A0A087X7P3_POEFO Loading...

Mitochondrial basic amino acids transporter

AlphaFold DB , UniProt , Accession A0A087X7P3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 330 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
1M29.7Very low29.9Very low111 Ų11168.1 Ų68.155%0.54740%0.399SS..  0-54.20-89.9-176.3170.600112.7F3 L4 V5 F194M1-F3 VanDerWaalsContact C-N 3.27Å; M1-F3 PolarHBondContact O-N 2.94Å; M1-L4 PolarHBondContact O-N 3.35Å; M1-L4 VanDerWaalsContact O-N 3.1Å; M1-V5 PolarHBondContact O-N 2.92Å; M1-V5 VanDerWaalsContact O-N 3.08Å; M1-F194 HydrophobicContact CB-CE2 4.49Å; M1-F194 HydrophobicContact CB-CZ 4.13Å; M1-F194 HydrophobicContact SD-CE2 4.49Å
2Q28.8Very low29.6Very low108 Ų10870.9 Ų70.951%0.50543%0.425SS..Hα-helixtrans-55.1-38179.8-129.5148.215.200113.9S6 F194Q2-S6 WeakPolarHBondContact O-CB 3.46Å; Q2-S6 PolarHBondContact O-N 2.91Å; Q2-F194 HydrophobicContact CB-CE1 4.3Å; Q2-F194 HydrophobicContact CG-CE1 3.86Å
3F33.3Very low29.3Very low48 Ų4871.4 Ų71.421%0.21145%0.453CS..Hα-helixtrans-75.6-36.2175-124-91000114.5M1 V5 S6 A7 D33 T36 T294 V298M1-F3 VanDerWaalsContact C-N 3.27Å; M1-F3 PolarHBondContact O-N 2.94Å; F3-V5 VanDerWaalsContact C-N 3.28Å; F3-V5 PolarHBondContact O-N 3.33Å; F3-S6 PolarHBondContact O-N 3.43Å; F3-A7 WeakPolarHBondContact O-CB 3.39Å; F3-A7 PolarHBondContact O-N 2.88Å; F3-D33 WeakPolarHBondContact CD1-OD1 3.5Å; F3-T36 HydrophobicContact CD2-CG2 4.27Å; F3-T36 VanDerWaalsContact CE2-CB 3.49Å; F3-T36 HydrophobicContact CE2-CG2 3.14Å; F3-T36 HydrophobicContact CZ-CG2 3.29Å; F3-T36 VanDerWaalsContact CZ-OG1 3.29Å; F3-T36 WeakPolarHBondContact CZ-OG1 3.35Å; F3-T294 HydrophobicContact CE2-CG2 3.86Å; F3-V298 HydrophobicContact CE1-CG2 4.1Å; F3-V298 HydrophobicContact CE2-CG2 4.37Å; F3-V298 HydrophobicContact CZ-CG2 3.46Å; F3-V298 VanDerWaalsContact CZ-CG2 3.46Å
4L32.4Very low28.9Very low64 Ų6474.9 Ų74.934%0.33547%0.467SS..Hα-helixtrans-64.5-34.8175.8-91.8160.7000111.5M1 A8M1-L4 PolarHBondContact O-N 3.35Å; M1-L4 VanDerWaalsContact O-N 3.1Å; L4-A8 VanDerWaalsContact O-CB 3.24Å; L4-A8 WeakPolarHBondContact O-CB 3.39Å; L4-A8 PolarHBondContact O-N 3.38Å
5V33.3Very low28.8Very low53 Ų5378.3 Ų78.332%0.32150%0.495SS..Hα-helixtrans-80.9-35.3175.2-166.90000111.8M1 F3 A8 Q9 F198M1-V5 PolarHBondContact O-N 2.92Å; M1-V5 VanDerWaalsContact O-N 3.08Å; F3-V5 VanDerWaalsContact C-N 3.28Å; F3-V5 PolarHBondContact O-N 3.33Å; V5-A8 PolarHBondContact O-N 2.93Å; V5-Q9 WeakPolarHBondContact O-CB 3.49Å; V5-Q9 WeakPolarHBondContact O-CG 3.41Å; V5-Q9 PolarHBondContact O-N 3.36Å; V5-F198 HydrophobicContact CB-CE1 4Å; V5-F198 HydrophobicContact CB-CE2 4.09Å; V5-F198 HydrophobicContact CB-CZ 3.39Å; V5-F198 HydrophobicContact CG1-CD1 4.16Å; V5-F198 HydrophobicContact CG1-CD2 4.41Å; V5-F198 HydrophobicContact CG1-CE1 3.29Å; V5-F198 HydrophobicContact CG1-CE2 3.6Å; V5-F198 HydrophobicContact CG1-CZ 3.02Å; V5-F198 HydrophobicContact CG2-CE2 4.33Å; V5-F198 HydrophobicContact CG2-CZ 4.09Å
6S31.1Very low28.5Very low36 Ų3679.9 Ų79.925%0.25249%0.494SS..Hα-helixtrans-66.6-36.5171.2-103.30000113.2Q2 F3 Q9 M10Q2-S6 WeakPolarHBondContact O-CB 3.46Å; Q2-S6 PolarHBondContact O-N 2.91Å; F3-S6 PolarHBondContact O-N 3.43Å; S6-Q9 PolarHBondContact O-N 3.43Å; S6-M10 WeakPolarHBondContact O-CB 3.38Å; S6-M10 WeakPolarHBondContact O-CG 3.3Å; S6-M10 PolarHBondContact O-N 2.94Å
7A30Very low28.4Very low56 Ų5679.1 Ų79.146%0.46349%0.49SS..Hα-helixtrans-70.4-37.7174.200000111.1F3 Q9 G11F3-A7 WeakPolarHBondContact O-CB 3.39Å; F3-A7 PolarHBondContact O-N 2.88Å; A7-Q9 VanDerWaalsContact C-N 3.3Å; A7-Q9 PolarHBondContact O-N 3.47Å; A7-G11 PolarHBondContact O-N 3.3Å
8A29.2Very low28.9Very low70 Ų7079.1 Ų79.158%0.57949%0.489SS*.Hα-helixtrans-64.9-32.4170.400000112.5L4 V5L4-A8 VanDerWaalsContact O-CB 3.24Å; L4-A8 WeakPolarHBondContact O-CB 3.39Å; L4-A8 PolarHBondContact O-N 3.38Å; V5-A8 PolarHBondContact O-N 2.93Å
9Q27.3Very low29.1Very low64 Ų6477.2 Ų77.230%0.29948%0.48SS..Hα-helixtrans-81.1-37.5177.4-75.8-170.6-39.700113.4V5 S6 A7 G11 S12 F198V5-Q9 WeakPolarHBondContact O-CB 3.49Å; V5-Q9 WeakPolarHBondContact O-CG 3.41Å; V5-Q9 PolarHBondContact O-N 3.36Å; S6-Q9 PolarHBondContact O-N 3.43Å; A7-Q9 VanDerWaalsContact C-N 3.3Å; A7-Q9 PolarHBondContact O-N 3.47Å; Q9-G11 PolarHBondContact O-N 3.39Å; Q9-S12 VanDerWaalsContact O-CB 3.24Å; Q9-S12 WeakPolarHBondContact O-CB 3.37Å; Q9-S12 PolarHBondContact O-N 3Å; Q9-S12 VanDerWaalsContact O-N 3.14Å; Q9-S12 PolarHBondContact O-OG 3.33Å; Q9-F198 VanDerWaalsContact OE1-CE1 3.23Å
10M26.8Very low29.2Very low104 Ų10479.8 Ų79.851%0.51249%0.486SS..Hα-helixtrans-73-13.6176.3-72.1-178.811000113.4S6 S12 V298S6-M10 WeakPolarHBondContact O-CB 3.38Å; S6-M10 WeakPolarHBondContact O-CG 3.3Å; S6-M10 PolarHBondContact O-N 2.94Å; M10-S12 VanDerWaalsContact C-N 3.26Å; M10-V298 HydrophobicContact CE-CG1 4.01Å; M10-V298 HydrophobicContact SD-CG1 4.01Å
11G26.6Very low29.5Very low35 Ų3580.9 Ų80.936%0.36148%0.482SS..THydrogen-bonded Turntrans-79.10.2167.900000114.7A7 Q9 G13 D14A7-G11 PolarHBondContact O-N 3.3Å; Q9-G11 PolarHBondContact O-N 3.39Å; G11-G13 PolarHBondContact O-N 3.5Å; G11-D14 PolarHBondContact O-N 2.99Å
12S26.1Very low29.8Very low102 Ų10279.2 Ų79.271%0.71348%0.48SS*.THydrogen-bonded Turntrans-77.240.5-177.7-52.40000113.5Q9 M10Q9-S12 VanDerWaalsContact O-CB 3.24Å; Q9-S12 WeakPolarHBondContact O-CB 3.37Å; Q9-S12 PolarHBondContact O-N 3Å; Q9-S12 VanDerWaalsContact O-N 3.14Å; Q9-S12 PolarHBondContact O-OG 3.33Å; M10-S12 VanDerWaalsContact C-N 3.26Å
13G26.6Very low30.4Very low77 Ų7779.8 Ų79.879%0.79449%0.485SS*.THydrogen-bonded Turntrans-111.1-16.1160.500000112.3G11G11-G13 PolarHBondContact O-N 3.5Å
14D23.3Very low30.5Very low120 Ų12081 Ų8164%0.64250%0.499SS*.SBendtrans-143.8115.4177.2-130.9-23.2000110.1G11 Q16G11-D14 PolarHBondContact O-N 2.99Å; D14-Q16 PolarHBondContact O-N 3.33Å
15S27.8Very low30.8Very low127 Ų12779.8 Ų79.889%0.88850%0.496SS*.  trans-75.462.9-180-63.10000110.4
16Q23.1Very low31.4Very low103 Ų10381.4 Ų81.448%0.48150%0.502SS..  trans-100.9130.8174.6-72.3-95.6-53.300109.6D14 Q20D14-Q16 PolarHBondContact O-N 3.33Å; Q16-Q20 VanDerWaalsContact OE1-OE1 3.08Å
17P27Very low31.9Very low66 Ų6687.5 Ų87.543%0.42952%0.519SS..  trans-61.5138.7178.725-32.1000110.6S19 Q20P17-S19 CarbonylContact O-C 3.57Å; P17-S19 WeakPolarHBondContact O-CA 3.46Å; P17-S19 PolarHBondContact O-N 2.96Å; P17-Q20 PolarHBondContact O-N 2.97Å
18V38Very low32.8Very low79 Ų7988.7 Ų88.748%0.47951%0.514SS..G310 helixtrans-51.1-27.2178.5-178.90000113Q20 Y21V18-Q20 PolarHBondContact O-N 3.49Å; V18-Y21 HydrophobicContact CG1-CD2 4.48Å; V18-Y21 WeakPolarHBondContact O-CD2 3.38Å
19S32.8Very low33.7Very low44 Ų4488.5 Ų88.531%0.30851%0.507SS..G310 helix20-86.7128.8-70.90000121.2P17 D115P17-S19 CarbonylContact O-C 3.57Å; P17-S19 WeakPolarHBondContact O-CA 3.46Å; P17-S19 PolarHBondContact O-N 2.96Å; S19-D115 VanDerWaalsContact CB-CB 3.41Å; S19-D115 WeakPolarHBondContact CB-OD2 3.34Å; S19-D115 PolarHBondContact OG-OD1 2.88Å; S19-D115 PolarHBondContact OG-OD2 2.84Å
20Q30.6Very low34.9Very low128 Ų12888.8 Ų88.860%0.59851%0.509SS*.G310 helixtrans-96.52.6-155.2-84.1167.5-51.900112.9Q16 P17 V18 P22Q16-Q20 VanDerWaalsContact OE1-OE1 3.08Å; P17-Q20 PolarHBondContact O-N 2.97Å; V18-Q20 PolarHBondContact O-N 3.49Å; Q20-P22 VanDerWaalsContact O-CD 3.31Å; Q20-P22 WeakPolarHBondContact O-CD 3.18Å
21Y35.5Very low36.1Very low103 Ų10390 Ų9040%0.40451%0.513SS..  trans-71.6119.2177.6-66.5-67.7000109.9V18 C25V18-Y21 HydrophobicContact CG1-CD2 4.48Å; V18-Y21 WeakPolarHBondContact O-CD2 3.38Å; Y21-C25 HydrophobicContact CD1-CB 4.46Å
22P36.3Very low37.4Very low77 Ų7789 Ų8950%0.550%0.5SS..  trans-59.1151.5177.623-31000109.8Q20 S24 C25 I26Q20-P22 VanDerWaalsContact O-CD 3.31Å; Q20-P22 WeakPolarHBondContact O-CD 3.18Å; P22-S24 PolarHBondContact O-N 3.08Å; P22-C25 HydrophobicContact CG-CB 4.07Å; P22-C25 WeakPolarHBondContact O-CA 3.43Å; P22-C25 VanDerWaalsContact O-CB 3.24Å; P22-C25 WeakPolarHBondContact O-CB 3.34Å; P22-C25 PolarHBondContact O-N 3.35Å; P22-I26 PolarHBondContact O-N 2.95Å
23I41.5Very low38.7Very low119 Ų11985.1 Ų85.161%0.6147%0.472SS*.Hα-helixtrans-53-28.1-177.8-63179000112.1R27I23-R27 WeakPolarHBondContact O-CB 3.49Å; I23-R27 PolarHBondContact O-N 3.28Å
24S35.1Very low40.4Very low74 Ų7484.3 Ų84.352%0.51745%0.449SS..Hα-helixtrans-63.9-37.1171.727.90000113.7P22 K28P22-S24 PolarHBondContact O-N 3.08Å; S24-K28 WeakPolarHBondContact O-CB 3.5Å; S24-K28 WeakPolarHBondContact O-CG 3.2Å; S24-K28 PolarHBondContact O-N 2.73Å
25C38.8Very low42Very low39 Ų3981 Ų8126%0.26444%0.435SS..Hα-helixtrans-70.7-41.5176-151.60000111Y21 P22 R27 K28 C29Y21-C25 HydrophobicContact CD1-CB 4.46Å; P22-C25 HydrophobicContact CG-CB 4.07Å; P22-C25 WeakPolarHBondContact O-CA 3.43Å; P22-C25 VanDerWaalsContact O-CB 3.24Å; P22-C25 WeakPolarHBondContact O-CB 3.34Å; P22-C25 PolarHBondContact O-N 3.35Å; C25-R27 VanDerWaalsContact C-N 3.35Å; C25-R27 PolarHBondContact O-N 2.9Å; C25-K28 PolarHBondContact O-N 3.2Å; C25-C29 PolarHBondContact O-N 3.36Å; C25-C29 PolarHBondContact O-SG 2.76Å; C25-C29 VanDerWaalsContact O-SG 3.39Å
26I45.1Very low43.4Very low86 Ų8675 Ų7544%0.44139%0.393SS..Hα-helixtrans-60.9-43.2173.4-61.1173.9000111P22 C29 Q30P22-I26 PolarHBondContact O-N 2.95Å; I26-C29 PolarHBondContact O-N 2.72Å; I26-Q30 WeakPolarHBondContact O-CB 3.39Å; I26-Q30 PolarHBondContact O-N 3.01Å
27R43.2Very low45.1Very low164 Ų16471.1 Ų71.162%0.61938%0.38SS*.Hα-helixtrans-65.4-37.5176.4-167.8-179.2-66.7-169.2-0.3112.2I23 C25 Q30 H31I23-R27 WeakPolarHBondContact O-CB 3.49Å; I23-R27 PolarHBondContact O-N 3.28Å; C25-R27 VanDerWaalsContact C-N 3.35Å; C25-R27 PolarHBondContact O-N 2.9Å; R27-Q30 WeakPolarHBondContact O-CB 3.44Å; R27-Q30 PolarHBondContact O-N 3.2Å; R27-H31 PolarHBondContact O-CD2 2.7Å; R27-H31 PolarHBondContact O-N 3.28Å
28K48.4Very low46.8Very low81 Ų8169 Ų6935%0.35237%0.369SS..Hα-helixtrans-68.9-41.2175.6-79.9178.8167.5-162.60112.3S24 C25 Q30 H31 S32 F301 M305 E308S24-K28 WeakPolarHBondContact O-CB 3.5Å; S24-K28 WeakPolarHBondContact O-CG 3.2Å; S24-K28 PolarHBondContact O-N 2.73Å; C25-K28 PolarHBondContact O-N 3.2Å; K28-Q30 VanDerWaalsContact C-N 3.29Å; K28-Q30 PolarHBondContact O-N 3.15Å; K28-H31 PolarHBondContact O-N 2.75Å; K28-S32 PolarHBondContact O-N 3.14Å; K28-S32 VanDerWaalsContact O-N 3.14Å; K28-F301 WeakPolarHBondContact O-CZ 3.18Å; K28-M305 HydrophobicContact CB-CE 4.5Å; K28-M305 HydrophobicContact CB-SD 4.33Å; K28-M305 HydrophobicContact CD-CE 3.81Å; K28-M305 HydrophobicContact CD-SD 3.89Å; K28-M305 HydrophobicContact CG-SD 4.39Å; K28-E308 WeakPolarHBondContact CE-OE2 3.47Å; K28-E308 IonicContact NZ-OE2 2.67Å; K28-E308 PolarHBondContact NZ-OE2 3.33Å
29C48.2Very low48Very low66 Ų6666.4 Ų66.445%0.44636%0.355SS..Hα-helixtrans-59-40.7170.3-70.80000111.7C25 I26 H31 S32 D33C25-C29 PolarHBondContact O-N 3.36Å; C25-C29 PolarHBondContact O-SG 2.76Å; C25-C29 VanDerWaalsContact O-SG 3.39Å; I26-C29 PolarHBondContact O-N 2.72Å; C29-H31 VanDerWaalsContact C-N 3.34Å; C29-H31 PolarHBondContact O-N 3.22Å; C29-S32 WeakPolarHBondContact O-CA 3.5Å; C29-S32 WeakPolarHBondContact O-CB 3.38Å; C29-S32 PolarHBondContact O-N 2.93Å; C29-D33 PolarHBondContact O-N 2.75Å
30Q51.5Low49.2Very low70 Ų7064.9 Ų64.933%0.32735%0.347SS..Hα-helixtrans-64.8-34.9179.3-165.1168.16.300113.4I26 R27 K28 L34 F102I26-Q30 WeakPolarHBondContact O-CB 3.39Å; I26-Q30 PolarHBondContact O-N 3.01Å; R27-Q30 WeakPolarHBondContact O-CB 3.44Å; R27-Q30 PolarHBondContact O-N 3.2Å; K28-Q30 VanDerWaalsContact C-N 3.29Å; K28-Q30 PolarHBondContact O-N 3.15Å; Q30-L34 PolarHBondContact O-N 3.36Å; Q30-F102 HydrophobicContact CG-CD2 3.82Å; Q30-F102 HydrophobicContact CG-CE2 3.87Å
31H53.6Low50.8Low131 Ų13160.5 Ų60.561%0.60633%0.328SS*.Hα-helixtrans-68.8-34.8171.1-88.4-85.8000112.4R27 K28 C29 S35R27-H31 PolarHBondContact O-CD2 2.7Å; R27-H31 PolarHBondContact O-N 3.28Å; K28-H31 PolarHBondContact O-N 2.75Å; C29-H31 VanDerWaalsContact C-N 3.34Å; C29-H31 PolarHBondContact O-N 3.22Å; H31-S35 PolarHBondContact O-N 3.48Å; H31-S35 VanDerWaalsContact O-N 3.13Å; H31-S35 PolarHBondContact O-OG 2.93Å
32S52.8Low52.2Low12 Ų1259.2 Ų59.28%0.08433%0.328CS..Hα-helixtrans-66.1-44.7175.3-159.70000113.5K28 C29 L34 S35 T36 F301K28-S32 PolarHBondContact O-N 3.14Å; K28-S32 VanDerWaalsContact O-N 3.14Å; C29-S32 WeakPolarHBondContact O-CA 3.5Å; C29-S32 WeakPolarHBondContact O-CB 3.38Å; C29-S32 PolarHBondContact O-N 2.93Å; S32-L34 VanDerWaalsContact C-N 3.3Å; S32-L34 PolarHBondContact O-N 2.9Å; S32-S35 PolarHBondContact O-N 3.26Å; S32-S35 PolarHBondContact O-OG 3.33Å; S32-T36 PolarHBondContact O-N 2.81Å; S32-T36 PolarHBondContact O-OG1 3.3Å; S32-F301 VanDerWaalsContact CB-CE1 3.41Å; S32-F301 VanDerWaalsContact CB-CE2 3.5Å; S32-F301 WeakPolarHBondContact OG-CD1 3.3Å; S32-F301 WeakPolarHBondContact OG-CD2 3.46Å; S32-F301 WeakPolarHBondContact OG-CE1 3.04Å; S32-F301 WeakPolarHBondContact OG-CG 3.34Å; S32-F301 WeakPolarHBondContact OG-CZ 2.93Å
33D54.5Low53.5Low22 Ų2258 Ų5812%0.11832%0.319CS..Hα-helixtrans-65.1-38.1-179.9-73.9-43.5000111.2F3 C29 G37 F102F3-D33 WeakPolarHBondContact CD1-OD1 3.5Å; C29-D33 PolarHBondContact O-N 2.75Å; D33-G37 PolarHBondContact O-N 3.06Å; D33-F102 WeakPolarHBondContact OD2-CZ 3.21Å
34L60.4Low54.4Low60 Ų6052.3 Ų52.331%0.31429%0.29SS..Hα-helixtrans-70.5-43.6178.8-174.962.7000111.8Q30 S32 A38 T95Q30-L34 PolarHBondContact O-N 3.36Å; S32-L34 VanDerWaalsContact C-N 3.3Å; S32-L34 PolarHBondContact O-N 2.9Å; L34-A38 VanDerWaalsContact O-CB 3.28Å; L34-A38 WeakPolarHBondContact O-CB 3.31Å; L34-A38 PolarHBondContact O-N 3.44Å; L34-T95 HydrophobicContact CD1-CG2 4.07Å; L34-T95 WeakPolarHBondContact CD1-OG1 3.39Å; L34-T95 HydrophobicContact CD2-CG2 4.31Å
35S58.2Low55.9Low50 Ų5048.8 Ų48.835%0.3527%0.265SS..Hα-helixtrans-66.2-41.7178.961.70000111.4H31 S32 A38 A39H31-S35 PolarHBondContact O-N 3.48Å; H31-S35 VanDerWaalsContact O-N 3.13Å; H31-S35 PolarHBondContact O-OG 2.93Å; S32-S35 PolarHBondContact O-N 3.26Å; S32-S35 PolarHBondContact O-OG 3.33Å; S35-A38 PolarHBondContact O-N 2.66Å; S35-A39 WeakPolarHBondContact O-CB 3.41Å; S35-A39 PolarHBondContact O-N 3.11Å
