X5D7Q9_HUMAN Loading...

General transcription factor IIi isoform E

AlphaFold DB , UniProt , Accession X5D7Q9, Species HUMAN (Homo sapiens, Human), Gene GTF2I, Length 300 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
1M39.8Very low44.8Very low249 Ų249141.4 Ų141.4100%1.22783%0.83SS**  0113.20-73.4175.2172.800107.2
2A39.3Very low45.4Very low99 Ų99143.8 Ų143.882%0.81883%0.827SS**  trans-122.9110.4170.800000106.4
3Q44.3Very low46.2Very low197 Ų197140.6 Ų140.692%0.92181%0.806SS**  trans-84.7120.7170.2-78-174.8-5.400107.7A5Q3-A5 PolarHBondContact O-N 3.03Å
4V41.5Very low47.2Very low126 Ų126141 Ų14176%0.76480%0.797SS**  trans-82.7107.7163.9175.10000106M6V4-M6 PolarHBondContact O-N 3.31Å
5A46.5Very low48.2Very low97 Ų97141.3 Ų141.380%0.80279%0.789SS**  trans-74.4110.4167.900000107.9Q3 S7Q3-A5 PolarHBondContact O-N 3.03Å; A5-S7 PolarHBondContact O-N 3.36Å
6M41.5Very low49.5Very low173 Ų173134.1 Ų134.185%0.85275%0.752SS**  trans-77.4113.4166-73.2-168.9174.500108V4 T8V4-M6 PolarHBondContact O-N 3.31Å; M6-T8 PolarHBondContact O-N 2.75Å
7S40.6Very low51.1Low109 Ų109129.1 Ų129.176%0.76273%0.727SS**  trans-77.8111.1171.8-155.80000108.2A5 L9A5-S7 PolarHBondContact O-N 3.36Å; S7-L9 PolarHBondContact O-N 3.15Å
8T48Very low53Low137 Ų137129.1 Ų129.184%0.8472%0.72SS**  trans-79.8109.3167.846.60000108.6M6M6-T8 PolarHBondContact O-N 2.75Å
9L49Very low54.9Low147 Ų147124.3 Ų124.377%0.7770%0.696SS**  trans-81.2156.5169.3-80172.5000110.7S7S7-L9 PolarHBondContact O-N 3.15Å
10P49Very low56.6Low91 Ų91122.7 Ų122.759%0.59168%0.679SS**  trans-78.2139.1-161.632.2-32.8000111.8E12P10-E12 VanDerWaalsContact C-N 3.25Å; P10-E12 PolarHBondContact O-N 3.29Å
11V53.5Low58.1Low130 Ų130122.5 Ų122.579%0.78868%0.675SS**THydrogen-bonded Turntrans-80-5-176.7-177.40000112.3
12E51.9Low60.7Low170 Ų170114.5 Ų114.579%0.79464%0.639SS**Hα-helixtrans-85.9-22.3-172.1-55.3-159.4122.800114.3P10P10-E12 VanDerWaalsContact C-N 3.25Å; P10-E12 PolarHBondContact O-N 3.29Å
13D55.7Low63.3Low103 Ų103110.9 Ų110.955%0.55161%0.607SS**Hα-helixtrans-79.1-31.2-176.1-162.658.6000112.7S17D13-S17 WeakPolarHBondContact O-CB 3.46Å; D13-S17 PolarHBondContact O-N 3.24Å
14E60.9Low65.5Low146 Ų146105.1 Ų105.168%0.68259%0.585SS**Hα-helixtrans-69.6-39.1-179.6-64.1-74.7112.800111.7S17 E18E14-S17 WeakPolarHBondContact O-CB 3.46Å; E14-S17 PolarHBondContact O-N 2.56Å; E14-E18 PolarHBondContact O-N 2.92Å
15E61.1Low68.1Low145 Ų145106.4 Ų106.468%0.67858%0.581SS**Hα-helixtrans-70.7-38178.6-170.2176.3101.900111.9S17 E18 S19E15-S17 VanDerWaalsContact C-N 3.34Å; E15-E18 PolarHBondContact O-N 3.34Å; E15-S19 WeakPolarHBondContact O-CB 3.01Å; E15-S19 PolarHBondContact O-N 3.48Å; E15-S19 PolarHBondContact O-OG 3.35Å
16S70.1Confident70.5Confident27 Ų27106.2 Ų106.219%0.18957%0.566CS.*Hα-helixtrans-65.2-38.2171.61730000111.4R20S16-R20 WeakPolarHBondContact O-CB 3.15Å; S16-R20 WeakPolarHBondContact O-CG 3.33Å; S16-R20 PolarHBondContact O-N 2.61Å; S16-R20 PolarHBondContact O-NE 3.11Å; S16-R20 PolarHBondContact OG-NE 3.17Å; S16-R20 PolarHBondContact OG-NH2 3.22Å
17S75.6Confident73.1Confident48 Ų4899.3 Ų99.334%0.33653%0.532SS..Hα-helixtrans-64.8-46.2175.6-172.80000112D13 E14 E15 S19 R20 M21D13-S17 WeakPolarHBondContact O-CB 3.46Å; D13-S17 PolarHBondContact O-N 3.24Å; E14-S17 WeakPolarHBondContact O-CB 3.46Å; E14-S17 PolarHBondContact O-N 2.56Å; E15-S17 VanDerWaalsContact C-N 3.34Å; S17-S19 PolarHBondContact O-N 2.93Å; S17-R20 PolarHBondContact O-N 3.08Å; S17-M21 WeakPolarHBondContact O-CG 3.38Å; S17-M21 PolarHBondContact O-N 2.97Å
18E86.3Confident75.7Confident129 Ų12997.3 Ų97.360%0.60352%0.518SS*.Hα-helixtrans-60.8-46.3175.9-174.1171.583.200111.9E14 E15 R20 M21 V22E14-E18 PolarHBondContact O-N 2.92Å; E15-E18 PolarHBondContact O-N 3.34Å; E18-R20 PolarHBondContact O-N 2.91Å; E18-M21 HydrophobicContact CB-CE 4.46Å; E18-M21 WeakPolarHBondContact O-CB 3.03Å; E18-M21 PolarHBondContact O-N 3.37Å; E18-M21 VanDerWaalsContact O-N 3.13Å; E18-V22 WeakPolarHBondContact O-CG2 3.24Å; E18-V22 PolarHBondContact O-N 2.88Å
19S88.9Confident78.1Confident38 Ų3893 Ų9327%0.26650%0.496SS..Hα-helixtrans-63.7-40.1179.4-590000112.2E15 S17 M21 V22 V23 Y50E15-S19 WeakPolarHBondContact O-CB 3.01Å; E15-S19 PolarHBondContact O-N 3.48Å; E15-S19 PolarHBondContact O-OG 3.35Å; S17-S19 PolarHBondContact O-N 2.93Å; S19-M21 VanDerWaalsContact C-N 3.32Å; S19-M21 PolarHBondContact O-N 3.46Å; S19-V22 PolarHBondContact O-N 3.22Å; S19-V23 WeakPolarHBondContact O-CG2 3.4Å; S19-V23 PolarHBondContact O-N 3.12Å; S19-Y50 WeakPolarHBondContact CB-OH 3.43Å
20R87.8Confident80.4Confident93 Ų9389.2 Ų89.235%0.35148%0.476SS..Hα-helixtrans-62.5-37.2173.4-77.3179.7-72.1175.2-5.2112.4S16 S17 E18 V23 T24 Y50S16-R20 WeakPolarHBondContact O-CB 3.15Å; S16-R20 WeakPolarHBondContact O-CG 3.33Å; S16-R20 PolarHBondContact O-N 2.61Å; S16-R20 PolarHBondContact O-NE 3.11Å; S16-R20 PolarHBondContact OG-NE 3.17Å; S16-R20 PolarHBondContact OG-NH2 3.22Å; S17-R20 PolarHBondContact O-N 3.08Å; E18-R20 PolarHBondContact O-N 2.91Å; R20-V23 PolarHBondContact O-N 3.13Å; R20-T24 WeakPolarHBondContact O-CB 3.45Å; R20-T24 PolarHBondContact O-N 2.93Å; R20-T24 PolarHBondContact O-OG1 3.05Å; R20-Y50 HydrophobicContact CG-CE1 3.92Å
21M89.8Confident82.6Confident119 Ų11987.6 Ų87.659%0.58646%0.461SS*.Hα-helixtrans-64.2-42.8173.6-71.7-170.4-72.400111.8S17 E18 S19 T24 F25S17-M21 WeakPolarHBondContact O-CG 3.38Å; S17-M21 PolarHBondContact O-N 2.97Å; E18-M21 HydrophobicContact CB-CE 4.46Å; E18-M21 WeakPolarHBondContact O-CB 3.03Å; E18-M21 PolarHBondContact O-N 3.37Å; E18-M21 VanDerWaalsContact O-N 3.13Å; S19-M21 VanDerWaalsContact C-N 3.32Å; S19-M21 PolarHBondContact O-N 3.46Å; M21-T24 PolarHBondContact O-N 3.43Å; M21-F25 PolarHBondContact O-N 3.4Å
22V94.3Very high84.7Confident80 Ų8084.7 Ų84.749%0.48545%0.446SS..Hα-helixtrans-60.9-47.6176.1174.80000111.1E18 S19 T24 F25 L26E18-V22 WeakPolarHBondContact O-CG2 3.24Å; E18-V22 PolarHBondContact O-N 2.88Å; S19-V22 PolarHBondContact O-N 3.22Å; V22-T24 VanDerWaalsContact C-N 3.32Å; V22-T24 PolarHBondContact O-N 3.31Å; V22-F25 WeakPolarHBondContact O-CB 3.37Å; V22-F25 PolarHBondContact O-N 3.28Å; V22-L26 HydrophobicContact CG1-CD1 4.16Å; V22-L26 WeakPolarHBondContact O-CG 3.43Å; V22-L26 PolarHBondContact O-N 3.04Å
23V93.3Very high86.9Confident24 Ų2482.1 Ų82.115%0.14544%0.436CS..Hα-helixtrans-59.1-45.5178172.60000110.7S19 R20 F25 L26 M27 Y50 F55S19-V23 WeakPolarHBondContact O-CG2 3.4Å; S19-V23 PolarHBondContact O-N 3.12Å; R20-V23 PolarHBondContact O-N 3.13Å; V23-F25 VanDerWaalsContact C-N 3.34Å; V23-F25 PolarHBondContact O-N 3.47Å; V23-L26 PolarHBondContact O-N 3.25Å; V23-M27 HydrophobicContact CG1-CG 4.32Å; V23-M27 WeakPolarHBondContact O-CG 3.45Å; V23-M27 PolarHBondContact O-N 2.99Å; V23-Y50 HydrophobicContact CG1-CG 4.45Å; V23-Y50 HydrophobicContact CG2-CD1 4.07Å; V23-Y50 HydrophobicContact CG2-CD2 3.95Å; V23-Y50 HydrophobicContact CG2-CE1 4.23Å; V23-Y50 HydrophobicContact CG2-CE2 4.14Å; V23-Y50 HydrophobicContact CG2-CG 3.91Å; V23-F55 HydrophobicContact CG1-CD2 4.43Å; V23-F55 HydrophobicContact CG1-CE2 3.94Å; V23-F55 HydrophobicContact CG1-CZ 4.17Å
24T90.9Very high88.9Confident75 Ų7577.5 Ų77.546%0.4641%0.411SS..Hα-helixtrans-60.7-41.7178.3-57.40000112.2R20 M21 V22 M27 S28R20-T24 WeakPolarHBondContact O-CB 3.45Å; R20-T24 PolarHBondContact O-N 2.93Å; R20-T24 PolarHBondContact O-OG1 3.05Å; M21-T24 PolarHBondContact O-N 3.43Å; V22-T24 VanDerWaalsContact C-N 3.32Å; V22-T24 PolarHBondContact O-N 3.31Å; T24-M27 PolarHBondContact O-N 3.02Å; T24-S28 PolarHBondContact O-N 3.15Å; T24-S28 PolarHBondContact O-OG 3.3Å
25F96.1Very high90.5Very high154 Ų15475.9 Ų75.968%0.67540%0.402SS*.Hα-helixtrans-61.9-46.3175.7176.7-98.1000111.8M21 V22 V23 M27 S28 A29M21-F25 PolarHBondContact O-N 3.4Å; V22-F25 WeakPolarHBondContact O-CB 3.37Å; V22-F25 PolarHBondContact O-N 3.28Å; V23-F25 VanDerWaalsContact C-N 3.34Å; V23-F25 PolarHBondContact O-N 3.47Å; F25-M27 PolarHBondContact O-N 2.82Å; F25-S28 WeakPolarHBondContact O-CB 3.38Å; F25-S28 PolarHBondContact O-N 3.12Å; F25-A29 PolarHBondContact O-N 3.32Å; F25-A29 VanDerWaalsContact O-N 3.08Å
26L97.1Very high92.3Very high92 Ų9273.8 Ų73.848%0.48239%0.392SS..Hα-helixtrans-64.2-40.2177.6-67.7174.9000112.2V22 V23 S28 A29 L30V22-L26 HydrophobicContact CG1-CD1 4.16Å; V22-L26 WeakPolarHBondContact O-CG 3.43Å; V22-L26 PolarHBondContact O-N 3.04Å; V23-L26 PolarHBondContact O-N 3.25Å; L26-S28 VanDerWaalsContact C-N 3.28Å; L26-S28 PolarHBondContact O-N 3.02Å; L26-A29 PolarHBondContact O-N 3.03Å; L26-L30 WeakPolarHBondContact O-CG 3.44Å; L26-L30 PolarHBondContact O-N 2.98Å
27M95.8Very high93.6Very high28 Ų2876.2 Ų76.214%0.13840%0.403CS..Hα-helixtrans-61.8-37.8175.1-70.7-54.5105.200111.8V23 T24 F25 L30 E31 A48 F55 V57V23-M27 HydrophobicContact CG1-CG 4.32Å; V23-M27 WeakPolarHBondContact O-CG 3.45Å; V23-M27 PolarHBondContact O-N 2.99Å; T24-M27 PolarHBondContact O-N 3.02Å; F25-M27 PolarHBondContact O-N 2.82Å; M27-L30 HydrophobicContact CE-CD1 3.51Å; M27-L30 PolarHBondContact O-N 3.13Å; M27-L30 HydrophobicContact SD-CD1 4.19Å; M27-E31 PolarHBondContact O-N 3.32Å; M27-A48 HydrophobicContact CE-CB 4.14Å; M27-A48 HydrophobicContact SD-CB 3.94Å; M27-F55 HydrophobicContact CG-CB 4.11Å; M27-F55 HydrophobicContact CG-CD1 4.12Å; M27-F55 HydrophobicContact CG-CG 4.02Å; M27-F55 HydrophobicContact SD-CB 3.89Å; M27-F55 HydrophobicContact SD-CG 4.35Å; M27-V57 HydrophobicContact CB-CG1 4.43Å; M27-V57 HydrophobicContact SD-CG1 4.36Å
28S95.6Very high94.6Very high68 Ų6876.1 Ų76.148%0.47641%0.405SS..Hα-helixtrans-64.9-41175.6-57.10000112T24 F25 L26 E31 S32T24-S28 PolarHBondContact O-N 3.15Å; T24-S28 PolarHBondContact O-OG 3.3Å; F25-S28 WeakPolarHBondContact O-CB 3.38Å; F25-S28 PolarHBondContact O-N 3.12Å; L26-S28 VanDerWaalsContact C-N 3.28Å; L26-S28 PolarHBondContact O-N 3.02Å; S28-E31 PolarHBondContact O-N 3.48Å; S28-S32 PolarHBondContact O-N 3.44Å; S28-S32 VanDerWaalsContact O-N 3.1Å
29A97.6Very high95.1Very high46 Ų4677 Ų7738%0.3841%0.407SS..Hα-helixtrans-64.4-44.7175.100000111.9F25 L26 E31 S32 M33F25-A29 PolarHBondContact O-N 3.32Å; F25-A29 VanDerWaalsContact O-N 3.08Å; L26-A29 PolarHBondContact O-N 3.03Å; A29-E31 VanDerWaalsContact C-N 3.31Å; A29-E31 PolarHBondContact O-N 3.48Å; A29-S32 WeakPolarHBondContact O-CB 3.38Å; A29-S32 PolarHBondContact O-N 2.89Å; A29-S32 VanDerWaalsContact O-N 3.17Å; A29-M33 WeakPolarHBondContact O-CG 3.43Å; A29-M33 PolarHBondContact O-N 2.8Å
30L97.3Very high95.5Very high67 Ų6779.9 Ų79.935%0.35143%0.427SS..Hα-helixtrans-61.1-39175.2-74.4173.1000112.2L26 M27 S32 M33 C34 V57L26-L30 WeakPolarHBondContact O-CG 3.44Å; L26-L30 PolarHBondContact O-N 2.98Å; M27-L30 HydrophobicContact CE-CD1 3.51Å; M27-L30 PolarHBondContact O-N 3.13Å; M27-L30 HydrophobicContact SD-CD1 4.19Å; L30-S32 VanDerWaalsContact C-N 3.33Å; L30-S32 PolarHBondContact O-N 2.9Å; L30-M33 HydrophobicContact CD2-SD 4.34Å; L30-M33 PolarHBondContact O-N 3.06Å; L30-C34 PolarHBondContact O-N 3.07Å; L30-C34 PolarHBondContact O-SG 3.05Å; L30-V57 HydrophobicContact CB-CG2 4.09Å
31E95.9Very high95.8Very high58 Ų5884.7 Ų84.727%0.27145%0.45SS..Hα-helixtrans-62.3-42.2175.3-162.5-163.8163.600111.5M27 S28 A29 M33 C34 K35 R63M27-E31 PolarHBondContact O-N 3.32Å; S28-E31 PolarHBondContact O-N 3.48Å; A29-E31 VanDerWaalsContact C-N 3.31Å; A29-E31 PolarHBondContact O-N 3.48Å; E31-M33 VanDerWaalsContact C-N 3.34Å; E31-M33 PolarHBondContact O-N 3.35Å; E31-C34 PolarHBondContact O-N 2.98Å; E31-K35 WeakPolarHBondContact O-CG 3.37Å; E31-K35 PolarHBondContact O-N 3.5Å; E31-K35 WeakPolarHBondContact OE1-CE 3.36Å; E31-K35 IonicContact OE1-NZ 2.73Å; E31-K35 PolarHBondContact OE1-NZ 2.95Å; E31-K35 IonicContact OE2-NZ 3.32Å; E31-R63 IonicContact OE1-CZ 2.66Å; E31-R63 IonicContact OE1-NH1 3.57Å; E31-R63 PolarHBondContact OE1-NH1 3.08Å
32S97.5Very high96.1Very high68 Ų6880.9 Ų80.948%0.47644%0.438SS..Hα-helixtrans-59.6-44.5174.9-168.50000111.8S28 A29 L30 C34 K35 E36S28-S32 PolarHBondContact O-N 3.44Å; S28-S32 VanDerWaalsContact O-N 3.1Å; A29-S32 WeakPolarHBondContact O-CB 3.38Å; A29-S32 PolarHBondContact O-N 2.89Å; A29-S32 VanDerWaalsContact O-N 3.17Å; L30-S32 VanDerWaalsContact C-N 3.33Å; L30-S32 PolarHBondContact O-N 2.9Å; S32-C34 PolarHBondContact O-N 2.92Å; S32-K35 WeakPolarHBondContact O-CB 3.41Å; S32-K35 PolarHBondContact O-N 3.47Å; S32-K35 VanDerWaalsContact O-N 3.16Å; S32-E36 PolarHBondContact O-N 3.47Å; S32-E36 VanDerWaalsContact O-N 3.11Å
33M97.2Very high96.3Very high116 Ų11682.1 Ų82.157%0.57144%0.438SS*.Hα-helixtrans-61.1-42.6175.2-67.3175.961.500112.3A29 L30 E31 K35 E36 L37A29-M33 WeakPolarHBondContact O-CG 3.43Å; A29-M33 PolarHBondContact O-N 2.8Å; L30-M33 HydrophobicContact CD2-SD 4.34Å; L30-M33 PolarHBondContact O-N 3.06Å; E31-M33 VanDerWaalsContact C-N 3.34Å; E31-M33 PolarHBondContact O-N 3.35Å; M33-K35 VanDerWaalsContact C-N 3.26Å; M33-K35 PolarHBondContact O-N 3.41Å; M33-E36 PolarHBondContact O-N 2.92Å; M33-L37 WeakPolarHBondContact O-CG 3.48Å; M33-L37 PolarHBondContact O-N 2.98Å
34C97.4Very high96.5Very high6 Ų682.8 Ų82.84%0.04144%0.442CS..Hα-helixtrans-62.1-35176.9-65.60000112.1L30 E31 S32 L37 A38L30-C34 PolarHBondContact O-N 3.07Å; L30-C34 PolarHBondContact O-SG 3.05Å; E31-C34 PolarHBondContact O-N 2.98Å; S32-C34 PolarHBondContact O-N 2.92Å; C34-L37 PolarHBondContact O-N 3.3Å; C34-A38 PolarHBondContact O-N 3.28Å; C34-A38 VanDerWaalsContact O-N 3.1Å
35K95.8Very high96.8Very high112 Ų11281.3 Ų81.349%0.48744%0.438SS..Hα-helixtrans-65.9-40.8174.5-71.7169.2-177.5161.90111.9E31 S32 M33 A38E31-K35 WeakPolarHBondContact O-CG 3.37Å; E31-K35 PolarHBondContact O-N 3.5Å; E31-K35 WeakPolarHBondContact OE1-CE 3.36Å; E31-K35 IonicContact OE1-NZ 2.73Å; E31-K35 PolarHBondContact OE1-NZ 2.95Å; E31-K35 IonicContact OE2-NZ 3.32Å; S32-K35 WeakPolarHBondContact O-CB 3.41Å; S32-K35 PolarHBondContact O-N 3.47Å; S32-K35 VanDerWaalsContact O-N 3.16Å; M33-K35 VanDerWaalsContact C-N 3.26Å; M33-K35 PolarHBondContact O-N 3.41Å; K35-A38 WeakPolarHBondContact O-CB 3.42Å; K35-A38 PolarHBondContact O-N 2.94Å
36E97.8Very high96.8Very high101 Ų10176.1 Ų76.147%0.47242%0.42SS..Hα-helixtrans-64.5-42.6174.6-70.3-57.3131.900111.8S32 M33 A38 K39S32-E36 PolarHBondContact O-N 3.47Å; S32-E36 VanDerWaalsContact O-N 3.11Å; M33-E36 PolarHBondContact O-N 2.92Å; E36-A38 VanDerWaalsContact C-N 3.27Å; E36-A38 PolarHBondContact O-N 3.31Å; E36-K39 VanDerWaalsContact O-CB 3.3Å; E36-K39 WeakPolarHBondContact O-CB 3.29Å; E36-K39 PolarHBondContact O-N 3.16Å; E36-K39 VanDerWaalsContact O-N 3.07Å; E36-K39 WeakPolarHBondContact OE1-CE 3.36Å; E36-K39 IonicContact OE1-NZ 3.83Å; E36-K39 PolarHBondContact OE1-NZ 3.48Å; E36-K39 WeakPolarHBondContact OE2-CD 3.49Å; E36-K39 WeakPolarHBondContact OE2-CE 3.46Å; E36-K39 IonicContact OE2-NZ 2.61Å; E36-K39 PolarHBondContact OE2-NZ 3.21Å
