O-CD2 3.48Å; V205-F209 PolarHBondContact O-N 2.76Å; G206-F209 PolarHBondContact O-N 3.03Å; F209-K211 PolarHBondContact O-N 3.2Å; F209-K211 VanDerWaalsContact O-N 3.17Å; F209-W212 HydrophobicContact CD1-CD2 4.21Å; F209-W212 HydrophobicContact CD1-CE3 4.2Å; F209-W212 HydrophobicContact CE1-CE3 4.35Å; F209-W212 HydrophobicContact CE1-CH2 4.42Å; F209-W212 HydrophobicContact CE1-CZ3 4.23Å; F209-W212 WeakPolarHBondContact O-CB 3.5Å; F209-W212 PolarHBondContact O-N 3.22Å
210S95.1Very high79.6Confident32 Ų3268.1 Ų68.122%0.22433%0.331CS..Hα-helixtrans-57.7-30.5176.372.30000112.5G206 R207 V208G206-S210 WeakPolarHBondContact O-CB 3.25Å; G206-S210 PolarHBondContact O-N 3.46Å; R207-S210 PolarHBondContact NH2-OG 3Å; R207-S210 PolarHBondContact O-OG 2.98Å; V208-S210 VanDerWaalsContact C-N 3.3Å; V208-S210 PolarHBondContact O-N 3.21Å
211K94.4Very high77Confident90 Ų9075.1 Ų75.139%0.39136%0.357SS..Hα-helixtrans-82.4-15.7178.5-64.4-53.9-169.8178.80114.2V208 F209 G213 E214V208-K211 PolarHBondContact O-N 3.09Å; V208-K211 VanDerWaalsContact O-N 3.07Å; F209-K211 PolarHBondContact O-N 3.2Å; F209-K211 VanDerWaalsContact O-N 3.17Å; K211-G213 PolarHBondContact O-N 3.34Å; K211-E214 WeakPolarHBondContact CD-OE1 3.42Å; K211-E214 VanDerWaalsContact CD-OE2 3.26Å; K211-E214 WeakPolarHBondContact CD-OE2 3.44Å; K211-E214 IonicContact NZ-OE1 3.13Å; K211-E214 PolarHBondContact NZ-OE1 2.87Å; K211-E214 IonicContact NZ-OE2 3.74Å; K211-E214 PolarHBondContact NZ-OE2 3.21Å; K211-E214 PolarHBondContact O-N 3.2Å
212W91.3Very high74.3Confident22 Ų2283.1 Ų83.18%0.08339%0.394CS..Hα-helixtrans-73.8-16.9178-73.728.3000113.4Y35 L39 R92 F95 L96 M153 L157 F209Y35-W212 PolarHBondContact OH-O 3.49Å; L39-W212 HydrophobicContact CD1-CB 3.89Å; L39-W212 HydrophobicContact CD1-CE3 4.36Å; L39-W212 HydrophobicContact CD2-CB 3.87Å; R92-W212 HydrophobicContact CB-CH2 3.61Å; R92-W212 HydrophobicContact CB-CZ2 3.71Å; R92-W212 HydrophobicContact CB-CZ3 4.32Å; R92-W212 HydrophobicContact CG-CD2 4.33Å; R92-W212 HydrophobicContact CG-CH2 3.85Å; R92-W212 HydrophobicContact CG-CZ2 3.63Å; R92-W212 HydrophobicContact CG-CZ3 4.31Å; F95-W212 HydrophobicContact CB-CZ2 4.31Å; F95-W212 AromaticContact CD1-CH2 3.94Å; F95-W212 HydrophobicContact CD1-CH2 3.94Å; F95-W212 AromaticContact CD1-CZ2 3.46Å; F95-W212 HydrophobicContact CD1-CZ2 3.46Å; F95-W212 VanDerWaalsContact CD1-CZ2 3.46Å; F95-W212 HydrophobicContact CE1-CZ2 4.1Å; F95-W212 HydrophobicContact CG-CZ2 4.17Å; L96-W212 HydrophobicContact CD1-CH2 4.03Å; L96-W212 