36T57.4Low57.1Low2 Ų247.7 Ų47.71%0.01226%0.258CS..Hα-helixtrans-71.7-39.2177.1-45.40000112.9F3 S32 A38 A39 G40 T294 T297F3-T36 HydrophobicContact CD2-CG2 4.27Å; F3-T36 VanDerWaalsContact CE2-CB 3.49Å; F3-T36 HydrophobicContact CE2-CG2 3.14Å; F3-T36 HydrophobicContact CZ-CG2 3.29Å; F3-T36 VanDerWaalsContact CZ-OG1 3.29Å; F3-T36 WeakPolarHBondContact CZ-OG1 3.35Å; S32-T36 PolarHBondContact O-N 2.81Å; S32-T36 PolarHBondContact O-OG1 3.3Å; T36-A38 VanDerWaalsContact C-N 3.29Å; T36-A38 PolarHBondContact O-N 2.73Å; T36-A39 PolarHBondContact O-N 2.97Å; T36-G40 PolarHBondContact O-N 3.21Å; T36-T294 HydrophobicContact CG2-CG2 4.21Å; T36-T297 HydrophobicContact CG2-CG2 4.08Å; T36-T297 WeakPolarHBondContact OG1-CG2 3.5Å
37G58.3Low58.2Low20 Ų2045.7 Ų45.721%0.20625%0.246CC..Hα-helixtrans-59.2-41.2172.200000112.3D33 V41D33-G37 PolarHBondContact O-N 3.06Å; G37-V41 WeakPolarHBondContact O-CB 3.45Å; G37-V41 WeakPolarHBondContact O-CG2 3.28Å; G37-V41 PolarHBondContact O-N 3.11Å; G37-V41 VanDerWaalsContact O-N 3.07Å
38A63.2Low59.4Low23 Ų2339.9 Ų39.919%0.1923%0.227CC..Hα-helixtrans-66.3-48.2176.700000112.9L34 S35 T36 V41 L42 M91L34-A38 VanDerWaalsContact O-CB 3.28Å; L34-A38 WeakPolarHBondContact O-CB 3.31Å; L34-A38 PolarHBondContact O-N 3.44Å; S35-A38 PolarHBondContact O-N 2.66Å; T36-A38 VanDerWaalsContact C-N 3.29Å; T36-A38 PolarHBondContact O-N 2.73Å; A38-V41 PolarHBondContact O-N 2.87Å; A38-L42 WeakPolarHBondContact O-CG 3.14Å; A38-L42 PolarHBondContact O-N 3.12Å; A38-M91 VanDerWaalsContact CA-CE 3.5Å; A38-M91 HydrophobicContact CB-CE 3.59Å; A38-M91 HydrophobicContact CB-SD 4.3Å
39A61.6Low60.2Low24 Ų2436.9 Ų36.920%0.19822%0.216CC..Hα-helixtrans-62.1-44.8178.800000111.9S35 T36 V41 L42 V43 T293 T297S35-A39 WeakPolarHBondContact O-CB 3.41Å; S35-A39 PolarHBondContact O-N 3.11Å; T36-A39 PolarHBondContact O-N 2.97Å; A39-V41 PolarHBondContact O-N 3.35Å; A39-L42 PolarHBondContact O-N 3Å; A39-V43 PolarHBondContact O-N 3.35Å; A39-V43 VanDerWaalsContact O-N 3.08Å; A39-T293 HydrophobicContact CB-CG2 3.89Å; A39-T297 HydrophobicContact CB-CG2 4.33Å; A39-T297 WeakPolarHBondContact CB-OG1 3.43Å
40G58.6Low61.1Low12 Ų1233.8 Ų33.812%0.12420%0.195CC..Hα-helixtrans-63.5-39.2177.300000113T36 G44T36-G40 PolarHBondContact O-N 3.21Å; G40-G44 PolarHBondContact O-N 3.35Å
41V64.4Low62Low35 Ų3531.5 Ų31.521%0.21218%0.183CC..Hα-helixtrans-64.4-45.1173.5169.10000110.6G37 A38 A39 V43 G44 H45 I87 P90 M91 L94G37-V41 WeakPolarHBondContact O-CB 3.45Å; G37-V41 WeakPolarHBondContact O-CG2 3.28Å; G37-V41 PolarHBondContact O-N 3.11Å; G37-V41 VanDerWaalsContact O-N 3.07Å; A38-V41 PolarHBondContact O-N 2.87Å; A39-V41 PolarHBondContact O-N 3.35Å; V41-V43 PolarHBondContact O-N 3.33Å; V41-G44 PolarHBondContact O-N 3.21Å; V41-H45 WeakPolarHBondContact O-CB 3.18Å; V41-H45 PolarHBondContact O-N 3.42Å; V41-I87 HydrophobicContact CG1-CD1 4.26Å; V41-I87 HydrophobicContact CG1-CG1 4.08Å; V41-P90 HydrophobicContact CG1-CB 4.49Å; V41-M91 HydrophobicContact CG1-CG 4.41Å; V41-L94 HydrophobicContact CG2-CD2 4.22Å
42L64.9Low62.5Low77 Ų7726.6 Ų26.640%0.40316%0.163SC..Hα-helixtrans-58.3-45.2179.7-76.4162.9000112.4A38 A39 P46 Y84 I87A38-L42 WeakPolarHBondContact O-CG 3.14Å; A38-L42 PolarHBondContact O-N 3.12Å; A39-L42 PolarHBondContact O-N 3Å; L42-P46 WeakPolarHBondContact O-CD 2.99Å; L42-Y84 HydrophobicContact CD2-CE1 4.38Å; L42-Y84 WeakPolarHBondContact O-CE1 3.35Å; L42-I87 HydrophobicContact CD2-CD1 3.52Å; L42-I87 HydrophobicContact CG-CD1 4.22Å
43V63.4Low63.2Low50 Ų5027.5 Ų27.530%0.30316%0.164SC..Hα-helixtrans-78.5-32.5-179.4177.10000112.7A39 V41 P46 P289 T293A39-V43 PolarHBondContact O-N 3.35Å; A39-V43 VanDerWaalsContact O-N 3.08Å; V41-V43 PolarHBondContact O-N 3.33Å; V43-P46 WeakPolarHBondContact O-CD 3.24Å; V43-P289 HydrophobicContact CG1-CB 3.72Å; V43-T293 HydrophobicContact CB-CG2 4.15Å; V43-T293 WeakPolarHBondContact CB-OG1 3.45Å; V43-T293 WeakPolarHBondContact CG1-OG1 3.44Å; V43-T293 HydrophobicContact CG2-CG2 3.69Å; V43-T293 WeakPolarHBondContact CG2-OG1 3.24Å
44G59.8Low63.7Low0 Ų027.3 Ų27.30%016%0.163CC..Hα-helixtrans-77.5-26178.900000114.4G40 V41 F47 D48G40-G44 PolarHBondContact O-N 3.35Å; V41-G44 PolarHBondContact O-N 3.21Å; G44-F47 PolarHBondContact O-N 3.28Å; G44-F47 VanDerWaalsContact O-N 3.12Å; G44-D48 PolarHBondContact O-N 3.47Å
45H67.3Low63.4Low1 Ų127 Ų271%0.00516%0.16CC..Hα-helixtrans-60.3-40-171.5-161.764.4000115.5V41 F47 D48 T49 L83 I87V41-H45 WeakPolarHBondContact O-CB 3.18Å; V41-H45 PolarHBondContact O-N 3.42Å; H45-F47 VanDerWaalsContact C-N 3.28Å; H45-F47 PolarHBondContact O-N 3.49Å; H45-D48 PolarHBondContact O-N 3.15Å; H45-T49 WeakPolarHBondContact O-CB 3.15Å; H45-T49 PolarHBondContact O-N 3.14Å; H45-T49 PolarHBondContact O-OG1 3.04Å; H45-L83 PolarHBondContact CD2-O 3.41Å; H45-I87 HydrophobicContact CB-CD1 4.16Å
46P64.4Low63.4Low15 Ų1526.7 Ų26.710%0.09716%0.156CC..Hα-helixtrans-57-42174.2-2736.4000112.4L42 V43 T49 V50 L83L42-P46 WeakPolarHBondContact O-CD 2.99Å; V43-P46 WeakPolarHBondContact O-CD 3.24Å; P46-T49 PolarHBondContact O-N 3.02Å; P46-V50 WeakPolarHBondContact O-CG2 3.42Å; P46-V50 PolarHBondContact O-N 3.23Å; P46-V50 VanDerWaalsContact O-N 3.11Å; P46-L83 HydrophobicContact CB-CB 4.42Å; P46-L83 HydrophobicContact CB-CD2 4.09Å
47F68.8Low63.4Low45 Ų4527.4 Ų27.420%0.19716%0.159CC..Hα-helixtrans-75-37.6179.9-62.7-80.5000112.6G44 H45 T49 V50 K51 L285 R286 P289G44-F47 PolarHBondContact O-N 3.28Å; G44-F47 VanDerWaalsContact O-N 3.12Å; H45-F47 VanDerWaalsContact C-N 3.28Å; H45-F47 PolarHBondContact O-N 3.49Å; F47-T49 PolarHBondContact O-N 3.43Å; F47-V50 PolarHBondContact O-N 3.09Å; F47-K51 WeakPolarHBondContact O-CB 3.49Å; F47-K51 PolarHBondContact O-N 3.48Å; F47-L285 HydrophobicContact CD1-CD2 4.45Å; F47-L285 HydrophobicContact CE1-CD2 3.85Å; F47-L285 HydrophobicContact CE1-CG 4.08Å; F47-R286 HydrophobicContact CB-CB 3.64Å; F47-R286 HydrophobicContact CB-CG 3.49Å; F47-R286 VanDerWaalsContact CB-CG 3.49Å; F47-R286 HydrophobicContact CD1-CB 4.29Å; F47-R286 HydrophobicContact CD2-CB 4.39Å; F47-R286 HydrophobicContact CD2-CG 4.11Å; F47-R286 HydrophobicContact CG-CB 3.87Å; F47-R286 HydrophobicContact CG-CG 3.91Å; F47-P289 HydrophobicContact CE2-CB 4.07Å; F47-P289 HydrophobicContact CE2-CG 3.81Å; F47-P289 HydrophobicContact CZ-CG 3.82Å
48D66.9Low63.2Low42 Ų4231.1 Ų31.123%0.22518%0.175CC..Hα-helixtrans-60.5-40.4173.4-69.2-19.4000110.4G44 H45 K51 V52 R286G44-D48 PolarHBondContact O-N 3.47Å; H45-D48 PolarHBondContact O-N 3.15Å; D48-K51 PolarHBondContact O-N 2.9Å; D48-V52 VanDerWaalsContact O-CG2 3.31Å; D48-V52 WeakPolarHBondContact O-CG2 2.95Å; D48-V52 PolarHBondContact O-N 3.06Å; D48-R286 WeakPolarHBondContact OD1-CD 3.39Å; D48-R286 IonicContact OD1-CZ 3.03Å; D48-R286 IonicContact OD1-NE 3.89Å; D48-R286 IonicContact OD1-NH1 3.26Å; D48-R286 PolarHBondContact OD1-NH1 3.41Å; D48-R286 IonicContact OD2-NH1 2.85Å
49T66.1Low62.8Low18 Ų1833.1 Ų33.111%0.1118%0.184CC..Hα-helixtrans-62.8-47.5176.3-59.90000111.5H45 P46 F47 R53H45-T49 WeakPolarHBondContact O-CB 3.15Å; H45-T49 PolarHBondContact O-N 3.14Å; H45-T49 PolarHBondContact O-OG1 3.04Å; P46-T49 PolarHBondContact O-N 3.02Å; F47-T49 PolarHBondContact O-N 3.43Å; T49-R53 WeakPolarHBondContact O-CG 3.4Å; T49-R53 PolarHBondContact O-N 3.13Å; T49-R53 VanDerWaalsContact O-N 3.09Å
50V67.8Low62.3Low1 Ų139.2 Ų39.21%0.00621%0.213CC..Hα-helixtrans-62.8-45.7177.41740000111.2P46 F47 V52 R53 L54 T67 C70 F71 I74P46-V50 WeakPolarHBondContact O-CG2 3.42Å; P46-V50 PolarHBondContact O-N 3.23Å; P46-V50 VanDerWaalsContact O-N 3.11Å; F47-V50 PolarHBondContact O-N 3.09Å; V50-V52 PolarHBondContact O-N 3.47Å; V50-R53 PolarHBondContact O-N 3.4Å; V50-L54 HydrophobicContact CG1-CD1 3.47Å; V50-L54 VanDerWaalsContact CG1-CD1 3.47Å; V50-L54 WeakPolarHBondContact O-CB 3.37Å; V50-L54 WeakPolarHBondContact O-CD1 3.35Å; V50-L54 PolarHBondContact O-N 3.38Å; V50-T67 HydrophobicContact CG1-CG2 3.64Å; V50-C70 HydrophobicContact CG1-CB 4.2Å; V50-F71 HydrophobicContact CG2-CB 3.99Å; V50-F71 HydrophobicContact CG2-CD2 3.89Å; V50-F71 HydrophobicContact CG2-CG 4.46Å; V50-I74 HydrophobicContact CG2-CD1 4.08Å
51K68.9Low62.1Low21 Ų2146.6 Ų46.69%0.09124%0.242CC..Hα-helixtrans-56.7-50.9178.3177.2-176.2173.1-1780111.5F47 D48 R53 L54 Q55 D240F47-K51 WeakPolarHBondContact O-CB 3.49Å; F47-K51 PolarHBondContact O-N 3.48Å; D48-K51 PolarHBondContact O-N 2.9Å; K51-R53 PolarHBondContact O-N 3.18Å; K51-L54 PolarHBondContact O-N 3.4Å; K51-Q55 VanDerWaalsContact CE-NE2 3.31Å; K51-Q55 HydrophobicContact CG-CG 4.39Å; K51-Q55 WeakPolarHBondContact O-CB 3.41Å; K51-Q55 WeakPolarHBondContact O-CG 3.38Å; K51-Q55 PolarHBondContact O-N 3.41Å; K51-D240 WeakPolarHBondContact CE-OD2 3.34Å; K51-D240 IonicContact NZ-OD2 3.54Å; K51-D240 PolarHBondContact NZ-OD2 3.26Å
52V64.4Low61.8Low28 Ų2848.9 Ų48.917%0.1726%0.257CS..Hα-helixtrans-61.8-44.7-179.7172.70000110.4D48 V50 L54 Q55 V56 Q146D48-V52 VanDerWaalsContact O-CG2 3.31Å; D48-V52 WeakPolarHBondContact O-CG2 2.95Å; D48-V52 PolarHBondContact O-N 3.06Å; V50-V52 PolarHBondContact O-N 3.47Å; V52-L54 VanDerWaalsContact C-N 3.33Å; V52-L54 PolarHBondContact O-N 3.18Å; V52-Q55 PolarHBondContact O-N 3.25Å; V52-V56 HydrophobicContact CG1-CG2 4.09Å; V52-V56 VanDerWaalsContact O-CB 3.32Å; V52-V56 WeakPolarHBondContact O-CB 3.44Å; V52-V56 WeakPolarHBondContact O-CG2 3.35Å; V52-V56 PolarHBondContact O-N 3.18Å; V52-Q146 HydrophobicContact CG1-CB 4.16Å
53R67.2Low61.7Low31 Ų3150.8 Ų50.812%0.11727%0.268CS..Hα-helixtrans-63.3-36.8178.2-67.5-156.5-173.9-164.25.6113.2T49 V50 K51 Q57 Y64 E78 T150T49-R53 WeakPolarHBondContact O-CG 3.4Å; T49-R53 PolarHBondContact O-N 3.13Å; T49-R53 VanDerWaalsContact O-N 3.09Å; V50-R53 PolarHBondContact O-N 3.4Å; K51-R53 PolarHBondContact O-N 3.18Å; R53-Q57 PolarHBondContact O-N 2.95Å; R53-Y64 HydrophobicContact CB-CE2 4.41Å; R53-E78 IonicContact CZ-OE1 3.47Å; R53-E78 IonicContact CZ-OE2 3.24Å; R53-E78 IonicContact NH1-OE1 2.88Å; R53-E78 PolarHBondContact NH1-OE1 2.83Å; R53-E78 VanDerWaalsContact NH2-CD 3.28Å; R53-E78 IonicContact NH2-OE1 3.34Å; R53-E78 PolarHBondContact NH2-OE1 3.42Å; R53-E78 IonicContact NH2-OE2 2.67Å; R53-E78 PolarHBondContact NH2-OE2 3.46Å; R53-T150 HydrophobicContact CB-CG2 3.9Å; R53-T150 HydrophobicContact CG-CG2 3.6Å
54L65.9Low61.8Low18 Ų1849.5 Ų49.59%0.09426%0.257CS..Hα-helixtrans-73.5-32.3176.3-95128.2000114.3V50 K51 V52 V56 Q57 T67 C70V50-L54 HydrophobicContact CG1-CD1 3.47Å; V50-L54 VanDerWaalsContact CG1-CD1 3.47Å; V50-L54 WeakPolarHBondContact O-CB 3.37Å; V50-L54 WeakPolarHBondContact O-CD1 3.35Å; V50-L54 PolarHBondContact O-N 3.38Å; K51-L54 PolarHBondContact O-N 3.4Å; V52-L54 VanDerWaalsContact C-N 3.33Å; V52-L54 PolarHBondContact O-N 3.18Å; L54-V56 VanDerWaalsContact C-N 3.35Å; L54-Q57 WeakPolarHBondContact O-CG 3.47Å; L54-Q57 PolarHBondContact O-NE2 3.05Å; L54-T67 VanDerWaalsContact CD1-CA 3.49Å; L54-C70 HydrophobicContact CD1-CB 3.54Å; L54-C70 HydrophobicContact CG-CB 4.22Å
55Q54.4Low62Low53 Ų5361.1 Ų61.125%0.24830%0.301CS..Hα-helixtrans-75.7-24.8176.7-74.6-175.4-17.400112.5K51 V52 S244K51-Q55 VanDerWaalsContact CE-NE2 3.31Å; K51-Q55 HydrophobicContact CG-CG 4.39Å; K51-Q55 WeakPolarHBondContact O-CB 3.41Å; K51-Q55 WeakPolarHBondContact O-CG 3.38Å; K51-Q55 PolarHBondContact O-N 3.41Å; V52-Q55 PolarHBondContact O-N 3.25Å; Q55-S244 PolarHBondContact OE1-OG 3.02Å
56V57.8Low62.1Low44 Ų4462.2 Ų62.227%0.26731%0.313SS..Hα-helixtrans-95.3-14.3-174.5176.40000112.9V52 L54 M147V52-V56 HydrophobicContact CG1-CG2 4.09Å; V52-V56 VanDerWaalsContact O-CB 3.32Å; V52-V56 WeakPolarHBondContact O-CB 3.44Å; V52-V56 WeakPolarHBondContact O-CG2 3.35Å; V52-V56 PolarHBondContact O-N 3.18Å; L54-V56 VanDerWaalsContact C-N 3.35Å; V56-M147 HydrophobicContact CG1-CB 4.5Å; V56-M147 HydrophobicContact CG1-CG 4.27Å; V56-M147 HydrophobicContact CG2-CG 3.59Å; V56-M147 HydrophobicContact CG2-SD 3.98Å
57Q57.7Low62.3Low18 Ų1862.5 Ų62.58%0.08431%0.314CS..SBendtrans-60141.7178.576.4-175.2-50.100111.8R53 L54 Y64R53-Q57 PolarHBondContact O-N 2.95Å; L54-Q57 WeakPolarHBondContact O-CG 3.47Å; L54-Q57 PolarHBondContact O-NE2 3.05Å; Q57-Y64 PolarHBondContact OE1-O 2.89Å
58N53.3Low62.5Low98 Ų9867.3 Ų67.352%0.52434%0.335SS..  trans-61.7138.7175.8-89.6-47.2000111.1D60 K61N58-D60 VanDerWaalsContact C-N 3.34Å; N58-K61 CarbonylContact O-C 3.45Å
59V55.8Low62.8Low65 Ų6569.3 Ų69.339%0.39434%0.343SS..SBendtrans-69.1-37.1-179.7-176.70000110.6E271V59-E271 HydrophobicContact CG1-CG 4.02Å; V59-E271 HydrophobicContact CG2-CG 4.41Å; V59-E271 WeakPolarHBondContact CG2-OE1 3.38Å; V59-E271 WeakPolarHBondContact CG2-OE2 3.5Å
60D50.6Low62.9Low151 Ų15168.5 Ų68.581%0.80734%0.338SS*.SBendtrans-79.1-21.5-175.3-53-52.3000113.7N58N58-D60 VanDerWaalsContact C-N 3.34Å
61K54.5Low63.1Low168 Ų16872.4 Ų72.473%0.7336%0.355SS*.SBendtrans-141.984.2176.3-70.6-174.1-176.91770110.3N58 L63N58-K61 CarbonylContact O-C 3.45Å; K61-L63 PolarHBondContact O-N 3.42Å; K61-L63 VanDerWaalsContact O-N 3.14Å
62P58.5Low63.4Low82 Ų8275.3 Ų75.353%0.53237%0.369SS..  trans-68.2112.8-178.726.4-32.8000110.7Y64P62-Y64 VanDerWaalsContact C-N 3.25Å; P62-Y64 PolarHBondContact O-N 3.41Å
63L62.9Low63.6Low118 Ų11874.8 Ų74.862%0.61837%0.367SS*.SBendtrans-69-24.8172.3-88.498.7000112.4K61K61-L63 PolarHBondContact O-N 3.42Å; K61-L63 VanDerWaalsContact O-N 3.14Å
64Y65.1Low63.7Low22 Ų2273.3 Ų73.39%0.08636%0.361CS..  trans-127.2121-176.8-57.4-69.8000111.1R53 Q57 P62 G66 C70R53-Y64 HydrophobicContact CB-CE2 4.41Å; Q57-Y64 PolarHBondContact OE1-O 2.89Å; P62-Y64 VanDerWaalsContact C-N 3.25Å; P62-Y64 PolarHBondContact O-N 3.41Å; Y64-G66 PolarHBondContact O-N 3.39Å; Y64-C70 HydrophobicContact CD1-CB 3.82Å; Y64-C70 HydrophobicContact CD2-CB 4.39Å; Y64-C70 HydrophobicContact CE1-CB 4.39Å; Y64-C70 HydrophobicContact CG-CB 3.8Å
65R64Low64.2Low245 Ų24574.4 Ų74.493%0.92537%0.369SS*.SBendtrans-65.2-18.5176.9-108.7-178.8170.4-148.5-1.6114.2H69R65-H69 HydrophobicContact CB-CB 4.41Å
66G68.4Low65.1Low24 Ų2481.1 Ų81.125%0.24739%0.391CS..SBendtrans172.2-178-179.800000113.6Y64 F68 H69 C70Y64-G66 PolarHBondContact O-N 3.39Å; G66-F68 PolarHBondContact O-N 2.93Å; G66-H69 PolarHBondContact O-N 3.39Å; G66-C70 WeakPolarHBondContact O-CB 3.48Å; G66-C70 PolarHBondContact O-N 3.39Å
67T68.8Low65.7Low21 Ų2186 Ų8613%0.12941%0.411CS..Hα-helixtrans-53.4-51.1-179.5-48.50000112.9V50 L54 C70 F71 S282V50-T67 HydrophobicContact CG1-CG2 3.64Å; L54-T67 VanDerWaalsContact CD1-CA 3.49Å; T67-C70 PolarHBondContact O-N 3Å; T67-F71 WeakPolarHBondContact O-CB 3.35Å; T67-F71 PolarHBondContact O-N 2.71Å; T67-S282 WeakPolarHBondContact CG2-OG 3.49Å
68F73.9Confident65.9Low145 Ų14588.7 Ų88.764%0.63642%0.424SS*.Hα-helixtrans-66.7-40.9-179-73.4-82.6000112.7G66 C70 F71 Q72 L285G66-F68 PolarHBondContact O-N 2.93Å; F68-C70 VanDerWaalsContact C-N 3.34Å; F68-C70 PolarHBondContact O-N 2.99Å; F68-F71 PolarHBondContact O-N 3.04Å; F68-Q72 VanDerWaalsContact O-CB 3.28Å; F68-Q72 WeakPolarHBondContact O-CB 3.45Å; F68-Q72 PolarHBondContact O-N 3.19Å; F68-L285 HydrophobicContact CZ-CD2 4.33Å