37L97.1Very high96.7Very high79 Ų7973.8 Ų73.841%0.41441%0.408SS..Hα-helixtrans-61.5-34.7176.8-69.5174.4000112.7M33 C34 K39 S40 A42 V44M33-L37 WeakPolarHBondContact O-CG 3.48Å; M33-L37 PolarHBondContact O-N 2.98Å; C34-L37 PolarHBondContact O-N 3.3Å; L37-K39 PolarHBondContact O-N 3.3Å; L37-S40 PolarHBondContact O-N 3.43Å; L37-A42 HydrophobicContact CB-CB 4.3Å; L37-A42 WeakPolarHBondContact O-CB 3.39Å; L37-A42 PolarHBondContact O-N 3.36Å; L37-V44 HydrophobicContact CD1-CG2 3.95Å
38A96.8Very high96.6Very high46 Ų4673.9 Ų73.938%0.3841%0.413SS..Hα-helixtrans-59.8-30.9175.700000112.7C34 K35 E36 S40 K41 T59C34-A38 PolarHBondContact O-N 3.28Å; C34-A38 VanDerWaalsContact O-N 3.1Å; K35-A38 WeakPolarHBondContact O-CB 3.42Å; K35-A38 PolarHBondContact O-N 2.94Å; E36-A38 VanDerWaalsContact C-N 3.27Å; E36-A38 PolarHBondContact O-N 3.31Å; A38-S40 PolarHBondContact O-N 3.34Å; A38-K41 WeakPolarHBondContact O-CA 3.27Å; A38-K41 PolarHBondContact O-N 2.88Å; A38-T59 HydrophobicContact CB-CG2 4Å
39K96.6Very high96.5Very high148 Ų14872.7 Ų72.764%0.64340%0.403SS*.Hα-helixtrans-62.7-28.9176.6-59.5179.9-174.3167.80112.1E36 L37 K41E36-K39 VanDerWaalsContact O-CB 3.3Å; E36-K39 WeakPolarHBondContact O-CB 3.29Å; E36-K39 PolarHBondContact O-N 3.16Å; E36-K39 VanDerWaalsContact O-N 3.07Å; E36-K39 WeakPolarHBondContact OE1-CE 3.36Å; E36-K39 IonicContact OE1-NZ 3.83Å; E36-K39 PolarHBondContact OE1-NZ 3.48Å; E36-K39 WeakPolarHBondContact OE2-CD 3.49Å; E36-K39 WeakPolarHBondContact OE2-CE 3.46Å; E36-K39 IonicContact OE2-NZ 2.61Å; E36-K39 PolarHBondContact OE2-NZ 3.21Å; L37-K39 PolarHBondContact O-N 3.3Å; K39-K41 VanDerWaalsContact C-N 3.27Å; K39-K41 PolarHBondContact O-N 3.48Å
40S97Very high96.3Very high98 Ų9873.5 Ų73.569%0.68540%0.396SS*.THydrogen-bonded Turntrans-87.211.4174.6-56.80000113.4L37 A38 A42L37-S40 PolarHBondContact O-N 3.43Å; A38-S40 PolarHBondContact O-N 3.34Å; S40-A42 PolarHBondContact O-N 2.88Å
41K94.6Very high95.8Very high193 Ų19375.4 Ų75.484%0.83940%0.404SS*.THydrogen-bonded Turntrans60.619.2-174-53.7178.1179.1174.60114.1A38 K39A38-K41 WeakPolarHBondContact O-CA 3.27Å; A38-K41 PolarHBondContact O-N 2.88Å; K39-K41 VanDerWaalsContact C-N 3.27Å; K39-K41 PolarHBondContact O-N 3.48Å
42A97.4Very high95.3Very high39 Ų3978.8 Ų78.832%0.32243%0.428SS..  trans-78.7136.1170.700000109.1L37 S40 T59L37-A42 HydrophobicContact CB-CB 4.3Å; L37-A42 WeakPolarHBondContact O-CB 3.39Å; L37-A42 PolarHBondContact O-N 3.36Å; S40-A42 PolarHBondContact O-N 2.88Å; A42-T59 WeakPolarHBondContact O-CG2 3.23Å
43E97.4Very high94.9Very high106 Ų10678.8 Ų78.850%0.49542%0.423SS..  trans-107126.9174.3-62.6-67.9171.200108.7T59 R61E43-T59 WeakPolarHBondContact OE2-CB 3.49Å; E43-T59 PolarHBondContact OE2-OG1 3.32Å; E43-R61 WeakPolarHBondContact OE1-CD 3.41Å; E43-R61 WeakPolarHBondContact OE2-CB 3.37Å
44V97.6Very high94.7Very high38 Ų3876 Ų7623%0.2341%0.412CS..  trans-135.6140.2-173.6-176.60000109.8L37 G58 T59L37-V44 HydrophobicContact CD1-CG2 3.95Å; V44-G58 CarbonylContact O-C 3.51Å; V44-G58 WeakPolarHBondContact O-CA 3.26Å; V44-T59 HydrophobicContact CB-CG2 4.3Å; V44-T59 PolarHBondContact N-OG1 2.78Å; V44-T59 PolarHBondContact O-N 2.88Å; V44-T59 PolarHBondContact O-OG1 3.23Å
45A96.6Very high94.6Very high44 Ų4478.1 Ų78.136%0.36442%0.421SS..EExtended strand (participates in β ladder)trans-136.7132.4168.400000109.3G62 V66A45-G62 WeakPolarHBondContact CB-O 3.25Å; A45-V66 HydrophobicContact CB-CG2 3.54Å
46C95.9Very high94.6Very high46 Ų4674.1 Ų74.131%0.31141%0.406SS..EExtended strand (participates in β ladder)trans-124.1137.4177.7-54.50000108.8V56 V57C46-V56 WeakPolarHBondContact O-CA 3.29Å; C46-V57 HydrophobicContact CB-CG2 3.68Å; C46-V57 PolarHBondContact N-O 3.25Å; C46-V57 PolarHBondContact O-N 2.94Å
47I95.6Very high94.6Very high43 Ų4370 Ų7022%0.22139%0.387CS..EExtended strand (participates in β ladder)trans-114.4126.2171.2-57.6167.8000106.3V54 F55 V66 F72 Q73 F76I47-V54 HydrophobicContact CG2-CG1 3.98Å; I47-F55 WeakPolarHBondContact CA-O 3.4Å; I47-V66 HydrophobicContact CD1-CG1 3.7Å; I47-V66 HydrophobicContact CG1-CG1 3.68Å; I47-F72 HydrophobicContact CD1-CB 4.33Å; I47-Q73 HydrophobicContact CD1-CG 4.18Å; I47-F76 HydrophobicContact CB-CD1 4.21Å; I47-F76 HydrophobicContact CG2-CD1 3.68Å; I47-F76 HydrophobicContact CG2-CE1 4.28Å
48A94.4Very high94.6Very high30 Ų3066.3 Ų66.325%0.24837%0.368CS..EExtended strand (participates in β ladder)trans-120.8142171.500000108.9M27 V54 F55M27-A48 HydrophobicContact CE-CB 4.14Å; M27-A48 HydrophobicContact SD-CB 3.94Å; A48-V54 CarbonylContact O-C 3.6Å; A48-V54 WeakPolarHBondContact O-CA 3.05Å; A48-F55 HydrophobicContact CB-CB 4.33Å; A48-F55 PolarHBondContact N-O 2.66Å; A48-F55 PolarHBondContact O-N 3.35Å
49V93.7Very high94.6Very high42 Ų4264.3 Ų64.326%0.25535%0.352SS..EExtended strand (participates in β ladder)trans-123129.1176.8-1770000107.1D53 V54 F76 V77V49-D53 WeakPolarHBondContact CA-O 3.41Å; V49-V54 HydrophobicContact CG2-CG1 4.5Å; V49-V54 HydrophobicContact CG2-CG2 4.34Å; V49-F76 HydrophobicContact CG2-CD1 3.7Å; V49-F76 HydrophobicContact CG2-CE1 3.93Å; V49-V77 HydrophobicContact CG1-CG2 4.16Å; V49-V77 HydrophobicContact CG2-CG2 3.64Å
50Y92Very high94.6Very high64 Ų6465 Ų6525%0.25136%0.357SS..EExtended strand (participates in β ladder)trans-138.2120.4175.1176.4-102000108.1S19 R20 V23 T52 D53S19-Y50 WeakPolarHBondContact CB-OH 3.43Å; R20-Y50 HydrophobicContact CG-CE1 3.92Å; V23-Y50 HydrophobicContact CG1-CG 4.45Å; V23-Y50 HydrophobicContact CG2-CD1 4.07Å; V23-Y50 HydrophobicContact CG2-CD2 3.95Å; V23-Y50 HydrophobicContact CG2-CE1 4.23Å; V23-Y50 HydrophobicContact CG2-CE2 4.14Å; V23-Y50 HydrophobicContact CG2-CG 3.91Å; Y50-T52 PolarHBondContact O-N 2.58Å; Y50-T52 VanDerWaalsContact O-N 3.1Å; Y50-D53 PolarHBondContact N-O 2.96Å; Y50-D53 PolarHBondContact O-N 3.43Å
51E88.1Confident94.6Very high107 Ų10769 Ų6950%0.536%0.357SS..THydrogen-bonded Turntrans51.3-115.5-170.5-57.9176.1174.400110.5
52T83.9Confident94.7Very high129 Ų12960.2 Ų60.279%0.79132%0.322SS*.THydrogen-bonded Turntrans-95.3-7.7176.457.10000114.1Y50Y50-T52 PolarHBondContact O-N 2.58Å; Y50-T52 VanDerWaalsContact O-N 3.1Å
53D89.6Confident94.7Very high68 Ų6861.7 Ų61.736%0.36432%0.319SS..EExtended strand (participates in β ladder)trans-90.4136.9-171.9-67.8-29000111.6V49 Y50 F55V49-D53 WeakPolarHBondContact CA-O 3.41Å; Y50-D53 PolarHBondContact N-O 2.96Å; Y50-D53 PolarHBondContact O-N 3.43Å; D53-F55 HydrophobicContact CB-CD2 4.45Å; D53-F55 HydrophobicContact CB-CE2 3.54Å; D53-F55 HydrophobicContact CB-CZ 3.68Å
54V93.4Very high94.7Very high56 Ų5659.1 Ų59.134%0.33932%0.316SS..EExtended strand (participates in β ladder)trans-116.9118.3177.6-174.90000109.1I47 A48 V49 Q73 V77I47-V54 HydrophobicContact CG2-CG1 3.98Å; A48-V54 CarbonylContact O-C 3.6Å; A48-V54 WeakPolarHBondContact O-CA 3.05Å; V49-V54 HydrophobicContact CG2-CG1 4.5Å; V49-V54 HydrophobicContact CG2-CG2 4.34Å; V54-Q73 HydrophobicContact CG1-CB 4.43Å; V54-V77 HydrophobicContact CG2-CG2 3.46Å; V54-V77 VanDerWaalsContact CG2-CG2 3.46Å
55F94.8Very high94.6Very high51 Ų5163 Ų6322%0.22433%0.33CS..EExtended strand (participates in β ladder)trans-105.2133.1179.1-55-90.2000109.8V23 M27 I47 A48 D53V23-F55 HydrophobicContact CG1-CD2 4.43Å; V23-F55 HydrophobicContact CG1-CE2 3.94Å; V23-F55 HydrophobicContact CG1-CZ 4.17Å; M27-F55 HydrophobicContact CG-CB 4.11Å; M27-F55 HydrophobicContact CG-CD1 4.12Å; M27-F55 HydrophobicContact CG-CG 4.02Å; M27-F55 HydrophobicContact SD-CB 3.89Å; M27-F55 HydrophobicContact SD-CG 4.35Å; I47-F55 WeakPolarHBondContact CA-O 3.4Å; A48-F55 HydrophobicContact CB-CB 4.33Å; A48-F55 PolarHBondContact N-O 2.66Å; A48-F55 PolarHBondContact O-N 3.35Å; D53-F55 HydrophobicContact CB-CD2 4.45Å; D53-F55 HydrophobicContact CB-CE2 3.54Å; D53-F55 HydrophobicContact CB-CZ 3.68Å
56V96.6Very high94.6Very high29 Ų2961.3 Ų61.318%0.17632%0.315CS..EExtended strand (participates in β ladder)trans-120.6111174.8-178.70000108.7C46 R63 V66 Q73C46-V56 WeakPolarHBondContact O-CA 3.29Å; V56-R63 HydrophobicContact CG1-CG 4.36Å; V56-V66 HydrophobicContact CG1-CB 4.04Å; V56-V66 HydrophobicContact CG1-CG1 3.69Å; V56-V66 HydrophobicContact CG2-CG1 3.98Å; V56-Q73 HydrophobicContact CG2-CG 4.34Å
57V97.1Very high94.6Very high14 Ų1462.6 Ų62.69%0.08532%0.319CS..EExtended strand (participates in β ladder)trans-117.6158.7176.3-60.30000109.8M27 L30 C46M27-V57 HydrophobicContact CB-CG1 4.43Å; M27-V57 HydrophobicContact SD-CG1 4.36Å; L30-V57 HydrophobicContact CB-CG2 4.09Å; C46-V57 HydrophobicContact CB-CG2 3.68Å; C46-V57 PolarHBondContact N-O 3.25Å; C46-V57 PolarHBondContact O-N 2.94Å
58G96.9Very high94.7Very high1 Ų166.1 Ų66.11%0.0134%0.342CS..EExtended strand (participates in β ladder)trans152.4-179.2-175.400000113.1V44 R63V44-G58 CarbonylContact O-C 3.51Å; V44-G58 WeakPolarHBondContact O-CA 3.26Å; G58-R63 WeakPolarHBondContact O-CD 3.06Å; G58-R63 PolarHBondContact O-NE 3.43Å; G58-R63 PolarHBondContact O-NH1 2.89Å
59T98Very high94.7Very high5 Ų569.4 Ų69.43%0.03135%0.348CS..  trans-60.7162.9166570000111.8A38 A42 E43 V44 R61 G62 R63A38-T59 HydrophobicContact CB-CG2 4Å; A42-T59 WeakPolarHBondContact O-CG2 3.23Å; E43-T59 WeakPolarHBondContact OE2-CB 3.49Å; E43-T59 PolarHBondContact OE2-OG1 3.32Å; V44-T59 HydrophobicContact CB-CG2 4.3Å; V44-T59 PolarHBondContact N-OG1 2.78Å; V44-T59 PolarHBondContact O-N 2.88Å; V44-T59 PolarHBondContact O-OG1 3.23Å; T59-R61 VanDerWaalsContact C-N 3.34Å; T59-R61 PolarHBondContact O-N 2.7Å; T59-G62 PolarHBondContact O-N 3.08Å; T59-G62 PolarHBondContact OG1-N 3.34Å; T59-R63 WeakPolarHBondContact O-CB 3.49Å; T59-R63 WeakPolarHBondContact O-CG 3.27Å; T59-R63 PolarHBondContact O-N 3.26Å
60E95.9Very high94.8Very high161 Ų16172 Ų7275%0.75236%0.356SS*.Hα-helixtrans-56.4-47.3-179.3-171.4175.7-175.500112.1A64E60-A64 VanDerWaalsContact O-CB 3.31Å; E60-A64 WeakPolarHBondContact O-CB 3.45Å; E60-A64 PolarHBondContact O-N 2.68Å
61R96.6Very high94.9Very high183 Ų18371.9 Ų71.969%0.69136%0.36SS*.Hα-helixtrans-71-40.3179.6-51.2-179.276.9159.2-0.1111.6E43 T59 A64 F65E43-R61 WeakPolarHBondContact OE1-CD 3.41Å; E43-R61 WeakPolarHBondContact OE2-CB 3.37Å; T59-R61 VanDerWaalsContact C-N 3.34Å; T59-R61 PolarHBondContact O-N 2.7Å; R61-A64 PolarHBondContact O-N 3.44Å; R61-F65 WeakPolarHBondContact O-CB 3.45Å; R61-F65 PolarHBondContact O-N 3.35Å
62G97.3Very high95.2Very high9 Ų970.4 Ų70.49%0.09335%0.352CS..Hα-helixtrans-60.1-47.9176.900000112.9A45 T59 F65 V66A45-G62 WeakPolarHBondContact CB-O 3.25Å; T59-G62 PolarHBondContact O-N 3.08Å; T59-G62 PolarHBondContact OG1-N 3.34Å; G62-F65 PolarHBondContact O-N 2.95Å; G62-V66 PolarHBondContact O-N 3.24Å; G62-V66 VanDerWaalsContact O-N 3.08Å
63R96.6Very high95.8Very high69 Ų6965.3 Ų65.326%0.2632%0.319SS..Hα-helixtrans-62.8-44.1175.2-70.1-172.6-62.1-141.32.8111.7E31 V56 G58 T59 F65 V66 N67E31-R63 IonicContact OE1-CZ 2.66Å; E31-R63 IonicContact OE1-NH1 3.57Å; E31-R63 PolarHBondContact OE1-NH1 3.08Å; V56-R63 HydrophobicContact CG1-CG 4.36Å; G58-R63 WeakPolarHBondContact O-CD 3.06Å; G58-R63 PolarHBondContact O-NE 3.43Å; G58-R63 PolarHBondContact O-NH1 2.89Å; T59-R63 WeakPolarHBondContact O-CB 3.49Å; T59-R63 WeakPolarHBondContact O-CG 3.27Å; T59-R63 PolarHBondContact O-N 3.26Å; R63-F65 VanDerWaalsContact C-N 3.32Å; R63-F65 PolarHBondContact O-N 3.45Å; R63-V66 PolarHBondContact O-N 3.05Å; R63-N67 VanDerWaalsContact O-CB 3.27Å; R63-N67 WeakPolarHBondContact O-CB 3.17Å; R63-N67 PolarHBondContact O-N 3.24Å; R63-N67 PolarHBondContact O-ND2 2.98Å
64A97.2Very high96Very high53 Ų5369.1 Ų69.144%0.43833%0.332SS..Hα-helixtrans-60.8-42.3178.100000111.9E60 R61 N67 T68E60-A64 VanDerWaalsContact O-CB 3.31Å; E60-A64 WeakPolarHBondContact O-CB 3.45Å; E60-A64 PolarHBondContact O-N 2.68Å; R61-A64 PolarHBondContact O-N 3.44Å; A64-N67 PolarHBondContact O-N 3.42Å; A64-T68 WeakPolarHBondContact O-CB 3.43Å; A64-T68 PolarHBondContact O-N 3.01Å; A64-T68 PolarHBondContact O-OG1 3.45Å
65F97.3Very high96.1Very high119 Ų11971.2 Ų71.252%0.52234%0.342SS..Hα-helixtrans-60.1-53.2176.8178.2-95.4000111.7R61 G62 R63 N67 T68 R69 F72R61-F65 WeakPolarHBondContact O-CB 3.45Å; R61-F65 PolarHBondContact O-N 3.35Å; G62-F65 PolarHBondContact O-N 2.95Å; R63-F65 VanDerWaalsContact C-N 3.32Å; R63-F65 PolarHBondContact O-N 3.45Å; F65-N67 VanDerWaalsContact C-N 3.32Å; F65-N67 PolarHBondContact O-N 2.84Å; F65-T68 PolarHBondContact O-N 3.48Å; F65-R69 PolarHBondContact O-N 3.48Å; F65-R69 VanDerWaalsContact O-N 3.11Å; F65-F72 HydrophobicContact CE1-CD2 4.23Å; F65-F72 AromaticContact CE1-CE2 3.68Å; F65-F72 HydrophobicContact CE1-CE2 3.68Å; F65-F72 AromaticContact CZ-CE2 3.9Å; F65-F72 HydrophobicContact CZ-CE2 3.9Å
66V96.7Very high96.2Very high9 Ų972.7 Ų72.76%0.05535%0.348CS..Hα-helixtrans-65.7-34-179.9170.20000112.1A45 I47 V56 G62 R63 R69 Q73A45-V66 HydrophobicContact CB-CG2 3.54Å; I47-V66 HydrophobicContact CD1-CG1 3.7Å; I47-V66 HydrophobicContact CG1-CG1 3.68Å; V56-V66 HydrophobicContact CG1-CB 4.04Å; V56-V66 HydrophobicContact CG1-CG1 3.69Å; V56-V66 HydrophobicContact CG2-CG1 3.98Å; G62-V66 PolarHBondContact O-N 3.24Å; G62-V66 VanDerWaalsContact O-N 3.08Å; R63-V66 PolarHBondContact O-N 3.05Å; V66-R69 CarbonylContact O-C 3.3Å; V66-R69 VanDerWaalsContact O-C 3.3Å; V66-R69 PolarHBondContact O-N 3.37Å; V66-R69 VanDerWaalsContact O-O 3.1Å; V66-Q73 HydrophobicContact CG1-CG 3.9Å; V66-Q73 PolarHBondContact O-NE2 3.41Å
67N95.3Very high96.1Very high73 Ų7373.4 Ų73.439%0.3935%0.352SS..Hα-helixtrans-73.1-30.4176.9-81-36.7000113.7R63 A64 F65 R69 K70 Q73R63-N67 VanDerWaalsContact O-CB 3.27Å; R63-N67 WeakPolarHBondContact O-CB 3.17Å; R63-N67 PolarHBondContact O-N 3.24Å; R63-N67 PolarHBondContact O-ND2 2.98Å; A64-N67 PolarHBondContact O-N 3.42Å; F65-N67 VanDerWaalsContact C-N 3.32Å; F65-N67 PolarHBondContact O-N 2.84Å; N67-R69 VanDerWaalsContact C-N 3.28Å; N67-K70 WeakPolarHBondContact O-CD 3.2Å; N67-K70 VanDerWaalsContact O-CE 3.27Å; N67-K70 WeakPolarHBondContact O-CE 3.12Å; N67-K70 PolarHBondContact OD1-NZ 2.76Å; N67-K70 VanDerWaalsContact OD1-NZ 3.1Å; N67-Q73 PolarHBondContact OD1-NE2 2.91Å