HydrophobicContact CD1-CZ3 4.33Å; L96-W212 HydrophobicContact CD2-CH2 3.93Å; L96-W212 HydrophobicContact CD2-CZ3 4.32Å; L96-W212 HydrophobicContact CG-CH2 3.8Å; L96-W212 HydrophobicContact CG-CZ3 4.45Å; M153-W212 HydrophobicContact CG-CZ3 4.1Å; L157-W212 HydrophobicContact CD1-CH2 4.37Å; L157-W212 HydrophobicContact CD1-CZ3 4.21Å; F209-W212 HydrophobicContact CD1-CD2 4.21Å; F209-W212 HydrophobicContact CD1-CE3 4.2Å; F209-W212 HydrophobicContact CE1-CE3 4.35Å; F209-W212 HydrophobicContact CE1-CH2 4.42Å; F209-W212 HydrophobicContact CE1-CZ3 4.23Å; F209-W212 WeakPolarHBondContact O-CB 3.5Å; F209-W212 PolarHBondContact O-N 3.22Å
213G77.5Confident71.7Confident19 Ų1987.9 Ų87.920%0.19643%0.428CS..THydrogen-bonded Turntrans-79.2-23.617400000113.5R36 K211 S215R36-G213 PolarHBondContact NH1-O 3.49Å; K211-G213 PolarHBondContact O-N 3.34Å; G213-S215 PolarHBondContact O-N 3.32Å
214E64.4Low69.1Low115 Ų11589.5 Ų89.554%0.53745%0.445SS..  trans-83.281.6178.5-62.7173-162.500109.1K211K211-E214 WeakPolarHBondContact CD-OE1 3.42Å; K211-E214 VanDerWaalsContact CD-OE2 3.26Å; K211-E214 WeakPolarHBondContact CD-OE2 3.44Å; K211-E214 IonicContact NZ-OE1 3.13Å; K211-E214 PolarHBondContact NZ-OE1 2.87Å; K211-E214 IonicContact NZ-OE2 3.74Å; K211-E214 PolarHBondContact NZ-OE2 3.21Å; K211-E214 PolarHBondContact O-N 3.2Å
215S47.3Very low66.5Low46 Ų4698 Ų9832%0.32248%0.484SS..  trans-67.7140.4167.7-63.60000109.8G213 N217 R218G213-S215 PolarHBondContact O-N 3.32Å; S215-N217 PolarHBondContact O-N 3.3Å; S215-N217 VanDerWaalsContact O-N 3.12Å; S215-R218 PolarHBondContact O-N 3.12Å
216P46.4Very low63.9Low132 Ų132107.1 Ų107.186%0.85753%0.527SS*.THydrogen-bonded Turntrans-60.8-21.4171.2-14.225.2000112.4R218P216-R218 PolarHBondContact O-N 3.12Å; P216-R218 VanDerWaalsContact O-N 3.12Å
217N41.7Very low61.3Low159 Ų159111 Ų11185%0.8556%0.559SS**THydrogen-bonded Turntrans-72.17.6178.5-98.2-1.6000115.4S215 S219S215-N217 PolarHBondContact O-N 3.3Å; S215-N217 VanDerWaalsContact O-N 3.12Å; N217-S219 PolarHBondContact O-N 2.64Å
218R44Very low58.8Low219 Ų219113.1 Ų113.183%0.82658%0.577SS**  trans-73.371.7152.2-79.3-173.9176.3177-0.6108S215 P216 R220S215-R218 PolarHBondContact O-N 3.12Å; P216-R218 PolarHBondContact O-N 3.12Å; P216-R218 VanDerWaalsContact O-N 3.12Å; R218-R220 PolarHBondContact O-N 3.28Å
219S42.8Very low56.1Low85 Ų85124.8 Ų124.859%0.59462%0.62SS**  trans-32.7130.5154.9159.70000108.4N217 R221N217-S219 PolarHBondContact O-N 2.64Å; S219-R221 PolarHBondContact O-N 2.86Å