69H72.6Confident66.5Low85 Ų8587.5 Ų87.539%0.39442%0.424SS..Hα-helixtrans-65.7-38.7177.1-171.8-96.5000111.5R65 G66 S73R65-H69 HydrophobicContact CB-CB 4.41Å; G66-H69 PolarHBondContact O-N 3.39Å; H69-S73 VanDerWaalsContact O-CB 3.23Å; H69-S73 WeakPolarHBondContact O-CB 3.45Å; H69-S73 PolarHBondContact O-N 2.99Å; H69-S73 PolarHBondContact O-OG 2.82Å
70C69.1Low66.8Low0 Ų089.9 Ų89.90%043%0.432CS..Hα-helixtrans-64.3-49.8174.9-169.60000111.3V50 L54 Y64 G66 T67 F68 Q72 S73 I74V50-C70 HydrophobicContact CG1-CB 4.2Å; L54-C70 HydrophobicContact CD1-CB 3.54Å; L54-C70 HydrophobicContact CG-CB 4.22Å; Y64-C70 HydrophobicContact CD1-CB 3.82Å; Y64-C70 HydrophobicContact CD2-CB 4.39Å; Y64-C70 HydrophobicContact CE1-CB 4.39Å; Y64-C70 HydrophobicContact CG-CB 3.8Å; G66-C70 WeakPolarHBondContact O-CB 3.48Å; G66-C70 PolarHBondContact O-N 3.39Å; T67-C70 PolarHBondContact O-N 3Å; F68-C70 VanDerWaalsContact C-N 3.34Å; F68-C70 PolarHBondContact O-N 2.99Å; C70-Q72 PolarHBondContact O-N 3.12Å; C70-S73 PolarHBondContact O-N 3.37Å; C70-I74 WeakPolarHBondContact O-CD1 3.33Å; C70-I74 VanDerWaalsContact O-CG1 3.22Å; C70-I74 WeakPolarHBondContact O-CG1 3.29Å; C70-I74 PolarHBondContact O-N 3.26Å
71F71.1Confident67.2Low83 Ų8389.4 Ų89.436%0.36443%0.428SS..Hα-helixtrans-58-50.5177.3-178.6-99.6000112.1V50 T67 F68 S73 I74 V75 L83V50-F71 HydrophobicContact CG2-CB 3.99Å; V50-F71 HydrophobicContact CG2-CD2 3.89Å; V50-F71 HydrophobicContact CG2-CG 4.46Å; T67-F71 WeakPolarHBondContact O-CB 3.35Å; T67-F71 PolarHBondContact O-N 2.71Å; F68-F71 PolarHBondContact O-N 3.04Å; F71-S73 VanDerWaalsContact C-N 3.31Å; F71-S73 PolarHBondContact O-N 3.01Å; F71-I74 PolarHBondContact O-N 3.32Å; F71-V75 HydrophobicContact CD1-CG2 4.4Å; F71-V75 HydrophobicContact CE1-CG2 4.01Å; F71-V75 HydrophobicContact CE2-CG2 4.34Å; F71-V75 HydrophobicContact CZ-CG2 3.99Å; F71-V75 WeakPolarHBondContact O-CG2 3.49Å; F71-V75 PolarHBondContact O-N 3.49Å; F71-L83 HydrophobicContact CD2-CD2 4.07Å; F71-L83 HydrophobicContact CE2-CD1 3.76Å; F71-L83 HydrophobicContact CE2-CD2 3.95Å; F71-L83 HydrophobicContact CZ-CD1 4.22Å
72Q75.8Confident67.5Low83 Ų8381.6 Ų81.639%0.38840%0.396SS..Hα-helixtrans-61.7-38.9178.6-172.7178.917.800112.3F68 C70 R76F68-Q72 VanDerWaalsContact O-CB 3.28Å; F68-Q72 WeakPolarHBondContact O-CB 3.45Å; F68-Q72 PolarHBondContact O-N 3.19Å; C70-Q72 PolarHBondContact O-N 3.12Å; Q72-R76 VanDerWaalsContact NE2-NH2 3.15Å; Q72-R76 WeakPolarHBondContact O-CB 3.21Å; Q72-R76 WeakPolarHBondContact O-CG 3.47Å; Q72-R76 PolarHBondContact O-N 3.02Å
73S68.7Low67.6Low17 Ų1777.9 Ų77.912%0.11937%0.372CS..Hα-helixtrans-65.8-40.6176.7-60.30000111.6H69 C70 F71 R76 Q77H69-S73 VanDerWaalsContact O-CB 3.23Å; H69-S73 WeakPolarHBondContact O-CB 3.45Å; H69-S73 PolarHBondContact O-N 2.99Å; H69-S73 PolarHBondContact O-OG 2.82Å; C70-S73 PolarHBondContact O-N 3.37Å; F71-S73 VanDerWaalsContact C-N 3.31Å; F71-S73 PolarHBondContact O-N 3.01Å; S73-R76 PolarHBondContact O-N 3.11Å; S73-Q77 VanDerWaalsContact O-CB 3.23Å; S73-Q77 WeakPolarHBondContact O-CB 3.39Å; S73-Q77 VanDerWaalsContact O-CG 3.25Å; S73-Q77 WeakPolarHBondContact O-CG 3.47Å; S73-Q77 PolarHBondContact O-N 3.08Å
74I69.6Low67.5Low0 Ų076.8 Ų76.80%036%0.36CS..Hα-helixtrans-63.6-48.2177.3-66.7161.5000110.2V50 C70 F71 R76 Q77 E78 L83V50-I74 HydrophobicContact CG2-CD1 4.08Å; C70-I74 WeakPolarHBondContact O-CD1 3.33Å; C70-I74 VanDerWaalsContact O-CG1 3.22Å; C70-I74 WeakPolarHBondContact O-CG1 3.29Å; C70-I74 PolarHBondContact O-N 3.26Å; F71-I74 PolarHBondContact O-N 3.32Å; I74-R76 VanDerWaalsContact C-N 3.31Å; I74-R76 PolarHBondContact O-N 3.06Å; I74-Q77 PolarHBondContact O-N 3.39Å; I74-E78 WeakPolarHBondContact O-CA 3.48Å; I74-E78 PolarHBondContact O-N 2.86Å; I74-L83 HydrophobicContact CG2-CD2 3.91Å; I74-L83 HydrophobicContact CG2-CG 4Å
75V74.6Confident67.2Low41 Ų4183.6 Ų83.625%0.24839%0.39CS..Hα-helixtrans-62.2-40.4179.81750000111.1F71 S79 M80 L83F71-V75 HydrophobicContact CD1-CG2 4.4Å; F71-V75 HydrophobicContact CE1-CG2 4.01Å; F71-V75 HydrophobicContact CE2-CG2 4.34Å; F71-V75 HydrophobicContact CZ-CG2 3.99Å; F71-V75 WeakPolarHBondContact O-CG2 3.49Å; F71-V75 PolarHBondContact O-N 3.49Å; V75-S79 WeakPolarHBondContact O-CA 3.33Å; V75-S79 PolarHBondContact O-N 3.06Å; V75-M80 HydrophobicContact CG1-CE 4.14Å; V75-M80 HydrophobicContact CG1-SD 4.18Å; V75-M80 HydrophobicContact CG2-SD 4.15Å; V75-L83 HydrophobicContact CG2-CD1 3.79Å
76R73.7Confident67Low193 Ų19374.2 Ų74.273%0.72837%0.37SS*.Hα-helixtrans-72.5-33178.5-77.9-177.8174163.8-2.8114.2Q72 S73 I74Q72-R76 VanDerWaalsContact NE2-NH2 3.15Å; Q72-R76 WeakPolarHBondContact O-CB 3.21Å; Q72-R76 WeakPolarHBondContact O-CG 3.47Å; Q72-R76 PolarHBondContact O-N 3.02Å; S73-R76 PolarHBondContact O-N 3.11Å; I74-R76 VanDerWaalsContact C-N 3.31Å; I74-R76 PolarHBondContact O-N 3.06Å
77Q70.6Confident66.8Low146 Ų14674.5 Ų74.568%0.68237%0.365SS*.Hα-helixtrans-98.4-32.1-173.3-66.6177.30.800113.9S73 I74S73-Q77 VanDerWaalsContact O-CB 3.23Å; S73-Q77 WeakPolarHBondContact O-CB 3.39Å; S73-Q77 VanDerWaalsContact O-CG 3.25Å; S73-Q77 WeakPolarHBondContact O-CG 3.47Å; S73-Q77 PolarHBondContact O-N 3.08Å; I74-Q77 PolarHBondContact O-N 3.39Å
78E62.7Low66.4Low76 Ų7675.3 Ų75.336%0.35538%0.377SS..Hα-helixtrans-120.21.4-173.1-63.6-177-155.900113.4R53 I74 G82R53-E78 IonicContact CZ-OE1 3.47Å; R53-E78 IonicContact CZ-OE2 3.24Å; R53-E78 IonicContact NH1-OE1 2.88Å; R53-E78 PolarHBondContact NH1-OE1 2.83Å; R53-E78 VanDerWaalsContact NH2-CD 3.28Å; R53-E78 IonicContact NH2-OE1 3.34Å; R53-E78 PolarHBondContact NH2-OE1 3.42Å; R53-E78 IonicContact NH2-OE2 2.67Å; R53-E78 PolarHBondContact NH2-OE2 3.46Å; I74-E78 WeakPolarHBondContact O-CA 3.48Å; I74-E78 PolarHBondContact O-N 2.86Å; E78-G82 PolarHBondContact O-N 3.49Å
79S66.3Low65.7Low73 Ų7370.9 Ų70.951%0.5137%0.365SS..Hα-helixtrans62.9173.8-174.2-169.70000113.7V75 L81 G82V75-S79 WeakPolarHBondContact O-CA 3.33Å; V75-S79 PolarHBondContact O-N 3.06Å; S79-L81 PolarHBondContact O-N 3.34Å; S79-G82 PolarHBondContact O-N 2.9Å
80M61.3Low65Low114 Ų11467.7 Ų67.756%0.56235%0.351SS*.Hα-helixtrans-58.6-29.5177.9-70.8-64.1-167.600112.3V75 G82 L83 Y84V75-M80 HydrophobicContact CG1-CE 4.14Å; V75-M80 HydrophobicContact CG1-SD 4.18Å; V75-M80 HydrophobicContact CG2-SD 4.15Å; M80-G82 VanDerWaalsContact C-N 3.25Å; M80-G82 PolarHBondContact O-N 3.44Å; M80-L83 WeakPolarHBondContact O-CB 3.42Å; M80-L83 PolarHBondContact O-N 2.79Å; M80-L83 HydrophobicContact SD-CD1 4.1Å; M80-Y84 WeakPolarHBondContact O-CD2 3.39Å
81L59Low64.7Low141 Ų14169.8 Ų69.874%0.73836%0.362SS*.Hα-helixtrans-68.7-21.9174.7-69.1170.1000113.2S79 L83 Y84 K85S79-L81 PolarHBondContact O-N 3.34Å; L81-L83 VanDerWaalsContact C-N 3.28Å; L81-L83 PolarHBondContact O-N 3.02Å; L81-Y84 PolarHBondContact O-N 2.78Å; L81-K85 PolarHBondContact O-N 2.91Å
82G60Low64.2Low5 Ų572.6 Ų72.65%0.05238%0.378CS..Hα-helixtrans-63.4-32.9172.700000113.1E78 S79 M80 Y84 K85E78-G82 PolarHBondContact O-N 3.49Å; S79-G82 PolarHBondContact O-N 2.9Å; M80-G82 VanDerWaalsContact C-N 3.25Å; M80-G82 PolarHBondContact O-N 3.44Å; G82-Y84 VanDerWaalsContact C-N 3.33Å; G82-K85 WeakPolarHBondContact O-CB 3.34Å; G82-K85 PolarHBondContact O-N 3.14Å
83L61.5Low63.7Low4 Ų469.2 Ų69.22%0.02137%0.365CS..Hα-helixtrans-71.8-25.6177.4-70.2158.7000113.1H45 P46 F71 I74 V75 M80 L81H45-L83 PolarHBondContact CD2-O 3.41Å; P46-L83 HydrophobicContact CB-CB 4.42Å; P46-L83 HydrophobicContact CB-CD2 4.09Å; F71-L83 HydrophobicContact CD2-CD2 4.07Å; F71-L83 HydrophobicContact CE2-CD1 3.76Å; F71-L83 HydrophobicContact CE2-CD2 3.95Å; F71-L83 HydrophobicContact CZ-CD1 4.22Å; I74-L83 HydrophobicContact CG2-CD2 3.91Å; I74-L83 HydrophobicContact CG2-CG 4Å; V75-L83 HydrophobicContact CG2-CD1 3.79Å; M80-L83 WeakPolarHBondContact O-CB 3.42Å; M80-L83 PolarHBondContact O-N 2.79Å; M80-L83 HydrophobicContact SD-CD1 4.1Å; L81-L83 VanDerWaalsContact C-N 3.28Å; L81-L83 PolarHBondContact O-N 3.02Å
84Y61.4Low63.4Low95 Ų9570.5 Ų70.537%0.37337%0.37SS..THydrogen-bonded Turntrans-99.50.1179.5-67.6-84.4000113.3L42 M80 L81 G82 G86 I87L42-Y84 HydrophobicContact CD2-CE1 4.38Å; L42-Y84 WeakPolarHBondContact O-CE1 3.35Å; M80-Y84 WeakPolarHBondContact O-CD2 3.39Å; L81-Y84 PolarHBondContact O-N 2.78Å; G82-Y84 VanDerWaalsContact C-N 3.33Å; Y84-G86 PolarHBondContact O-N 3.34Å; Y84-G86 VanDerWaalsContact O-N 3.15Å; Y84-I87 HydrophobicContact CD1-CD1 4Å; Y84-I87 WeakPolarHBondContact O-CB 3.02Å; Y84-I87 WeakPolarHBondContact O-CG2 3.32Å; Y84-I87 PolarHBondContact O-N 2.88Å
85K58.3Low63.1Low164 Ų16473.6 Ų73.671%0.71339%0.389SS*.THydrogen-bonded Turntrans-70.6112.9-176.1-164.4172-174.6169.10110.6L81 G82L81-K85 PolarHBondContact O-N 2.91Å; G82-K85 WeakPolarHBondContact O-CB 3.34Å; G82-K85 PolarHBondContact O-N 3.14Å
86G60.3Low62.9Low49 Ų4977.7 Ų77.751%0.50540%0.404SS..THydrogen-bonded Turntrans100.97.7-18000000114.6Y84 G88 S89 P90Y84-G86 PolarHBondContact O-N 3.34Å; Y84-G86 VanDerWaalsContact O-N 3.15Å; G86-G88 PolarHBondContact O-N 2.86Å; G86-S89 PolarHBondContact O-N 3.4Å; G86-P90 WeakPolarHBondContact O-CD 3.42Å
87I64.5Low62.8Low30 Ų3069.1 Ų69.115%0.15437%0.372CS..THydrogen-bonded Turntrans-63.2-23.8175.8-160.2166.1000113.8V41 L42 H45 Y84 S89 P90 M91V41-I87 HydrophobicContact CG1-CD1 4.26Å; V41-I87 HydrophobicContact CG1-CG1 4.08Å; L42-I87 HydrophobicContact CD2-CD1 3.52Å; L42-I87 HydrophobicContact CG-CD1 4.22Å; H45-I87 HydrophobicContact CB-CD1 4.16Å; Y84-I87 HydrophobicContact CD1-CD1 4Å; Y84-I87 WeakPolarHBondContact O-CB 3.02Å; Y84-I87 WeakPolarHBondContact O-CG2 3.32Å; Y84-I87 PolarHBondContact O-N 2.88Å; I87-S89 VanDerWaalsContact C-N 3.29Å; I87-S89 PolarHBondContact O-N 3.06Å; I87-P90 WeakPolarHBondContact O-CD 3.42Å; I87-P90 VanDerWaalsContact O-CG 3.23Å; I87-P90 WeakPolarHBondContact O-CG 3.48Å; I87-M91 HydrophobicContact CG1-CG 4Å; I87-M91 WeakPolarHBondContact O-CB 3.44Å; I87-M91 VanDerWaalsContact O-CG 3.24Å; I87-M91 WeakPolarHBondContact O-CG 3.48Å; I87-M91 PolarHBondContact O-N 3.37Å; I87-M91 VanDerWaalsContact O-N 3.08Å
88G58.7Low62.6Low37 Ų3763.8 Ų63.838%0.38135%0.348SS..Hα-helixtrans-61.6-33.2179.900000113.9G86 M92G86-G88 PolarHBondContact O-N 2.86Å; G88-M92 PolarHBondContact O-N 2.89Å
89S60Low62.9Low53 Ų5362.6 Ų62.637%0.37135%0.352SS..Hα-helixtrans-67.1-50.1177.6173.40000113.3G86 I87 G93G86-S89 PolarHBondContact O-N 3.4Å; I87-S89 VanDerWaalsContact C-N 3.29Å; I87-S89 PolarHBondContact O-N 3.06Å; S89-G93 PolarHBondContact O-N 3.44Å; S89-G93 VanDerWaalsContact O-N 3.14Å
90P58.6Low63.3Low18 Ų1861 Ų6112%0.11734%0.337CS..Hα-helixtrans-63.9-36.5172.411-19.3000114.1V41 G86 I87 G93 L94 K142V41-P90 HydrophobicContact CG1-CB 4.49Å; G86-P90 WeakPolarHBondContact O-CD 3.42Å; I87-P90 WeakPolarHBondContact O-CD 3.42Å; I87-P90 VanDerWaalsContact O-CG 3.23Å; I87-P90 WeakPolarHBondContact O-CG 3.48Å; P90-G93 PolarHBondContact O-N 2.66Å; P90-L94 WeakPolarHBondContact O-CB 3.18Å; P90-L94 PolarHBondContact O-N 3.28Å; P90-K142 HydrophobicContact CB-CD 4.43Å; P90-K142 VanDerWaalsContact CB-NZ 3.34Å; P90-K142 HydrophobicContact CG-CD 4.42Å
91M61.1Low63.8Low43 Ų4356 Ų5621%0.21231%0.313CS..Hα-helixtrans-66.3-48.1-179.2-73.2-101.357.300112.3A38 V41 I87 G93 L94 T95A38-M91 VanDerWaalsContact CA-CE 3.5Å; A38-M91 HydrophobicContact CB-CE 3.59Å; A38-M91 HydrophobicContact CB-SD 4.3Å; V41-M91 HydrophobicContact CG1-CG 4.41Å; I87-M91 HydrophobicContact CG1-CG 4Å; I87-M91 WeakPolarHBondContact O-CB 3.44Å; I87-M91 VanDerWaalsContact O-CG 3.24Å; I87-M91 WeakPolarHBondContact O-CG 3.48Å; I87-M91 PolarHBondContact O-N 3.37Å; I87-M91 VanDerWaalsContact O-N 3.08Å; M91-G93 VanDerWaalsContact C-N 3.33Å; M91-G93 PolarHBondContact O-N 3.05Å; M91-L94 HydrophobicContact CE-CD2 4.49Å; M91-L94 PolarHBondContact O-N 3.37Å; M91-T95 PolarHBondContact O-N 3.06Å; M91-T95 PolarHBondContact O-OG1 2.87Å
92M61.5Low64.2Low143 Ų14351.3 Ų51.370%0.70429%0.287SS*.Hα-helixtrans-63.5-39.5174.8-80.8-167.3-7500112.2G88 L94 F96G88-M92 PolarHBondContact O-N 2.89Å; M92-L94 PolarHBondContact O-N 2.58Å; M92-F96 WeakPolarHBondContact O-CB 3.43Å; M92-F96 PolarHBondContact O-N 2.92Å
93G66.1Low64.8Low11 Ų1153.3 Ų53.311%0.11331%0.307CS..Hα-helixtrans-61.3-43.2177.500000112.3S89 P90 M91 F96 I97S89-G93 PolarHBondContact O-N 3.44Å; S89-G93 VanDerWaalsContact O-N 3.14Å; P90-G93 PolarHBondContact O-N 2.66Å; M91-G93 VanDerWaalsContact C-N 3.33Å; M91-G93 PolarHBondContact O-N 3.05Å; G93-F96 PolarHBondContact O-N 3.26Å; G93-I97 VanDerWaalsContact O-CB 3.27Å; G93-I97 WeakPolarHBondContact O-CB 3.11Å; G93-I97 VanDerWaalsContact O-CD1 3.29Å; G93-I97 WeakPolarHBondContact O-CD1 3.43Å; G93-I97 WeakPolarHBondContact O-CG1 3.45Å; G93-I97 PolarHBondContact O-N 2.85Å
94L61.6Low65.4Low44 Ų4454.6 Ų54.623%0.2332%0.315CS..Hα-helixtrans-63-47-178.1-173.863.9000112.4V41 P90 M91 M92 N98V41-L94 HydrophobicContact CG2-CD2 4.22Å; P90-L94 WeakPolarHBondContact O-CB 3.18Å; P90-L94 PolarHBondContact O-N 3.28Å; M91-L94 HydrophobicContact CE-CD2 4.49Å; M91-L94 PolarHBondContact O-N 3.37Å; M92-L94 PolarHBondContact O-N 2.58Å; L94-N98 WeakPolarHBondContact O-CB 3.43Å; L94-N98 VanDerWaalsContact O-CG 3.25Å; L94-N98 PolarHBondContact O-N 2.95Å; L94-N98 PolarHBondContact O-ND2 3.16Å
95T63.7Low66Low65 Ų6552 Ų5240%0.39931%0.307SS..Hα-helixtrans-62.4-45.6178.5-49.40000111.4L34 M91 N98 A99L34-T95 HydrophobicContact CD1-CG2 4.07Å; L34-T95 WeakPolarHBondContact CD1-OG1 3.39Å; L34-T95 HydrophobicContact CD2-CG2 4.31Å; M91-T95 PolarHBondContact O-N 3.06Å; M91-T95 PolarHBondContact O-OG1 2.87Å; T95-N98 PolarHBondContact O-N 3.37Å; T95-A99 WeakPolarHBondContact O-CB 3.5Å; T95-A99 PolarHBondContact O-N 3.42Å
96F71.1Confident66.5Low127 Ų12746.1 Ų46.156%0.55729%0.292SS*.Hα-helixtrans-67.7-43.2-177.9-170.2-107.5000112.2M92 G93 A99 I100M92-F96 WeakPolarHBondContact O-CB 3.43Å; M92-F96 PolarHBondContact O-N 2.92Å; G93-F96 PolarHBondContact O-N 3.26Å; F96-A99 PolarHBondContact O-N 3.47Å; F96-I100 HydrophobicContact CD1-CD1 3.67Å; F96-I100 HydrophobicContact CE1-CD1 3.32Å; F96-I100 HydrophobicContact CE1-CG1 4.5Å; F96-I100 HydrophobicContact CE2-CD1 4.41Å; F96-I100 HydrophobicContact CG-CD1 4.37Å; F96-I100 HydrophobicContact CZ-CD1 3.73Å; F96-I100 WeakPolarHBondContact O-CG1 3.48Å; F96-I100 PolarHBondContact O-N 3.28Å; F96-I100 VanDerWaalsContact O-N 3.1Å