68T97.1Very high96Very high117 Ų11778.3 Ų78.372%0.71837%0.373SS*.Hα-helixtrans-70.1-31.3171.9-54.80000110.9A64 F65A64-T68 WeakPolarHBondContact O-CB 3.43Å; A64-T68 PolarHBondContact O-N 3.01Å; A64-T68 PolarHBondContact O-OG1 3.45Å; F65-T68 PolarHBondContact O-N 3.48Å
69R95.6Very high95.9Very high99 Ų9985.1 Ų85.137%0.37440%0.399SS..  trans-106.671.9-176.5-67.6-66-61.5-85.6-0.4111.8F65 V66 N67 D71 F72F65-R69 PolarHBondContact O-N 3.48Å; F65-R69 VanDerWaalsContact O-N 3.11Å; V66-R69 CarbonylContact O-C 3.3Å; V66-R69 VanDerWaalsContact O-C 3.3Å; V66-R69 PolarHBondContact O-N 3.37Å; V66-R69 VanDerWaalsContact O-O 3.1Å; N67-R69 VanDerWaalsContact C-N 3.28Å; R69-D71 WeakPolarHBondContact CA-OD1 3.46Å; R69-D71 VanDerWaalsContact CB-OD1 3.27Å; R69-D71 WeakPolarHBondContact CB-OD1 3.06Å; R69-D71 IonicContact CZ-OD1 3.75Å; R69-D71 IonicContact CZ-OD2 3.69Å; R69-D71 IonicContact NE-OD1 3.86Å; R69-D71 PolarHBondContact NE-OD1 3.28Å; R69-D71 IonicContact NE-OD2 2.97Å; R69-D71 PolarHBondContact NE-OD2 2.89Å; R69-D71 VanDerWaalsContact NE-OD2 3.12Å; R69-D71 IonicContact NH2-OD1 3.91Å; R69-D71 IonicContact NH2-OD2 3.65Å; R69-D71 PolarHBondContact NH2-OD2 3.45Å; R69-D71 PolarHBondContact O-N 2.99Å; R69-F72 HydrophobicContact CB-CD2 3.38Å; R69-F72 HydrophobicContact CB-CE2 3.67Å; R69-F72 HydrophobicContact CB-CG 4.38Å; R69-F72 HydrophobicContact CG-CD2 4.18Å; R69-F72 HydrophobicContact CG-CE2 3.95Å; R69-F72 PolarHBondContact O-N 3.46Å; R69-F72 VanDerWaalsContact O-N 3.13Å
70K94.6Very high95.6Very high96 Ų9686.9 Ų86.942%0.41741%0.411SS..Hα-helixtrans-64-17.7177.7-64-55.5-167.1178.90113.4N67 F72 Q73 K74N67-K70 WeakPolarHBondContact O-CD 3.2Å; N67-K70 VanDerWaalsContact O-CE 3.27Å; N67-K70 WeakPolarHBondContact O-CE 3.12Å; N67-K70 PolarHBondContact OD1-NZ 2.76Å; N67-K70 VanDerWaalsContact OD1-NZ 3.1Å; K70-F72 VanDerWaalsContact C-N 3.34Å; K70-Q73 PolarHBondContact O-N 3.19Å; K70-K74 WeakPolarHBondContact O-CG 3.49Å; K70-K74 PolarHBondContact O-N 3.25Å
71D95.2Very high95.3Very high61 Ų6182.4 Ų82.433%0.32639%0.394SS..Hα-helixtrans-58.7-43170.254.9-39.1000111.6R69 Q73 K74 D75R69-D71 WeakPolarHBondContact CA-OD1 3.46Å; R69-D71 VanDerWaalsContact CB-OD1 3.27Å; R69-D71 WeakPolarHBondContact CB-OD1 3.06Å; R69-D71 IonicContact CZ-OD1 3.75Å; R69-D71 IonicContact CZ-OD2 3.69Å; R69-D71 IonicContact NE-OD1 3.86Å; R69-D71 PolarHBondContact NE-OD1 3.28Å; R69-D71 IonicContact NE-OD2 2.97Å; R69-D71 PolarHBondContact NE-OD2 2.89Å; R69-D71 VanDerWaalsContact NE-OD2 3.12Å; R69-D71 IonicContact NH2-OD1 3.91Å; R69-D71 IonicContact NH2-OD2 3.65Å; R69-D71 PolarHBondContact NH2-OD2 3.45Å; R69-D71 PolarHBondContact O-N 2.99Å; D71-Q73 PolarHBondContact O-N 3.48Å; D71-K74 PolarHBondContact O-N 2.93Å; D71-D75 WeakPolarHBondContact O-CB 3.4Å; D71-D75 VanDerWaalsContact O-CG 3.29Å; D71-D75 PolarHBondContact O-N 3.27Å
72F94.1Very high95.1Very high77 Ų7778.4 Ų78.434%0.33838%0.384SS..Hα-helixtrans-63.1-40.7176.6-66.2-49.1000113.1I47 F65 R69 K70 F76I47-F72 HydrophobicContact CD1-CB 4.33Å; F65-F72 HydrophobicContact CE1-CD2 4.23Å; F65-F72 AromaticContact CE1-CE2 3.68Å; F65-F72 HydrophobicContact CE1-CE2 3.68Å; F65-F72 AromaticContact CZ-CE2 3.9Å; F65-F72 HydrophobicContact CZ-CE2 3.9Å; R69-F72 HydrophobicContact CB-CD2 3.38Å; R69-F72 HydrophobicContact CB-CE2 3.67Å; R69-F72 HydrophobicContact CB-CG 4.38Å; R69-F72 HydrophobicContact CG-CD2 4.18Å; R69-F72 HydrophobicContact CG-CE2 3.95Å; R69-F72 PolarHBondContact O-N 3.46Å; R69-F72 VanDerWaalsContact O-N 3.13Å; K70-F72 VanDerWaalsContact C-N 3.34Å; F72-F76 VanDerWaalsContact O-CB 3.29Å; F72-F76 WeakPolarHBondContact O-CB 3.32Å; F72-F76 PolarHBondContact O-N 3.36Å
73Q95.1Very high94.6Very high21 Ų2182.5 Ų82.510%0.09840%0.401CS..Hα-helixtrans-64.5-44.5177.2-62.5179.131.400110.4I47 V54 V56 V66 N67 K70 D71 F76 V77I47-Q73 HydrophobicContact CD1-CG 4.18Å; V54-Q73 HydrophobicContact CG1-CB 4.43Å; V56-Q73 HydrophobicContact CG2-CG 4.34Å; V66-Q73 HydrophobicContact CG1-CG 3.9Å; V66-Q73 PolarHBondContact O-NE2 3.41Å; N67-Q73 PolarHBondContact OD1-NE2 2.91Å; K70-Q73 PolarHBondContact O-N 3.19Å; D71-Q73 PolarHBondContact O-N 3.48Å; Q73-F76 PolarHBondContact O-N 3.04Å; Q73-V77 VanDerWaalsContact O-CG2 3.23Å; Q73-V77 WeakPolarHBondContact O-CG2 3.34Å; Q73-V77 PolarHBondContact O-N 3.21Å
74K94.8Very high94Very high148 Ų14885.8 Ų85.864%0.64342%0.419SS*.Hα-helixtrans-66.4-44.4179-73.2177.9178.7-175.90112.7K70 D71 F76 V77 K78K70-K74 WeakPolarHBondContact O-CG 3.49Å; K70-K74 PolarHBondContact O-N 3.25Å; D71-K74 PolarHBondContact O-N 2.93Å; K74-F76 VanDerWaalsContact C-N 3.3Å; K74-F76 PolarHBondContact O-N 3.21Å; K74-V77 PolarHBondContact O-N 2.95Å; K74-K78 VanDerWaalsContact O-CB 3.24Å; K74-K78 WeakPolarHBondContact O-CB 3.29Å; K74-K78 PolarHBondContact O-N 3.33Å
75D95.5Very high93.4Very high101 Ų10189 Ų8954%0.5443%0.425SS..Hα-helixtrans-64.1-38.4178.6-74.7-8000110.8D71 Y79D71-D75 WeakPolarHBondContact O-CB 3.4Å; D71-D75 VanDerWaalsContact O-CG 3.29Å; D71-D75 PolarHBondContact O-N 3.27Å; D75-Y79 WeakPolarHBondContact O-CB 3.34Å; D75-Y79 PolarHBondContact O-N 2.98Å
76F95.8Very high92.7Very high82 Ų8289.6 Ų89.636%0.3643%0.427SS..Hα-helixtrans-69.4-44.5176.3-171.2-115.3000112.5I47 V49 F72 Q73 K74 K78 Y79 C80I47-F76 HydrophobicContact CB-CD1 4.21Å; I47-F76 HydrophobicContact CG2-CD1 3.68Å; I47-F76 HydrophobicContact CG2-CE1 4.28Å; V49-F76 HydrophobicContact CG2-CD1 3.7Å; V49-F76 HydrophobicContact CG2-CE1 3.93Å; F72-F76 VanDerWaalsContact O-CB 3.29Å; F72-F76 WeakPolarHBondContact O-CB 3.32Å; F72-F76 PolarHBondContact O-N 3.36Å; Q73-F76 PolarHBondContact O-N 3.04Å; K74-F76 VanDerWaalsContact C-N 3.3Å; K74-F76 PolarHBondContact O-N 3.21Å; F76-K78 VanDerWaalsContact C-N 3.31Å; F76-K78 PolarHBondContact O-N 3.29Å; F76-Y79 WeakPolarHBondContact O-CB 3.34Å; F76-Y79 PolarHBondContact O-N 3.43Å; F76-C80 PolarHBondContact O-N 3.45Å; F76-C80 PolarHBondContact O-SG 2.86Å; F76-C80 VanDerWaalsContact O-SG 3.34Å
77V95.2Very high92Very high43 Ų4390.8 Ų90.826%0.26144%0.438SS..Hα-helixtrans-58.2-46.5173170.50000110.6V49 V54 Q73 K74 Y79 C80 V81V49-V77 HydrophobicContact CG1-CG2 4.16Å; V49-V77 HydrophobicContact CG2-CG2 3.64Å; V54-V77 HydrophobicContact CG2-CG2 3.46Å; V54-V77 VanDerWaalsContact CG2-CG2 3.46Å; Q73-V77 VanDerWaalsContact O-CG2 3.23Å; Q73-V77 WeakPolarHBondContact O-CG2 3.34Å; Q73-V77 PolarHBondContact O-N 3.21Å; K74-V77 PolarHBondContact O-N 2.95Å; V77-Y79 VanDerWaalsContact C-N 3.33Å; V77-Y79 PolarHBondContact O-N 2.71Å; V77-C80 PolarHBondContact O-N 3.34Å; V77-V81 WeakPolarHBondContact O-CG2 3.44Å; V77-V81 PolarHBondContact O-N 2.79Å
78K94.8Very high91.1Very high117 Ų11790 Ų9051%0.50944%0.441SS..Hα-helixtrans-58.3-46.5177.1179.3-177.9168.4-172.90111.1K74 F76 C80 V81 E82K74-K78 VanDerWaalsContact O-CB 3.24Å; K74-K78 WeakPolarHBondContact O-CB 3.29Å; K74-K78 PolarHBondContact O-N 3.33Å; F76-K78 VanDerWaalsContact C-N 3.31Å; F76-K78 PolarHBondContact O-N 3.29Å; K78-C80 PolarHBondContact O-N 3.35Å; K78-V81 PolarHBondContact O-N 3.32Å; K78-E82 WeakPolarHBondContact CE-OE1 3.4Å; K78-E82 HydrophobicContact CG-CG 4.32Å; K78-E82 IonicContact NZ-OE1 2.87Å; K78-E82 WeakPolarHBondContact O-CB 3.22Å; K78-E82 WeakPolarHBondContact O-CG 3.17Å; K78-E82 PolarHBondContact O-N 2.79Å
79Y95.1Very high89.6Confident145 Ų14590.7 Ų90.757%0.56944%0.436SS*.Hα-helixtrans-58-46.3175.5173.8-90.9000111.9D75 F76 V77 V81 E82 E83D75-Y79 WeakPolarHBondContact O-CB 3.34Å; D75-Y79 PolarHBondContact O-N 2.98Å; F76-Y79 WeakPolarHBondContact O-CB 3.34Å; F76-Y79 PolarHBondContact O-N 3.43Å; V77-Y79 VanDerWaalsContact C-N 3.33Å; V77-Y79 PolarHBondContact O-N 2.71Å; Y79-V81 PolarHBondContact O-N 2.78Å; Y79-E82 PolarHBondContact O-N 3.06Å; Y79-E83 VanDerWaalsContact O-CB 3.26Å; Y79-E83 WeakPolarHBondContact O-CB 3.37Å; Y79-E83 PolarHBondContact O-N 3.23Å
80C92.1Very high87.8Confident41 Ų4192.8 Ų92.828%0.27745%0.452SS..Hα-helixtrans-59.9-44.3178.6-69.20000112.3F76 V77 K78 E83 E84F76-C80 PolarHBondContact O-N 3.45Å; F76-C80 PolarHBondContact O-SG 2.86Å; F76-C80 VanDerWaalsContact O-SG 3.34Å; V77-C80 PolarHBondContact O-N 3.34Å; K78-C80 PolarHBondContact O-N 3.35Å; C80-E83 PolarHBondContact O-N 3.28Å; C80-E84 WeakPolarHBondContact O-CB 3.39Å; C80-E84 PolarHBondContact O-N 2.91Å
81V90.4Very high85.8Confident67 Ų6795.4 Ų95.441%0.40647%0.466SS..Hα-helixtrans-67.7-44.8177.9175.90000111.4V77 K78 Y79 E83 E84 E85V77-V81 WeakPolarHBondContact O-CG2 3.44Å; V77-V81 PolarHBondContact O-N 2.79Å; K78-V81 PolarHBondContact O-N 3.32Å; Y79-V81 PolarHBondContact O-N 2.78Å; V81-E83 VanDerWaalsContact C-N 3.28Å; V81-E83 PolarHBondContact O-N 3.3Å; V81-E84 PolarHBondContact O-N 2.89Å; V81-E85 HydrophobicContact CG1-CG 4.39Å; V81-E85 WeakPolarHBondContact O-CB 3.14Å; V81-E85 WeakPolarHBondContact O-CG 3.45Å; V81-E85 PolarHBondContact O-N 3.17Å
82E90.8Very high83.7Confident100 Ų100100 Ų10047%0.46748%0.483SS..Hα-helixtrans-63.5-35177.1-74.3179.9167.500112K78 Y79 K86K78-E82 WeakPolarHBondContact CE-OE1 3.4Å; K78-E82 HydrophobicContact CG-CG 4.32Å; K78-E82 IonicContact NZ-OE1 2.87Å; K78-E82 WeakPolarHBondContact O-CB 3.22Å; K78-E82 WeakPolarHBondContact O-CG 3.17Å; K78-E82 PolarHBondContact O-N 2.79Å; Y79-E82 PolarHBondContact O-N 3.06Å; E82-K86 WeakPolarHBondContact O-CB 3.29Å; E82-K86 PolarHBondContact O-N 3.46Å
83E88.4Confident81.4Confident95 Ų95102 Ų10244%0.44450%0.495SS..Hα-helixtrans-70.5-42.3175.8-150.9-76126.500111.2Y79 C80 V81 K86 A87Y79-E83 VanDerWaalsContact O-CB 3.26Å; Y79-E83 WeakPolarHBondContact O-CB 3.37Å; Y79-E83 PolarHBondContact O-N 3.23Å; C80-E83 PolarHBondContact O-N 3.28Å; V81-E83 VanDerWaalsContact C-N 3.28Å; V81-E83 PolarHBondContact O-N 3.3Å; E83-K86 PolarHBondContact O-N 2.89Å; E83-A87 WeakPolarHBondContact O-CB 3.41Å; E83-A87 PolarHBondContact O-N 3.45Å
84E83.9Confident79.1Confident138 Ų138110.3 Ų110.365%0.64553%0.53SS*.Hα-helixtrans-63.4-44.1174.1-174.2177.3-173.300111.8C80 V81 A87 A88C80-E84 WeakPolarHBondContact O-CB 3.39Å; C80-E84 PolarHBondContact O-N 2.91Å; V81-E84 PolarHBondContact O-N 2.89Å; E84-A87 PolarHBondContact O-N 3.3Å; E84-A88 VanDerWaalsContact O-CB 3.25Å; E84-A88 WeakPolarHBondContact O-CB 3.38Å; E84-A88 PolarHBondContact O-N 2.93Å
85E84Confident76.9Confident121 Ų121107.3 Ų107.357%0.56553%0.528SS*.Hα-helixtrans-62.6-42.5173.9-75.9-175.8169.200111.2V81 A88 E89V81-E85 HydrophobicContact CG1-CG 4.39Å; V81-E85 WeakPolarHBondContact O-CB 3.14Å; V81-E85 WeakPolarHBondContact O-CG 3.45Å; V81-E85 PolarHBondContact O-N 3.17Å; E85-A88 CarbonylContact O-C 3.59Å; E85-A88 PolarHBondContact O-N 3.21Å; E85-E89 WeakPolarHBondContact O-CB 3.41Å; E85-E89 WeakPolarHBondContact O-CG 3.18Å; E85-E89 PolarHBondContact O-N 2.97Å
86K83.1Confident74.7Confident131 Ų131107.7 Ų107.757%0.5753%0.534SS*.Hα-helixtrans-65.2-40.7175.7-177.4-175.5171.9-1680111.7E82 E83 E89 M90E82-K86 WeakPolarHBondContact O-CB 3.29Å; E82-K86 PolarHBondContact O-N 3.46Å; E83-K86 PolarHBondContact O-N 2.89Å; K86-E89 CarbonylContact O-C 3.56Å; K86-E89 PolarHBondContact O-N 3.39Å; K86-M90 VanDerWaalsContact O-CG 3.28Å; K86-M90 WeakPolarHBondContact O-CG 3.43Å; K86-M90 PolarHBondContact O-N 3.23Å
87A80.8Confident72.2Confident33 Ų33108.1 Ų108.127%0.27354%0.544SS..Hα-helixtrans-64.3-44.9174.500000110.6E83 E84 E89 M90 H91E83-A87 WeakPolarHBondContact O-CB 3.41Å; E83-A87 PolarHBondContact O-N 3.45Å; E84-A87 PolarHBondContact O-N 3.3Å; A87-E89 VanDerWaalsContact C-N 3.33Å; A87-E89 PolarHBondContact O-N 3.47Å; A87-M90 WeakPolarHBondContact O-CB 3.47Å; A87-M90 PolarHBondContact O-N 2.93Å; A87-M90 VanDerWaalsContact O-N 3.17Å; A87-H91 PolarHBondContact O-CD2 3.43Å; A87-H91 PolarHBondContact O-N 3.41Å
88A76.8Confident70.1Confident57 Ų57113.8 Ų113.847%0.47157%0.568SS.*Hα-helixtrans-63.1-37174.200000112.1E84 E85 H91 K92E84-A88 VanDerWaalsContact O-CB 3.25Å; E84-A88 WeakPolarHBondContact O-CB 3.38Å; E84-A88 PolarHBondContact O-N 2.93Å; E85-A88 CarbonylContact O-C 3.59Å; E85-A88 PolarHBondContact O-N 3.21Å; A88-H91 CarbonylContact O-C 3.21Å; A88-H91 PolarHBondContact O-N 2.99Å; A88-K92 VanDerWaalsContact O-CB 3.29Å; A88-K92 WeakPolarHBondContact O-CB 3.32Å; A88-K92 PolarHBondContact O-N 3.18Å
89E65.6Low67.8Low131 Ų131112.6 Ų112.661%0.61258%0.579SS**Hα-helixtrans-68.5-38171.9-78.5-152143.100111.7E85 K86 A87 H91 K92 M93E85-E89 WeakPolarHBondContact O-CB 3.41Å; E85-E89 WeakPolarHBondContact O-CG 3.18Å; E85-E89 PolarHBondContact O-N 2.97Å; K86-E89 CarbonylContact O-C 3.56Å; K86-E89 PolarHBondContact O-N 3.39Å; A87-E89 VanDerWaalsContact C-N 3.33Å; A87-E89 PolarHBondContact O-N 3.47Å; E89-H91 PolarHBondContact O-N 3.46Å; E89-K92 CarbonylContact O-C 3.52Å; E89-K92 PolarHBondContact O-N 2.9Å; E89-K92 VanDerWaalsContact O-N 3.08Å; E89-M93 WeakPolarHBondContact O-CB 3.45Å; E89-M93 PolarHBondContact O-N 3.07Å
90M58.6Low65.6Low143 Ų143111.5 Ų111.570%0.70458%0.583SS**Hα-helixtrans-62.6-31.1170.9-71.5-160.775.600111.8K86 A87K86-M90 VanDerWaalsContact O-CG 3.28Å; K86-M90 WeakPolarHBondContact O-CG 3.43Å; K86-M90 PolarHBondContact O-N 3.23Å; A87-M90 WeakPolarHBondContact O-CB 3.47Å; A87-M90 PolarHBondContact O-N 2.93Å; A87-M90 VanDerWaalsContact O-N 3.17Å
91H52.8Low63.6Low152 Ų152116.1 Ų116.170%0.70460%0.595SS**Hα-helixtrans-78.1-28.8171.1-74.5-69.7000113.5A87 A88 E89A87-H91 PolarHBondContact O-CD2 3.43Å; A87-H91 PolarHBondContact O-N 3.41Å; A88-H91 CarbonylContact O-C 3.21Å; A88-H91 PolarHBondContact O-N 2.99Å; E89-H91 PolarHBondContact O-N 3.46Å
92K49.6Very low61.7Low158 Ų158120.9 Ų120.969%0.68762%0.615SS**Hα-helixtrans-84.8-23.1177.7-160.8176.5-178.8-177.10113.1A88 E89 K94 S95A88-K92 VanDerWaalsContact O-CB 3.29Å; A88-K92 WeakPolarHBondContact O-CB 3.32Å; A88-K92 PolarHBondContact O-N 3.18Å; E89-K92 CarbonylContact O-C 3.52Å; E89-K92 PolarHBondContact O-N 2.9Å; E89-K92 VanDerWaalsContact O-N 3.08Å; K92-K94 PolarHBondContact O-N 2.89Å; K92-S95 PolarHBondContact O-N 3.39Å; K92-S95 VanDerWaalsContact O-N 3.12Å
93M46Very low60Low119 Ų119119.4 Ų119.459%0.58662%0.616SS**THydrogen-bonded Turntrans-78.721.4176.6-160.8151.2135.300112.7E89E89-M93 WeakPolarHBondContact O-CB 3.45Å; E89-M93 PolarHBondContact O-N 3.07Å
94K47.1Very low58.7Low194 Ų194119.5 Ų119.584%0.84362%0.622SS**THydrogen-bonded Turntrans-76.4-6.3152.4-86.8178.3175.6175.40113K92K92-K94 PolarHBondContact O-N 2.89Å
95S49.1Very low58.1Low86 Ų86116.8 Ų116.860%0.60161%0.612SS**SBendtrans-140.4111.5168.152.40000111.7K92K92-S95 PolarHBondContact O-N 3.39Å; K92-S95 VanDerWaalsContact O-N 3.12Å