220R44.4Very low53.4Low228 Ų228133.5 Ų133.586%0.8666%0.658SS**  trans-44.380.5156.9-70.9174.7177.1172.8-1.7108.5R218 H222R218-R220 PolarHBondContact O-N 3.28Å; R220-H222 PolarHBondContact O-N 2.89Å
221R45.3Very low50.8Low225 Ų225135.2 Ų135.285%0.84968%0.681SS**  trans-7094.2158-75.6-168.5-167.4-155.63.1103.3S219 S223S219-R221 PolarHBondContact O-N 2.86Å; R221-S223 VanDerWaalsContact C-N 3.28Å; R221-S223 PolarHBondContact O-N 2.86Å
222H41.9Very low48.3Very low167 Ų167137.4 Ų137.477%0.77370%0.701SS**  trans-41.8103.9154.7-76.8-41.4000106.9R220 P224R220-H222 PolarHBondContact O-N 2.89Å; H222-P224 WeakPolarHBondContact O-CD 3.43Å
223S42.4Very low46Very low101 Ų101148 Ų14871%0.70674%0.742SS**  trans-55.5121.4156-57.80000105R221 H225R221-S223 VanDerWaalsContact C-N 3.28Å; R221-S223 PolarHBondContact O-N 2.86Å; S223-H225 PolarHBondContact O-N 3.05Å; S223-H225 VanDerWaalsContact O-N 3.1Å
224P44.2Very low44.1Very low119 Ų119157.6 Ų157.677%0.77377%0.772SS**  trans-59.3124.5170.9-9.122.3000105.6H222 Q226H222-P224 WeakPolarHBondContact O-CD 3.43Å; P224-Q226 PolarHBondContact O-N 3.1Å
225H44.4Very low42.8Very low182 Ų182157.9 Ų157.984%0.84378%0.782SS**  trans-39.8118.6173.4-70.1-81.4000109.2S223 A227S223-H225 PolarHBondContact O-N 3.05Å; S223-H225 VanDerWaalsContact O-N 3.1Å; H225-A227 PolarHBondContact O-N 3Å
226Q44Very low42.6Very low193 Ų193167.2 Ų167.290%0.90281%0.81SS**  trans-59.892.3158.8-86177-16.900105.9P224 L228P224-Q226 PolarHBondContact O-N 3.1Å; Q226-L228 PolarHBondContact O-N 2.75Å
227A44.5Very low42.7Very low86 Ų86166.8 Ų166.871%0.71181%0.807SS**  trans-59.1110.9171.900000107H225 R229H225-A227 PolarHBondContact O-N 3Å; A227-R229 PolarHBondContact O-N 2.85Å
228L45.3Very low42.7Very low148 Ų148164.3 Ų164.378%0.77580%0.802SS**  trans-39.793.1166-135.889.7000109.9Q226 K230Q226-L228 PolarHBondContact O-N 2.75Å; L228-K230 HydrophobicContact CD2-CB 4.37Å; L228-K230 HydrophobicContact CD2-CD 4.16Å; L228-K230 PolarHBondContact O-N 2.94Å
229R40.1Very low42.5Very low252 Ų252165 Ų16595%0.95181%0.805SS**  trans-78.572.2162.5-80.2-166.2176.5-172.60.8108.3A227A227-R229 PolarHBondContact O-N 2.85Å
230K39.3Very low42.3Very low184 Ų184170.8 Ų170.880%0.882%0.819SS**  trans-80132.5158-124176.4-178.2179.40107.2L228L228-K230 HydrophobicContact CD2-CB 4.37Å; L228-K230 HydrophobicContact CD2-CD 4.16Å; L228-K230 PolarHBondContact O-N 2.94Å
231G40.8Very low41.9Very low68 Ų68163 Ų16370%0.70181%0.809SS**  trans-81.6168.9-151.300000116.7