97I70.3Confident67.3Low14 Ų1448.1 Ų48.17%0.07229%0.291CS..Hα-helixtrans-61.6-47.9176.4-73.2162.3000110.7G93 A99 I100 V101 Q131 C135 M138G93-I97 VanDerWaalsContact O-CB 3.27Å; G93-I97 WeakPolarHBondContact O-CB 3.11Å; G93-I97 VanDerWaalsContact O-CD1 3.29Å; G93-I97 WeakPolarHBondContact O-CD1 3.43Å; G93-I97 WeakPolarHBondContact O-CG1 3.45Å; G93-I97 PolarHBondContact O-N 2.85Å; I97-A99 VanDerWaalsContact C-N 3.34Å; I97-A99 PolarHBondContact O-N 2.92Å; I97-I100 PolarHBondContact O-N 2.95Å; I97-V101 HydrophobicContact CG2-CG2 4.38Å; I97-V101 WeakPolarHBondContact O-CG2 3.26Å; I97-V101 PolarHBondContact O-N 3.33Å; I97-Q131 HydrophobicContact CG2-CG 3.71Å; I97-C135 HydrophobicContact CD1-CB 4.03Å; I97-C135 VanDerWaalsContact CD1-SG 3.58Å; I97-M138 HydrophobicContact CD1-CE 3.18Å; I97-M138 HydrophobicContact CG1-CE 3.57Å
98N66.9Low67.6Low33 Ų3347.5 Ų47.518%0.17629%0.291CS..Hα-helixtrans-64.3-40.7-178.5-72.5-15.9000111.1L94 T95 I100 V101 F102L94-N98 WeakPolarHBondContact O-CB 3.43Å; L94-N98 VanDerWaalsContact O-CG 3.25Å; L94-N98 PolarHBondContact O-N 2.95Å; L94-N98 PolarHBondContact O-ND2 3.16Å; T95-N98 PolarHBondContact O-N 3.37Å; N98-I100 VanDerWaalsContact C-N 3.32Å; N98-I100 PolarHBondContact O-N 3.24Å; N98-V101 PolarHBondContact O-N 3.46Å; N98-F102 HydrophobicContact CB-CD2 4.5Å; N98-F102 HydrophobicContact CB-CE2 4.33Å; N98-F102 WeakPolarHBondContact O-CD2 3.24Å; N98-F102 PolarHBondContact O-N 3.43Å
99A68.6Low68.1Low52 Ų5247.8 Ų47.843%0.4328%0.283SS..Hα-helixtrans-58.3-42.5174.800000112.5T95 F96 I97 G103T95-A99 WeakPolarHBondContact O-CB 3.5Å; T95-A99 PolarHBondContact O-N 3.42Å; F96-A99 PolarHBondContact O-N 3.47Å; I97-A99 VanDerWaalsContact C-N 3.34Å; I97-A99 PolarHBondContact O-N 2.92Å; A99-G103 PolarHBondContact O-N 3.32Å
100I75.2Confident68.8Low40 Ų4054.8 Ų54.821%0.20530%0.301CS..Hα-helixtrans-66.7-43.9177.5-69169.9000111.3F96 I97 N98 F102 G103 V104 I130 I134F96-I100 HydrophobicContact CD1-CD1 3.67Å; F96-I100 HydrophobicContact CE1-CD1 3.32Å; F96-I100 HydrophobicContact CE1-CG1 4.5Å; F96-I100 HydrophobicContact CE2-CD1 4.41Å; F96-I100 HydrophobicContact CG-CD1 4.37Å; F96-I100 HydrophobicContact CZ-CD1 3.73Å; F96-I100 WeakPolarHBondContact O-CG1 3.48Å; F96-I100 PolarHBondContact O-N 3.28Å; F96-I100 VanDerWaalsContact O-N 3.1Å; I97-I100 PolarHBondContact O-N 2.95Å; N98-I100 VanDerWaalsContact C-N 3.32Å; N98-I100 PolarHBondContact O-N 3.24Å; I100-F102 PolarHBondContact O-N 3.34Å; I100-G103 PolarHBondContact O-N 2.95Å; I100-V104 HydrophobicContact CG2-CG2 4.16Å; I100-V104 WeakPolarHBondContact O-CB 3.38Å; I100-V104 VanDerWaalsContact O-CG2 3.25Å; I100-V104 WeakPolarHBondContact O-CG2 3.08Å; I100-V104 PolarHBondContact O-N 3.47Å; I100-I130 HydrophobicContact CG2-CG2 3.82Å; I100-I134 HydrophobicContact CD1-CD1 3.66Å; I100-I134 HydrophobicContact CG2-CD1 4.11Å
101V70.7Confident69.7Low9 Ų961.9 Ų61.96%0.05533%0.33CS..Hα-helixtrans-57.1-50.4177.9167.90000110.9I97 N98 G103 V104 Q105 A127 Q131I97-V101 HydrophobicContact CG2-CG2 4.38Å; I97-V101 WeakPolarHBondContact O-CG2 3.26Å; I97-V101 PolarHBondContact O-N 3.33Å; N98-V101 PolarHBondContact O-N 3.46Å; V101-G103 PolarHBondContact O-N 2.88Å; V101-V104 PolarHBondContact O-N 2.96Å; V101-Q105 VanDerWaalsContact O-CB 3.25Å; V101-Q105 WeakPolarHBondContact O-CB 3.29Å; V101-Q105 PolarHBondContact O-N 3.28Å; V101-A127 HydrophobicContact CG1-CB 4.23Å; V101-Q131 HydrophobicContact CG2-CB 3.65Å; V101-Q131 HydrophobicContact CG2-CG 3.94Å
102F68.6Low70.4Confident41 Ų4163.1 Ų63.118%0.1834%0.337CS..Hα-helixtrans-66.4-37.8179.3-71.4-61.7000112.4Q30 D33 N98 I100 G106Q30-F102 HydrophobicContact CG-CD2 3.82Å; Q30-F102 HydrophobicContact CG-CE2 3.87Å; D33-F102 WeakPolarHBondContact OD2-CZ 3.21Å; N98-F102 HydrophobicContact CB-CD2 4.5Å; N98-F102 HydrophobicContact CB-CE2 4.33Å; N98-F102 WeakPolarHBondContact O-CD2 3.24Å; N98-F102 PolarHBondContact O-N 3.43Å; I100-F102 PolarHBondContact O-N 3.34Å; F102-G106 PolarHBondContact O-N 3.12Å
103G72.8Confident70.4Confident47 Ų4759.4 Ų59.449%0.48534%0.336SS..Hα-helixtrans-62.4-44.217500000112.6A99 I100 V101 N107A99-G103 PolarHBondContact O-N 3.32Å; I100-G103 PolarHBondContact O-N 2.95Å; V101-G103 PolarHBondContact O-N 2.88Å; G103-N107 VanDerWaalsContact O-CB 3.29Å; G103-N107 WeakPolarHBondContact O-CB 3.39Å; G103-N107 PolarHBondContact O-N 3.06Å; G103-N107 VanDerWaalsContact O-N 3.07Å
104V72.6Confident70.4Confident32 Ų3268 Ų6819%0.19437%0.365CS..Hα-helixtrans-69-47.2178.1173.50000111I100 V101 N107 A108 A127 I130I100-V104 HydrophobicContact CG2-CG2 4.16Å; I100-V104 WeakPolarHBondContact O-CB 3.38Å; I100-V104 VanDerWaalsContact O-CG2 3.25Å; I100-V104 WeakPolarHBondContact O-CG2 3.08Å; I100-V104 PolarHBondContact O-N 3.47Å; V101-V104 PolarHBondContact O-N 2.96Å; V104-N107 PolarHBondContact O-N 3.1Å; V104-A108 WeakPolarHBondContact O-CB 3.32Å; V104-A108 PolarHBondContact O-N 3.4Å; V104-A127 HydrophobicContact CB-CB 4.16Å; V104-A127 HydrophobicContact CG1-CB 3.94Å; V104-I130 HydrophobicContact CB-CD1 4.41Å; V104-I130 HydrophobicContact CG1-CD1 3.67Å; V104-I130 HydrophobicContact CG2-CB 4.47Å; V104-I130 HydrophobicContact CG2-CD1 3.79Å; V104-I130 HydrophobicContact CG2-CG2 4.16Å
105Q74Confident70.6Confident40 Ų4069.5 Ų69.519%0.18737%0.373CS..Hα-helixtrans-61.8-46.4179.6-175.7176.6-11.800111.1V101 N107 A108 M109 A127V101-Q105 VanDerWaalsContact O-CB 3.25Å; V101-Q105 WeakPolarHBondContact O-CB 3.29Å; V101-Q105 PolarHBondContact O-N 3.28Å; Q105-N107 PolarHBondContact O-N 3.44Å; Q105-A108 PolarHBondContact O-N 2.99Å; Q105-M109 HydrophobicContact CG-SD 4.31Å; Q105-M109 WeakPolarHBondContact O-CB 3.16Å; Q105-M109 WeakPolarHBondContact O-CG 3.11Å; Q105-M109 PolarHBondContact O-N 2.78Å; Q105-A127 HydrophobicContact CB-CB 4.02Å
106G70.6Confident71.1Confident40 Ų4069 Ų6941%0.41237%0.37SS..Hα-helixtrans-63.7-40.7178.600000112.9F102 R110F102-G106 PolarHBondContact O-N 3.12Å; G106-R110 WeakPolarHBondContact O-CB 3.45Å; G106-R110 PolarHBondContact O-N 3.24Å
107N75.5Confident70.8Confident91 Ų9168 Ų6849%0.48738%0.376SS..Hα-helixtrans-72.9-34.3177.7-159.442000112.4G103 V104 Q105 K111G103-N107 VanDerWaalsContact O-CB 3.29Å; G103-N107 WeakPolarHBondContact O-CB 3.39Å; G103-N107 PolarHBondContact O-N 3.06Å; G103-N107 VanDerWaalsContact O-N 3.07Å; V104-N107 PolarHBondContact O-N 3.1Å; Q105-N107 PolarHBondContact O-N 3.44Å; N107-K111 WeakPolarHBondContact O-CG 3.31Å; N107-K111 PolarHBondContact O-N 2.67Å; N107-K111 VanDerWaalsContact O-N 3.12Å
108A72.3Confident70.8Confident18 Ų1873.2 Ų73.215%0.14940%0.404CS..Hα-helixtrans-66.3-46.817400000111.1V104 Q105 R110 K111 L112 A123V104-A108 WeakPolarHBondContact O-CB 3.32Å; V104-A108 PolarHBondContact O-N 3.4Å; Q105-A108 PolarHBondContact O-N 2.99Å; A108-R110 VanDerWaalsContact C-N 3.33Å; A108-R110 PolarHBondContact O-N 2.96Å; A108-K111 PolarHBondContact O-N 3.47Å; A108-L112 WeakPolarHBondContact O-CD1 3.3Å; A108-L112 PolarHBondContact O-N 3.31Å; A108-A123 HydrophobicContact CB-CB 3.72Å
109M69.5Low71Confident43 Ų4373.3 Ų73.321%0.21240%0.404CS..Hα-helixtrans-60.9-41.7175.4-72.6-173.766.400112Q105 K111 L112 G113 Q120 A123Q105-M109 HydrophobicContact CG-SD 4.31Å; Q105-M109 WeakPolarHBondContact O-CB 3.16Å; Q105-M109 WeakPolarHBondContact O-CG 3.11Å; Q105-M109 PolarHBondContact O-N 2.78Å; M109-K111 VanDerWaalsContact C-N 3.29Å; M109-K111 PolarHBondContact O-N 2.88Å; M109-L112 PolarHBondContact O-N 3.17Å; M109-G113 PolarHBondContact O-N 3.24Å; M109-G113 VanDerWaalsContact O-N 3.14Å; M109-Q120 HydrophobicContact CE-CG 4.26Å; M109-A123 HydrophobicContact CG-CB 3.74Å
110R74.3Confident70.9Confident199 Ų19973.3 Ų73.375%0.75140%0.395SS*.Hα-helixtrans-62.7-32.7176.6-174175.5-81.7172.4-6.6113.1G106 A108G106-R110 WeakPolarHBondContact O-CB 3.45Å; G106-R110 PolarHBondContact O-N 3.24Å; A108-R110 VanDerWaalsContact C-N 3.33Å; A108-R110 PolarHBondContact O-N 2.96Å
111K76.8Confident70.7Confident168 Ų16878.4 Ų78.473%0.7342%0.416SS*.Hα-helixtrans-78.3-31.1175.5-76.9-173.3177.2-170.70113.5N107 A108 M109N107-K111 WeakPolarHBondContact O-CG 3.31Å; N107-K111 PolarHBondContact O-N 2.67Å; N107-K111 VanDerWaalsContact O-N 3.12Å; A108-K111 PolarHBondContact O-N 3.47Å; M109-K111 VanDerWaalsContact C-N 3.29Å; M109-K111 PolarHBondContact O-N 2.88Å
112L75Confident70.7Confident68 Ų6882.6 Ų82.636%0.35644%0.438SS..Hα-helixtrans-82.1-19.3-177.5-88.371.3000112.6A108 M109 R114 N119 L122A108-L112 WeakPolarHBondContact O-CD1 3.3Å; A108-L112 PolarHBondContact O-N 3.31Å; M109-L112 PolarHBondContact O-N 3.17Å; L112-R114 PolarHBondContact O-N 2.93Å; L112-N119 HydrophobicContact CB-CB 4.23Å; L112-N119 HydrophobicContact CD2-CB 3.64Å; L112-L122 HydrophobicContact CD2-CB 4.31Å; L112-L122 HydrophobicContact CD2-CD1 4.48Å
113G62.6Low70.8Confident66 Ų6680.7 Ų80.768%0.6843%0.43SS*.  trans62-2.6162.900000117.1M109M109-G113 PolarHBondContact O-N 3.24Å; M109-G113 VanDerWaalsContact O-N 3.14Å
114R66.6Low70.5Confident192 Ų19279.8 Ų79.873%0.72542%0.42SS*.SBendtrans-136.4128.5-179.8-94.3-175.4160.1106.8-2.4109.7L112 T116 N119L112-R114 PolarHBondContact O-N 2.93Å; R114-T116 VanDerWaalsContact C-N 3.27Å; R114-T116 PolarHBondContact O-N 2.97Å; R114-N119 WeakPolarHBondContact O-CB 3.27Å; R114-N119 PolarHBondContact O-ND2 3.44Å
115D65.5Low70.4Confident75 Ų7580.2 Ų80.240%0.40143%0.427SS..  trans-89.568.9-179.8-59.7-62.8000111.7S19S19-D115 VanDerWaalsContact CB-CB 3.41Å; S19-D115 WeakPolarHBondContact CB-OD2 3.34Å; S19-D115 PolarHBondContact OG-OD1 2.88Å; S19-D115 PolarHBondContact OG-OD2 2.84Å
116T72.8Confident70.4Confident53 Ų5380.3 Ų80.333%0.32544%0.435SS..  trans-93.8150.3168.759.60000109.6R114 L118 N119 Q120R114-T116 VanDerWaalsContact C-N 3.27Å; R114-T116 PolarHBondContact O-N 2.97Å; T116-L118 PolarHBondContact O-N 3.41Å; T116-N119 PolarHBondContact O-N 3.43Å; T116-N119 WeakPolarHBondContact OG1-CB 3.23Å; T116-N119 PolarHBondContact OG1-N 3.34Å; T116-N119 PolarHBondContact OG1-ND2 2.85Å; T116-N119 VanDerWaalsContact OG1-ND2 3.12Å; T116-N119 PolarHBondContact OG1-OD1 2.85Å; T116-Q120 PolarHBondContact O-N 3.26Å
117P65.6Low70.4Confident106 Ų10678.5 Ų78.569%0.68842%0.416SS*.Hα-helixtrans-57.5-31176.421.8-33000112.2F121P117-F121 WeakPolarHBondContact O-CB 3.28Å; P117-F121 PolarHBondContact O-N 3.04Å
118L70.9Confident69.9Low124 Ų12474.5 Ų74.565%0.64940%0.396SS*.Hα-helixtrans-68.2-42.3173.6-76.3174.2000112.8T116 Q120 F121 L122T116-L118 PolarHBondContact O-N 3.41Å; L118-Q120 VanDerWaalsContact C-N 3.32Å; L118-Q120 PolarHBondContact O-N 3.4Å; L118-F121 WeakPolarHBondContact O-CB 3.03Å; L118-F121 PolarHBondContact O-N 3.04Å; L118-L122 WeakPolarHBondContact O-CB 3.3Å; L118-L122 VanDerWaalsContact O-CG 3.31Å; L118-L122 WeakPolarHBondContact O-CG 3.19Å; L118-L122 PolarHBondContact O-N 3.49Å
119N70.2Confident70Confident35 Ų3578 Ų7819%0.18742%0.416CS..Hα-helixtrans-67.6-35.3178.2-71-9.6000111.8L112 R114 T116 L122 A123L112-N119 HydrophobicContact CB-CB 4.23Å; L112-N119 HydrophobicContact CD2-CB 3.64Å; R114-N119 WeakPolarHBondContact O-CB 3.27Å; R114-N119 PolarHBondContact O-ND2 3.44Å; T116-N119 PolarHBondContact O-N 3.43Å; T116-N119 WeakPolarHBondContact OG1-CB 3.23Å; T116-N119 PolarHBondContact OG1-N 3.34Å; T116-N119 PolarHBondContact OG1-ND2 2.85Å; T116-N119 VanDerWaalsContact OG1-ND2 3.12Å; T116-N119 PolarHBondContact OG1-OD1 2.85Å; N119-L122 PolarHBondContact O-N 2.97Å; N119-A123 VanDerWaalsContact O-CB 3.27Å; N119-A123 WeakPolarHBondContact O-CB 3.47Å; N119-A123 PolarHBondContact O-N 2.92Å
120Q67.4Low70.3Confident52 Ų5279.2 Ų79.224%0.24342%0.423CS..Hα-helixtrans-66.5-41.8172.2-70.6174.7-11.100111.6M109 T116 L118 A123 G124M109-Q120 HydrophobicContact CE-CG 4.26Å; T116-Q120 PolarHBondContact O-N 3.26Å; L118-Q120 VanDerWaalsContact C-N 3.32Å; L118-Q120 PolarHBondContact O-N 3.4Å; Q120-A123 PolarHBondContact O-N 3.45Å; Q120-G124 PolarHBondContact O-N 3.02Å
121F69.5Low70.4Confident148 Ų14871.2 Ų71.265%0.64939%0.394SS*.Hα-helixtrans-61.8-45.4173.6-178.8-94.7000111.9P117 L118 G124 A125P117-F121 WeakPolarHBondContact O-CB 3.28Å; P117-F121 PolarHBondContact O-N 3.04Å; L118-F121 WeakPolarHBondContact O-CB 3.03Å; L118-F121 PolarHBondContact O-N 3.04Å; F121-G124 PolarHBondContact O-N 2.91Å; F121-A125 VanDerWaalsContact O-CB 3.22Å; F121-A125 WeakPolarHBondContact O-CB 3.2Å; F121-A125 PolarHBondContact O-N 3.38Å
122L72.4Confident69.9Low97 Ų9765.1 Ų65.151%0.50837%0.372SS..Hα-helixtrans-65.1-43.6178.3-72.7171.1000112.2L112 L118 N119 G124 A125 A126L112-L122 HydrophobicContact CD2-CB 4.31Å; L112-L122 HydrophobicContact CD2-CD1 4.48Å; L118-L122 WeakPolarHBondContact O-CB 3.3Å; L118-L122 VanDerWaalsContact O-CG 3.31Å; L118-L122 WeakPolarHBondContact O-CG 3.19Å; L118-L122 PolarHBondContact O-N 3.49Å; N119-L122 PolarHBondContact O-N 2.97Å; L122-G124 VanDerWaalsContact C-N 3.34Å; L122-A125 PolarHBondContact O-N 3.26Å; L122-A126 WeakPolarHBondContact O-CB 3.31Å; L122-A126 PolarHBondContact O-N 3.05Å
123A70.4Confident69.9Low1 Ų166.5 Ų66.51%0.00838%0.383CS..Hα-helixtrans-62.5-42.517500000111.5A108 M109 N119 Q120 A127A108-A123 HydrophobicContact CB-CB 3.72Å; M109-A123 HydrophobicContact CG-CB 3.74Å; N119-A123 VanDerWaalsContact O-CB 3.27Å; N119-A123 WeakPolarHBondContact O-CB 3.47Å; N119-A123 PolarHBondContact O-N 2.92Å; Q120-A123 PolarHBondContact O-N 3.45Å; A123-A127 WeakPolarHBondContact O-CB 3.16Å; A123-A127 PolarHBondContact O-N 2.7Å
124G66.6Low70.5Confident27 Ų2765.6 Ų65.628%0.27836%0.362SS..Hα-helixtrans-65.6-40.3174.700000112.9Q120 F121 L122 A127 G128Q120-G124 PolarHBondContact O-N 3.02Å; F121-G124 PolarHBondContact O-N 2.91Å; L122-G124 VanDerWaalsContact C-N 3.34Å; G124-A127 PolarHBondContact O-N 3.47Å; G124-G128 PolarHBondContact O-N 2.96Å
125A69.5Low70.7Confident42 Ų4257.7 Ų57.735%0.34734%0.336SS..Hα-helixtrans-66.9-40.6177.100000111.6F121 L122 G128 T129F121-A125 VanDerWaalsContact O-CB 3.22Å; F121-A125 WeakPolarHBondContact O-CB 3.2Å; F121-A125 PolarHBondContact O-N 3.38Å; L122-A125 PolarHBondContact O-N 3.26Å; A125-G128 PolarHBondContact O-N 3.23Å; A125-T129 WeakPolarHBondContact O-CB 3.32Å; A125-T129 PolarHBondContact O-N 3.45Å; A125-T129 PolarHBondContact O-OG1 3.4Å
126A73.8Confident71Confident41 Ų4154.8 Ų54.834%0.33932%0.321SS..Hα-helixtrans-63.6-45.7174.400000111.7L122 T129 I130L122-A126 WeakPolarHBondContact O-CB 3.31Å; L122-A126 PolarHBondContact O-N 3.05Å; A126-T129 PolarHBondContact O-N 3.31Å; A126-I130 PolarHBondContact O-N 3.03Å; A126-I130 VanDerWaalsContact O-N 3.11Å