96T48.1Very low58Low109 Ų109113.5 Ų113.567%0.66961%0.606SS**  trans77.3106.7173.2-33.30000112.8
97T43.4Very low58.2Low91 Ų91112 Ų11256%0.55861%0.608SS**  -171.914283.4-58.60000110.4
98Q52.2Low58.7Low162 Ų162114.1 Ų114.176%0.75761%0.612SS**  trans-104.479.1-162-178.5-179.43.600110.3
99A46.1Very low59.4Low92 Ų92112.8 Ų112.876%0.7660%0.596SS**SBendtrans-156.7-28.2169.700000114.2
100N49.1Very low60.8Low122 Ų122111 Ų11165%0.65259%0.588SS**SBendtrans-102.816.5176.8-147.614.9000113.4M102N100-M102 PolarHBondContact O-N 3.29Å
101R49.3Very low62.6Low138 Ų138108.2 Ų108.252%0.52158%0.579SS.*Hα-helixtrans-71.2-25-173-77.1-176.9174.4153-1114.3D105R101-D105 WeakPolarHBondContact O-CB 3.37Å; R101-D105 PolarHBondContact O-N 2.83Å
102M51.3Low64.7Low166 Ų166102 Ų10282%0.81855%0.551SS**Hα-helixtrans-75.8-30.3-165.4-70.9166.965.800114.5N100 A106N100-M102 PolarHBondContact O-N 3.29Å; M102-A106 VanDerWaalsContact O-CB 3.23Å; M102-A106 WeakPolarHBondContact O-CB 3.28Å; M102-A106 PolarHBondContact O-N 3.4Å
103S55.8Low67Low70 Ų7097.3 Ų97.349%0.4953%0.529SS..Hα-helixtrans-86.1-39-176.355.20000113.1V107S103-V107 WeakPolarHBondContact O-CG2 3.47Å; S103-V107 PolarHBondContact O-N 2.96Å
104V60.3Low69.4Low96 Ų9698.4 Ų98.458%0.58253%0.531SS*.Hα-helixtrans-72.5-40.9178.3-178.30000110.9A106 V107 E108V104-A106 VanDerWaalsContact C-N 3.31Å; V104-A106 PolarHBondContact O-N 2.99Å; V104-V107 PolarHBondContact O-N 2.95Å; V104-E108 WeakPolarHBondContact O-CB 3.41Å; V104-E108 PolarHBondContact O-N 3.45Å
105D71.6Confident71.8Confident81 Ų8192.1 Ų92.143%0.43351%0.509SS..Hα-helixtrans-64.3-35.9176.3-16843000111.8R101 E108 I109 L167R101-D105 WeakPolarHBondContact O-CB 3.37Å; R101-D105 PolarHBondContact O-N 2.83Å; D105-E108 PolarHBondContact O-N 2.86Å; D105-I109 WeakPolarHBondContact O-CB 3.45Å; D105-I109 VanDerWaalsContact O-CG2 3.26Å; D105-I109 WeakPolarHBondContact O-CG2 2.74Å; D105-I109 PolarHBondContact O-N 2.86Å; D105-L167 WeakPolarHBondContact OD1-CD1 3.25Å
106A81.4Confident74.2Confident53 Ų5388 Ų8844%0.43848%0.48SS..Hα-helixtrans-68-36.9175.700000113.3M102 V104 I109 E110M102-A106 VanDerWaalsContact O-CB 3.23Å; M102-A106 WeakPolarHBondContact O-CB 3.28Å; M102-A106 PolarHBondContact O-N 3.4Å; V104-A106 VanDerWaalsContact C-N 3.31Å; V104-A106 PolarHBondContact O-N 2.99Å; A106-I109 VanDerWaalsContact O-CG2 3.29Å; A106-I109 WeakPolarHBondContact O-CG2 3.35Å; A106-E110 WeakPolarHBondContact O-CB 3.47Å; A106-E110 PolarHBondContact O-N 3.45Å
107V86.9Confident76.5Confident100 Ų10084.8 Ų84.861%0.60646%0.457SS*.Hα-helixtrans-73.8-38.9175.6175.40000110.8S103 V104 E110 T111S103-V107 WeakPolarHBondContact O-CG2 3.47Å; S103-V107 PolarHBondContact O-N 2.96Å; V104-V107 PolarHBondContact O-N 2.95Å; V107-E110 PolarHBondContact O-N 3.47Å; V107-T111 PolarHBondContact O-N 3.24Å; V107-T111 PolarHBondContact O-OG1 2.89Å
108E91Very high79.1Confident77 Ų7784.8 Ų84.836%0.3645%0.454SS..Hα-helixtrans-64.9-48.6177.7-172-180172.800111.6V104 D105 E110 T111 L112 K171V104-E108 WeakPolarHBondContact O-CB 3.41Å; V104-E108 PolarHBondContact O-N 3.45Å; D105-E108 PolarHBondContact O-N 2.86Å; E108-E110 VanDerWaalsContact C-N 3.27Å; E108-E110 PolarHBondContact O-N 3.2Å; E108-T111 PolarHBondContact O-N 3.44Å; E108-L112 HydrophobicContact CG-CD1 4.22Å; E108-L112 VanDerWaalsContact O-CG 3.32Å; E108-L112 WeakPolarHBondContact O-CG 3.41Å; E108-L112 PolarHBondContact O-N 3.42Å; E108-K171 WeakPolarHBondContact OE1-CE 3.41Å; E108-K171 IonicContact OE1-NZ 3.95Å; E108-K171 PolarHBondContact OE1-NZ 3.47Å
109I93.2Very high81.3Confident28 Ų2879.1 Ų79.114%0.14443%0.426CS..Hα-helixtrans-61.2-37.5178.7-164.6172.9000111.6D105 A106 L112 R113 L167 L170D105-I109 WeakPolarHBondContact O-CB 3.45Å; D105-I109 VanDerWaalsContact O-CG2 3.26Å; D105-I109 WeakPolarHBondContact O-CG2 2.74Å; D105-I109 PolarHBondContact O-N 2.86Å; A106-I109 VanDerWaalsContact O-CG2 3.29Å; A106-I109 WeakPolarHBondContact O-CG2 3.35Å; I109-L112 PolarHBondContact O-N 3.35Å; I109-R113 WeakPolarHBondContact O-CB 3.24Å; I109-R113 VanDerWaalsContact O-CG 3.25Å; I109-R113 WeakPolarHBondContact O-CG 3.39Å; I109-R113 PolarHBondContact O-N 3.01Å; I109-L167 HydrophobicContact CD1-CB 4.38Å; I109-L167 HydrophobicContact CG1-CB 4.49Å; I109-L170 HydrophobicContact CG1-CD1 3.84Å
110E95.1Very high83.7Confident95 Ų9574.7 Ų74.744%0.44439%0.39SS..Hα-helixtrans-70-38.6179.2-162.655.4-147.900112A106 V107 E108 L112 R113 K114A106-E110 WeakPolarHBondContact O-CB 3.47Å; A106-E110 PolarHBondContact O-N 3.45Å; V107-E110 PolarHBondContact O-N 3.47Å; E108-E110 VanDerWaalsContact C-N 3.27Å; E108-E110 PolarHBondContact O-N 3.2Å; E110-L112 VanDerWaalsContact C-N 3.34Å; E110-L112 PolarHBondContact O-N 2.93Å; E110-R113 PolarHBondContact O-N 3.44Å; E110-R113 WeakPolarHBondContact OE2-CD 3.41Å; E110-R113 IonicContact OE2-NH1 3.15Å; E110-R113 PolarHBondContact OE2-NH1 3.1Å; E110-R113 VanDerWaalsContact OE2-NH1 3.16Å; E110-K114 PolarHBondContact O-N 3.41Å
111T95.6Very high86Confident83 Ų8369.5 Ų69.551%0.50936%0.363SS..Hα-helixtrans-62.8-42.5173.4-55.60000111.3V107 E108 K114 T115V107-T111 PolarHBondContact O-N 3.24Å; V107-T111 PolarHBondContact O-OG1 2.89Å; E108-T111 PolarHBondContact O-N 3.44Å; T111-K114 PolarHBondContact O-N 3.27Å; T111-T115 WeakPolarHBondContact O-CB 3.47Å; T111-T115 PolarHBondContact O-N 2.95Å; T111-T115 PolarHBondContact O-OG1 3Å
112L96.3Very high88.3Confident23 Ų2368.1 Ų68.112%0.1236%0.36CS..Hα-helixtrans-64.2-45176.3-71.3170000111.7E108 I109 E110 K114 T115 V116 L167 L170 K171 L174E108-L112 HydrophobicContact CG-CD1 4.22Å; E108-L112 VanDerWaalsContact O-CG 3.32Å; E108-L112 WeakPolarHBondContact O-CG 3.41Å; E108-L112 PolarHBondContact O-N 3.42Å; I109-L112 PolarHBondContact O-N 3.35Å; E110-L112 VanDerWaalsContact C-N 3.34Å; E110-L112 PolarHBondContact O-N 2.93Å; L112-K114 PolarHBondContact O-N 3.06Å; L112-T115 PolarHBondContact O-N 3.34Å; L112-V116 WeakPolarHBondContact O-CB 3.34Å; L112-V116 WeakPolarHBondContact O-CG2 3.26Å; L112-V116 PolarHBondContact O-N 2.85Å; L112-L167 HydrophobicContact CD1-CG 4.18Å; L112-L170 HydrophobicContact CB-CB 3.99Å; L112-L170 HydrophobicContact CB-CD1 4.1Å; L112-L170 HydrophobicContact CD1-CB 4.45Å; L112-K171 HydrophobicContact CD1-CD 4.42Å; L112-K171 HydrophobicContact CD1-CG 3.74Å; L112-K171 HydrophobicContact CD2-CG 4.18Å; L112-L174 HydrophobicContact CD2-CD1 3.61Å
113R97.7Very high90.4Very high59 Ų5960.8 Ų60.822%0.22333%0.325CS..Hα-helixtrans-56.3-49175.8-76.7169.5175.1155.2-2111.6I109 E110 T115 V116 E117 E163 L170I109-R113 WeakPolarHBondContact O-CB 3.24Å; I109-R113 VanDerWaalsContact O-CG 3.25Å; I109-R113 WeakPolarHBondContact O-CG 3.39Å; I109-R113 PolarHBondContact O-N 3.01Å; E110-R113 PolarHBondContact O-N 3.44Å; E110-R113 WeakPolarHBondContact OE2-CD 3.41Å; E110-R113 IonicContact OE2-NH1 3.15Å; E110-R113 PolarHBondContact OE2-NH1 3.1Å; E110-R113 VanDerWaalsContact OE2-NH1 3.16Å; R113-T115 PolarHBondContact O-N 3.48Å; R113-V116 PolarHBondContact O-N 2.97Å; R113-E117 WeakPolarHBondContact O-CB 3.08Å; R113-E117 PolarHBondContact O-N 3.28Å; R113-E163 PolarHBondContact NE-O 3.08Å; R113-E163 PolarHBondContact NH2-O 3.41Å; R113-L170 HydrophobicContact CG-CD1 3.66Å; R113-L170 HydrophobicContact CG-CD2 4.31Å
114K97.6Very high92.4Very high141 Ų14157.9 Ų57.961%0.61330%0.304SS*.Hα-helixtrans-60.7-45177.6-175.6171.3-176.9136.40112.1E110 T111 L112 V116 E117 D118E110-K114 PolarHBondContact O-N 3.41Å; T111-K114 PolarHBondContact O-N 3.27Å; L112-K114 PolarHBondContact O-N 3.06Å; K114-V116 PolarHBondContact O-N 2.84Å; K114-E117 PolarHBondContact O-N 2.86Å; K114-D118 PolarHBondContact O-N 2.8Å
115T97.6Very high94.1Very high63 Ų6353.3 Ų53.339%0.38728%0.276SS..Hα-helixtrans-64.9-40.5-179.6-530000111.8T111 L112 R113 Y119 L174T111-T115 WeakPolarHBondContact O-CB 3.47Å; T111-T115 PolarHBondContact O-N 2.95Å; T111-T115 PolarHBondContact O-OG1 3Å; L112-T115 PolarHBondContact O-N 3.34Å; R113-T115 PolarHBondContact O-N 3.48Å; T115-Y119 VanDerWaalsContact O-CB 3.29Å; T115-Y119 WeakPolarHBondContact O-CB 3.45Å; T115-Y119 PolarHBondContact O-N 3.32Å; T115-L174 HydrophobicContact CG2-CD1 3.92Å; T115-L174 HydrophobicContact CG2-CD2 3.77Å
116V98Very high95.2Very high0 Ų056.7 Ų56.70%029%0.287CS..Hα-helixtrans-67.5-40.9175.5172.20000111.2L112 R113 K114 Y119 F120 P162 L170 I173 L174L112-V116 WeakPolarHBondContact O-CB 3.34Å; L112-V116 WeakPolarHBondContact O-CG2 3.26Å; L112-V116 PolarHBondContact O-N 2.85Å; R113-V116 PolarHBondContact O-N 2.97Å; K114-V116 PolarHBondContact O-N 2.84Å; V116-Y119 PolarHBondContact O-N 2.95Å; V116-F120 HydrophobicContact CG1-CD2 3.95Å; V116-F120 HydrophobicContact CG1-CE1 4.18Å; V116-F120 HydrophobicContact CG1-CE2 3.59Å; V116-F120 HydrophobicContact CG1-CG 4.4Å; V116-F120 HydrophobicContact CG1-CZ 3.72Å; V116-F120 WeakPolarHBondContact O-CG 3.22Å; V116-F120 PolarHBondContact O-N 3.5Å; V116-P162 HydrophobicContact CB-CB 4.23Å; V116-P162 HydrophobicContact CB-CG 4.44Å; V116-P162 HydrophobicContact CG1-CB 4Å; V116-P162 HydrophobicContact CG1-CG 3.88Å; V116-L170 HydrophobicContact CB-CD2 4Å; V116-L170 HydrophobicContact CG1-CD2 4.26Å; V116-L170 HydrophobicContact CG2-CB 4.47Å; V116-L170 HydrophobicContact CG2-CD2 3.76Å; V116-I173 HydrophobicContact CG1-CD1 4.5Å; V116-I173 HydrophobicContact CG1-CG2 3.93Å; V116-I173 HydrophobicContact CG2-CB 4.46Å; V116-I173 HydrophobicContact CG2-CG2 3.98Å; V116-L174 HydrophobicContact CG2-CD1 4.09Å; V116-L174 HydrophobicContact CG2-CD2 3.7Å; V116-L174 HydrophobicContact CG2-CG 3.65Å
117E98Very high95.9Very high41 Ų4155.9 Ų55.919%0.19228%0.281CS..Hα-helixtrans-59.3-51.3175.6-178.561.5-151.400111.5R113 K114 Y119 F120 C121 Y138 H161 P162R113-E117 WeakPolarHBondContact O-CB 3.08Å; R113-E117 PolarHBondContact O-N 3.28Å; K114-E117 PolarHBondContact O-N 2.86Å; E117-Y119 VanDerWaalsContact C-N 3.26Å; E117-Y119 PolarHBondContact O-N 3.41Å; E117-F120 PolarHBondContact O-N 3.37Å; E117-C121 PolarHBondContact O-N 3.02Å; E117-C121 PolarHBondContact O-SG 3.48Å; E117-Y138 VanDerWaalsContact CD-OH 3.31Å; E117-Y138 WeakPolarHBondContact OE1-CE2 3.42Å; E117-Y138 PolarHBondContact OE1-OH 3.42Å; E117-Y138 WeakPolarHBondContact OE2-CE2 3.4Å; E117-Y138 PolarHBondContact OE2-OH 2.99Å; E117-H161 IonicContact OE2-NE2 3.16Å; E117-P162 HydrophobicContact CB-CG 4.06Å; E117-P162 WeakPolarHBondContact OE2-CD 3.31Å; E117-P162 WeakPolarHBondContact OE2-CG 3.35Å
118D97.6Very high96.2Very high91 Ų9153.5 Ų53.549%0.48726%0.264SS..Hα-helixtrans-59.9-40178.2-71.3-23.1000111K114 C121 F122K114-D118 PolarHBondContact O-N 2.8Å; D118-C121 PolarHBondContact O-N 2.8Å; D118-F122 WeakPolarHBondContact O-CB 3.33Å; D118-F122 PolarHBondContact O-N 3.4Å
119Y97.6Very high96.4Very high42 Ų4253.2 Ų53.217%0.16528%0.282CS..Hα-helixtrans-65.4-43.9177.1-179.7-106.5000112.7T115 V116 E117 F122 C123 K177 I180T115-Y119 VanDerWaalsContact O-CB 3.29Å; T115-Y119 WeakPolarHBondContact O-CB 3.45Å; T115-Y119 PolarHBondContact O-N 3.32Å; V116-Y119 PolarHBondContact O-N 2.95Å; E117-Y119 VanDerWaalsContact C-N 3.26Å; E117-Y119 PolarHBondContact O-N 3.41Å; Y119-F122 WeakPolarHBondContact O-CB 3.42Å; Y119-F122 PolarHBondContact O-N 3.2Å; Y119-C123 PolarHBondContact O-N 3.25Å; Y119-C123 PolarHBondContact OH-SG 3.05Å; Y119-K177 HydrophobicContact CD1-CB 4.37Å; Y119-K177 HydrophobicContact CD2-CD 4.23Å; Y119-K177 HydrophobicContact CE1-CB 3.78Å; Y119-K177 HydrophobicContact CE2-CB 4.06Å; Y119-K177 HydrophobicContact CE2-CD 3.98Å; Y119-K177 HydrophobicContact CE2-CG 4.4Å; Y119-K177 PolarHBondContact OH-O 3.1Å; Y119-I180 HydrophobicContact CE1-CB 4.19Å; Y119-I180 HydrophobicContact CE1-CG2 4.37Å
120F97.9Very high96.4Very high0 Ų056.5 Ų56.50%030%0.295CS..Hα-helixtrans-64.4-40.2175.2-73.1-13.4000111.9V116 E117 F122 C123 Y124 V136 Y138 L153 F159 P162 Y165 I173 I180 F182V116-F120 HydrophobicContact CG1-CD2 3.95Å; V116-F120 HydrophobicContact CG1-CE1 4.18Å; V116-F120 HydrophobicContact CG1-CE2 3.59Å; V116-F120 HydrophobicContact CG1-CG 4.4Å; V116-F120 HydrophobicContact CG1-CZ 3.72Å; V116-F120 WeakPolarHBondContact O-CG 3.22Å; V116-F120 PolarHBondContact O-N 3.5Å; E117-F120 PolarHBondContact O-N 3.37Å; F120-F122 VanDerWaalsContact C-N 3.3Å; F120-F122 PolarHBondContact O-N 3.01Å; F120-C123 PolarHBondContact O-N 2.96Å; F120-Y124 VanDerWaalsContact O-CB 3.32Å; F120-Y124 WeakPolarHBondContact O-CB 3.33Å; F120-Y124 PolarHBondContact O-N 3.46Å; F120-V136 HydrophobicContact CB-CG2 3.96Å; F120-V136 WeakPolarHBondContact O-CG2 3.35Å; F120-Y138 HydrophobicContact CD2-CE1 4.42Å; F120-L153 HydrophobicContact CZ-CD2 4.26Å; F120-F159 AromaticContact CD2-CE2 3.97Å; F120-F159 HydrophobicContact CD2-CE2 3.97Å; F120-F159 HydrophobicContact CE2-CD2 4.46Å; F120-F159 AromaticContact CE2-CE2 3.87Å; F120-F159 HydrophobicContact CE2-CE2 3.87Å; F120-F159 HydrophobicContact CG-CE2 4.49Å; F120-F159 HydrophobicContact CZ-CE2 4.32Å; F120-P162 HydrophobicContact CD2-CG 3.96Å; F120-P162 HydrophobicContact CE2-CG 4.17Å; F120-Y165 HydrophobicContact CE2-CE2 4.09Å; F120-Y165 HydrophobicContact CZ-CE2 4.49Å; F120-I173 HydrophobicContact CE1-CG2 4.03Å; F120-I173 HydrophobicContact CZ-CD1 4.16Å; F120-I173 HydrophobicContact CZ-CG2 4.12Å; F120-I180 HydrophobicContact CE1-CD1 4.49Å; F120-I180 HydrophobicContact CE1-CG2 4.21Å; F120-F182 HydrophobicContact CB-CE2 4.46Å; F120-F182 HydrophobicContact CB-CZ 4.11Å; F120-F182 HydrophobicContact CD1-CE2 4.12Å; F120-F182 HydrophobicContact CD1-CZ 4.26Å; F120-F182 HydrophobicContact CG-CE2 4.46Å; F120-F182 HydrophobicContact CG-CZ 4.2Å
121C97.3Very high96.1Very high13 Ų1358.2 Ų58.29%0.08832%0.318CS..Hα-helixtrans-59.8-41.7173.7-68.80000112.2E117 D118 G125 V134E117-C121 PolarHBondContact O-N 3.02Å; E117-C121 PolarHBondContact O-SG 3.48Å; D118-C121 PolarHBondContact O-N 2.8Å; C121-G125 PolarHBondContact O-N 2.94Å; C121-V134 CarbonylContact C-O 3.5Å; C121-V134 WeakPolarHBondContact CA-O 3.34Å; C121-V134 WeakPolarHBondContact CB-O 3.48Å; C121-V134 PolarHBondContact O-N 2.96Å; C121-V134 VanDerWaalsContact O-O 3.07Å
122F96.7Very high95.9Very high108 Ų10858.6 Ų58.647%0.47432%0.32SS..Hα-helixtrans-63.6-49.4174.6173-99.1000111.9D118 Y119 F120 Y124 G125 K126D118-F122 WeakPolarHBondContact O-CB 3.33Å; D118-F122 PolarHBondContact O-N 3.4Å; Y119-F122 WeakPolarHBondContact O-CB 3.42Å; Y119-F122 PolarHBondContact O-N 3.2Å; F120-F122 VanDerWaalsContact C-N 3.3Å; F120-F122 PolarHBondContact O-N 3.01Å; F122-Y124 VanDerWaalsContact C-N 3.34Å; F122-Y124 PolarHBondContact O-N 3.13Å; F122-G125 PolarHBondContact O-N 3.38Å; F122-K126 WeakPolarHBondContact O-CB 3.33Å; F122-K126 PolarHBondContact O-N 3.02Å