232V42.2Very low41.7Very low135 Ų135160.5 Ų160.582%0.81881%0.813SS**  trans-141.992.8146.6-178.10000107.2R234V232-R234 HydrophobicContact CG1-CB 4.47Å
233R43Very low41.6Very low246 Ų246163 Ų16393%0.92882%0.815SS**  trans-79.8111.9153.5-86-176.9174.5-179.1-1.3106.5
234R37Very low41.7Very low220 Ų220166.5 Ų166.583%0.8383%0.825SS**  trans170.1137163.9-103.1169.7-167.4-167.54.9105.9V232V232-R234 HydrophobicContact CG1-CB 4.47Å
235T37.1Very low42.1Very low121 Ų121168.2 Ų168.274%0.74283%0.825SS**  cis-167.4137.91.5-17.70000103.5
236R44.5Very low42.5Very low242 Ų242164.8 Ų164.891%0.91382%0.819SS**  trans-79.2140.4164.8-150.6179.6-168.2178.72.8107.6
237P48.8Very low42.6Very low123 Ų123168 Ų16880%0.79982%0.823SS**  trans-132.5142.9137.321.7-3000113.2
238S41.2Very low42.4Very low107 Ų107167.6 Ų167.675%0.74883%0.827SS**  trans-89.9143.2167.7165.60000109.8
239R40.3Very low42.5Very low234 Ų234170 Ų17088%0.88383%0.834SS**  trans153.4114.9145.2-89.1175.5173.2-171-1.4108.8
240K37.8Very low42.7Very low206 Ų206166 Ų16690%0.89683%0.83SS**  71.8104.476.9-160.5-179.5-172-177.60112.8
241G36Very low43.4Very low63 Ų63162.8 Ų162.865%0.64983%0.829SS**  trans87.4114.5142.500000117.6
242N41.5Very low43.2Very low173 Ų173174.9 Ų174.993%0.92585%0.853SS**  -159.8131.8119.8-99.3-15.4000112.5
243R38.9Very low43.3Very low220 Ų220176.9 Ų176.983%0.8386%0.855SS**PPolyproline II helixtrans-61.4139.4173.8-74.8168.9166168.2-6.3110.4
244L45.3Very low43.3Very low175 Ų175173.3 Ų173.392%0.91685%0.851SS**PPolyproline II helixtrans-94.9120.3153.2-71166.9000107.2
245M51.5Low43.7Very low154 Ų154170.7 Ų170.776%0.75985%0.852SS**PPolyproline II helixtrans-92.6153.6168.1-84.9-73.9121.400109.9
246P54.4Low44Very low111 Ų111173.6 Ų173.672%0.72186%0.859SS**PPolyproline II helixtrans-96.4151.9-163.437.1-32.4000112.7
247R44.4Very low44Very low260 Ų260169.3 Ų169.398%0.98186%0.855SS**  trans-162.7127.8154.3-121.6175.6-178.3173.9-0.1111.3
248G41.9Very low43.7Very low77 Ų77172.4 Ų172.479%0.79486%0.859SS**  trans152.173.7168.100000113
249Q46.8Very low43.9Very low198 Ų198177.1 Ų177.193%0.92587%0.867SS**  trans-63.2143.2161.9-76.1179.6-21.100110.2
250L43.3Very low44.1Very low168 Ų168172.7 Ų172.788%0.8887%0.866SS**  trans-135.2137154.3-96.8163.6000108
251P53.8Low44.7Very low118 Ų118169.9 Ų169.977%0.76686%0.863SS**  trans-90.4145.6-169.834.7-32.5000112.9
252R38.3Very low45.5Very low322 Ų322179.6 Ų179.6100%1.21588%0.883SS**  trans-147.10136.5-104.5-173-177.51591.6108.5

Retrieved 252 of 252 residues in 506.4 ms (Link to these results)