127A70.4Confident70.9Confident2 Ų253.3 Ų53.32%0.01731%0.312CS..Hα-helixtrans-62.4-43.4175.300000112.2V101 V104 Q105 A123 G124 T129 I130 Q131V101-A127 HydrophobicContact CG1-CB 4.23Å; V104-A127 HydrophobicContact CB-CB 4.16Å; V104-A127 HydrophobicContact CG1-CB 3.94Å; Q105-A127 HydrophobicContact CB-CB 4.02Å; A123-A127 WeakPolarHBondContact O-CB 3.16Å; A123-A127 PolarHBondContact O-N 2.7Å; G124-A127 PolarHBondContact O-N 3.47Å; A127-T129 PolarHBondContact O-N 3.2Å; A127-I130 PolarHBondContact O-N 3.48Å; A127-Q131 VanDerWaalsContact O-CB 3.3Å; A127-Q131 WeakPolarHBondContact O-CB 3.3Å; A127-Q131 PolarHBondContact O-N 3.12Å
128G66.3Low71.2Confident8 Ų851.5 Ų51.58%0.08230%0.296CS..Hα-helixtrans-63.9-37.1176.200000113.2G124 A125 Q131 C132G124-G128 PolarHBondContact O-N 2.96Å; A125-G128 PolarHBondContact O-N 3.23Å; G128-Q131 WeakPolarHBondContact O-CB 3.4Å; G128-Q131 PolarHBondContact O-N 3.45Å; G128-C132 WeakPolarHBondContact O-CB 3.36Å; G128-C132 PolarHBondContact O-N 3.32Å; G128-C132 PolarHBondContact O-SG 2.95Å
129T72.9Confident71.1Confident90 Ų9048.6 Ų48.655%0.55228%0.279SS*.Hα-helixtrans-65.4-48176.3-56.70000111.1A125 A126 A127 Q131 C132 V133A125-T129 WeakPolarHBondContact O-CB 3.32Å; A125-T129 PolarHBondContact O-N 3.45Å; A125-T129 PolarHBondContact O-OG1 3.4Å; A126-T129 PolarHBondContact O-N 3.31Å; A127-T129 PolarHBondContact O-N 3.2Å; T129-Q131 VanDerWaalsContact C-N 3.32Å; T129-Q131 PolarHBondContact O-N 2.76Å; T129-C132 PolarHBondContact O-N 2.87Å; T129-V133 WeakPolarHBondContact O-CG2 3.33Å; T129-V133 PolarHBondContact O-N 3.48Å; T129-V133 VanDerWaalsContact O-N 3.12Å
130I76.3Confident71.2Confident70 Ų7047 Ų4736%0.35927%0.27SS..Hα-helixtrans-63.7-40.8177.5-72.1165.5000110.8I100 V104 A126 A127 C132 V133 I134I100-I130 HydrophobicContact CG2-CG2 3.82Å; V104-I130 HydrophobicContact CB-CD1 4.41Å; V104-I130 HydrophobicContact CG1-CD1 3.67Å; V104-I130 HydrophobicContact CG2-CB 4.47Å; V104-I130 HydrophobicContact CG2-CD1 3.79Å; V104-I130 HydrophobicContact CG2-CG2 4.16Å; A126-I130 PolarHBondContact O-N 3.03Å; A126-I130 VanDerWaalsContact O-N 3.11Å; A127-I130 PolarHBondContact O-N 3.48Å; I130-C132 PolarHBondContact O-N 3.03Å; I130-V133 PolarHBondContact O-N 2.96Å; I130-I134 HydrophobicContact CG2-CD1 4.19Å; I130-I134 WeakPolarHBondContact O-CG1 3.41Å; I130-I134 PolarHBondContact O-N 3.45Å
131Q76.4Confident71.4Confident30 Ų3044.8 Ų44.814%0.1426%0.26CS..Hα-helixtrans-57.5-46.4172.8174.4171.547.400112I97 V101 A127 G128 T129 V133 I134 C135I97-Q131 HydrophobicContact CG2-CG 3.71Å; V101-Q131 HydrophobicContact CG2-CB 3.65Å; V101-Q131 HydrophobicContact CG2-CG 3.94Å; A127-Q131 VanDerWaalsContact O-CB 3.3Å; A127-Q131 WeakPolarHBondContact O-CB 3.3Å; A127-Q131 PolarHBondContact O-N 3.12Å; G128-Q131 WeakPolarHBondContact O-CB 3.4Å; G128-Q131 PolarHBondContact O-N 3.45Å; T129-Q131 VanDerWaalsContact C-N 3.32Å; T129-Q131 PolarHBondContact O-N 2.76Å; Q131-V133 VanDerWaalsContact C-N 3.35Å; Q131-V133 PolarHBondContact O-N 3.28Å; Q131-I134 PolarHBondContact O-N 2.9Å; Q131-C135 WeakPolarHBondContact O-CB 3.39Å; Q131-C135 PolarHBondContact O-N 3.46Å
132C67.6Low71.5Confident41 Ų4140.2 Ų40.228%0.27724%0.24SC..Hα-helixtrans-61-43.8-179.9-74.20000111.7G128 T129 I130 I134 C135 C136G128-C132 WeakPolarHBondContact O-CB 3.36Å; G128-C132 PolarHBondContact O-N 3.32Å; G128-C132 PolarHBondContact O-SG 2.95Å; T129-C132 PolarHBondContact O-N 2.87Å; I130-C132 PolarHBondContact O-N 3.03Å; C132-I134 PolarHBondContact O-N 3.47Å; C132-C135 PolarHBondContact O-N 3.44Å; C132-C136 VanDerWaalsContact O-CB 3.24Å; C132-C136 WeakPolarHBondContact O-CB 3.46Å; C132-C136 PolarHBondContact O-N 2.9Å; C132-C136 PolarHBondContact O-SG 3.01Å
133V74.9Confident71.2Confident96 Ų9637 Ų3758%0.58223%0.225SC*.Hα-helixtrans-60.3-34.3179.4173.20000112.1T129 I130 Q131 P137T129-V133 WeakPolarHBondContact O-CG2 3.33Å; T129-V133 PolarHBondContact O-N 3.48Å; T129-V133 VanDerWaalsContact O-N 3.12Å; I130-V133 PolarHBondContact O-N 2.96Å; Q131-V133 VanDerWaalsContact C-N 3.35Å; Q131-V133 PolarHBondContact O-N 3.28Å; V133-P137 WeakPolarHBondContact O-CD 3.48Å; V133-P137 WeakPolarHBondContact O-CG 3.47Å
134I74.3Confident71.2Confident48 Ų4837.1 Ų37.125%0.24623%0.225CC..Hα-helixtrans-87.6-40.7-179.9-61.8176.1000111.8I100 I130 Q131 C132 P137 M138I100-I134 HydrophobicContact CD1-CD1 3.66Å; I100-I134 HydrophobicContact CG2-CD1 4.11Å; I130-I134 HydrophobicContact CG2-CD1 4.19Å; I130-I134 WeakPolarHBondContact O-CG1 3.41Å; I130-I134 PolarHBondContact O-N 3.45Å; Q131-I134 PolarHBondContact O-N 2.9Å; C132-I134 PolarHBondContact O-N 3.47Å; I134-P137 WeakPolarHBondContact O-CD 3.25Å; I134-P137 VanDerWaalsContact O-CG 3.31Å; I134-P137 WeakPolarHBondContact O-CG 3.23Å; I134-M138 HydrophobicContact CG2-CE 4.39Å; I134-M138 WeakPolarHBondContact O-CG 3.43Å
135C71.6Confident71.2Confident25 Ų2538.4 Ų38.417%0.16923%0.225CC..Hα-helixtrans-71.7-38.5-175.3-160.50000111.6I97 Q131 C132 M138 E139I97-C135 HydrophobicContact CD1-CB 4.03Å; I97-C135 VanDerWaalsContact CD1-SG 3.58Å; Q131-C135 WeakPolarHBondContact O-CB 3.39Å; Q131-C135 PolarHBondContact O-N 3.46Å; C132-C135 PolarHBondContact O-N 3.44Å; C135-M138 PolarHBondContact O-N 3.34Å; C135-E139 WeakPolarHBondContact O-CB 3.19Å; C135-E139 WeakPolarHBondContact O-CG 3.47Å; C135-E139 PolarHBondContact O-N 3.03Å; C135-E139 PolarHBondContact SG-OE1 3.15Å; C135-E139 VanDerWaalsContact SG-OE1 3.34Å
136C70.8Confident70.7Confident15 Ų1538.8 Ų38.810%0.10122%0.219CC..Hα-helixtrans-56-53.2-179-71.70000114.2C132 M138 E139 L140 M183C132-C136 VanDerWaalsContact O-CB 3.24Å; C132-C136 WeakPolarHBondContact O-CB 3.46Å; C132-C136 PolarHBondContact O-N 2.9Å; C132-C136 PolarHBondContact O-SG 3.01Å; C136-M138 VanDerWaalsContact C-N 3.29Å; C136-M138 PolarHBondContact O-N 3.48Å; C136-E139 PolarHBondContact O-N 3.4Å; C136-L140 WeakPolarHBondContact O-CB 3.22Å; C136-L140 PolarHBondContact O-N 3.46Å; C136-M183 HydrophobicContact CB-CG 4.49Å; C136-M183 HydrophobicContact CB-SD 4.38Å
137P71.1Confident70.1Confident21 Ų2137.8 Ų37.814%0.13621%0.208CC..Hα-helixtrans-64-34.4177.521.9-32000112.6V133 I134 A141 L167 I179V133-P137 WeakPolarHBondContact O-CD 3.48Å; V133-P137 WeakPolarHBondContact O-CG 3.47Å; I134-P137 WeakPolarHBondContact O-CD 3.25Å; I134-P137 VanDerWaalsContact O-CG 3.31Å; I134-P137 WeakPolarHBondContact O-CG 3.23Å; P137-A141 WeakPolarHBondContact O-CB 3.28Å; P137-A141 PolarHBondContact O-N 3.46Å; P137-L167 HydrophobicContact CB-CD1 3.68Å; P137-L167 HydrophobicContact CB-CD2 3.96Å; P137-L167 HydrophobicContact CB-CG 4.45Å; P137-L167 WeakPolarHBondContact O-CD1 3.35Å; P137-I179 HydrophobicContact CB-CG2 3.78Å
138M72.1Confident69.4Low68 Ų6840.1 Ų40.134%0.33522%0.218SC..Hα-helixtrans-70.6-42.6178.5-66.9-159.9-45.300112.4I97 I134 C135 C136 L140 A141 K142I97-M138 HydrophobicContact CD1-CE 3.18Å; I97-M138 HydrophobicContact CG1-CE 3.57Å; I134-M138 HydrophobicContact CG2-CE 4.39Å; I134-M138 WeakPolarHBondContact O-CG 3.43Å; C135-M138 PolarHBondContact O-N 3.34Å; C136-M138 VanDerWaalsContact C-N 3.29Å; C136-M138 PolarHBondContact O-N 3.48Å; M138-L140 VanDerWaalsContact C-N 3.34Å; M138-A141 PolarHBondContact O-N 2.99Å; M138-K142 VanDerWaalsContact O-CB 3.28Å; M138-K142 WeakPolarHBondContact O-CB 3.49Å; M138-K142 PolarHBondContact O-N 2.93Å
139E68.8Low68.7Low64 Ų6442.8 Ų42.830%0.29925%0.246SC..Hα-helixtrans-59.5-46.1172.3-78-173.3-160.500110.8C135 C136 K142 T143 K243C135-E139 WeakPolarHBondContact O-CB 3.19Å; C135-E139 WeakPolarHBondContact O-CG 3.47Å; C135-E139 PolarHBondContact O-N 3.03Å; C135-E139 PolarHBondContact SG-OE1 3.15Å; C135-E139 VanDerWaalsContact SG-OE1 3.34Å; C136-E139 PolarHBondContact O-N 3.4Å; E139-K142 PolarHBondContact O-N 3.37Å; E139-T143 VanDerWaalsContact O-CG2 3.31Å; E139-T143 WeakPolarHBondContact O-CG2 3.31Å; E139-T143 PolarHBondContact O-N 3.21Å; E139-T143 PolarHBondContact O-OG1 3.37Å; E139-T143 VanDerWaalsContact O-OG1 3.04Å; E139-K243 IonicContact OE2-NZ 3.48Å; E139-K243 PolarHBondContact OE2-NZ 3.01Å
140L72.1Confident67.5Low2 Ų239.8 Ų39.81%0.0123%0.227CC..Hα-helixtrans-60-49.6176.6-177.668000111.5C136 M138 K142 T143 R144 I170 Q247C136-L140 WeakPolarHBondContact O-CB 3.22Å; C136-L140 PolarHBondContact O-N 3.46Å; M138-L140 VanDerWaalsContact C-N 3.34Å; L140-K142 VanDerWaalsContact C-N 3.32Å; L140-K142 PolarHBondContact O-N 3.33Å; L140-T143 PolarHBondContact O-N 3.11Å; L140-T143 PolarHBondContact O-OG1 3.39Å; L140-R144 HydrophobicContact CD1-CG 4.38Å; L140-R144 HydrophobicContact CG-CG 4.47Å; L140-R144 WeakPolarHBondContact O-CB 3.39Å; L140-R144 WeakPolarHBondContact O-CG 3.42Å; L140-R144 PolarHBondContact O-N 2.7Å; L140-I170 HydrophobicContact CD2-CD1 4.21Å; L140-I170 HydrophobicContact CG-CD1 4.45Å; L140-Q247 HydrophobicContact CD1-CB 4.32Å; L140-Q247 HydrophobicContact CD1-CG 4.09Å
141A71.8Confident65.8Low4 Ų439.3 Ų39.33%0.03324%0.24CC..Hα-helixtrans-61.3-41.2178.500000111.9P137 M138 M145 L167P137-A141 WeakPolarHBondContact O-CB 3.28Å; P137-A141 PolarHBondContact O-N 3.46Å; M138-A141 PolarHBondContact O-N 2.99Å; A141-M145 WeakPolarHBondContact O-CB 3.22Å; A141-M145 WeakPolarHBondContact O-CG 3.49Å; A141-M145 PolarHBondContact O-N 2.95Å; A141-L167 HydrophobicContact CB-CD1 4.36Å
142K71.3Confident63.9Low52 Ų5245.4 Ų45.423%0.22627%0.268CS..Hα-helixtrans-63.2-49.9178.3-176.8-175.9173.1-161.30111.8P90 M138 E139 L140 R144 M145 Q146P90-K142 HydrophobicContact CB-CD 4.43Å; P90-K142 VanDerWaalsContact CB-NZ 3.34Å; P90-K142 HydrophobicContact CG-CD 4.42Å; M138-K142 VanDerWaalsContact O-CB 3.28Å; M138-K142 WeakPolarHBondContact O-CB 3.49Å; M138-K142 PolarHBondContact O-N 2.93Å; E139-K142 PolarHBondContact O-N 3.37Å; L140-K142 VanDerWaalsContact C-N 3.32Å; L140-K142 PolarHBondContact O-N 3.33Å; K142-R144 PolarHBondContact O-N 3.23Å; K142-M145 PolarHBondContact O-N 2.86Å; K142-Q146 WeakPolarHBondContact O-CG 3.45Å; K142-Q146 PolarHBondContact O-N 3.43Å
143T67.2Low62.5Low31 Ų3152.4 Ų52.419%0.1929%0.294CS..Hα-helixtrans-59.1-46.4178.352.90000111E139 L140 M145 Q146 M147E139-T143 VanDerWaalsContact O-CG2 3.31Å; E139-T143 WeakPolarHBondContact O-CG2 3.31Å; E139-T143 PolarHBondContact O-N 3.21Å; E139-T143 PolarHBondContact O-OG1 3.37Å; E139-T143 VanDerWaalsContact O-OG1 3.04Å; L140-T143 PolarHBondContact O-N 3.11Å; L140-T143 PolarHBondContact O-OG1 3.39Å; T143-M145 PolarHBondContact O-N 3.26Å; T143-Q146 PolarHBondContact O-N 3.08Å; T143-M147 WeakPolarHBondContact O-CE 3.35Å; T143-M147 WeakPolarHBondContact O-CG 3.04Å; T143-M147 PolarHBondContact O-N 3.17Å
144R68.9Low60.8Low2 Ų258 Ų581%0.00831%0.311CS..Hα-helixtrans-58.9-44.8176.2-65.5-78.8-166.3-171.43.3113.2L140 K142 M147 Q148 I170 Q247 A248 D249 V251L140-R144 HydrophobicContact CD1-CG 4.38Å; L140-R144 HydrophobicContact CG-CG 4.47Å; L140-R144 WeakPolarHBondContact O-CB 3.39Å; L140-R144 WeakPolarHBondContact O-CG 3.42Å; L140-R144 PolarHBondContact O-N 2.7Å; K142-R144 PolarHBondContact O-N 3.23Å; R144-M147 HydrophobicContact CG-CE 4.36Å; R144-M147 PolarHBondContact O-N 3.29Å; R144-Q148 PolarHBondContact O-N 2.81Å; R144-Q148 VanDerWaalsContact O-N 3.12Å; R144-I170 HydrophobicContact CG-CD1 4.29Å; R144-Q247 PolarHBondContact NE-O 3.49Å; R144-Q247 VanDerWaalsContact NE-O 3.11Å; R144-Q247 PolarHBondContact NH1-O 2.97Å; R144-Q247 PolarHBondContact NH2-O 3.27Å; R144-A248 PolarHBondContact NH1-O 3.46Å; R144-A248 VanDerWaalsContact NH1-O 3.12Å; R144-D249 VanDerWaalsContact NH1-C 3.26Å; R144-D249 PolarHBondContact NH1-O 3.24Å; R144-D249 PolarHBondContact NH2-O 3.1Å; R144-V251 VanDerWaalsContact NH1-CG2 3.35Å
145M67.4Low59.2Low55 Ų5560.3 Ų60.327%0.27133%0.331SS..Hα-helixtrans-64.5-39.5177.1-74.2-68.7-66.300111.9A141 K142 T143 M147 Q148 Y160 C166A141-M145 WeakPolarHBondContact O-CB 3.22Å; A141-M145 WeakPolarHBondContact O-CG 3.49Å; A141-M145 PolarHBondContact O-N 2.95Å; K142-M145 PolarHBondContact O-N 2.86Å; T143-M145 PolarHBondContact O-N 3.26Å; M145-M147 VanDerWaalsContact C-N 3.35Å; M145-Q148 PolarHBondContact O-N 2.9Å; M145-Y160 VanDerWaalsContact SD-CB 3.57Å; M145-Y160 HydrophobicContact SD-CG 4.44Å; M145-C166 HydrophobicContact SD-CB 4.44Å
146Q59.5Low57.9Low50 Ų5069.5 Ų69.523%0.23437%0.368CS..Hα-helixtrans-65.6-38.6175.5-73-178.6-22.700111.6V52 K142 T143 Q148 G149 T150V52-Q146 HydrophobicContact CG1-CB 4.16Å; K142-Q146 WeakPolarHBondContact O-CG 3.45Å; K142-Q146 PolarHBondContact O-N 3.43Å; T143-Q146 PolarHBondContact O-N 3.08Å; Q146-Q148 VanDerWaalsContact C-N 3.34Å; Q146-Q148 PolarHBondContact O-N 2.94Å; Q146-G149 PolarHBondContact O-N 3.32Å; Q146-T150 PolarHBondContact O-OG1 3.35Å
147M60.5Low56.6Low20 Ų2077.5 Ų77.510%0.09940%0.401CS..Hα-helixtrans-66.4-32176.7-72.2-172.9-72.600113.7V56 T143 R144 M145 G149 T150 Q247 A248 V251V56-M147 HydrophobicContact CG1-CB 4.5Å; V56-M147 HydrophobicContact CG1-CG 4.27Å; V56-M147 HydrophobicContact CG2-CG 3.59Å; V56-M147 HydrophobicContact CG2-SD 3.98Å; T143-M147 WeakPolarHBondContact O-CE 3.35Å; T143-M147 WeakPolarHBondContact O-CG 3.04Å; T143-M147 PolarHBondContact O-N 3.17Å; R144-M147 HydrophobicContact CG-CE 4.36Å; R144-M147 PolarHBondContact O-N 3.29Å; M145-M147 VanDerWaalsContact C-N 3.35Å; M147-G149 PolarHBondContact O-N 3.09Å; M147-G149 VanDerWaalsContact O-N 3.15Å; M147-T150 PolarHBondContact O-N 3.11Å; M147-Q247 WeakPolarHBondContact CE-O 3.36Å; M147-A248 HydrophobicContact CE-CB 4.17Å; M147-A248 VanDerWaalsContact SD-CA 3.54Å; M147-A248 HydrophobicContact SD-CB 3.45Å; M147-A248 WeakPolarHBondContact SD-CB 3.02Å; M147-V251 HydrophobicContact CE-CG2 3.97Å; M147-V251 HydrophobicContact SD-CG2 4.45Å
148Q55.7Low55.8Low51 Ų5184.3 Ų84.324%0.23843%0.428CS..THydrogen-bonded Turntrans-62.4-21.1178.1-171.8-177.2-38.700113.2R144 M145 Q146 M159 Y160R144-Q148 PolarHBondContact O-N 2.81Å; R144-Q148 VanDerWaalsContact O-N 3.12Å; M145-Q148 PolarHBondContact O-N 2.9Å; Q146-Q148 VanDerWaalsContact C-N 3.34Å; Q146-Q148 PolarHBondContact O-N 2.94Å; Q148-M159 HydrophobicContact CG-CB 4.28Å; Q148-Y160 VanDerWaalsContact CD-N 3.34Å; Q148-Y160 PolarHBondContact NE2-O 2.88Å; Q148-Y160 VanDerWaalsContact NE2-O 3.14Å; Q148-Y160 PolarHBondContact OE1-O 2.67Å
149G52Low55.1Low64 Ų6484.5 Ų84.566%0.6643%0.429SS*.THydrogen-bonded Turntrans-84.7-8.6179.100000115.2Q146 M147Q146-G149 PolarHBondContact O-N 3.32Å; M147-G149 PolarHBondContact O-N 3.09Å; M147-G149 VanDerWaalsContact O-N 3.15Å
150T48.3Very low54.7Low26 Ų2682.4 Ų82.416%0.1642%0.419CS..SBendtrans-122.126-162.5-28.50000115.7R53 Q146 M147R53-T150 HydrophobicContact CB-CG2 3.9Å; R53-T150 HydrophobicContact CG-CG2 3.6Å; Q146-T150 PolarHBondContact O-OG1 3.35Å; M147-T150 PolarHBondContact O-N 3.11Å