123C96.2Very high95.7Very high12 Ų1262.4 Ų62.48%0.08134%0.344CS..Hα-helixtrans-63.4-39.1-179.9-770000112.8Y119 F120 K126 A127 F182Y119-C123 PolarHBondContact O-N 3.25Å; Y119-C123 PolarHBondContact OH-SG 3.05Å; F120-C123 PolarHBondContact O-N 2.96Å; C123-K126 PolarHBondContact O-N 3.17Å; C123-A127 WeakPolarHBondContact O-CB 3.23Å; C123-A127 PolarHBondContact O-N 3.43Å; C123-F182 HydrophobicContact CB-CD2 3.62Å; C123-F182 HydrophobicContact CB-CE2 3.8Å
124Y96.6Very high95.6Very high10 Ų1060 Ų604%0.03934%0.336CS..Hα-helixtrans-67.3-43.6175.7-177.1-114.7000111.9F120 F122 K126 A127 L128 V134 V136 P137 V148 F182 I184F120-Y124 VanDerWaalsContact O-CB 3.32Å; F120-Y124 WeakPolarHBondContact O-CB 3.33Å; F120-Y124 PolarHBondContact O-N 3.46Å; F122-Y124 VanDerWaalsContact C-N 3.34Å; F122-Y124 PolarHBondContact O-N 3.13Å; Y124-K126 VanDerWaalsContact C-N 3.33Å; Y124-K126 PolarHBondContact O-N 2.69Å; Y124-A127 PolarHBondContact O-N 3.2Å; Y124-L128 HydrophobicContact CD1-CD1 3.9Å; Y124-L128 HydrophobicContact CE1-CD1 3.45Å; Y124-L128 VanDerWaalsContact CE1-CD1 3.45Å; Y124-L128 HydrophobicContact CE1-CG 4.32Å; Y124-L128 HydrophobicContact CE2-CD1 4.39Å; Y124-L128 HydrophobicContact CE2-CG 4.42Å; Y124-L128 WeakPolarHBondContact O-CG 3.45Å; Y124-L128 PolarHBondContact O-N 3.12Å; Y124-V134 HydrophobicContact CD1-CB 4.08Å; Y124-V134 HydrophobicContact CD1-CG1 3.85Å; Y124-V134 HydrophobicContact CE1-CG1 3.86Å; Y124-V136 HydrophobicContact CD1-CG2 4.44Å; Y124-V136 HydrophobicContact CG-CG2 4.23Å; Y124-P137 VanDerWaalsContact CE1-CD 3.46Å; Y124-P137 HydrophobicContact CE1-CG 4.21Å; Y124-V148 HydrophobicContact CE2-CG2 4.41Å; Y124-F182 AromaticContact CD2-CD1 3.86Å; Y124-F182 HydrophobicContact CD2-CD1 3.86Å; Y124-F182 HydrophobicContact CD2-CE1 4.39Å; Y124-F182 HydrophobicContact CG-CD1 4.49Å; Y124-I184 HydrophobicContact CD2-CD1 4.3Å; Y124-I184 HydrophobicContact CE2-CD1 3.94Å
125G95.8Very high95.6Very high0 Ų058 Ų580%034%0.337CS..Hα-helixtrans-58.2-45173.100000112.5C121 F122 A127 L128 G129 K130C121-G125 PolarHBondContact O-N 2.94Å; F122-G125 PolarHBondContact O-N 3.38Å; G125-A127 PolarHBondContact O-N 3.13Å; G125-L128 CarbonylContact O-C 3.59Å; G125-L128 WeakPolarHBondContact O-CB 3.29Å; G125-L128 PolarHBondContact O-N 2.92Å; G125-G129 PolarHBondContact O-N 3.29Å; G125-K130 CarbonylContact C-O 3.59Å; G125-K130 PolarHBondContact O-N 3.43Å
126K95.3Very high95.5Very high151 Ų15155.5 Ų55.566%0.65732%0.322SS*.Hα-helixtrans-60.3-44.3174.9-175.7-177.8176-175.30112F122 C123 Y124 L128 G129F122-K126 WeakPolarHBondContact O-CB 3.33Å; F122-K126 PolarHBondContact O-N 3.02Å; C123-K126 PolarHBondContact O-N 3.17Å; Y124-K126 VanDerWaalsContact C-N 3.33Å; Y124-K126 PolarHBondContact O-N 2.69Å; K126-L128 VanDerWaalsContact C-N 3.26Å; K126-L128 PolarHBondContact O-N 2.96Å; K126-G129 PolarHBondContact O-N 3.1Å
127A95.3Very high95.4Very high37 Ų3756.6 Ų56.631%0.30633%0.329SS..Hα-helixtrans-66.6-27.6177.800000113.2C123 Y124 G125 G129 F182 I184C123-A127 WeakPolarHBondContact O-CB 3.23Å; C123-A127 PolarHBondContact O-N 3.43Å; Y124-A127 PolarHBondContact O-N 3.2Å; G125-A127 PolarHBondContact O-N 3.13Å; A127-G129 VanDerWaalsContact C-N 3.26Å; A127-F182 HydrophobicContact CB-CB 3.72Å; A127-F182 WeakPolarHBondContact CB-O 3.34Å; A127-I184 HydrophobicContact CB-CD1 3.83Å; A127-I184 HydrophobicContact CB-CG1 3.99Å
128L94.5Very high95.3Very high50 Ų5055 Ų5526%0.26232%0.321SS..THydrogen-bonded Turntrans-77.8-7.1170.7-73.7171000113.5Y124 G125 K126 K130 V134 I184 P187Y124-L128 HydrophobicContact CD1-CD1 3.9Å; Y124-L128 HydrophobicContact CE1-CD1 3.45Å; Y124-L128 VanDerWaalsContact CE1-CD1 3.45Å; Y124-L128 HydrophobicContact CE1-CG 4.32Å; Y124-L128 HydrophobicContact CE2-CD1 4.39Å; Y124-L128 HydrophobicContact CE2-CG 4.42Å; Y124-L128 WeakPolarHBondContact O-CG 3.45Å; Y124-L128 PolarHBondContact O-N 3.12Å; G125-L128 CarbonylContact O-C 3.59Å; G125-L128 WeakPolarHBondContact O-CB 3.29Å; G125-L128 PolarHBondContact O-N 2.92Å; K126-L128 VanDerWaalsContact C-N 3.26Å; K126-L128 PolarHBondContact O-N 2.96Å; L128-K130 VanDerWaalsContact C-N 3.29Å; L128-K130 HydrophobicContact CB-CG 4.18Å; L128-V134 HydrophobicContact CD1-CB 4.38Å; L128-V134 HydrophobicContact CD1-CG1 3.92Å; L128-V134 HydrophobicContact CD1-CG2 4.32Å; L128-I184 HydrophobicContact CB-CD1 4.22Å; L128-I184 HydrophobicContact CD2-CD1 3.32Å; L128-I184 HydrophobicContact CG-CD1 3.43Å; L128-I184 VanDerWaalsContact CG-CD1 3.43Å; L128-P187 HydrophobicContact CD2-CB 4.3Å
129G93.8Very high95.1Very high71 Ų7156.6 Ų56.673%0.73233%0.326SS*.THydrogen-bonded Turntrans71.920.5-173.300000113.9G125 K126 A127G125-G129 PolarHBondContact O-N 3.29Å; K126-G129 PolarHBondContact O-N 3.1Å; A127-G129 VanDerWaalsContact C-N 3.26Å
130K93.6Very high94.9Very high96 Ų9658.1 Ų58.142%0.41733%0.333SS..  trans-93.2142175.1-62.1-172.2-171.3170.50110G125 L128 T132 V134G125-K130 CarbonylContact C-O 3.59Å; G125-K130 PolarHBondContact O-N 3.43Å; L128-K130 VanDerWaalsContact C-N 3.29Å; L128-K130 HydrophobicContact CB-CG 4.18Å; K130-T132 VanDerWaalsContact C-N 3.35Å; K130-V134 HydrophobicContact CB-CG2 4.18Å; K130-V134 HydrophobicContact CD-CG2 3.68Å; K130-V134 HydrophobicContact CG-CG2 4.47Å
131S89.2Confident94.8Very high132 Ų13258.4 Ų58.492%0.92333%0.334SS*.SBendtrans-81.6-14.7175.653.60000113.5
132T90.8Very high94.5Very high90 Ų9062 Ų6255%0.55235%0.352SS*.SBendtrans-93.6154.9177.161.50000111K130K130-T132 VanDerWaalsContact C-N 3.35Å
133V92.9Very high94.4Very high103 Ų10366.2 Ų66.262%0.62437%0.365SS*.  trans-61.7138.6167.2-63.30000110.2
134V95.9Very high94.2Very high8 Ų867.9 Ų67.95%0.04837%0.373CS..  trans-128.6123.3-178.6-176.40000108.7C121 Y124 L128 K130 V136C121-V134 CarbonylContact C-O 3.5Å; C121-V134 WeakPolarHBondContact CA-O 3.34Å; C121-V134 WeakPolarHBondContact CB-O 3.48Å; C121-V134 PolarHBondContact O-N 2.96Å; C121-V134 VanDerWaalsContact O-O 3.07Å; Y124-V134 HydrophobicContact CD1-CB 4.08Å; Y124-V134 HydrophobicContact CD1-CG1 3.85Å; Y124-V134 HydrophobicContact CE1-CG1 3.86Å; L128-V134 HydrophobicContact CD1-CB 4.38Å; L128-V134 HydrophobicContact CD1-CG1 3.92Å; L128-V134 HydrophobicContact CD1-CG2 4.32Å; K130-V134 HydrophobicContact CB-CG2 4.18Å; K130-V134 HydrophobicContact CD-CG2 3.68Å; K130-V134 HydrophobicContact CG-CG2 4.47Å; V134-V136 PolarHBondContact O-N 2.88Å
135P96.6Very high93.9Very high100 Ų10074.3 Ų74.365%0.64940%0.404SS*.  trans-54.6137.1175.9-26.335.1000112.2
136V96.8Very high93.6Very high10 Ų1077.5 Ų77.56%0.06143%0.426CS..  trans-80.7125.9-179.3-173.90000110.2F120 Y124 V134 Y138 M141 F159 F182F120-V136 HydrophobicContact CB-CG2 3.96Å; F120-V136 WeakPolarHBondContact O-CG2 3.35Å; Y124-V136 HydrophobicContact CD1-CG2 4.44Å; Y124-V136 HydrophobicContact CG-CG2 4.23Å; V134-V136 PolarHBondContact O-N 2.88Å; V136-Y138 VanDerWaalsContact C-N 3.28Å; V136-Y138 HydrophobicContact CB-CD2 4.27Å; V136-Y138 HydrophobicContact CB-CE1 4.23Å; V136-Y138 HydrophobicContact CB-CE2 3.85Å; V136-Y138 HydrophobicContact CG1-CD1 4.22Å; V136-Y138 HydrophobicContact CG1-CE1 4.06Å; V136-Y138 HydrophobicContact CG1-CE2 4.43Å; V136-Y138 HydrophobicContact CG1-CG 4.45Å; V136-Y138 WeakPolarHBondContact O-CD2 3.37Å; V136-Y138 PolarHBondContact O-N 2.79Å; V136-M141 HydrophobicContact CG1-SD 3.44Å; V136-M141 WeakPolarHBondContact CG1-SD 3.47Å; V136-F159 HydrophobicContact CG1-CE1 4.39Å; V136-F159 HydrophobicContact CG1-CZ 3.96Å; V136-F182 HydrophobicContact CG1-CE1 4.04Å
137P95.4Very high93.5Very high23 Ų2370.3 Ų70.315%0.14940%0.395CS..  trans-83.470.9-179.834.3-35.8000111.1Y124 E139 K140 M141 F188Y124-P137 VanDerWaalsContact CE1-CD 3.46Å; Y124-P137 HydrophobicContact CE1-CG 4.21Å; P137-E139 VanDerWaalsContact C-N 3.3Å; P137-E139 PolarHBondContact O-N 3.34Å; P137-K140 HydrophobicContact CB-CB 4.14Å; P137-K140 HydrophobicContact CB-CD 4.02Å; P137-K140 HydrophobicContact CB-CG 4.17Å; P137-K140 PolarHBondContact O-N 2.89Å; P137-M141 HydrophobicContact CG-CG 4.45Å; P137-M141 PolarHBondContact O-N 3.23Å; P137-F188 HydrophobicContact CG-CD2 3.65Å; P137-F188 HydrophobicContact CG-CE2 4.12Å; P137-F188 HydrophobicContact CG-CG 4.49Å
138Y95.6Very high93.6Very high8 Ų868.8 Ų68.83%0.03138%0.382CS..Hα-helixtrans-50.5-45-174.7-65.1-79.9000113E117 F120 V136 K140 M141 L142 F159 H161 P162E117-Y138 VanDerWaalsContact CD-OH 3.31Å; E117-Y138 WeakPolarHBondContact OE1-CE2 3.42Å; E117-Y138 PolarHBondContact OE1-OH 3.42Å; E117-Y138 WeakPolarHBondContact OE2-CE2 3.4Å; E117-Y138 PolarHBondContact OE2-OH 2.99Å; F120-Y138 HydrophobicContact CD2-CE1 4.42Å; V136-Y138 VanDerWaalsContact C-N 3.28Å; V136-Y138 HydrophobicContact CB-CD2 4.27Å; V136-Y138 HydrophobicContact CB-CE1 4.23Å; V136-Y138 HydrophobicContact CB-CE2 3.85Å; V136-Y138 HydrophobicContact CG1-CD1 4.22Å; V136-Y138 HydrophobicContact CG1-CE1 4.06Å; V136-Y138 HydrophobicContact CG1-CE2 4.43Å; V136-Y138 HydrophobicContact CG1-CG 4.45Å; V136-Y138 WeakPolarHBondContact O-CD2 3.37Å; V136-Y138 PolarHBondContact O-N 2.79Å; Y138-K140 VanDerWaalsContact C-N 3.28Å; Y138-K140 PolarHBondContact O-N 3.49Å; Y138-M141 PolarHBondContact O-N 2.9Å; Y138-L142 WeakPolarHBondContact O-CB 3.2Å; Y138-L142 VanDerWaalsContact O-CG 3.24Å; Y138-L142 WeakPolarHBondContact O-CG 3.27Å; Y138-L142 PolarHBondContact O-N 3.03Å; Y138-F159 AromaticContact CD1-CE1 3.6Å; Y138-F159 HydrophobicContact CD1-CE1 3.6Å; Y138-F159 AromaticContact CD1-CZ 3.63Å; Y138-F159 HydrophobicContact CD1-CZ 3.63Å; Y138-F159 AromaticContact CE1-CE1 3.87Å; Y138-F159 HydrophobicContact CE1-CE1 3.87Å; Y138-F159 HydrophobicContact CE1-CE2 4.12Å; Y138-F159 AromaticContact CE1-CZ 3.36Å; Y138-F159 HydrophobicContact CE1-CZ 3.36Å; Y138-H161 AromaticContact CD2-CD2 3.45Å; Y138-H161 VanDerWaalsContact CD2-CD2 3.45Å; Y138-H161 WeakPolarHBondContact CD2-CD2 3.48Å; Y138-H161 AromaticContact CE2-CD2 3.45Å; Y138-H161 VanDerWaalsContact CE2-CD2 3.45Å; Y138-H161 WeakPolarHBondContact CE2-CD2 3.4Å; Y138-P162 VanDerWaalsContact OH-CD 3.27Å; Y138-P162 WeakPolarHBondContact OH-CD 3.47Å
139E94.4Very high93.5Very high125 Ų12568.5 Ų68.558%0.58438%0.382SS*.Hα-helixtrans-66.8-28.8-178.8-6072.9-159.700112.8P137 R143P137-E139 VanDerWaalsContact C-N 3.3Å; P137-E139 PolarHBondContact O-N 3.34Å; E139-R143 WeakPolarHBondContact O-CG 3.27Å; E139-R143 PolarHBondContact O-N 3.41Å; E139-R143 PolarHBondContact O-NE 3.23Å
140K93.6Very high93.6Very high74 Ų7466.4 Ų66.432%0.32236%0.355SS..Hα-helixtrans-79-41.4177-60.6-175-174.5172.10110.3P137 Y138 R143 D144 F188P137-K140 HydrophobicContact CB-CB 4.14Å; P137-K140 HydrophobicContact CB-CD 4.02Å; P137-K140 HydrophobicContact CB-CG 4.17Å; P137-K140 PolarHBondContact O-N 2.89Å; Y138-K140 VanDerWaalsContact C-N 3.28Å; Y138-K140 PolarHBondContact O-N 3.49Å; K140-R143 PolarHBondContact O-N 3.01Å; K140-D144 PolarHBondContact O-N 2.98Å; K140-F188 HydrophobicContact CB-CD1 3.84Å; K140-F188 HydrophobicContact CB-CD2 4.21Å; K140-F188 HydrophobicContact CB-CE1 3.72Å; K140-F188 HydrophobicContact CB-CE2 4.1Å; K140-F188 HydrophobicContact CB-CG 4.08Å; K140-F188 HydrophobicContact CB-CZ 3.86Å; K140-F188 HydrophobicContact CD-CB 3.99Å; K140-F188 HydrophobicContact CD-CD1 4.05Å; K140-F188 HydrophobicContact CD-CG 3.95Å
141M94.4Very high93.7Very high5 Ų566.8 Ų66.83%0.02536%0.358CS..Hα-helixtrans-64.3-41176.8-70.3179.661.200112.4V136 P137 Y138 R143 D144 Q145 V148 V150 F159 F182 F188V136-M141 HydrophobicContact CG1-SD 3.44Å; V136-M141 WeakPolarHBondContact CG1-SD 3.47Å; P137-M141 HydrophobicContact CG-CG 4.45Å; P137-M141 PolarHBondContact O-N 3.23Å; Y138-M141 PolarHBondContact O-N 2.9Å; M141-R143 VanDerWaalsContact C-N 3.29Å; M141-R143 PolarHBondContact O-N 3.4Å; M141-D144 CarbonylContact O-C 3.56Å; M141-D144 PolarHBondContact O-N 3.33Å; M141-Q145 WeakPolarHBondContact O-CA 3.42Å; M141-Q145 WeakPolarHBondContact O-CG 3.43Å; M141-Q145 PolarHBondContact O-N 2.88Å; M141-Q145 VanDerWaalsContact O-N 3.15Å; M141-V148 HydrophobicContact CE-CB 3.94Å; M141-V148 HydrophobicContact CE-CG1 3.63Å; M141-V148 HydrophobicContact CG-CB 4.23Å; M141-V148 HydrophobicContact CG-CG2 4.49Å; M141-V148 HydrophobicContact SD-CB 4.41Å; M141-V148 HydrophobicContact SD-CG1 4.28Å; M141-V150 HydrophobicContact CE-CG2 3.61Å; M141-F159 HydrophobicContact CB-CE1 4.48Å; M141-F159 HydrophobicContact CE-CD1 3.8Å; M141-F159 HydrophobicContact CE-CE1 3.36Å; M141-F159 HydrophobicContact CE-CZ 3.92Å; M141-F159 HydrophobicContact SD-CE1 3.85Å; M141-F159 HydrophobicContact SD-CZ 4.34Å; M141-F182 HydrophobicContact CE-CD1 4Å; M141-F182 HydrophobicContact CE-CE1 3.76Å; M141-F182 HydrophobicContact SD-CE1 4.22Å; M141-F188 HydrophobicContact CG-CE2 3.55Å; M141-F188 HydrophobicContact CG-CZ 4.08Å
142L92.2Very high94Very high88 Ų8862.1 Ų62.146%0.46133%0.331SS..Hα-helixtrans-67.2-30.9177.6-70.7172.9000112.4Y138 F159Y138-L142 WeakPolarHBondContact O-CB 3.2Å; Y138-L142 VanDerWaalsContact O-CG 3.24Å; Y138-L142 WeakPolarHBondContact O-CG 3.27Å; Y138-L142 PolarHBondContact O-N 3.03Å; L142-F159 WeakPolarHBondContact CD2-O 3.44Å
143R92.9Very high94.2Very high198 Ų19859.3 Ų59.375%0.74731%0.312SS*.Hα-helixtrans-78.3-39.1175.7-78.4-174.9-77.6161.9-12.7113.3E139 K140 M141E139-R143 WeakPolarHBondContact O-CG 3.27Å; E139-R143 PolarHBondContact O-N 3.41Å; E139-R143 PolarHBondContact O-NE 3.23Å; K140-R143 PolarHBondContact O-N 3.01Å; M141-R143 VanDerWaalsContact C-N 3.29Å; M141-R143 PolarHBondContact O-N 3.4Å
144D93.1Very high94.2Very high46 Ų4655.2 Ų55.225%0.24629%0.288CS..  trans-125.278.3177.5-172.20.4000110.5K140 M141 S146 A147 R186 F188K140-D144 PolarHBondContact O-N 2.98Å; M141-D144 CarbonylContact O-C 3.56Å; M141-D144 PolarHBondContact O-N 3.33Å; D144-S146 PolarHBondContact O-N 3.11Å; D144-S146 VanDerWaalsContact O-N 3.13Å; D144-S146 WeakPolarHBondContact OD1-CB 3.39Å; D144-S146 PolarHBondContact OD1-N 2.98Å; D144-S146 PolarHBondContact OD1-OG 3.27Å; D144-A147 HydrophobicContact CB-CB 4.2Å; D144-A147 WeakPolarHBondContact O-CB 3.46Å; D144-A147 PolarHBondContact O-N 2.77Å; D144-A147 VanDerWaalsContact O-N 3.12Å; D144-A147 PolarHBondContact OD1-N 3.44Å; D144-R186 IonicContact OD2-NH1 2.69Å; D144-R186 PolarHBondContact OD2-NH1 3.41Å; D144-R186 VanDerWaalsContact OD2-NH1 3.15Å; D144-F188 HydrophobicContact CB-CE1 4.45Å