151G39.8Very low54.1Low60 Ų6089.6 Ų89.662%0.61945%0.45SS*.SBendtrans-148.8115.5177.800000111.5
152E36.2Very low53.9Low158 Ų15894.6 Ų94.674%0.73848%0.476SS*.SBendtrans41.3118.6168.7-71.2-171.4109.300119.1
153K38Very low53.6Low188 Ų18894.2 Ų94.282%0.81748%0.48SS*.SBendtrans43.7103.8156.8-65.6179.4-179.6175.60114.4S155K153-S155 WeakPolarHBondContact O-CA 3.26Å; K153-S155 PolarHBondContact O-N 3.4Å
154K40.9Very low53.8Low215 Ų21599.1 Ų99.194%0.93550%0.504SS*.  trans-374.1155.1-80-177.8175175.40112.4K156K154-K156 PolarHBondContact O-N 3.48Å; K154-K156 VanDerWaalsContact O-N 3.11Å
155S39.8Very low54.1Low96 Ų96101 Ų10167%0.67152%0.515SS*.  trans-72.6119.8178.1-170.20000102.3K153 K157K153-S155 WeakPolarHBondContact O-CA 3.26Å; K153-S155 PolarHBondContact O-N 3.4Å; S155-K157 CarbonylContact O-C 3.4Å; S155-K157 PolarHBondContact O-N 2.95Å
156K43.5Very low54.3Low218 Ų21898.4 Ų98.495%0.94850%0.502SS*.SBendtrans-56.5-6.7-170.4-76.3-179175.1179.90113.1K154K154-K156 PolarHBondContact O-N 3.48Å; K154-K156 VanDerWaalsContact O-N 3.11Å
157K44.1Very low54.9Low183 Ų18398 Ų9880%0.79650%0.501SS*.SBendtrans-116.9114.8166.5-77.2177.8175.5174.90111.4S155 M159S155-K157 CarbonylContact O-C 3.4Å; S155-K157 PolarHBondContact O-N 2.95Å; K157-M159 PolarHBondContact O-N 3.27Å
158K54.8Low55.8Low163 Ų163100.4 Ų100.471%0.70952%0.517SS*.  trans-54.2119.9162.6-70.8-178.9179.7178.60108.7Y160K158-Y160 VanDerWaalsContact C-N 3.33Å; K158-Y160 PolarHBondContact O-N 3.48Å
159M56.6Low56.7Low73 Ų73102.4 Ų102.436%0.3652%0.522SS..SBendtrans-59.7-41.8-179.8-172.3148.966.100111.7Q148 K157 R169 V251Q148-M159 HydrophobicContact CG-CB 4.28Å; K157-M159 PolarHBondContact O-N 3.27Å; M159-R169 VanDerWaalsContact O-CZ 3.31Å; M159-R169 PolarHBondContact O-NH1 3.45Å; M159-V251 HydrophobicContact CE-CG1 3.75Å
160Y59.9Low57.8Low19 Ų1999.6 Ų99.68%0.07549%0.492CS..  trans-118.4135.6168.4-51.8-67.3000109.8M145 Q148 K158 C166 R169M145-Y160 VanDerWaalsContact SD-CB 3.57Å; M145-Y160 HydrophobicContact SD-CG 4.44Å; Q148-Y160 VanDerWaalsContact CD-N 3.34Å; Q148-Y160 PolarHBondContact NE2-O 2.88Å; Q148-Y160 VanDerWaalsContact NE2-O 3.14Å; Q148-Y160 PolarHBondContact OE1-O 2.67Å; K158-Y160 VanDerWaalsContact C-N 3.33Å; K158-Y160 PolarHBondContact O-N 3.48Å; Y160-C166 VanDerWaalsContact CD1-CA 3.44Å; Y160-C166 HydrophobicContact CD1-CB 3.75Å; Y160-C166 HydrophobicContact CD2-CB 4.27Å; Y160-C166 HydrophobicContact CE1-CB 4.28Å; Y160-C166 HydrophobicContact CG-CB 3.75Å; Y160-R169 HydrophobicContact CE1-CB 4.27Å
161K60.7Low59.2Low153 Ų153104.7 Ų104.767%0.66551%0.509SS*.SBendtrans-80.9-43176.7-72.8-177.1177.2-177.90111.5D165K161-D165 PolarHBondContact N-OD2 2.75Å
162N66.1Low61.1Low109 Ų109111.8 Ų111.858%0.58352%0.518SS*.SBendtrans-144.5162.1-175.6-69.6-30.7000110.5L164 D165 C166N162-L164 PolarHBondContact O-N 3.37Å; N162-D165 HydrophobicContact CB-CB 4.5Å; N162-D165 WeakPolarHBondContact O-CB 3.16Å; N162-D165 PolarHBondContact O-N 3.43Å; N162-C166 PolarHBondContact O-N 2.88Å
163S66.4Low62.9Low45 Ų45111.7 Ų111.732%0.31552%0.515SS..Hα-helixtrans-56.6-34.9175.9-53.20000113C166 L167S163-C166 WeakPolarHBondContact O-CB 3.44Å; S163-C166 PolarHBondContact O-N 2.95Å; S163-L167 PolarHBondContact O-N 3.11Å
164L70.4Confident64.4Low133 Ų133105 Ų10570%0.69649%0.486SS*.Hα-helixtrans-69.4-41.2174.7-72.2171.7000112.7N162 C166 L167 V168N162-L164 PolarHBondContact O-N 3.37Å; L164-C166 VanDerWaalsContact C-N 3.26Å; L164-C166 PolarHBondContact O-N 3.42Å; L164-L167 PolarHBondContact O-N 3.48Å; L164-V168 WeakPolarHBondContact O-CB 3.31Å; L164-V168 VanDerWaalsContact O-CG2 3.26Å; L164-V168 WeakPolarHBondContact O-CG2 3.47Å; L164-V168 PolarHBondContact O-N 3.45Å
165D75.3Confident66.1Low42 Ų4295.9 Ų95.923%0.22545%0.454CS..Hα-helixtrans-64.5-34.9175.1176.547.6000110.8K161 N162 R169K161-D165 PolarHBondContact N-OD2 2.75Å; N162-D165 HydrophobicContact CB-CB 4.5Å; N162-D165 WeakPolarHBondContact O-CB 3.16Å; N162-D165 PolarHBondContact O-N 3.43Å; D165-R169 WeakPolarHBondContact O-CB 3.47Å; D165-R169 WeakPolarHBondContact O-CG 3.41Å; D165-R169 PolarHBondContact O-N 3.12Å; D165-R169 VanDerWaalsContact O-N 3.1Å; D165-R169 IonicContact OD1-CZ 3.76Å; D165-R169 IonicContact OD1-NE 3.38Å; D165-R169 PolarHBondContact OD1-NE 3.19Å; D165-R169 IonicContact OD1-NH2 3.97Å; D165-R169 PolarHBondContact OD1-NH2 3.26Å; D165-R169 IonicContact OD2-CZ 2.9Å; D165-R169 IonicContact OD2-NE 2.66Å; D165-R169 PolarHBondContact OD2-NE 3.46Å; D165-R169 IonicContact OD2-NH2 2.78Å; D165-R169 PolarHBondContact OD2-NH2 3.27Å
166C71.6Confident67.6Low0 Ų098 Ų980%045%0.451CS..Hα-helixtrans-60.6-52.3170-170.10000111.5M145 Y160 N162 S163 L164 V168 R169 I170M145-C166 HydrophobicContact SD-CB 4.44Å; Y160-C166 VanDerWaalsContact CD1-CA 3.44Å; Y160-C166 HydrophobicContact CD1-CB 3.75Å; Y160-C166 HydrophobicContact CD2-CB 4.27Å; Y160-C166 HydrophobicContact CE1-CB 4.28Å; Y160-C166 HydrophobicContact CG-CB 3.75Å; N162-C166 PolarHBondContact O-N 2.88Å; S163-C166 WeakPolarHBondContact O-CB 3.44Å; S163-C166 PolarHBondContact O-N 2.95Å; L164-C166 VanDerWaalsContact C-N 3.26Å; L164-C166 PolarHBondContact O-N 3.42Å; C166-V168 PolarHBondContact O-N 2.9Å; C166-R169 PolarHBondContact O-N 3.35Å; C166-I170 VanDerWaalsContact O-CG1 3.26Å; C166-I170 WeakPolarHBondContact O-CG1 3.36Å; C166-I170 PolarHBondContact O-N 3.25Å
167L72.4Confident68.7Low41 Ų4198.4 Ų98.422%0.21545%0.447CS..Hα-helixtrans-63.9-42.5-177.5-155.975.1000112.5P137 A141 S163 L164 R169 I170 Y171P137-L167 HydrophobicContact CB-CD1 3.68Å; P137-L167 HydrophobicContact CB-CD2 3.96Å; P137-L167 HydrophobicContact CB-CG 4.45Å; P137-L167 WeakPolarHBondContact O-CD1 3.35Å; A141-L167 HydrophobicContact CB-CD1 4.36Å; S163-L167 PolarHBondContact O-N 3.11Å; L164-L167 PolarHBondContact O-N 3.48Å; L167-R169 VanDerWaalsContact C-N 3.35Å; L167-R169 PolarHBondContact O-N 3.35Å; L167-I170 PolarHBondContact O-N 3.2Å; L167-Y171 WeakPolarHBondContact O-CB 3.39Å; L167-Y171 PolarHBondContact O-N 3Å
168V78.5Confident69.9Low72 Ų7289.7 Ų89.744%0.43641%0.409SS..Hα-helixtrans-63.4-40.2177.3170.90000111.3L164 C166 Y171 R172L164-V168 WeakPolarHBondContact O-CB 3.31Å; L164-V168 VanDerWaalsContact O-CG2 3.26Å; L164-V168 WeakPolarHBondContact O-CG2 3.47Å; L164-V168 PolarHBondContact O-N 3.45Å; C166-V168 PolarHBondContact O-N 2.9Å; V168-Y171 PolarHBondContact O-N 3.43Å; V168-R172 WeakPolarHBondContact O-CG 3.49Å; V168-R172 PolarHBondContact O-N 2.82Å
169R74.9Confident70.6Confident92 Ų9283.1 Ų83.135%0.34738%0.382SS..Hα-helixtrans-70.3-36.9176.9-72.5-178.6-163.1-169.116.6112.7M159 Y160 D165 C166 L167 R172 K173M159-R169 VanDerWaalsContact O-CZ 3.31Å; M159-R169 PolarHBondContact O-NH1 3.45Å; Y160-R169 HydrophobicContact CE1-CB 4.27Å; D165-R169 WeakPolarHBondContact O-CB 3.47Å; D165-R169 WeakPolarHBondContact O-CG 3.41Å; D165-R169 PolarHBondContact O-N 3.12Å; D165-R169 VanDerWaalsContact O-N 3.1Å; D165-R169 IonicContact OD1-CZ 3.76Å; D165-R169 IonicContact OD1-NE 3.38Å; D165-R169 PolarHBondContact OD1-NE 3.19Å; D165-R169 IonicContact OD1-NH2 3.97Å; D165-R169 PolarHBondContact OD1-NH2 3.26Å; D165-R169 IonicContact OD2-CZ 2.9Å; D165-R169 IonicContact OD2-NE 2.66Å; D165-R169 PolarHBondContact OD2-NE 3.46Å; D165-R169 IonicContact OD2-NH2 2.78Å; D165-R169 PolarHBondContact OD2-NH2 3.27Å; C166-R169 PolarHBondContact O-N 3.35Å; L167-R169 VanDerWaalsContact C-N 3.35Å; L167-R169 PolarHBondContact O-N 3.35Å; R169-R172 PolarHBondContact O-N 3.45Å; R169-K173 WeakPolarHBondContact O-CB 3.28Å; R169-K173 WeakPolarHBondContact O-CG 3.19Å; R169-K173 PolarHBondContact O-N 3.2Å
170I75.3Confident71.1Confident5 Ų581.8 Ų81.83%0.02638%0.376CS..Hα-helixtrans-62.3-47.4173-68.7164.9000109.3L140 R144 C166 L167 R172 K173 E174 I179L140-I170 HydrophobicContact CD2-CD1 4.21Å; L140-I170 HydrophobicContact CG-CD1 4.45Å; R144-I170 HydrophobicContact CG-CD1 4.29Å; C166-I170 VanDerWaalsContact O-CG1 3.26Å; C166-I170 WeakPolarHBondContact O-CG1 3.36Å; C166-I170 PolarHBondContact O-N 3.25Å; L167-I170 PolarHBondContact O-N 3.2Å; I170-R172 VanDerWaalsContact C-N 3.33Å; I170-R172 PolarHBondContact O-N 3.46Å; I170-K173 PolarHBondContact O-N 2.86Å; I170-E174 PolarHBondContact O-N 2.89Å; I170-I179 HydrophobicContact CG2-CG1 4.27Å
171Y79Confident71.3Confident133 Ų13382.8 Ų82.852%0.52238%0.379SS..Hα-helixtrans-57.8-44.8177-173.2-111.1000112.3L167 V168 K173 G175 I179L167-Y171 WeakPolarHBondContact O-CB 3.39Å; L167-Y171 PolarHBondContact O-N 3Å; V168-Y171 PolarHBondContact O-N 3.43Å; Y171-K173 VanDerWaalsContact C-N 3.33Å; Y171-K173 PolarHBondContact O-N 2.78Å; Y171-G175 WeakPolarHBondContact O-CA 3.38Å; Y171-G175 PolarHBondContact O-N 3.02Å; Y171-I179 HydrophobicContact CD2-CD1 3.56Å; Y171-I179 HydrophobicContact CD2-CG1 4.44Å; Y171-I179 HydrophobicContact CG-CD1 4.18Å
172R78.2Confident71.5Confident210 Ų21075.8 Ų75.879%0.79235%0.351SS*.Hα-helixtrans-67.5-28.5178.7-76-174.1178.7-169.50114.1V168 R169 I170V168-R172 WeakPolarHBondContact O-CG 3.49Å; V168-R172 PolarHBondContact O-N 2.82Å; R169-R172 PolarHBondContact O-N 3.45Å; I170-R172 VanDerWaalsContact C-N 3.33Å; I170-R172 PolarHBondContact O-N 3.46Å
173K74.6Confident71.6Confident156 Ų15673 Ų7368%0.67834%0.335SS*.Hα-helixtrans-93.6-42.3-177-74.6-171.5174.7-167.50113.9R169 I170 Y171R169-K173 WeakPolarHBondContact O-CB 3.28Å; R169-K173 WeakPolarHBondContact O-CG 3.19Å; R169-K173 PolarHBondContact O-N 3.2Å; I170-K173 PolarHBondContact O-N 2.86Å; Y171-K173 VanDerWaalsContact C-N 3.33Å; Y171-K173 PolarHBondContact O-N 2.78Å
174E69.8Low71.7Confident46 Ų4675.3 Ų75.322%0.21535%0.346CS..Hα-helixtrans-117.7-4.4-170.8-65.8-179.3-138.900112.7I170 G178 R181 N255I170-E174 PolarHBondContact O-N 2.89Å; E174-G178 PolarHBondContact O-N 3.44Å; E174-R181 IonicContact OE1-NH1 2.7Å; E174-R181 IonicContact OE2-CZ 3.6Å; E174-R181 IonicContact OE2-NH1 3.84Å; E174-R181 PolarHBondContact OE2-NH1 3.47Å; E174-N255 PolarHBondContact OE1-OD1 3Å
175G76.4Confident71.6Confident25 Ų2569.1 Ų69.126%0.25831%0.314SS..Hα-helixtrans64.9-158.6-178.900000113.6Y171 R177 G178 I179Y171-G175 WeakPolarHBondContact O-CA 3.38Å; Y171-G175 PolarHBondContact O-N 3.02Å; G175-R177 VanDerWaalsContact C-N 3.3Å; G175-R177 PolarHBondContact O-N 3.2Å; G175-G178 PolarHBondContact O-N 3.42Å; G175-I179 PolarHBondContact O-N 3.06Å
176F70.8Confident71.2Confident140 Ų14067.8 Ų67.861%0.61431%0.308SS*.Hα-helixtrans-65.5-31.2-178.9-162.9-105.5000113G178 I179 N180F176-G178 VanDerWaalsContact C-N 3.31Å; F176-G178 PolarHBondContact O-N 2.95Å; F176-I179 PolarHBondContact O-N 2.96Å; F176-N180 WeakPolarHBondContact CD1-ND2 3.36Å; F176-N180 WeakPolarHBondContact CE1-ND2 3.19Å; F176-N180 PolarHBondContact O-N 3.34Å
177R67.9Low71.1Confident226 Ų22671.7 Ų71.785%0.85333%0.328SS*.Hα-helixtrans-66.7-32.1174.4-77.6173.190.51745.5112.3G175 R181G175-R177 VanDerWaalsContact C-N 3.3Å; G175-R177 PolarHBondContact O-N 3.2Å; R177-R181 PolarHBondContact O-N 3.24Å; R177-R181 VanDerWaalsContact O-N 3.13Å
178G68.2Low71Confident1 Ų174.6 Ų74.61%0.0134%0.343CS..Hα-helixtrans-68.2-39.3174.600000113.7E174 G175 F176 N180 R181E174-G178 PolarHBondContact O-N 3.44Å; G175-G178 PolarHBondContact O-N 3.42Å; F176-G178 VanDerWaalsContact C-N 3.31Å; F176-G178 PolarHBondContact O-N 2.95Å; G178-N180 VanDerWaalsContact C-N 3.35Å; G178-R181 WeakPolarHBondContact O-CB 3.37Å; G178-R181 PolarHBondContact O-N 2.9Å
179I69.6Low70.9Confident25 Ų2572.9 Ų72.913%0.12833%0.329CS..Hα-helixtrans-66.5-39.6175.9-63.1-179.6000111P137 I170 Y171 G175 F176 R181P137-I179 HydrophobicContact CB-CG2 3.78Å; I170-I179 HydrophobicContact CG2-CG1 4.27Å; Y171-I179 HydrophobicContact CD2-CD1 3.56Å; Y171-I179 HydrophobicContact CD2-CG1 4.44Å; Y171-I179 HydrophobicContact CG-CD1 4.18Å; G175-I179 PolarHBondContact O-N 3.06Å; F176-I179 PolarHBondContact O-N 2.96Å; I179-R181 PolarHBondContact O-N 2.97Å
180N67.5Low70.6Confident44 Ų4471.5 Ų71.524%0.23533%0.327CS..THydrogen-bonded Turntrans-83.55.2178.2-67.4-18.6000113.3F176 G178 G182 M183F176-N180 WeakPolarHBondContact CD1-ND2 3.36Å; F176-N180 WeakPolarHBondContact CE1-ND2 3.19Å; F176-N180 PolarHBondContact O-N 3.34Å; G178-N180 VanDerWaalsContact C-N 3.35Å; N180-G182 PolarHBondContact O-N 3.13Å; N180-G182 VanDerWaalsContact O-N 3.12Å; N180-M183 HydrophobicContact CB-CB 4.43Å; N180-M183 HydrophobicContact CB-CE 4.04Å; N180-M183 VanDerWaalsContact O-CB 3.24Å; N180-M183 WeakPolarHBondContact O-CB 3.26Å; N180-M183 PolarHBondContact O-N 3.24Å
181R64.7Low70.4Confident41 Ų4176.1 Ų76.116%0.15536%0.355CS..THydrogen-bonded Turntrans-71110.5-178.3-156.6169.5-176.8-162.8-8109.3E174 R177 G178 I179 L246 D249 N255 Y257E174-R181 IonicContact OE1-NH1 2.7Å; E174-R181 IonicContact OE2-CZ 3.6Å; E174-R181 IonicContact OE2-NH1 3.84Å; E174-R181 PolarHBondContact OE2-NH1 3.47Å; R177-R181 PolarHBondContact O-N 3.24Å; R177-R181 VanDerWaalsContact O-N 3.13Å; G178-R181 WeakPolarHBondContact O-CB 3.37Å; G178-R181 PolarHBondContact O-N 2.9Å; I179-R181 PolarHBondContact O-N 2.97Å; R181-L246 HydrophobicContact CG-CD2 4.46Å; R181-L246 HydrophobicContact CG-CG 4.29Å; R181-D249 IonicContact CZ-OD2 3.67Å; R181-D249 IonicContact NH2-OD2 3.93Å; R181-D249 PolarHBondContact NH2-OD2 2.86Å; R181-N255 PolarHBondContact NH1-ND2 3.14Å; R181-N255 PolarHBondContact NH1-OD1 2.96Å; R181-Y257 PolarHBondContact NH2-O 3.22Å
182G64.1Low70.3Confident6 Ų672.2 Ų72.26%0.06235%0.346CS..THydrogen-bonded Turntrans99.3-1-173.400000115N180 T185 T186N180-G182 PolarHBondContact O-N 3.13Å; N180-G182 VanDerWaalsContact O-N 3.12Å; G182-T185 VanDerWaalsContact C-OG1 3.27Å; G182-T185 WeakPolarHBondContact CA-OG1 3.39Å; G182-T185 PolarHBondContact O-OG1 3.15Å; G182-T186 WeakPolarHBondContact O-CB 3.32Å; G182-T186 PolarHBondContact O-N 3.05Å; G182-T186 PolarHBondContact O-OG1 2.9Å
183M67.2Low70Confident51 Ų5162.6 Ų62.625%0.25131%0.312SS..Hα-helixtrans-66.7-47.8173.4-177.516775.900111.2C136 N180 T185 T186 L187C136-M183 HydrophobicContact CB-CG 4.49Å; C136-M183 HydrophobicContact CB-SD 4.38Å; N180-M183 HydrophobicContact CB-CB 4.43Å; N180-M183 HydrophobicContact CB-CE 4.04Å; N180-M183 VanDerWaalsContact O-CB 3.24Å; N180-M183 WeakPolarHBondContact O-CB 3.26Å; N180-M183 PolarHBondContact O-N 3.24Å; M183-T185 VanDerWaalsContact C-N 3.32Å; M183-T185 PolarHBondContact O-N 2.93Å; M183-T186 WeakPolarHBondContact O-CA 3.17Å; M183-T186 WeakPolarHBondContact O-CB 3.32Å; M183-T186 PolarHBondContact O-N 2.71Å; M183-L187 PolarHBondContact O-N 3.47Å
184V68.9Low69.9Low92 Ų9256.8 Ų56.856%0.55829%0.287SS*.Hα-helixtrans-60.1-42.7177.2178.20000111.1T186 L187 L188 I260V184-T186 VanDerWaalsContact C-N 3.26Å; V184-T186 PolarHBondContact O-N 3.01Å; V184-L187 PolarHBondContact O-N 3.47Å; V184-L188 VanDerWaalsContact O-CB 3.28Å; V184-L188 WeakPolarHBondContact O-CB 3.22Å; V184-L188 PolarHBondContact O-N 3.31Å; V184-I260 HydrophobicContact CB-CD1 4.43Å; V184-I260 HydrophobicContact CG1-CD1 4.23Å
185T67.9Low70.2Confident3 Ų356.6 Ų56.62%0.01830%0.297CS..Hα-helixtrans-67.4-27.5175.150.80000112.8G182 M183 R189 L246 I260G182-T185 VanDerWaalsContact C-OG1 3.27Å; G182-T185 WeakPolarHBondContact CA-OG1 3.39Å; G182-T185 PolarHBondContact O-OG1 3.15Å; M183-T185 VanDerWaalsContact C-N 3.32Å; M183-T185 PolarHBondContact O-N 2.93Å; T185-R189 WeakPolarHBondContact O-CB 3.36Å; T185-R189 PolarHBondContact O-N 2.92Å; T185-R189 VanDerWaalsContact O-N 3.08Å; T185-L246 HydrophobicContact CG2-CD2 4.28Å; T185-I260 HydrophobicContact CG2-CD1 3.49Å; T185-I260 VanDerWaalsContact CG2-CD1 3.49Å; T185-I260 HydrophobicContact CG2-CG1 3.71Å; T185-I260 HydrophobicContact CG2-CG2 4.08Å
186T68.3Low70.4Confident14 Ų1457.4 Ų57.49%0.08630%0.297CS..Hα-helixtrans-70.7-49.1174.5-58.60000110.2G182 M183 V184 L188 R189 E190 K243G182-T186 WeakPolarHBondContact O-CB 3.32Å; G182-T186 PolarHBondContact O-N 3.05Å; G182-T186 PolarHBondContact O-OG1 2.9Å; M183-T186 WeakPolarHBondContact O-CA 3.17Å; M183-T186 WeakPolarHBondContact O-CB 3.32Å; M183-T186 PolarHBondContact O-N 2.71Å; V184-T186 VanDerWaalsContact C-N 3.26Å; V184-T186 PolarHBondContact O-N 3.01Å; T186-L188 VanDerWaalsContact C-N 3.32Å; T186-L188 PolarHBondContact O-N 3.36Å; T186-R189 WeakPolarHBondContact O-CB 3.43Å; T186-R189 PolarHBondContact O-N 3.28Å; T186-E190 HydrophobicContact CG2-CG 4.12Å; T186-E190 VanDerWaalsContact O-CG 3.32Å; T186-E190 WeakPolarHBondContact O-CG 3.21Å; T186-E190 PolarHBondContact O-N 2.83Å; T186-K243 WeakPolarHBondContact OG1-CD 3.25Å; T186-K243 WeakPolarHBondContact OG1-CE 3.35Å; T186-K243 PolarHBondContact OG1-NZ 2.81Å
187L68.1Low70.6Confident83 Ų8351.9 Ų51.944%0.43527%0.272SS..Hα-helixtrans-59-44.8175.1-68173000111.4M183 V184 R189 E190 T191M183-L187 PolarHBondContact O-N 3.47Å; V184-L187 PolarHBondContact O-N 3.47Å; L187-R189 PolarHBondContact O-N 2.86Å; L187-E190 PolarHBondContact O-N 3.41Å; L187-T191 PolarHBondContact O-N 2.97Å; L187-T191 PolarHBondContact O-OG1 3.47Å; L187-T191 VanDerWaalsContact O-OG1 3.12Å
188L72.2Confident71Confident102 Ų10243 Ų4353%0.53424%0.24SC..Hα-helixtrans-62.7-22.4176-15992.1000113.2V184 T186 P192 V239V184-L188 VanDerWaalsContact O-CB 3.28Å; V184-L188 WeakPolarHBondContact O-CB 3.22Å; V184-L188 PolarHBondContact O-N 3.31Å; T186-L188 VanDerWaalsContact C-N 3.32Å; T186-L188 PolarHBondContact O-N 3.36Å; L188-P192 WeakPolarHBondContact O-CD 3.29Å; L188-P192 WeakPolarHBondContact O-CG 3.37Å; L188-V239 HydrophobicContact CB-CG1 4.45Å; L188-V239 HydrophobicContact CD2-CG1 4.13Å; L188-V239 HydrophobicContact CD2-CG2 4.45Å
189R74.7Confident71.5Confident36 Ų3648.6 Ų48.614%0.13627%0.269CS..Hα-helixtrans-85.2-49.4174.7-177.8-167.869.4-175.61.5111.2T185 T186 L187 P192 G193 T236 V239 D240T185-R189 WeakPolarHBondContact O-CB 3.36Å; T185-R189 PolarHBondContact O-N 2.92Å; T185-R189 VanDerWaalsContact O-N 3.08Å; T186-R189 WeakPolarHBondContact O-CB 3.43Å; T186-R189 PolarHBondContact O-N 3.28Å; L187-R189 PolarHBondContact O-N 2.86Å; R189-P192 WeakPolarHBondContact O-CD 3.35Å; R189-G193 PolarHBondContact O-N 3.48Å; R189-T236 HydrophobicContact CG-CG2 4.44Å; R189-T236 WeakPolarHBondContact O-CG2 3.33Å; R189-V239 HydrophobicContact CB-CB 4.42Å; R189-V239 HydrophobicContact CB-CG1 3.86Å; R189-D240 WeakPolarHBondContact CD-OD1 3.5Å; R189-D240 IonicContact CZ-OD1 2.96Å; R189-D240 IonicContact NE-OD1 3.52Å; R189-D240 IonicContact NH1-OD1 2.86Å; R189-D240 PolarHBondContact NH1-OD1 3.38Å
190E68.6Low72Confident63 Ų6348.1 Ų48.129%0.29427%0.269SS..Hα-helixtrans-64.6-44.8-173.8-66.9-57.9127.300111.6T186 L187 G193 F194T186-E190 HydrophobicContact CG2-CG 4.12Å; T186-E190 VanDerWaalsContact O-CG 3.32Å; T186-E190 WeakPolarHBondContact O-CG 3.21Å; T186-E190 PolarHBondContact O-N 2.83Å; L187-E190 PolarHBondContact O-N 3.41Å; E190-G193 PolarHBondContact O-N 3.4Å; E190-F194 HydrophobicContact CB-CD2 4.32Å; E190-F194 HydrophobicContact CB-CE2 3.94Å; E190-F194 WeakPolarHBondContact O-CD2 2.95Å; E190-F194 PolarHBondContact O-N 2.93Å; E190-F194 WeakPolarHBondContact OE2-CE2 3.38Å; E190-F194 VanDerWaalsContact OE2-CZ 3.29Å; E190-F194 WeakPolarHBondContact OE2-CZ 3.43Å
191T72.4Confident72.4Confident102 Ų10247.7 Ų47.763%0.62626%0.264SS*.Hα-helixtrans-57.3-56.1-178.4-59.50000113.2L187 G193 G195L187-T191 PolarHBondContact O-N 2.97Å; L187-T191 PolarHBondContact O-OG1 3.47Å; L187-T191 VanDerWaalsContact O-OG1 3.12Å; T191-G193 VanDerWaalsContact C-N 3.33Å; T191-G195 PolarHBondContact O-N 2.94Å; T191-G195 VanDerWaalsContact O-N 3.17Å
192P75.5Confident72.8Confident50 Ų5048.6 Ų48.633%0.32527%0.272SS..Hα-helixtrans-70-30.4176.226.3-33.1000112.5L188 R189 F194 G195 V196 T236L188-P192 WeakPolarHBondContact O-CD 3.29Å; L188-P192 WeakPolarHBondContact O-CG 3.37Å; R189-P192 WeakPolarHBondContact O-CD 3.35Å; P192-F194 PolarHBondContact O-N 3.19Å; P192-G195 PolarHBondContact O-N 3.08Å; P192-V196 WeakPolarHBondContact O-CB 3.48Å; P192-V196 WeakPolarHBondContact O-CG2 3.23Å; P192-V196 PolarHBondContact O-N 3.36Å; P192-T236 HydrophobicContact CG-CG2 4.4Å
193G73.5Confident73.7Confident8 Ų852 Ų528%0.08229%0.292CS..Hα-helixtrans-58.8-47.8176.600000112.5R189 E190 T191 Y197 S232R189-G193 PolarHBondContact O-N 3.48Å; E190-G193 PolarHBondContact O-N 3.4Å; T191-G193 VanDerWaalsContact C-N 3.33Å; G193-Y197 VanDerWaalsContact O-CB 3.23Å; G193-Y197 WeakPolarHBondContact O-CB 3.43Å; G193-Y197 PolarHBondContact O-N 3.32Å; G193-S232 PolarHBondContact O-OG 3Å
194F72.3Confident74.3Confident35 Ų3551.6 Ų51.615%0.15429%0.29CS..Hα-helixtrans-67.2-43.7175-67.3-50.7000111.9M1 Q2 E190 P192 V196 Y197 F198M1-F194 HydrophobicContact CB-CE2 4.49Å; M1-F194 HydrophobicContact CB-CZ 4.13Å; M1-F194 HydrophobicContact SD-CE2 4.49Å; Q2-F194 HydrophobicContact CB-CE1 4.3Å; Q2-F194 HydrophobicContact CG-CE1 3.86Å; E190-F194 HydrophobicContact CB-CD2 4.32Å; E190-F194 HydrophobicContact CB-CE2 3.94Å; E190-F194 WeakPolarHBondContact O-CD2 2.95Å; E190-F194 PolarHBondContact O-N 2.93Å; E190-F194 WeakPolarHBondContact OE2-CE2 3.38Å; E190-F194 VanDerWaalsContact OE2-CZ 3.29Å; E190-F194 WeakPolarHBondContact OE2-CZ 3.43Å; P192-F194 PolarHBondContact O-N 3.19Å; F194-V196 PolarHBondContact O-N 3.19Å; F194-Y197 PolarHBondContact O-N 3.47Å; F194-F198 HydrophobicContact CB-CD2 4.33Å; F194-F198 HydrophobicContact CB-CE2 4.05Å; F194-F198 HydrophobicContact CD1-CE2 4.36Å; F194-F198 WeakPolarHBondContact O-CD2 3.44Å; F194-F198 PolarHBondContact O-N 2.94Å
195G75.1Confident74.6Confident42 Ų4248.4 Ų48.443%0.43327%0.271SS..Hα-helixtrans-57.4-50179.100000113T191 P192 F198 L199T191-G195 PolarHBondContact O-N 2.94Å; T191-G195 VanDerWaalsContact O-N 3.17Å; P192-G195 PolarHBondContact O-N 3.08Å; G195-F198 PolarHBondContact O-N 3.34Å; G195-L199 VanDerWaalsContact O-CB 3.3Å; G195-L199 WeakPolarHBondContact O-CB 3.34Å; G195-L199 PolarHBondContact O-N 3.12Å
196V80.4Confident75Confident41 Ų4156.9 Ų56.925%0.24830%0.303CS..Hα-helixtrans-67.5-37.2178.7175.40000111.4P192 F194 A200 A231P192-V196 WeakPolarHBondContact O-CB 3.48Å; P192-V196 WeakPolarHBondContact O-CG2 3.23Å; P192-V196 PolarHBondContact O-N 3.36Å; F194-V196 PolarHBondContact O-N 3.19Å; V196-A200 WeakPolarHBondContact O-CB 3.46Å; V196-A200 PolarHBondContact O-N 2.89Å; V196-A231 HydrophobicContact CG1-CB 4.4Å
197Y76.4Confident75.6Confident25 Ų2560.7 Ų60.710%0.09833%0.329CS..Hα-helixtrans-59.8-52.6176.2-179.3-92000111.4G193 F194 A200 Y201G193-Y197 VanDerWaalsContact O-CB 3.23Å; G193-Y197 WeakPolarHBondContact O-CB 3.43Å; G193-Y197 PolarHBondContact O-N 3.32Å; F194-Y197 PolarHBondContact O-N 3.47Å; Y197-A200 PolarHBondContact O-N 2.92Å; Y197-Y201 WeakPolarHBondContact O-CB 3.4Å; Y197-Y201 PolarHBondContact O-N 3.39Å
198F76.3Confident76Confident40 Ų4059.5 Ų59.518%0.17532%0.323CS..Hα-helixtrans-67-40.1-178.5-70.6-58.5000112.7V5 Q9 F194 G195 Y201 D202V5-F198 HydrophobicContact CB-CE1 4Å; V5-F198 HydrophobicContact CB-CE2 4.09Å; V5-F198 HydrophobicContact CB-CZ 3.39Å; V5-F198 HydrophobicContact CG1-CD1 4.16Å; V5-F198 HydrophobicContact CG1-CD2 4.41Å; V5-F198 HydrophobicContact CG1-CE1 3.29Å; V5-F198 HydrophobicContact CG1-CE2 3.6Å; V5-F198 HydrophobicContact CG1-CZ 3.02Å; V5-F198 HydrophobicContact CG2-CE2 4.33Å; V5-F198 HydrophobicContact CG2-CZ 4.09Å; Q9-F198 VanDerWaalsContact OE1-CE1 3.23Å; F194-F198 HydrophobicContact CB-CD2 4.33Å; F194-F198 HydrophobicContact CB-CE2 4.05Å; F194-F198 HydrophobicContact CD1-CE2 4.36Å; F194-F198 WeakPolarHBondContact O-CD2 3.44Å; F194-F198 PolarHBondContact O-N 2.94Å; G195-F198 PolarHBondContact O-N 3.34Å; F198-Y201 PolarHBondContact O-N 2.98Å; F198-D202 WeakPolarHBondContact O-CB 3.36Å; F198-D202 PolarHBondContact O-N 3.36Å
199L78.1Confident76Confident117 Ų11756 Ų5661%0.61331%0.312SS*.Hα-helixtrans-63.1-47.5176.4-178.5140.3000111.4G195 Y201 D202 V203G195-L199 VanDerWaalsContact O-CB 3.3Å; G195-L199 WeakPolarHBondContact O-CB 3.34Å; G195-L199 PolarHBondContact O-N 3.12Å; L199-Y201 VanDerWaalsContact C-N 3.32Å; L199-Y201 PolarHBondContact O-N 3.34Å; L199-D202 PolarHBondContact O-N 2.89Å; L199-V203 WeakPolarHBondContact O-CB 3.3Å; L199-V203 VanDerWaalsContact O-CG2 3.27Å; L199-V203 WeakPolarHBondContact O-CG2 3.49Å; L199-V203 PolarHBondContact O-N 3.44Å
200A79.3Confident75.4Confident15 Ų1556 Ų5612%0.12432%0.317CS..Hα-helixtrans-64.8-38.8177.800000111.6V196 Y197 L204 A231V196-A200 WeakPolarHBondContact O-CB 3.46Å; V196-A200 PolarHBondContact O-N 2.89Å; Y197-A200 PolarHBondContact O-N 2.92Å; A200-L204 VanDerWaalsContact O-CB 3.28Å; A200-L204 WeakPolarHBondContact O-CB 3.27Å; A200-L204 VanDerWaalsContact O-CD1 3.3Å; A200-L204 WeakPolarHBondContact O-CD1 3.39Å; A200-L204 WeakPolarHBondContact O-CG 3.49Å; A200-L204 PolarHBondContact O-N 3Å; A200-A231 HydrophobicContact CB-CB 4.07Å
201Y76.3Confident75.4Confident35 Ų3559.2 Ų59.214%0.13733%0.332CS..Hα-helixtrans-62.5-50.8177.3-175.7-98.6000111.5Y197 F198 L199 V203 L204 T205 L221 A224Y197-Y201 WeakPolarHBondContact O-CB 3.4Å; Y197-Y201 PolarHBondContact O-N 3.39Å; F198-Y201 PolarHBondContact O-N 2.98Å; L199-Y201 VanDerWaalsContact C-N 3.32Å; L199-Y201 PolarHBondContact O-N 3.34Å; Y201-V203 PolarHBondContact O-N 3.26Å; Y201-L204 PolarHBondContact O-N 2.82Å; Y201-T205 HydrophobicContact CD1-CG2 4.18Å; Y201-T205 HydrophobicContact CD2-CG2 4.41Å; Y201-T205 HydrophobicContact CE1-CG2 3.82Å; Y201-T205 HydrophobicContact CE2-CG2 4.06Å; Y201-T205 HydrophobicContact CG-CG2 4.46Å; Y201-T205 WeakPolarHBondContact O-CG2 3.29Å; Y201-T205 PolarHBondContact O-N 3.19Å; Y201-T205 PolarHBondContact O-OG1 3.47Å; Y201-T205 VanDerWaalsContact O-OG1 3.05Å; Y201-L221 WeakPolarHBondContact OH-CD2 3.4Å; Y201-A224 HydrophobicContact CD2-CB 4.39Å; Y201-A224 HydrophobicContact CE2-CB 4.35Å
202D73.8Confident74.8Confident61 Ų6159.6 Ų59.633%0.32634%0.336SS..Hα-helixtrans-62.9-41.1179.9-176.552.9000112.5F198 L199 T205 R206F198-D202 WeakPolarHBondContact O-CB 3.36Å; F198-D202 PolarHBondContact O-N 3.36Å; L199-D202 PolarHBondContact O-N 2.89Å; D202-T205 PolarHBondContact O-OG1 2.84Å; D202-R206 VanDerWaalsContact CG-NE 3.32Å; D202-R206 VanDerWaalsContact CG-NH2 3.3Å; D202-R206 WeakPolarHBondContact O-CB 3.15Å; D202-R206 WeakPolarHBondContact O-CG 3.24Å; D202-R206 PolarHBondContact O-N 2.9Å; D202-R206 VanDerWaalsContact O-N 3.13Å; D202-R206 IonicContact OD1-CZ 2.97Å; D202-R206 VanDerWaalsContact OD1-CZ 3.25Å; D202-R206 IonicContact OD1-NE 2.92Å; D202-R206 PolarHBondContact OD1-NE 3.43Å; D202-R206 IonicContact OD1-NH2 3.71Å; D202-R206 PolarHBondContact OD1-NH2 3.5Å; D202-R206 IonicContact OD2-CZ 2.93Å; D202-R206 IonicContact OD2-NE 2.89Å; D202-R206 PolarHBondContact OD2-NE 2.99Å; D202-R206 IonicContact OD2-NH1 2.78Å; D202-R206 IonicContact OD2-NH2 3.5Å; D202-R206 PolarHBondContact OD2-NH2 2.9Å
203V82.1Confident73.9Confident78 Ų7866.1 Ų66.147%0.47336%0.362SS..Hα-helixtrans-63.7-42.9175.1170.60000111.3L199 Y201 S207L199-V203 WeakPolarHBondContact O-CB 3.3Å; L199-V203 VanDerWaalsContact O-CG2 3.27Å; L199-V203 WeakPolarHBondContact O-CG2 3.49Å; L199-V203 PolarHBondContact O-N 3.44Å; Y201-V203 PolarHBondContact O-N 3.26Å; V203-S207 VanDerWaalsContact O-CB 3.3Å; V203-S207 WeakPolarHBondContact O-CB 3.34Å; V203-S207 PolarHBondContact O-N 3.01Å; V203-S207 PolarHBondContact O-OG 3.35Å
204L79.4Confident73.5Confident41 Ų4168.2 Ų68.222%0.21537%0.372CS..Hα-helixtrans-71.1-42.5-178.3-75.6165.1000112.4A200 Y201 R206 S207 L208 A224 M227A200-L204 VanDerWaalsContact O-CB 3.28Å; A200-L204 WeakPolarHBondContact O-CB 3.27Å; A200-L204 VanDerWaalsContact O-CD1 3.3Å; A200-L204 WeakPolarHBondContact O-CD1 3.39Å; A200-L204 WeakPolarHBondContact O-CG 3.49Å; A200-L204 PolarHBondContact O-N 3Å; Y201-L204 PolarHBondContact O-N 2.82Å; L204-R206 VanDerWaalsContact C-N 3.35Å; L204-S207 PolarHBondContact O-N 2.91Å; L204-L208 WeakPolarHBondContact O-CB 3.41Å; L204-L208 WeakPolarHBondContact O-CD1 3.27Å; L204-L208 WeakPolarHBondContact O-CG 3.35Å; L204-L208 PolarHBondContact O-N 3.17Å; L204-A224 HydrophobicContact CB-CB 3.87Å; L204-M227 HydrophobicContact CD1-CB 3.54Å
205T75.1Confident73.2Confident25 Ų2572 Ų7215%0.15340%0.4CS..Hα-helixtrans-66-38.1178.452.50000112Y201 D202 G209 C210 A224Y201-T205 HydrophobicContact CD1-CG2 4.18Å; Y201-T205 HydrophobicContact CD2-CG2 4.41Å; Y201-T205 HydrophobicContact CE1-CG2 3.82Å; Y201-T205 HydrophobicContact CE2-CG2 4.06Å; Y201-T205 HydrophobicContact CG-CG2 4.46Å; Y201-T205 WeakPolarHBondContact O-CG2 3.29Å; Y201-T205 PolarHBondContact O-N 3.19Å; Y201-T205 PolarHBondContact O-OG1 3.47Å; Y201-T205 VanDerWaalsContact O-OG1 3.05Å; D202-T205 PolarHBondContact O-OG1 2.84Å; T205-G209 PolarHBondContact O-N 2.96Å; T205-C210 PolarHBondContact O-N 3.12Å; T205-A224 HydrophobicContact CG2-CB 3.92Å