145Q89.6Confident94Very high145 Ų14564.4 Ų64.468%0.67833%0.33SS*.THydrogen-bonded Turntrans-65.6-13.3178.5-62.8179.126.400112.7M141M141-Q145 WeakPolarHBondContact O-CA 3.42Å; M141-Q145 WeakPolarHBondContact O-CG 3.43Å; M141-Q145 PolarHBondContact O-N 2.88Å; M141-Q145 VanDerWaalsContact O-N 3.15Å
146S90.6Very high93.7Very high67 Ų6763.7 Ų63.747%0.46934%0.341SS..THydrogen-bonded Turntrans-80.2-25176.181.80000112.6D144 K185D144-S146 PolarHBondContact O-N 3.11Å; D144-S146 VanDerWaalsContact O-N 3.13Å; D144-S146 WeakPolarHBondContact OD1-CB 3.39Å; D144-S146 PolarHBondContact OD1-N 2.98Å; D144-S146 PolarHBondContact OD1-OG 3.27Å; S146-K185 WeakPolarHBondContact O-CD 3.32Å
147A93.4Very high93.6Very high1 Ų165.2 Ų65.21%0.00835%0.35CS..THydrogen-bonded Turntrans-71.5-40.4-177.800000112.7D144 K185 R186 F188D144-A147 HydrophobicContact CB-CB 4.2Å; D144-A147 WeakPolarHBondContact O-CB 3.46Å; D144-A147 PolarHBondContact O-N 2.77Å; D144-A147 VanDerWaalsContact O-N 3.12Å; D144-A147 PolarHBondContact OD1-N 3.44Å; A147-K185 PolarHBondContact O-N 3.43Å; A147-R186 HydrophobicContact CB-CB 4.2Å; A147-R186 PolarHBondContact O-N 3.32Å; A147-F188 HydrophobicContact CB-CE1 3.82Å; A147-F188 HydrophobicContact CB-CE2 4.47Å; A147-F188 HydrophobicContact CB-CZ 3.66Å
148V95.5Very high93.5Very high5 Ų567.7 Ų67.73%0.0337%0.373CS..EExtended strand (participates in β ladder)trans-137120.6179.3-175.30000109.1Y124 M141 F182 I183 I184 F188Y124-V148 HydrophobicContact CE2-CG2 4.41Å; M141-V148 HydrophobicContact CE-CB 3.94Å; M141-V148 HydrophobicContact CE-CG1 3.63Å; M141-V148 HydrophobicContact CG-CB 4.23Å; M141-V148 HydrophobicContact CG-CG2 4.49Å; M141-V148 HydrophobicContact SD-CB 4.41Å; M141-V148 HydrophobicContact SD-CG1 4.28Å; V148-F182 HydrophobicContact CG1-CB 4.47Å; V148-F182 HydrophobicContact CG1-CD1 3.98Å; V148-I183 WeakPolarHBondContact CA-O 3.5Å; V148-I184 HydrophobicContact CG1-CG1 4.28Å; V148-I184 HydrophobicContact CG2-CG1 4.29Å; V148-I184 HydrophobicContact CG2-CG2 4.44Å; V148-F188 HydrophobicContact CB-CE2 4.45Å; V148-F188 HydrophobicContact CG2-CD2 4.23Å; V148-F188 HydrophobicContact CG2-CE2 3.57Å; V148-F188 HydrophobicContact CG2-CZ 4.23Å
149V94Very high93.5Very high43 Ų4368.7 Ų68.726%0.26138%0.377SS..EExtended strand (participates in β ladder)trans-103.1129.3177.9-179.40000108.8Q151 I183V149-Q151 HydrophobicContact CG1-CG 4.35Å; V149-I183 HydrophobicContact CB-CB 4.4Å; V149-I183 PolarHBondContact N-O 3.1Å; V149-I183 PolarHBondContact O-N 3.08Å
150V96.1Very high93.6Very high27 Ų2766.4 Ų66.416%0.16437%0.365CS..EExtended strand (participates in β ladder)trans-100.3126.9174-174.60000108.5M141 L153 F159 I180 S181 F182M141-V150 HydrophobicContact CE-CG2 3.61Å; V150-L153 HydrophobicContact CB-CD1 4.45Å; V150-L153 HydrophobicContact CG1-CD1 3.95Å; V150-L153 HydrophobicContact CG1-CG 4.05Å; V150-F159 HydrophobicContact CB-CB 4.36Å; V150-F159 HydrophobicContact CB-CD2 4.12Å; V150-F159 HydrophobicContact CB-CG 4.25Å; V150-F159 HydrophobicContact CG1-CD2 3.96Å; V150-F159 HydrophobicContact CG1-CE2 4.45Å; V150-F159 HydrophobicContact CG2-CB 4.33Å; V150-F159 HydrophobicContact CG2-CD1 4.13Å; V150-F159 HydrophobicContact CG2-CD2 3.74Å; V150-F159 HydrophobicContact CG2-CE1 4.4Å; V150-F159 HydrophobicContact CG2-CE2 4.03Å; V150-F159 HydrophobicContact CG2-CG 3.78Å; V150-F159 HydrophobicContact CG2-CZ 4.34Å; V150-I180 HydrophobicContact CG1-CG2 4.39Å; V150-S181 WeakPolarHBondContact CA-O 3.49Å; V150-F182 HydrophobicContact CG1-CE2 4.37Å; V150-F182 HydrophobicContact CG2-CD1 3.85Å; V150-F182 HydrophobicContact CG2-CE1 3.75Å; V150-F182 HydrophobicContact CG2-CG 4.34Å; V150-F182 HydrophobicContact CG2-CZ 4.14Å
151Q95.1Very high93.7Very high104 Ų10465.2 Ų65.249%0.48636%0.361SS..EExtended strand (participates in β ladder)trans-113.5159.5176.7-68-169.95.900111V149 I180 S181 I183V149-Q151 HydrophobicContact CG1-CG 4.35Å; Q151-I180 VanDerWaalsContact O-CA 3.27Å; Q151-I180 WeakPolarHBondContact O-CA 3.38Å; Q151-S181 PolarHBondContact N-O 3.24Å; Q151-S181 PolarHBondContact O-N 3.45Å; Q151-I183 HydrophobicContact CG-CD1 3.88Å
152G94.3Very high93.8Very high35 Ų3565 Ų6536%0.36136%0.36SS..SBendtrans837.2174.700000115.6W172 G179 I180G152-W172 WeakPolarHBondContact O-CZ3 3.39Å; G152-G179 WeakPolarHBondContact CA-O 3.3Å; G152-I180 WeakPolarHBondContact O-CG1 3.49Å
153L95.1Very high94Very high30 Ų3066 Ų6616%0.15736%0.362CS..PPolyproline II helixtrans-69.6159.1170.4-74.2177.6000111.4F120 V150 F159 I173 I180F120-L153 HydrophobicContact CZ-CD2 4.26Å; V150-L153 HydrophobicContact CB-CD1 4.45Å; V150-L153 HydrophobicContact CG1-CD1 3.95Å; V150-L153 HydrophobicContact CG1-CG 4.05Å; L153-F159 HydrophobicContact CD1-CB 3.74Å; L153-F159 HydrophobicContact CD1-CD2 4.07Å; L153-F159 HydrophobicContact CD1-CG 4.42Å; L153-I173 HydrophobicContact CD2-CD1 4.24Å; L153-I173 HydrophobicContact CD2-CG1 4.25Å; L153-I180 HydrophobicContact CD2-CD1 4.36Å
154P93.5Very high94.1Very high17 Ų1761.4 Ų61.411%0.1135%0.353CS..PPolyproline II helixtrans-60.4147.1178.39.2-9.1000111.2G156 V157 T169 W172P154-G156 PolarHBondContact O-N 3.24Å; P154-V157 HydrophobicContact CB-CB 4.29Å; P154-V157 HydrophobicContact CB-CG2 4.02Å; P154-V157 HydrophobicContact CG-CB 3.84Å; P154-V157 HydrophobicContact CG-CG1 4.24Å; P154-V157 HydrophobicContact CG-CG2 3.82Å; P154-V157 WeakPolarHBondContact O-CB 3.42Å; P154-V157 PolarHBondContact O-N 3.37Å; P154-T169 HydrophobicContact CG-CG2 4.06Å; P154-W172 HydrophobicContact CB-CD2 3.8Å; P154-W172 HydrophobicContact CB-CE3 3.68Å; P154-W172 HydrophobicContact CB-CG 4.5Å; P154-W172 HydrophobicContact CB-CH2 4.07Å; P154-W172 HydrophobicContact CB-CZ2 4.16Å; P154-W172 HydrophobicContact CB-CZ3 3.85Å; P154-W172 VanDerWaalsContact CD-CE3 3.47Å; P154-W172 HydrophobicContact CG-CD2 3.92Å; P154-W172 HydrophobicContact CG-CE3 3.42Å; P154-W172 VanDerWaalsContact CG-CE3 3.42Å; P154-W172 HydrophobicContact CG-CH2 4.48Å; P154-W172 HydrophobicContact CG-CZ3 3.76Å; P154-W172 VanDerWaalsContact N-CZ3 3.27Å
155E91.1Very high94.2Very high201 Ų20159.4 Ų59.494%0.93934%0.342SS*.THydrogen-bonded Turntrans-58.1132.5-178.9-171173.6-172.400111V157E155-V157 PolarHBondContact O-N 2.77Å
156G90.8Very high94.4Very high85 Ų8556.9 Ų56.988%0.87633%0.333SS*.THydrogen-bonded Turntrans77.1-1.9-177.600000115.4P154P154-G156 PolarHBondContact O-N 3.24Å
157V94.3Very high94.5Very high42 Ų4255.7 Ų55.726%0.25532%0.321SS..PPolyproline II helixtrans-98.7118.5177.4178.20000110.9P154 E155 Y165 T169P154-V157 HydrophobicContact CB-CB 4.29Å; P154-V157 HydrophobicContact CB-CG2 4.02Å; P154-V157 HydrophobicContact CG-CB 3.84Å; P154-V157 HydrophobicContact CG-CG1 4.24Å; P154-V157 HydrophobicContact CG-CG2 3.82Å; P154-V157 WeakPolarHBondContact O-CB 3.42Å; P154-V157 PolarHBondContact O-N 3.37Å; E155-V157 PolarHBondContact O-N 2.77Å; V157-Y165 HydrophobicContact CG1-CD1 4.14Å; V157-Y165 HydrophobicContact CG1-CE1 3.54Å; V157-T169 HydrophobicContact CG1-CG2 3.95Å; V157-T169 HydrophobicContact CG2-CG2 4.47Å
158A93.8Very high94.5Very high75 Ų7558.7 Ų58.762%0.6235%0.346SS*.PPolyproline II helixtrans-76.6149.9173.600000111.8K160 Y165A158-K160 PolarHBondContact O-N 2.94Å; A158-Y165 PolarHBondContact O-OH 3.05Å
159F95.6Very high94.6Very high29 Ų2959.5 Ų59.513%0.12735%0.351CS..PPolyproline II helixtrans-66.1123.8172.4-178.6-104.2000111.2F120 V136 Y138 M141 L142 V150 L153 F182F120-F159 AromaticContact CD2-CE2 3.97Å; F120-F159 HydrophobicContact CD2-CE2 3.97Å; F120-F159 HydrophobicContact CE2-CD2 4.46Å; F120-F159 AromaticContact CE2-CE2 3.87Å; F120-F159 HydrophobicContact CE2-CE2 3.87Å; F120-F159 HydrophobicContact CG-CE2 4.49Å; F120-F159 HydrophobicContact CZ-CE2 4.32Å; V136-F159 HydrophobicContact CG1-CE1 4.39Å; V136-F159 HydrophobicContact CG1-CZ 3.96Å; Y138-F159 AromaticContact CD1-CE1 3.6Å; Y138-F159 HydrophobicContact CD1-CE1 3.6Å; Y138-F159 AromaticContact CD1-CZ 3.63Å; Y138-F159 HydrophobicContact CD1-CZ 3.63Å; Y138-F159 AromaticContact CE1-CE1 3.87Å; Y138-F159 HydrophobicContact CE1-CE1 3.87Å; Y138-F159 HydrophobicContact CE1-CE2 4.12Å; Y138-F159 AromaticContact CE1-CZ 3.36Å; Y138-F159 HydrophobicContact CE1-CZ 3.36Å; M141-F159 HydrophobicContact CB-CE1 4.48Å; M141-F159 HydrophobicContact CE-CD1 3.8Å; M141-F159 HydrophobicContact CE-CE1 3.36Å; M141-F159 HydrophobicContact CE-CZ 3.92Å; M141-F159 HydrophobicContact SD-CE1 3.85Å; M141-F159 HydrophobicContact SD-CZ 4.34Å; L142-F159 WeakPolarHBondContact CD2-O 3.44Å; V150-F159 HydrophobicContact CB-CB 4.36Å; V150-F159 HydrophobicContact CB-CD2 4.12Å; V150-F159 HydrophobicContact CB-CG 4.25Å; V150-F159 HydrophobicContact CG1-CD2 3.96Å; V150-F159 HydrophobicContact CG1-CE2 4.45Å; V150-F159 HydrophobicContact CG2-CB 4.33Å; V150-F159 HydrophobicContact CG2-CD1 4.13Å; V150-F159 HydrophobicContact CG2-CD2 3.74Å; V150-F159 HydrophobicContact CG2-CE1 4.4Å; V150-F159 HydrophobicContact CG2-CE2 4.03Å; V150-F159 HydrophobicContact CG2-CG 3.78Å; V150-F159 HydrophobicContact CG2-CZ 4.34Å; L153-F159 HydrophobicContact CD1-CB 3.74Å; L153-F159 HydrophobicContact CD1-CD2 4.07Å; L153-F159 HydrophobicContact CD1-CG 4.42Å; F159-F182 HydrophobicContact CE2-CE1 4.09Å; F159-F182 AromaticContact CE2-CZ 3.72Å; F159-F182 HydrophobicContact CE2-CZ 3.72Å; F159-F182 AromaticContact CZ-CE1 3.87Å; F159-F182 HydrophobicContact CZ-CE1 3.87Å; F159-F182 AromaticContact CZ-CZ 3.9Å; F159-F182 HydrophobicContact CZ-CZ 3.9Å
160K95.9Very high94.7Very high77 Ų7757.4 Ų57.434%0.33534%0.338SS..  trans-149.7172.5178.157.9-175.21721730111A158 N164 Y165A158-K160 PolarHBondContact O-N 2.94Å; K160-N164 HydrophobicContact CD-CB 3.85Å; K160-N164 WeakPolarHBondContact CE-O 3.38Å; K160-N164 HydrophobicContact CG-CB 4.25Å; K160-N164 PolarHBondContact NZ-O 3.4Å; K160-Y165 HydrophobicContact CD-CD1 4.16Å; K160-Y165 HydrophobicContact CD-CE1 3.93Å; K160-Y165 HydrophobicContact CG-CD1 3.99Å; K160-Y165 HydrophobicContact CG-CE1 3.4Å; K160-Y165 VanDerWaalsContact CG-CE1 3.4Å; K160-Y165 HydrophobicContact CG-CE2 4.12Å; K160-Y165 VanDerWaalsContact CG-CZ 3.46Å; K160-Y165 PolarHBondContact N-OH 3.42Å; K160-Y165 WeakPolarHBondContact O-CE2 3.27Å; K160-Y165 PolarHBondContact O-OH 3.38Å
161H97.3Very high94.7Very high49 Ų4959.4 Ų59.423%0.22735%0.345CS..  trans-57.5138.5174.8-164.2-91.9000111E117 Y138 E163 N164E117-H161 IonicContact OE2-NE2 3.16Å; Y138-H161 AromaticContact CD2-CD2 3.45Å; Y138-H161 VanDerWaalsContact CD2-CD2 3.45Å; Y138-H161 WeakPolarHBondContact CD2-CD2 3.48Å; Y138-H161 AromaticContact CE2-CD2 3.45Å; Y138-H161 VanDerWaalsContact CE2-CD2 3.45Å; Y138-H161 WeakPolarHBondContact CE2-CD2 3.4Å; H161-E163 VanDerWaalsContact CE1-CD 3.44Å; H161-E163 IonicContact CE1-OE1 2.92Å; H161-E163 IonicContact CE1-OE2 3.12Å; H161-E163 WeakPolarHBondContact ND1-CB 3.41Å; H161-E163 WeakPolarHBondContact ND1-CG 3.47Å; H161-E163 PolarHBondContact ND1-N 3.23Å; H161-E163 IonicContact ND1-OE2 3.9Å; H161-E163 PolarHBondContact O-N 2.94Å; H161-N164 WeakPolarHBondContact O-CB 3.21Å; H161-N164 PolarHBondContact O-N 3.21Å
162P96.1Very high94.8Very high1 Ų158.7 Ų58.71%0.00634%0.337CS..G310 helixtrans-56.2-33.6-176.9-30.839.2000114.8V116 E117 F120 Y138 N164 Y165 L170V116-P162 HydrophobicContact CB-CB 4.23Å; V116-P162 HydrophobicContact CB-CG 4.44Å; V116-P162 HydrophobicContact CG1-CB 4Å; V116-P162 HydrophobicContact CG1-CG 3.88Å; E117-P162 HydrophobicContact CB-CG 4.06Å; E117-P162 WeakPolarHBondContact OE2-CD 3.31Å; E117-P162 WeakPolarHBondContact OE2-CG 3.35Å; F120-P162 HydrophobicContact CD2-CG 3.96Å; F120-P162 HydrophobicContact CE2-CG 4.17Å; Y138-P162 VanDerWaalsContact OH-CD 3.27Å; Y138-P162 WeakPolarHBondContact OH-CD 3.47Å; P162-N164 PolarHBondContact O-N 2.88Å; P162-N164 VanDerWaalsContact O-N 3.11Å; P162-Y165 PolarHBondContact O-N 3.35Å; P162-Y165 VanDerWaalsContact O-N 3.08Å; P162-L170 HydrophobicContact CB-CD2 4.34Å
163E95.3Very high94.9Very high109 Ų10957 Ų5751%0.50932%0.32SS..G310 helixtrans-56.1-27.7174.5-68.7175-178.900113.5R113 H161R113-E163 PolarHBondContact NE-O 3.08Å; R113-E163 PolarHBondContact NH2-O 3.41Å; H161-E163 VanDerWaalsContact CE1-CD 3.44Å; H161-E163 IonicContact CE1-OE1 2.92Å; H161-E163 IonicContact CE1-OE2 3.12Å; H161-E163 WeakPolarHBondContact ND1-CB 3.41Å; H161-E163 WeakPolarHBondContact ND1-CG 3.47Å; H161-E163 PolarHBondContact ND1-N 3.23Å; H161-E163 IonicContact ND1-OE2 3.9Å; H161-E163 PolarHBondContact O-N 2.94Å
164N94.9Very high95Very high102 Ų10257 Ų5755%0.54532%0.32SS..G310 helixtrans-91.91.8-177.2-61.4-38.5000113.5K160 H161 P162K160-N164 HydrophobicContact CD-CB 3.85Å; K160-N164 WeakPolarHBondContact CE-O 3.38Å; K160-N164 HydrophobicContact CG-CB 4.25Å; K160-N164 PolarHBondContact NZ-O 3.4Å; H161-N164 WeakPolarHBondContact O-CB 3.21Å; H161-N164 PolarHBondContact O-N 3.21Å; P162-N164 PolarHBondContact O-N 2.88Å; P162-N164 VanDerWaalsContact O-N 3.11Å
165Y95.8Very high95.1Very high4 Ų463 Ų632%0.01635%0.347CS..SBendtrans-87.1150.7169.3-66.8-59.7000111.1F120 V157 A158 K160 P162 T169 L170 I173F120-Y165 HydrophobicContact CE2-CE2 4.09Å; F120-Y165 HydrophobicContact CZ-CE2 4.49Å; V157-Y165 HydrophobicContact CG1-CD1 4.14Å; V157-Y165 HydrophobicContact CG1-CE1 3.54Å; A158-Y165 PolarHBondContact O-OH 3.05Å; K160-Y165 HydrophobicContact CD-CD1 4.16Å; K160-Y165 HydrophobicContact CD-CE1 3.93Å; K160-Y165 HydrophobicContact CG-CD1 3.99Å; K160-Y165 HydrophobicContact CG-CE1 3.4Å; K160-Y165 VanDerWaalsContact CG-CE1 3.4Å; K160-Y165 HydrophobicContact CG-CE2 4.12Å; K160-Y165 VanDerWaalsContact CG-CZ 3.46Å; K160-Y165 PolarHBondContact N-OH 3.42Å; K160-Y165 WeakPolarHBondContact O-CE2 3.27Å; K160-Y165 PolarHBondContact O-OH 3.38Å; P162-Y165 PolarHBondContact O-N 3.35Å; P162-Y165 VanDerWaalsContact O-N 3.08Å; Y165-T169 HydrophobicContact CD1-CG2 3.4Å; Y165-T169 HydrophobicContact CE1-CG2 3.96Å; Y165-T169 HydrophobicContact CG-CG2 3.88Å; Y165-L170 HydrophobicContact CD2-CD2 4.03Å; Y165-L170 HydrophobicContact CG-CD2 4.41Å; Y165-I173 HydrophobicContact CD2-CD1 4.02Å; Y165-I173 HydrophobicContact CE1-CD1 4.5Å; Y165-I173 HydrophobicContact CE2-CD1 3.91Å; Y165-I173 HydrophobicContact CG-CD1 4.44Å
166D93.9Very high95.4Very high92 Ų9256.7 Ų56.749%0.49232%0.319SS..  trans-79166.5166.763.81.7000110.5A168 T169 L170D166-A168 VanDerWaalsContact C-N 3.27Å; D166-A168 PolarHBondContact O-N 3Å; D166-T169 PolarHBondContact O-N 2.82Å; D166-T169 WeakPolarHBondContact OD1-CB 3.41Å; D166-T169 PolarHBondContact OD1-N 3.02Å; D166-T169 PolarHBondContact OD1-OG1 3.26Å; D166-L170 WeakPolarHBondContact O-CG 3.47Å; D166-L170 PolarHBondContact O-N 2.87Å
167L92.9Very high95.6Very high42 Ų4257.5 Ų57.522%0.2230%0.299CS..Hα-helixtrans-58.1-39.7-178178.3150.7000112.4D105 I109 L112 L170 K171D105-L167 WeakPolarHBondContact OD1-CD1 3.25Å; I109-L167 HydrophobicContact CD1-CB 4.38Å; I109-L167 HydrophobicContact CG1-CB 4.49Å; L112-L167 HydrophobicContact CD1-CG 4.18Å; L167-L170 PolarHBondContact O-N 3.24Å; L167-K171 HydrophobicContact CD2-CD 3.75Å; L167-K171 HydrophobicContact CD2-CG 4.4Å; L167-K171 HydrophobicContact CG-CD 4.45Å; L167-K171 WeakPolarHBondContact O-CG 3.18Å; L167-K171 PolarHBondContact O-N 3.29Å
168A94.2Very high95.6Very high64 Ų6460.5 Ų60.553%0.52933%0.328SS..Hα-helixtrans-62.5-45.6179.900000111.5D166 K171 W172D166-A168 VanDerWaalsContact C-N 3.27Å; D166-A168 PolarHBondContact O-N 3Å; A168-K171 PolarHBondContact O-N 3.19Å; A168-W172 WeakPolarHBondContact O-CB 3.18Å; A168-W172 PolarHBondContact O-N 3.16Å
169T96.3Very high95.6Very high21 Ų2159.2 Ų59.213%0.12932%0.323CS..Hα-helixtrans-66.6-41.2178.5-57.70000111.7P154 V157 Y165 D166 K171 W172 I173P154-T169 HydrophobicContact CG-CG2 4.06Å; V157-T169 HydrophobicContact CG1-CG2 3.95Å; V157-T169 HydrophobicContact CG2-CG2 4.47Å; Y165-T169 HydrophobicContact CD1-CG2 3.4Å; Y165-T169 HydrophobicContact CE1-CG2 3.96Å; Y165-T169 HydrophobicContact CG-CG2 3.88Å; D166-T169 PolarHBondContact O-N 2.82Å; D166-T169 WeakPolarHBondContact OD1-CB 3.41Å; D166-T169 PolarHBondContact OD1-N 3.02Å; D166-T169 PolarHBondContact OD1-OG1 3.26Å; T169-K171 PolarHBondContact O-N 3.16Å; T169-W172 PolarHBondContact O-N 3.03Å; T169-I173 HydrophobicContact CG2-CD1 3.81Å; T169-I173 HydrophobicContact CG2-CG1 4.36Å; T169-I173 WeakPolarHBondContact O-CB 3.41Å; T169-I173 VanDerWaalsContact O-CG1 3.29Å; T169-I173 WeakPolarHBondContact O-CG1 3.44Å; T169-I173 PolarHBondContact O-N 2.97Å
170L96.6Very high95.6Very high0 Ų058.2 Ų58.20%032%0.318CS..Hα-helixtrans-60.6-45.3177.9-70.3166.2000111.9I109 L112 R113 V116 P162 Y165 D166 L167 I173 L174I109-L170 HydrophobicContact CG1-CD1 3.84Å; L112-L170 HydrophobicContact CB-CB 3.99Å; L112-L170 HydrophobicContact CB-CD1 4.1Å; L112-L170 HydrophobicContact CD1-CB 4.45Å; R113-L170 HydrophobicContact CG-CD1 3.66Å; R113-L170 HydrophobicContact CG-CD2 4.31Å; V116-L170 HydrophobicContact CB-CD2 4Å; V116-L170 HydrophobicContact CG1-CD2 4.26Å; V116-L170 HydrophobicContact CG2-CB 4.47Å; V116-L170 HydrophobicContact CG2-CD2 3.76Å; P162-L170 HydrophobicContact CB-CD2 4.34Å; Y165-L170 HydrophobicContact CD2-CD2 4.03Å; Y165-L170 HydrophobicContact CG-CD2 4.41Å; D166-L170 WeakPolarHBondContact O-CG 3.47Å; D166-L170 PolarHBondContact O-N 2.87Å; L167-L170 PolarHBondContact O-N 3.24Å; L170-I173 PolarHBondContact O-N 3.19Å; L170-L174 PolarHBondContact O-N 2.85Å
171K95.7Very high95.6Very high68 Ų6856.8 Ų56.830%0.29632%0.318SS..Hα-helixtrans-61.6-47.6175.7-72.1-175.5177.9-177.40111.3E108 L112 L167 A168 T169 I173 L174 E175E108-K171 WeakPolarHBondContact OE1-CE 3.41Å; E108-K171 IonicContact OE1-NZ 3.95Å; E108-K171 PolarHBondContact OE1-NZ 3.47Å; L112-K171 HydrophobicContact CD1-CD 4.42Å; L112-K171 HydrophobicContact CD1-CG 3.74Å; L112-K171 HydrophobicContact CD2-CG 4.18Å; L167-K171 HydrophobicContact CD2-CD 3.75Å; L167-K171 HydrophobicContact CD2-CG 4.4Å; L167-K171 HydrophobicContact CG-CD 4.45Å; L167-K171 WeakPolarHBondContact O-CG 3.18Å; L167-K171 PolarHBondContact O-N 3.29Å; A168-K171 PolarHBondContact O-N 3.19Å; T169-K171 PolarHBondContact O-N 3.16Å; K171-I173 VanDerWaalsContact C-N 3.31Å; K171-I173 PolarHBondContact O-N 2.87Å; K171-L174 PolarHBondContact O-N 2.97Å; K171-L174 VanDerWaalsContact O-N 3.13Å; K171-E175 WeakPolarHBondContact O-CG 3.35Å; K171-E175 PolarHBondContact O-N 3.36Å
172W97.1Very high95.6Very high89 Ų8955.1 Ų55.134%0.33731%0.31SS..Hα-helixtrans-58-42.9179.5-171.196.7000112.4G152 P154 A168 T169 L174 E175 N176G152-W172 WeakPolarHBondContact O-CZ3 3.39Å; P154-W172 HydrophobicContact CB-CD2 3.8Å; P154-W172 HydrophobicContact CB-CE3 3.68Å; P154-W172 HydrophobicContact CB-CG 4.5Å; P154-W172 HydrophobicContact CB-CH2 4.07Å; P154-W172 HydrophobicContact CB-CZ2 4.16Å; P154-W172 HydrophobicContact CB-CZ3 3.85Å; P154-W172 VanDerWaalsContact CD-CE3 3.47Å; P154-W172 HydrophobicContact CG-CD2 3.92Å; P154-W172 HydrophobicContact CG-CE3 3.42Å; P154-W172 VanDerWaalsContact CG-CE3 3.42Å; P154-W172 HydrophobicContact CG-CH2 4.48Å; P154-W172 HydrophobicContact CG-CZ3 3.76Å; P154-W172 VanDerWaalsContact N-CZ3 3.27Å; A168-W172 WeakPolarHBondContact O-CB 3.18Å; A168-W172 PolarHBondContact O-N 3.16Å; T169-W172 PolarHBondContact O-N 3.03Å; W172-L174 VanDerWaalsContact C-N 3.33Å; W172-L174 PolarHBondContact O-N 3.29Å; W172-E175 PolarHBondContact O-N 3.43Å; W172-N176 HydrophobicContact CD2-CB 4.37Å; W172-N176 VanDerWaalsContact CE2-ND2 3.33Å; W172-N176 HydrophobicContact CE3-CB 4.13Å; W172-N176 HydrophobicContact CH2-CB 3.83Å; W172-N176 HydrophobicContact CZ2-CB 4.08Å; W172-N176 HydrophobicContact CZ3-CB 3.84Å; W172-N176 PolarHBondContact NE1-ND2 2.95Å; W172-N176 WeakPolarHBondContact O-CB 3.35Å; W172-N176 PolarHBondContact O-N 3.25Å; W172-N176 PolarHBondContact O-ND2 3.17Å
173I97.1Very high95.6Very high0 Ų058.1 Ų58.10%033%0.325CS..Hα-helixtrans-59-44.4177.7-76.3166.4000110.9V116 F120 L153 Y165 T169 L170 K171 N176 K177 I180V116-I173 HydrophobicContact CG1-CD1 4.5Å; V116-I173 HydrophobicContact CG1-CG2 3.93Å; V116-I173 HydrophobicContact CG2-CB 4.46Å; V116-I173 HydrophobicContact CG2-CG2 3.98Å; F120-I173 HydrophobicContact CE1-CG2 4.03Å; F120-I173 HydrophobicContact CZ-CD1 4.16Å; F120-I173 HydrophobicContact CZ-CG2 4.12Å; L153-I173 HydrophobicContact CD2-CD1 4.24Å; L153-I173 HydrophobicContact CD2-CG1 4.25Å; Y165-I173 HydrophobicContact CD2-CD1 4.02Å; Y165-I173 HydrophobicContact CE1-CD1 4.5Å; Y165-I173 HydrophobicContact CE2-CD1 3.91Å; Y165-I173 HydrophobicContact CG-CD1 4.44Å; T169-I173 HydrophobicContact CG2-CD1 3.81Å; T169-I173 HydrophobicContact CG2-CG1 4.36Å; T169-I173 WeakPolarHBondContact O-CB 3.41Å; T169-I173 VanDerWaalsContact O-CG1 3.29Å; T169-I173 WeakPolarHBondContact O-CG1 3.44Å; T169-I173 PolarHBondContact O-N 2.97Å; L170-I173 PolarHBondContact O-N 3.19Å; K171-I173 VanDerWaalsContact C-N 3.31Å; K171-I173 PolarHBondContact O-N 2.87Å; I173-N176 CarbonylContact O-C 3.49Å; I173-K177 VanDerWaalsContact O-CA 3.22Å; I173-K177 WeakPolarHBondContact O-CA 3.45Å; I173-K177 WeakPolarHBondContact O-CB 3.49Å; I173-K177 PolarHBondContact O-N 3.48Å; I173-I180 HydrophobicContact CB-CD1 4.21Å; I173-I180 HydrophobicContact CG1-CD1 4.31Å; I173-I180 HydrophobicContact CG2-CD1 3.65Å
174L96.4Very high95.6Very high30 Ų3054.9 Ų54.916%0.15731%0.311CS..Hα-helixtrans-72.6-33.2-179-67.2178.2000113.1L112 T115 V116 L170 K171 W172 K177L112-L174 HydrophobicContact CD2-CD1 3.61Å; T115-L174 HydrophobicContact CG2-CD1 3.92Å; T115-L174 HydrophobicContact CG2-CD2 3.77Å; V116-L174 HydrophobicContact CG2-CD1 4.09Å; V116-L174 HydrophobicContact CG2-CD2 3.7Å; V116-L174 HydrophobicContact CG2-CG 3.65Å; L170-L174 PolarHBondContact O-N 2.85Å; K171-L174 PolarHBondContact O-N 2.97Å; K171-L174 VanDerWaalsContact O-N 3.13Å; W172-L174 VanDerWaalsContact C-N 3.33Å; W172-L174 PolarHBondContact O-N 3.29Å; L174-K177 WeakPolarHBondContact O-CG 3.43Å; L174-K177 PolarHBondContact O-NZ 3.02Å
175E97Very high95.6Very high143 Ų14357.2 Ų57.267%0.66832%0.317SS*.Hα-helixtrans-67.1-44.8174.3-73171.6-173.900111.3K171 W172K171-E175 WeakPolarHBondContact O-CG 3.35Å; K171-E175 PolarHBondContact O-N 3.36Å; W172-E175 PolarHBondContact O-N 3.43Å
176N96.6Very high95.4Very high68 Ų6864.1 Ų64.136%0.36434%0.343SS..SBendtrans-98.219.3-177.1-63.9-84000112.9W172 I173 A178 G179W172-N176 HydrophobicContact CD2-CB 4.37Å; W172-N176 VanDerWaalsContact CE2-ND2 3.33Å; W172-N176 HydrophobicContact CE3-CB 4.13Å; W172-N176 HydrophobicContact CH2-CB 3.83Å; W172-N176 HydrophobicContact CZ2-CB 4.08Å; W172-N176 HydrophobicContact CZ3-CB 3.84Å; W172-N176 PolarHBondContact NE1-ND2 2.95Å; W172-N176 WeakPolarHBondContact O-CB 3.35Å; W172-N176 PolarHBondContact O-N 3.25Å; W172-N176 PolarHBondContact O-ND2 3.17Å; I173-N176 CarbonylContact O-C 3.49Å; N176-A178 PolarHBondContact O-N 3.11Å; N176-A178 VanDerWaalsContact O-N 3.07Å; N176-G179 PolarHBondContact O-N 3.49Å
177K94.6Very high95Very high102 Ų10263 Ų6344%0.44334%0.341SS..G310 helixtrans-54.8-36.1-171.868171.9171.4-83.60113.1Y119 I173 L174 G179 I180Y119-K177 HydrophobicContact CD1-CB 4.37Å; Y119-K177 HydrophobicContact CD2-CD 4.23Å; Y119-K177 HydrophobicContact CE1-CB 3.78Å; Y119-K177 HydrophobicContact CE2-CB 4.06Å; Y119-K177 HydrophobicContact CE2-CD 3.98Å; Y119-K177 HydrophobicContact CE2-CG 4.4Å; Y119-K177 PolarHBondContact OH-O 3.1Å; I173-K177 VanDerWaalsContact O-CA 3.22Å; I173-K177 WeakPolarHBondContact O-CA 3.45Å; I173-K177 WeakPolarHBondContact O-CB 3.49Å; I173-K177 PolarHBondContact O-N 3.48Å; L174-K177 WeakPolarHBondContact O-CG 3.43Å; L174-K177 PolarHBondContact O-NZ 3.02Å; K177-G179 PolarHBondContact O-N 3.38Å; K177-G179 VanDerWaalsContact O-N 3.08Å; K177-I180 PolarHBondContact O-N 3.29Å
178A94Very high94.7Very high105 Ų10562.9 Ų62.987%0.86834%0.338SS*.G310 helixtrans-59.5-24.8-179.800000114.1N176N176-A178 PolarHBondContact O-N 3.11Å; N176-A178 VanDerWaalsContact O-N 3.07Å
179G94Very high93.6Very high49 Ų4967.2 Ų67.251%0.50535%0.352SS..G310 helixtrans-83.4-13.7175.600000114.2G152 N176 K177G152-G179 WeakPolarHBondContact CA-O 3.3Å; N176-G179 PolarHBondContact O-N 3.49Å; K177-G179 PolarHBondContact O-N 3.38Å; K177-G179 VanDerWaalsContact O-N 3.08Å
180I96.5Very high92.1Very high7 Ų772.6 Ų72.64%0.03638%0.376CS..  trans-84.9128.2-174.6-60.2174.3000110.3Y119 F120 V150 Q151 G152 L153 I173 K177Y119-I180 HydrophobicContact CE1-CB 4.19Å; Y119-I180 HydrophobicContact CE1-CG2 4.37Å; F120-I180 HydrophobicContact CE1-CD1 4.49Å; F120-I180 HydrophobicContact CE1-CG2 4.21Å; V150-I180 HydrophobicContact CG1-CG2 4.39Å; Q151-I180 VanDerWaalsContact O-CA 3.27Å; Q151-I180 WeakPolarHBondContact O-CA 3.38Å; G152-I180 WeakPolarHBondContact O-CG1 3.49Å; L153-I180 HydrophobicContact CD2-CD1 4.36Å; I173-I180 HydrophobicContact CB-CD1 4.21Å; I173-I180 HydrophobicContact CG1-CD1 4.31Å; I173-I180 HydrophobicContact CG2-CD1 3.65Å; K177-I180 PolarHBondContact O-N 3.29Å
181S95.6Very high90.1Very high48 Ų4878 Ų7834%0.33641%0.411SS..EExtended strand (participates in β ladder)trans-146150.7178.563.20000112.7V150 Q151V150-S181 WeakPolarHBondContact CA-O 3.49Å; Q151-S181 PolarHBondContact N-O 3.24Å; Q151-S181 PolarHBondContact O-N 3.45Å
182F96.9Very high87.7Confident13 Ų1383.5 Ų83.56%0.05744%0.435CS..EExtended strand (participates in β ladder)trans-104.9129.1175.5-74-116000108.5F120 C123 Y124 A127 V136 M141 V148 V150 F159F120-F182 HydrophobicContact CB-CE2 4.46Å; F120-F182 HydrophobicContact CB-CZ 4.11Å; F120-F182 HydrophobicContact CD1-CE2 4.12Å; F120-F182 HydrophobicContact CD1-CZ 4.26Å; F120-F182 HydrophobicContact CG-CE2 4.46Å; F120-F182 HydrophobicContact CG-CZ 4.2Å; C123-F182 HydrophobicContact CB-CD2 3.62Å; C123-F182 HydrophobicContact CB-CE2 3.8Å; Y124-F182 AromaticContact CD2-CD1 3.86Å; Y124-F182 HydrophobicContact CD2-CD1 3.86Å; Y124-F182 HydrophobicContact CD2-CE1 4.39Å; Y124-F182 HydrophobicContact CG-CD1 4.49Å; A127-F182 HydrophobicContact CB-CB 3.72Å; A127-F182 WeakPolarHBondContact CB-O 3.34Å; V136-F182 HydrophobicContact CG1-CE1 4.04Å; M141-F182 HydrophobicContact CE-CD1 4Å; M141-F182 HydrophobicContact CE-CE1 3.76Å; M141-F182 HydrophobicContact SD-CE1 4.22Å; V148-F182 HydrophobicContact CG1-CB 4.47Å; V148-F182 HydrophobicContact CG1-CD1 3.98Å; V150-F182 HydrophobicContact CG1-CE2 4.37Å; V150-F182 HydrophobicContact CG2-CD1 3.85Å; V150-F182 HydrophobicContact CG2-CE1 3.75Å; V150-F182 HydrophobicContact CG2-CG 4.34Å; V150-F182 HydrophobicContact CG2-CZ 4.14Å; F159-F182 HydrophobicContact CE2-CE1 4.09Å; F159-F182 AromaticContact CE2-CZ 3.72Å; F159-F182 HydrophobicContact CE2-CZ 3.72Å; F159-F182 AromaticContact CZ-CE1 3.87Å; F159-F182 HydrophobicContact CZ-CE1 3.87Å; F159-F182 AromaticContact CZ-CZ 3.9Å; F159-F182 HydrophobicContact CZ-CZ 3.9Å
183I95.8Very high85.3Confident64 Ų6488.7 Ų88.733%0.32846%0.46SS..EExtended strand (participates in β ladder)trans-115.4108.6179-61.6167000108V148 V149 Q151 K185V148-I183 WeakPolarHBondContact CA-O 3.5Å; V149-I183 HydrophobicContact CB-CB 4.4Å; V149-I183 PolarHBondContact N-O 3.1Å; V149-I183 PolarHBondContact O-N 3.08Å; Q151-I183 HydrophobicContact CG-CD1 3.88Å; I183-K185 PolarHBondContact O-N 3.38Å
184I95.3Very high82.5Confident42 Ų4296.8 Ų96.822%0.21550%0.497CS..EExtended strand (participates in β ladder)trans-90.9106.8-177.2-56.6-178000108.7Y124 A127 L128 V148 P187Y124-I184 HydrophobicContact CD2-CD1 4.3Å; Y124-I184 HydrophobicContact CE2-CD1 3.94Å; A127-I184 HydrophobicContact CB-CD1 3.83Å; A127-I184 HydrophobicContact CB-CG1 3.99Å; L128-I184 HydrophobicContact CB-CD1 4.22Å; L128-I184 HydrophobicContact CD2-CD1 3.32Å; L128-I184 HydrophobicContact CG-CD1 3.43Å; L128-I184 VanDerWaalsContact CG-CD1 3.43Å; V148-I184 HydrophobicContact CG1-CG1 4.28Å; V148-I184 HydrophobicContact CG2-CG1 4.29Å; V148-I184 HydrophobicContact CG2-CG2 4.44Å; I184-P187 HydrophobicContact CG2-CB 4.04Å
185K94.7Very high80.1Confident150 Ų150102.5 Ų102.565%0.65253%0.533SS*.SBendtrans-84.1-36.6172.2-59.8-168.6-174.2170.20111.3S146 A147 I183S146-K185 WeakPolarHBondContact O-CD 3.32Å; A147-K185 PolarHBondContact O-N 3.43Å; I183-K185 PolarHBondContact O-N 3.38Å
186R92Very high77.4Confident149 Ų14998.5 Ų98.556%0.56253%0.53SS*.SBendtrans-141.5114.7176.1-172.7-169.2-61.3146.6-2.1108.8D144 A147D144-R186 IonicContact OD2-NH1 2.69Å; D144-R186 PolarHBondContact OD2-NH1 3.41Å; D144-R186 VanDerWaalsContact OD2-NH1 3.15Å; A147-R186 HydrophobicContact CB-CB 4.2Å; A147-R186 PolarHBondContact O-N 3.32Å
187P86.1Confident75Confident70 Ų7099.1 Ų99.146%0.45555%0.552SS.*  trans-68142.5178.125.1-30.8000111.2L128 I184 L189L128-P187 HydrophobicContact CD2-CB 4.3Å; I184-P187 HydrophobicContact CG2-CB 4.04Å; P187-L189 PolarHBondContact O-N 3.04Å
188F86.1Confident72.3Confident38 Ų38104.4 Ų104.417%0.16757%0.569CS.*  trans-75.4109.1168.8-58.8-67.4000108.5P137 K140 M141 D144 A147 V148 E190P137-F188 HydrophobicContact CG-CD2 3.65Å; P137-F188 HydrophobicContact CG-CE2 4.12Å; P137-F188 HydrophobicContact CG-CG 4.49Å; K140-F188 HydrophobicContact CB-CD1 3.84Å; K140-F188 HydrophobicContact CB-CD2 4.21Å; K140-F188 HydrophobicContact CB-CE1 3.72Å; K140-F188 HydrophobicContact CB-CE2 4.1Å; K140-F188 HydrophobicContact CB-CG 4.08Å; K140-F188 HydrophobicContact CB-CZ 3.86Å; K140-F188 HydrophobicContact CD-CB 3.99Å; K140-F188 HydrophobicContact CD-CD1 4.05Å; K140-F188 HydrophobicContact CD-CG 3.95Å; M141-F188 HydrophobicContact CG-CE2 3.55Å; M141-F188 HydrophobicContact CG-CZ 4.08Å; D144-F188 HydrophobicContact CB-CE1 4.45Å; A147-F188 HydrophobicContact CB-CE1 3.82Å; A147-F188 HydrophobicContact CB-CE2 4.47Å; A147-F188 HydrophobicContact CB-CZ 3.66Å; V148-F188 HydrophobicContact CB-CE2 4.45Å; V148-F188 HydrophobicContact CG2-CD2 4.23Å; V148-F188 HydrophobicContact CG2-CE2 3.57Å; V148-F188 HydrophobicContact CG2-CZ 4.23Å; F188-E190 PolarHBondContact O-N 3.25Å
189L70.9Confident69.6Low155 Ų155105.7 Ų105.781%0.81257%0.567SS**  trans-60.6121.4174.6-62.1175.6000109P187P187-L189 PolarHBondContact O-N 3.04Å
190E65.9Low67.3Low135 Ų135111.5 Ų111.563%0.63158%0.582SS**  trans-80.9134.2167.3-67.4-167.3125.600108.9F188 K192F188-E190 PolarHBondContact O-N 3.25Å; E190-K192 PolarHBondContact O-N 3Å; E190-K192 VanDerWaalsContact O-N 3.07Å
191P54.7Low64.5Low113 Ų113116.6 Ų116.673%0.73461%0.614SS**  trans-57.6116163.2-20.232.1000108.2K193P191-K193 PolarHBondContact O-N 3.46Å
192K44Very low61.7Low184 Ų184120.6 Ų120.680%0.864%0.636SS**  trans-56.6106.2167.5-87.2-175.6172.6174.40107.2E190 H194E190-K192 PolarHBondContact O-N 3Å; E190-K192 VanDerWaalsContact O-N 3.07Å; K192-H194 VanDerWaalsContact C-N 3.29Å; K192-H194 PolarHBondContact O-N 2.73Å
193K47.2Very low58.8Low198 Ų198127.3 Ų127.386%0.86167%0.673SS**  trans-65.1102.3158.3-69.3-173.7-178.2179.60105.2P191 V195P191-K193 PolarHBondContact O-N 3.46Å; K193-V195 PolarHBondContact O-N 3.07Å
194H38.5Very low56.2Low169 Ų169128.4 Ų128.478%0.78269%0.691SS**  trans-55110.7167.8-78.2-105.5000107K192 G196K192-H194 VanDerWaalsContact C-N 3.29Å; K192-H194 PolarHBondContact O-N 2.73Å; H194-G196 PolarHBondContact O-N 3.34Å
195V46.6Very low53.4Low151 Ų151133.1 Ų133.192%0.91572%0.717SS**  trans-67.382.8153.5173.50000104.7K193 G197K193-V195 PolarHBondContact O-N 3.07Å; V195-G197 PolarHBondContact O-N 3.35Å
196G38.8Very low50.9Low59 Ų59136.8 Ų136.861%0.60873%0.727SS**  trans-80.8104.9172.500000107.8H194 R198H194-G196 PolarHBondContact O-N 3.34Å; G196-R198 PolarHBondContact O-N 3.48Å
197G47.5Very low48.1Very low81 Ų81134.8 Ų134.884%0.83574%0.736SS**  trans-55.1123.515600000108.2V195V195-G197 PolarHBondContact O-N 3.35Å
198R36.6Very low45.9Very low212 Ų212138.1 Ų138.180%0.875%0.748SS**  trans-119.388.5172.4-163.7175.4-177.3-144.2-2.3108.5G196 V201G196-R198 PolarHBondContact O-N 3.48Å; R198-V201 PolarHBondContact NH2-O 2.94Å; R198-V201 VanDerWaalsContact NH2-O 3.17Å
199V38.6Very low43.5Very low133 Ų133144.2 Ų144.281%0.80678%0.782SS**  trans-66.4131146.7170.50000106.9
200M45.4Very low41.8Very low170 Ų170142.2 Ų142.284%0.83778%0.781SS**  trans1.2125.2162.1-59.5177153.200117.2
201V37.7Very low40.8Very low114 Ų114141.7 Ų141.769%0.69179%0.789SS**  -158.8131.3121.1175.40000107.5R198R198-V201 PolarHBondContact NH2-O 2.94Å; R198-V201 VanDerWaalsContact NH2-O 3.17Å
202T36.8Very low39.8Very low133 Ų133140.5 Ų140.582%0.81680%0.797SS**  trans-69150.8175.929.30000113.8
203D35.4Very low39.1Very low153 Ų153135.4 Ų135.482%0.81880%0.797SS**  trans-27.5134.9165.4-157.4-77.5000117.5
204A40.7Very low38.4Very low87 Ų87132.2 Ų132.272%0.71980%0.799SS**  trans-170.8112.714000000112.1
205D37.1Very low38.4Very low141 Ų141130.2 Ų130.275%0.75480%0.803SS**  trans67.3109.1143.2-76.9-50.1000125.1
206R42.8Very low37.9Very low228 Ų228126.6 Ų126.686%0.8680%0.796SS**  46.1134.2122.1-84.2-175176.1-1560.8123.6
207S33.8Very low38.3Very low107 Ų107130 Ų13075%0.74881%0.808SS**  trans87.6152.1141.981.40000117.9
208I38.6Very low38.2Very low140 Ų140133.1 Ų133.172%0.71880%0.804SS**  cis-172.4140.8-14.7-104.6170.4000104
209L35.8Very low38.4Very low166 Ų166133.1 Ų133.187%0.86981%0.809SS**  trans59.2129.9154.4-57.3168.8000122.6
210S35.2Very low38.3Very low113 Ų113132.7 Ų132.779%0.7981%0.807SS**  trans-68.9164.3157.6-45.10000111.4
211P45.8Very low38Very low124 Ų124133.5 Ų133.581%0.80581%0.806SS**  -153.416059.437.8-15000118.6
212G33.6Very low37.9Very low87 Ų87133.7 Ų133.790%0.89781%0.807SS**  trans60.5129.7139.900000122.3
213G28.6Very low37.9Very low78 Ų78135.9 Ų135.980%0.80481%0.808SS**  trans140.6116.1144.300000118.8
214S33.5Very low38.6Very low130 Ų130133 Ų13391%0.90980%0.798SS**  trans83.8145.2135.1-158.70000122
215C38Very low38.5Very low127 Ų127136.1 Ų136.186%0.85881%0.808SS**  trans-91.7152.9-164.6-57.20000115.9
216G36.3Very low38.9Very low75 Ų75138 Ų13877%0.77381%0.812SS**  trans96.2159.5142.600000118.3
217P46.8Very low38.6Very low132 Ų132134.1 Ų134.186%0.85781%0.809SS**  cis-132.5173.11.938.8-19.8000116.6
218I45.5Very low39.4Very low146 Ų146134 Ų13475%0.74981%0.808SS**  trans-65143.8174.5-69.9152.2000113V220I218-V220 HydrophobicContact CG2-CG2 3.77Å
219K39.8Very low39.1Very low211 Ų211130.3 Ų130.392%0.91780%0.804SS**  trans-140.7139.7148.2-71.6-152.5176.1-163.20112
220V37.2Very low39.1Very low124 Ų124130.6 Ų130.675%0.75281%0.805SS**  trans-113.2156.8-166.5173.80000110.5I218I218-V220 HydrophobicContact CG2-CG2 3.77Å
221K39Very low39.3Very low187 Ų187130.3 Ų130.381%0.81380%0.803SS**  trans80.6134.6159.3-115-178165.5-1780115
222T36.3Very low39.3Very low118 Ų118133.1 Ų133.172%0.72481%0.81SS**  cis-165.7142.143.521.90000110.7
223E37.3Very low39.9Very low180 Ų180137.5 Ų137.584%0.84181%0.807SS**  trans-70.2-178.3152.8-107-170.7120.900111.1
224P49.3Very low40.8Very low92 Ų92142.8 Ų142.860%0.59781%0.813SS**  cis-135.3176.6-12.628.1-5.5000113.3
225T38.6Very low41.1Very low152 Ų152141.2 Ų141.293%0.93381%0.808SS**  trans-140.4123.4146.517.40000110.2
226E46.4Very low41.1Very low181 Ų181139.8 Ų139.885%0.84681%0.805SS**  trans-88.5134175.2-34.7-177.911900107.1
227D35.3Very low41.2Very low147 Ų147142.8 Ų142.879%0.78681%0.808SS**  trans-161.3125.8130.2-162.426000111.6
228S50.3Low41.1Very low105 Ų105142.4 Ų142.473%0.73480%0.804SS**  trans-15.8151.2151.4-35.80000115.9
229G32.9Very low41.1Very low61 Ų61141.9 Ų141.963%0.62981%0.807SS**  cis160.9160.814.200000108.2
230I35.8Very low41.5Very low172 Ų172141.2 Ų141.288%0.88280%0.804SS**  trans60.2117.9155.666.9144.6000120.9
231S38.9Very low42.5Very low107 Ų107144 Ų14475%0.74881%0.809SS**  153.7109.5103.7-160.80000110.1
232L45.4Very low42.6Very low183 Ų183144.4 Ų144.496%0.95881%0.814SS**  trans-93.5106.4166.2-92.7163.5000107.1
233E45.9Very low43.3Very low179 Ų179143.8 Ų143.884%0.83681%0.814SS**  trans-121.6142.8163.7-126.4-158.1138.200110.6
234M49Very low43.9Very low190 Ų190144.4 Ų144.494%0.93682%0.817SS**  trans-68.9135.8-176.6-67175.1173.400111.2
235A38.6Very low43.9Very low97 Ų97147 Ų14780%0.80283%0.826SS**  trans-124.9124.5161.400000109.1
236A38.5Very low44.5Very low96 Ų96145.2 Ų145.279%0.79382%0.817SS**  trans-59.1137.5-174.300000112.9T238A236-T238 PolarHBondContact O-N 3.27Å
237V39.1Very low44.8Very low138 Ų138143.7 Ų143.784%0.83681%0.814SS**  trans-74.3112168.9174.30000108.1
238T43.8Very low45.5Very low125 Ų125145.8 Ų145.877%0.76781%0.813SS**PPolyproline II helixtrans-75.8117.7166.239.10000109.1A236 K240A236-T238 PolarHBondContact O-N 3.27Å; T238-K240 PolarHBondContact O-N 2.61Å
239V45.9Very low45.2Very low135 Ų135149 Ų14982%0.81881%0.81SS**PPolyproline II helixtrans-68117.9168.6177.20000107.2
240K48.3Very low45.5Very low196 Ų196154 Ų15485%0.85282%0.817SS**PPolyproline II helixtrans-80.7117.4166-85-174.8171.2-177.60108.2T238T238-K240 PolarHBondContact O-N 2.61Å
241E58.4Low45.7Very low184 Ų184156 Ų15686%0.8682%0.815SS**PPolyproline II helixtrans-58.3128.1165.3-169.2-179.812400109.4
242E40.7Very low45.6Very low195 Ų195157.1 Ų157.191%0.91181%0.813SS**PPolyproline II helixtrans-92.1120.9174-153.1-178.2131.100107.8
243S51.6Low45.3Very low104 Ų104155.7 Ų155.773%0.72780%0.804SS**PPolyproline II helixtrans-84.2130.7-175.752.80000111.6
244E49.7Very low44.8Very low193 Ų193155.7 Ų155.790%0.90280%0.804SS**PPolyproline II helixtrans-67.3131.6169.4-86.6169.493.800111.6P246E244-P246 WeakPolarHBondContact O-CD 3.46Å
245D49.3Very low44Very low147 Ų147151.2 Ų151.279%0.78680%0.798SS**  trans-77.5114.2179.1-172.214000110.5D247D245-D247 PolarHBondContact O-N 3.36Å
246P50.8Low43.7Very low115 Ų115150.2 Ų150.275%0.74780%0.796SS**  trans-98.473.1-173.937.1-28.8000110.6E244E244-P246 WeakPolarHBondContact O-CD 3.46Å
247D51.5Low44.2Very low148 Ų148151.1 Ų151.179%0.79180%0.795SS**  trans-152.741.5171.9-114.9-16.9000114.8D245D245-D247 PolarHBondContact O-N 3.36Å
248Y51.6Low44.1Very low191 Ų191149.3 Ų149.375%0.74979%0.788SS**SBendtrans-105.899.4169.2-154.4-120.8000111.1
249Y43Very low43.8Very low172 Ų172150.9 Ų150.968%0.67579%0.786SS**  trans99.390.8172.7-61.9-69.9000118.1
250Q38.6Very low43.4Very low166 Ų166150 Ų15078%0.77678%0.781SS**  trans-83.6112.3155.1-170171.440.600109.7
251Y40.4Very low42.7Very low214 Ų214146.8 Ų146.884%0.83977%0.774SS**  trans-123.6110.7162.6-122.3-85.3000108.7
252N38.4Very low41.5Very low131 Ų131144.5 Ų144.570%0.70177%0.767SS**  trans-90.5121.3173.4-79.3-12.1000110
253I37.2Very low41.4Very low153 Ų153141 Ų14179%0.78576%0.759SS**  trans-145.396.3140-59.8-66.7000109.3
254Q35.5Very low40.7Very low179 Ų179142.6 Ų142.684%0.83676%0.76SS**  45.6116.5127.5-138.3149.927.100123
255A33.9Very low40.2Very low97 Ų97140 Ų14080%0.80275%0.747SS**  trans75.9115.6138.300000120.7
256G32.4Very low39.6Very low75 Ų75141 Ų14177%0.77374%0.744SS**  trans-80.5-145.1173.100000114.6
257P48.1Very low38.9Very low116 Ų116144 Ų14475%0.75375%0.749SS**  cis-129.5168.714.342-25.3000115.9
258S36.8Very low38.6Very low99 Ų99142.7 Ų142.769%0.69275%0.748SS**  trans41.6142.4130.8-58.30000120.3
259E38.5Very low38Very low158 Ų158141.1 Ų141.174%0.73875%0.752SS**  cis177.1157.926-120.7169.1158.300108.9
260T36.3Very low37.6Very low116 Ų116138.6 Ų138.671%0.71276%0.759SS**  trans66.8150.5147.365.20000118.3
261D33.8Very low37.7Very low130 Ų130139.8 Ų139.870%0.69576%0.762SS**  cis-169.3167.3-6.6-116.5-52.9000107.2
262D34Very low37.9Very low135 Ų135134.6 Ų134.672%0.72275%0.754SS**  trans75.8114.8148-77.2-56.3000124.6
263V38.9Very low37.6Very low122 Ų122135.9 Ų135.974%0.73976%0.76SS**  trans24.1134.7132.2-111.10000124.4
264D36.3Very low37.5Very low138 Ų138137.2 Ų137.274%0.73876%0.764SS**  90.3137122.8-148.9-135.9000123.8
265E38.3Very low37.2Very low137 Ų137131.9 Ų131.964%0.6476%0.756SS**  trans57.8128.4152.3-81.3-105.1101.600124.3
266K36.2Very low37.1Very low168 Ų168132.2 Ų132.273%0.7375%0.753SS**  trans73.4118.5137.5-64.4-105.6-178.3172.40121.7
267Q38Very low37.4Very low180 Ų180136.3 Ų136.384%0.84175%0.752SS**  trans-47.6153.7142.3-78.7-168.7-53.900112.1
268P44.7Very low36.9Very low119 Ų119137.6 Ų137.677%0.77375%0.747SS**  -152.316253.637.5-14.5000119.7
269L39.4Very low36.8Very low158 Ų158139 Ų13983%0.82776%0.757SS**  trans10.9123.7145.9-152.677.1000121
270S34.5Very low36.8Very low119 Ų119136.3 Ų136.383%0.83276%0.756SS**  trans-168.3142.9134.436.40000113
271K39.7Very low37.2Very low191 Ų191140 Ų14083%0.8377%0.765SS**  trans-81.9-170.7-178.3-59.5174173.6174.60110.7
272P45.7Very low37.1Very low105 Ų105137.6 Ų137.668%0.68277%0.77SS**  cis-153.2-17710.644.8-22.7000120.2
273L32.1Very low37.4Very low158 Ų158138.4 Ų138.483%0.82778%0.775SS**  trans71.5137154.9-99.378.7000117.9
274Q35.2Very low37.7Very low182 Ų182141.8 Ų141.885%0.8578%0.783SS**  cis-144157.819.6-85.6163.3-16.300107.5
275G28.8Very low37.8Very low66 Ų66138.2 Ų138.268%0.6878%0.778SS**  cis122117.224.900000109.6
276S32.3Very low38Very low104 Ų104137.6 Ų137.673%0.72778%0.784SS**  trans86.6134.4169.7-490000116.8
277H37.9Very low38.2Very low162 Ų162138 Ų13875%0.7579%0.788SS**  cis-141.715318.6-82.2-87.4000113
278H37.5Very low38.2Very low143 Ų143136.3 Ų136.366%0.66278%0.782SS**  trans-75144.8171.832.5-87.5000112.4
279S34.1Very low38Very low129 Ų129137.5 Ų137.590%0.90278%0.777SS**  -170.3124.3121.4-2.30000110.8
280S39.8Very low38Very low101 Ų101135.9 Ų135.971%0.70677%0.769SS**  trans-121.9140.816668.90000109.2
281E44.5Very low38Very low193 Ų193134.7 Ų134.790%0.90276%0.76SS**  trans61.4140146.9-61.5-175.8117.200121.6
282G31.7Very low37.9Very low79 Ų79132.2 Ų132.281%0.81476%0.757SS**  trans177.682.9170.800000113.2
283N39Very low37.9Very low153 Ų153135.4 Ų135.482%0.81876%0.762SS**  trans-63.2136.9166.4170.247.6000112
284E45.8Very low38.4Very low193 Ų193132 Ų13290%0.90276%0.756SS**  trans-141.3121.7155.7-72.8-165.8116.900109.7
285G37.8Very low38.8Very low62 Ų62134.4 Ų134.464%0.63976%0.758SS**  trans-109.2151.1164.400000110.1
286T42.9Very low39.7Very low125 Ų125136.4 Ų136.477%0.76776%0.757SS**  trans-161.4109.7160.6-40.10000105.2
287E40.3Very low40.4Very low176 Ų176142.3 Ų142.382%0.82276%0.763SS**  44.8133.898.6-56.2-163.9105.100112.8
288M38Very low41.6Very low145 Ų145140 Ų14071%0.71476%0.762SS**  cis-175.9143.738.3-157.7174.217400107.8
289E40.2Very low42Very low143 Ų143141.5 Ų141.567%0.66877%0.769SS**  trans53.4157.6140.3-78-151121.600122.1
290L39.8Very low42.7Very low125 Ų125145 Ų14565%0.65479%0.785SS**  cis-161.3150.218.3-113.8139.3000107.5
291S34.9Very low42.9Very low93 Ų93147.2 Ų147.265%0.6579%0.789SS**  trans25.2147.4139.3-51.10000120.7
292D38.5Very low42.8Very low140 Ų140144.8 Ų144.875%0.74978%0.783SS**  cis-179.2164.846.7-145.6-56.4000110.4
293Q43.8Very low43.4Very low172 Ų172148.4 Ų148.480%0.80478%0.781SS**  trans98.9103.1140.7-148.4153.598.800121.3
294A43.9Very low43.7Very low85 Ų85148.2 Ų148.270%0.70278%0.779SS**  trans-60.2150.5156.200000114.2
295R43.6Very low43.6Very low234 Ų234145.4 Ų145.488%0.88377%0.772SS**  174.2114.1126.1-103.5179.3168.7176.1-2.5113.7
296T47.6Very low43.9Very low108 Ų108150.9 Ų150.966%0.66378%0.78SS**  29.9126.1128.947.90000122.9
297R46.3Very low44Very low228 Ų228152.8 Ų152.886%0.8678%0.781SS**  84.9163.6127.6-78-176.7-172.6-1643.2119.6
298P64.1Low44.3Very low112 Ų112151 Ų15173%0.72778%0.778SS**  cis-137.7179.2-32.336.1-17.4000114.3
299H44.5Very low44.8Very low175 Ų175151.5 Ų151.581%0.8178%0.783SS**  trans-4.6128.3149.6-109.1-74.7000118.4
300V50.6Low45.2Very low203 Ų203152.3 Ų152.3100%1.2379%0.794SS**  -138.20114175.30000107.2

Retrieved 300 of 300 residues in 566 ms (Link to these results)

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