206R77.6Confident72.9Confident182 Ų18277.7 Ų77.769%0.68741%0.409SS*.Hα-helixtrans-66.2-41.6172.7-70.4175.8-167.3-166.33.9112.5D202 L204 L208 G209D202-R206 VanDerWaalsContact CG-NE 3.32Å; D202-R206 VanDerWaalsContact CG-NH2 3.3Å; D202-R206 WeakPolarHBondContact O-CB 3.15Å; D202-R206 WeakPolarHBondContact O-CG 3.24Å; D202-R206 PolarHBondContact O-N 2.9Å; D202-R206 VanDerWaalsContact O-N 3.13Å; D202-R206 IonicContact OD1-CZ 2.97Å; D202-R206 VanDerWaalsContact OD1-CZ 3.25Å; D202-R206 IonicContact OD1-NE 2.92Å; D202-R206 PolarHBondContact OD1-NE 3.43Å; D202-R206 IonicContact OD1-NH2 3.71Å; D202-R206 PolarHBondContact OD1-NH2 3.5Å; D202-R206 IonicContact OD2-CZ 2.93Å; D202-R206 IonicContact OD2-NE 2.89Å; D202-R206 PolarHBondContact OD2-NE 2.99Å; D202-R206 IonicContact OD2-NH1 2.78Å; D202-R206 IonicContact OD2-NH2 3.5Å; D202-R206 PolarHBondContact OD2-NH2 2.9Å; L204-R206 VanDerWaalsContact C-N 3.35Å; R206-L208 VanDerWaalsContact C-N 3.32Å; R206-L208 PolarHBondContact O-N 3.26Å; R206-G209 PolarHBondContact O-N 3.48Å
207S80Confident72.3Confident93 Ų9379 Ų7965%0.6541%0.414SS*.Hα-helixtrans-70.4-28.1-179.8-57.80000113.1V203 L204V203-S207 VanDerWaalsContact O-CB 3.3Å; V203-S207 WeakPolarHBondContact O-CB 3.34Å; V203-S207 PolarHBondContact O-N 3.01Å; V203-S207 PolarHBondContact O-OG 3.35Å; L204-S207 PolarHBondContact O-N 2.91Å
208L77.4Confident71.9Confident58 Ų5882.7 Ų82.730%0.30443%0.434SS..THydrogen-bonded Turntrans-87.8-4.7-179.4-71.6164.3000113.8L204 R206 K220 F223 A224L204-L208 WeakPolarHBondContact O-CB 3.41Å; L204-L208 WeakPolarHBondContact O-CD1 3.27Å; L204-L208 WeakPolarHBondContact O-CG 3.35Å; L204-L208 PolarHBondContact O-N 3.17Å; R206-L208 VanDerWaalsContact C-N 3.32Å; R206-L208 PolarHBondContact O-N 3.26Å; L208-K220 PolarHBondContact O-NZ 3.23Å; L208-F223 HydrophobicContact CD1-CD1 4.13Å; L208-A224 HydrophobicContact CD1-CB 4.15Å
209G70.9Confident71.6Confident28 Ų2884.3 Ų84.329%0.28945%0.449SS..THydrogen-bonded Turntrans56.556.7-176.800000111.2T205 R206 E211 K220T205-G209 PolarHBondContact O-N 2.96Å; R206-G209 PolarHBondContact O-N 3.48Å; G209-E211 VanDerWaalsContact C-N 3.29Å; G209-E211 PolarHBondContact O-N 3.35Å; G209-K220 PolarHBondContact O-NZ 2.76Å
210C63.3Low71.2Confident38 Ų3881.3 Ų81.326%0.25743%0.431SS..  trans-74.484.5175.7-72.50000109.7T205 L221T205-C210 PolarHBondContact O-N 3.12Å; C210-L221 HydrophobicContact CB-CD1 4.3Å
211E67.6Low70.8Confident129 Ų12982.2 Ų82.260%0.60343%0.433SS*.  trans-88.4145.4170.6-83.1147.88700111.2G209 E213 D214G209-E211 VanDerWaalsContact C-N 3.29Å; G209-E211 PolarHBondContact O-N 3.35Å; E211-E213 PolarHBondContact O-N 2.87Å; E211-D214 WeakPolarHBondContact O-CB 3.42Å; E211-D214 PolarHBondContact O-N 3.04Å
212P59.8Low70.4Confident111 Ų11184.2 Ų84.272%0.72145%0.446SS*.THydrogen-bonded Turntrans-66.3-15.1-176.123-30.7000114.4
213E58.2Low70.5Confident186 Ų18686.8 Ų86.887%0.86945%0.454SS*.THydrogen-bonded Turntrans-92.5-1.7-178.1-59.6-178.9-176.200113.2E211E211-E213 PolarHBondContact O-N 2.87Å
214D64.6Low70.1Confident52 Ų5283 Ų8328%0.27843%0.432SS..  trans-91.7121.9-167.8-144.95.9000111.5E211 Y216 M217 K220E211-D214 WeakPolarHBondContact O-CB 3.42Å; E211-D214 PolarHBondContact O-N 3.04Å; D214-Y216 PolarHBondContact O-N 2.81Å; D214-M217 VanDerWaalsContact O-CB 3.23Å; D214-M217 WeakPolarHBondContact O-CB 3.21Å; D214-M217 PolarHBondContact O-N 3.43Å; D214-K220 IonicContact OD2-NZ 2.81Å; D214-K220 PolarHBondContact OD2-NZ 3.14Å
215P65.8Low69.8Low115 Ų11581.1 Ų81.175%0.74742%0.422SS*.THydrogen-bonded Turntrans-63.8-15.8-176.219.9-29.4000114
216Y68.4Low69.6Low161 Ų16180.3 Ų80.363%0.63142%0.418SS*.THydrogen-bonded Turntrans-97.812.3176-60-76.6000114.2D214 I218 P219 K220D214-Y216 PolarHBondContact O-N 2.81Å; Y216-I218 VanDerWaalsContact C-N 3.35Å; Y216-I218 PolarHBondContact O-N 2.89Å; Y216-P219 VanDerWaalsContact O-CD 3.27Å; Y216-P219 WeakPolarHBondContact O-CD 3.17Å; Y216-K220 WeakPolarHBondContact O-CG 3.15Å; Y216-K220 PolarHBondContact O-N 3.41Å
217M67.9Low69.8Low69 Ų6975.3 Ų75.334%0.3440%0.404SS..Hα-helixtrans-53.9-47.6179.5178.2175.674.600112.2D214 K220 L221D214-M217 VanDerWaalsContact O-CB 3.23Å; D214-M217 WeakPolarHBondContact O-CB 3.21Å; D214-M217 PolarHBondContact O-N 3.43Å; M217-K220 PolarHBondContact O-N 3.01Å; M217-L221 HydrophobicContact CB-CD1 4.45Å; M217-L221 HydrophobicContact CG-CD1 3.35Å; M217-L221 WeakPolarHBondContact O-CD1 3.23Å; M217-L221 PolarHBondContact O-N 3.3Å; M217-L221 HydrophobicContact SD-CD1 4.46Å
218I68Low69.6Low102 Ų10270.9 Ų70.952%0.52337%0.373SS..Hα-helixtrans-62-50.4-177.8-62.6-177.1000112.2Y216 K220 L221 L222Y216-I218 VanDerWaalsContact C-N 3.35Å; Y216-I218 PolarHBondContact O-N 2.89Å; I218-K220 PolarHBondContact O-N 3.08Å; I218-L221 PolarHBondContact O-N 2.88Å; I218-L222 WeakPolarHBondContact O-CB 3.38Å; I218-L222 PolarHBondContact O-N 3.33Å
219P70.2Confident69.4Low75 Ų7568.4 Ų68.449%0.48736%0.361SS..Hα-helixtrans-56.9-42.2172.5-27.131.7000114.5Y216 L222 F223Y216-P219 VanDerWaalsContact O-CD 3.27Å; Y216-P219 WeakPolarHBondContact O-CD 3.17Å; P219-L222 PolarHBondContact O-N 3.01Å; P219-F223 PolarHBondContact O-N 3.46Å
220K70.3Confident69.9Low54 Ų5468.3 Ų68.324%0.23535%0.354CS..Hα-helixtrans-64.6-44.9179.3-72.5176.8175.6-174.50111.7L208 G209 D214 Y216 M217 I218 L222 F223 A224L208-K220 PolarHBondContact O-NZ 3.23Å; G209-K220 PolarHBondContact O-NZ 2.76Å; D214-K220 IonicContact OD2-NZ 2.81Å; D214-K220 PolarHBondContact OD2-NZ 3.14Å; Y216-K220 WeakPolarHBondContact O-CG 3.15Å; Y216-K220 PolarHBondContact O-N 3.41Å; M217-K220 PolarHBondContact O-N 3.01Å; I218-K220 PolarHBondContact O-N 3.08Å; K220-L222 VanDerWaalsContact C-N 3.31Å; K220-L222 PolarHBondContact O-N 3.03Å; K220-F223 PolarHBondContact O-N 3.1Å; K220-A224 WeakPolarHBondContact O-CB 3.38Å; K220-A224 PolarHBondContact O-N 3.29Å
221L69.1Low70.8Confident34 Ų3468.1 Ų68.118%0.17836%0.355CS..Hα-helixtrans-63.2-37.2174.4-89.493.5000112.2Y201 C210 M217 I218 A224 G225Y201-L221 WeakPolarHBondContact OH-CD2 3.4Å; C210-L221 HydrophobicContact CB-CD1 4.3Å; M217-L221 HydrophobicContact CB-CD1 4.45Å; M217-L221 HydrophobicContact CG-CD1 3.35Å; M217-L221 WeakPolarHBondContact O-CD1 3.23Å; M217-L221 PolarHBondContact O-N 3.3Å; M217-L221 HydrophobicContact SD-CD1 4.46Å; I218-L221 PolarHBondContact O-N 2.88Å; L221-A224 PolarHBondContact O-N 3.29Å; L221-G225 PolarHBondContact O-N 3.16Å
222L68.8Low71.4Confident76 Ų7662.5 Ų62.540%0.39833%0.329SS..Hα-helixtrans-67.3-40.5178.6-169.5139.6000111.5I218 P219 K220 G226 F295I218-L222 WeakPolarHBondContact O-CB 3.38Å; I218-L222 PolarHBondContact O-N 3.33Å; P219-L222 PolarHBondContact O-N 3.01Å; K220-L222 VanDerWaalsContact C-N 3.31Å; K220-L222 PolarHBondContact O-N 3.03Å; L222-G226 PolarHBondContact O-N 3.47Å; L222-F295 HydrophobicContact CB-CD2 4.44Å; L222-F295 HydrophobicContact CB-CE2 4.48Å; L222-F295 HydrophobicContact CD1-CB 3.92Å; L222-F295 HydrophobicContact CD1-CD2 3.86Å; L222-F295 HydrophobicContact CD1-CG 3.97Å; L222-F295 HydrophobicContact CG-CD2 3.88Å; L222-F295 HydrophobicContact CG-CE2 4.22Å; L222-F295 HydrophobicContact CG-CG 4.38Å
223F76.4Confident72.4Confident115 Ų11559.6 Ų59.650%0.50430%0.304SS..Hα-helixtrans-64.4-45.8173.1-173.6-99000111.6L208 P219 K220 G225 G226 M227L208-F223 HydrophobicContact CD1-CD1 4.13Å; P219-F223 PolarHBondContact O-N 3.46Å; K220-F223 PolarHBondContact O-N 3.1Å; F223-G225 PolarHBondContact O-N 3.35Å; F223-G226 PolarHBondContact O-N 2.9Å; F223-M227 HydrophobicContact CD1-CG 4.19Å; F223-M227 HydrophobicContact CD2-CG 4.45Å; F223-M227 HydrophobicContact CE1-CG 3.83Å; F223-M227 HydrophobicContact CE2-CG 4.12Å; F223-M227 HydrophobicContact CE2-SD 4.48Å; F223-M227 HydrophobicContact CG-CG 4.49Å; F223-M227 HydrophobicContact CZ-CG 3.79Å; F223-M227 HydrophobicContact CZ-SD 4.27Å; F223-M227 WeakPolarHBondContact O-CB 3.45Å; F223-M227 WeakPolarHBondContact O-CG 3.19Å; F223-M227 PolarHBondContact O-N 2.9Å
224A73.7Confident73.7Confident0 Ų054.8 Ų54.80%028%0.284CS..Hα-helixtrans-61.4-43.8176.900000112.4Y201 L204 T205 L208 K220 L221 S228Y201-A224 HydrophobicContact CD2-CB 4.39Å; Y201-A224 HydrophobicContact CE2-CB 4.35Å; L204-A224 HydrophobicContact CB-CB 3.87Å; T205-A224 HydrophobicContact CG2-CB 3.92Å; L208-A224 HydrophobicContact CD1-CB 4.15Å; K220-A224 WeakPolarHBondContact O-CB 3.38Å; K220-A224 PolarHBondContact O-N 3.29Å; L221-A224 PolarHBondContact O-N 3.29Å; A224-S228 VanDerWaalsContact O-CB 3.26Å; A224-S228 WeakPolarHBondContact O-CB 3.02Å; A224-S228 PolarHBondContact O-N 3.24Å; A224-S228 PolarHBondContact O-OG 3.1Å
225G71.9Confident74.6Confident1 Ų155.3 Ų55.31%0.0129%0.292CS..Hα-helixtrans-65.2-40.2174.600000113.1L221 F223 S228 G229L221-G225 PolarHBondContact O-N 3.16Å; F223-G225 PolarHBondContact O-N 3.35Å; G225-S228 WeakPolarHBondContact CA-OG 3.12Å; G225-S228 PolarHBondContact O-OG 2.98Å; G225-G229 PolarHBondContact O-N 3.4Å
226G72.5Confident75.3Confident7 Ų750.1 Ų50.17%0.07226%0.258CS..Hα-helixtrans-60.8-52175.200000112.5L222 F223 G229 I230L222-G226 PolarHBondContact O-N 3.47Å; F223-G226 PolarHBondContact O-N 2.9Å; G226-G229 PolarHBondContact O-N 2.91Å; G226-I230 WeakPolarHBondContact O-CG1 3.39Å; G226-I230 PolarHBondContact O-N 3.36Å; G226-I230 VanDerWaalsContact O-N 3.08Å
227M80.4Confident76Confident78 Ų7842.7 Ų42.738%0.38423%0.229SC..Hα-helixtrans-69.3-40.2-177.4-70.7-60.7-65.100112.7L204 F223 G229 I230 A231L204-M227 HydrophobicContact CD1-CB 3.54Å; F223-M227 HydrophobicContact CD1-CG 4.19Å; F223-M227 HydrophobicContact CD2-CG 4.45Å; F223-M227 HydrophobicContact CE1-CG 3.83Å; F223-M227 HydrophobicContact CE2-CG 4.12Å; F223-M227 HydrophobicContact CE2-SD 4.48Å; F223-M227 HydrophobicContact CG-CG 4.49Å; F223-M227 HydrophobicContact CZ-CG 3.79Å; F223-M227 HydrophobicContact CZ-SD 4.27Å; F223-M227 WeakPolarHBondContact O-CB 3.45Å; F223-M227 WeakPolarHBondContact O-CG 3.19Å; F223-M227 PolarHBondContact O-N 2.9Å; M227-G229 VanDerWaalsContact C-N 3.33Å; M227-G229 PolarHBondContact O-N 3.44Å; M227-I230 PolarHBondContact O-N 3.37Å; M227-I230 HydrophobicContact SD-CD1 4.21Å; M227-A231 WeakPolarHBondContact O-CB 3.33Å; M227-A231 PolarHBondContact O-N 3.41Å
228S76.6Confident76.7Confident0 Ų041.9 Ų41.90%023%0.229CC..Hα-helixtrans-63.9-37.2173.154.90000112.4A224 G225 A231 S232A224-S228 VanDerWaalsContact O-CB 3.26Å; A224-S228 WeakPolarHBondContact O-CB 3.02Å; A224-S228 PolarHBondContact O-N 3.24Å; A224-S228 PolarHBondContact O-OG 3.1Å; G225-S228 WeakPolarHBondContact CA-OG 3.12Å; G225-S228 PolarHBondContact O-OG 2.98Å; S228-A231 PolarHBondContact O-N 3.15Å; S228-S232 WeakPolarHBondContact O-CB 3.44Å; S228-S232 PolarHBondContact O-N 3.45Å
229G73.2Confident77.4Confident5 Ų538.4 Ų38.45%0.05221%0.212CC..Hα-helixtrans-59.6-46.6171.100000112.7G225 G226 M227 S232 W233G225-G229 PolarHBondContact O-N 3.4Å; G226-G229 PolarHBondContact O-N 2.91Å; M227-G229 VanDerWaalsContact C-N 3.33Å; M227-G229 PolarHBondContact O-N 3.44Å; G229-S232 PolarHBondContact O-N 3Å; G229-W233 PolarHBondContact O-N 3.23Å
230I80.9Confident77.9Confident27 Ų2735 Ų3514%0.13819%0.19CC..Hα-helixtrans-62.3-46.5176.7-65.6166.5000110.4G226 M227 S232 W233 L234 L284 F288G226-I230 WeakPolarHBondContact O-CG1 3.39Å; G226-I230 PolarHBondContact O-N 3.36Å; G226-I230 VanDerWaalsContact O-N 3.08Å; M227-I230 PolarHBondContact O-N 3.37Å; M227-I230 HydrophobicContact SD-CD1 4.21Å; I230-S232 PolarHBondContact O-N 3.3Å; I230-W233 PolarHBondContact O-N 3.33Å; I230-L234 HydrophobicContact CG2-CD1 3.92Å; I230-L234 HydrophobicContact CG2-CG 4.42Å; I230-L234 WeakPolarHBondContact O-CB 3.43Å; I230-L234 WeakPolarHBondContact O-CG 3.48Å; I230-L234 PolarHBondContact O-N 3.49Å; I230-L284 HydrophobicContact CB-CD2 4.33Å; I230-L284 HydrophobicContact CG1-CD2 4.38Å; I230-L284 HydrophobicContact CG2-CD2 3.76Å; I230-F288 HydrophobicContact CD1-CE2 3.62Å; I230-F288 HydrophobicContact CD1-CZ 3.66Å
231A82.5Confident78.3Confident34 Ų3432.9 Ų32.928%0.28118%0.182SC..Hα-helixtrans-60.4-44.5178.800000112.2V196 A200 M227 S228 L234 S235V196-A231 HydrophobicContact CG1-CB 4.4Å; A200-A231 HydrophobicContact CB-CB 4.07Å; M227-A231 WeakPolarHBondContact O-CB 3.33Å; M227-A231 PolarHBondContact O-N 3.41Å; S228-A231 PolarHBondContact O-N 3.15Å; A231-L234 PolarHBondContact O-N 3.5Å; A231-S235 PolarHBondContact O-N 2.94Å
232S80.9Confident78.8Confident10 Ų1032.4 Ų32.47%0.0718%0.179CC..Hα-helixtrans-61.1-45.7175.4177.60000112G193 S228 G229 I230 S235 T236G193-S232 PolarHBondContact O-OG 3Å; S228-S232 WeakPolarHBondContact O-CB 3.44Å; S228-S232 PolarHBondContact O-N 3.45Å; G229-S232 PolarHBondContact O-N 3Å; I230-S232 PolarHBondContact O-N 3.3Å; S232-S235 PolarHBondContact O-N 3.42Å; S232-T236 WeakPolarHBondContact O-CG2 3.42Å; S232-T236 PolarHBondContact O-N 3.27Å; S232-T236 PolarHBondContact O-OG1 2.96Å
233W80.1Confident79.3Confident50 Ų5029 Ų2919%0.18916%0.161CC..Hα-helixtrans-64.1-42.7176.8-85.4109.5000112.1G229 I230 S235 T236 Y237 T283G229-W233 PolarHBondContact O-N 3.23Å; I230-W233 PolarHBondContact O-N 3.33Å; W233-S235 VanDerWaalsContact C-N 3.34Å; W233-S235 PolarHBondContact O-N 2.94Å; W233-T236 PolarHBondContact O-N 3.43Å; W233-T236 PolarHBondContact O-OG1 3.08Å; W233-Y237 WeakPolarHBondContact O-CA 3.48Å; W233-Y237 WeakPolarHBondContact O-CB 3.35Å; W233-Y237 PolarHBondContact O-N 3.31Å; W233-T283 HydrophobicContact CD2-CG2 3.57Å; W233-T283 HydrophobicContact CE3-CG2 3.37Å; W233-T283 HydrophobicContact CG-CG2 4.14Å; W233-T283 HydrophobicContact CH2-CG2 4.23Å; W233-T283 HydrophobicContact CZ2-CG2 4.41Å; W233-T283 HydrophobicContact CZ3-CG2 3.73Å
234L84.8Confident79.2Confident85 Ų8525 Ų2545%0.44515%0.147SC..Hα-helixtrans-59.3-44.1177.1-76.4168.8000112I230 A231 L280 L284I230-L234 HydrophobicContact CG2-CD1 3.92Å; I230-L234 HydrophobicContact CG2-CG 4.42Å; I230-L234 WeakPolarHBondContact O-CB 3.43Å; I230-L234 WeakPolarHBondContact O-CG 3.48Å; I230-L234 PolarHBondContact O-N 3.49Å; A231-L234 PolarHBondContact O-N 3.5Å; L234-L280 HydrophobicContact CD2-CD1 3.98Å; L234-L280 HydrophobicContact CD2-CD2 3.76Å; L234-L280 HydrophobicContact CD2-CG 4.36Å; L234-L284 HydrophobicContact CG-CD2 4.47Å
235S83.8Confident79.2Confident63 Ų6327.2 Ų27.244%0.44116%0.155SC..Hα-helixtrans-68-37.4179.7-178.20000112.9A231 S232 W233A231-S235 PolarHBondContact O-N 2.94Å; S232-S235 PolarHBondContact O-N 3.42Å; W233-S235 VanDerWaalsContact C-N 3.34Å; W233-S235 PolarHBondContact O-N 2.94Å
236T81.9Confident79.4Confident7 Ų727.6 Ų27.64%0.04316%0.157CC..Hα-helixtrans-91.7-10.7-175.154.60000113.8R189 P192 S232 W233 P238 V239 D240R189-T236 HydrophobicContact CG-CG2 4.44Å; R189-T236 WeakPolarHBondContact O-CG2 3.33Å; P192-T236 HydrophobicContact CG-CG2 4.4Å; S232-T236 WeakPolarHBondContact O-CG2 3.42Å; S232-T236 PolarHBondContact O-N 3.27Å; S232-T236 PolarHBondContact O-OG1 2.96Å; W233-T236 PolarHBondContact O-N 3.43Å; W233-T236 PolarHBondContact O-OG1 3.08Å; T236-P238 VanDerWaalsContact C-CD 3.49Å; T236-V239 PolarHBondContact O-N 3.47Å; T236-V239 VanDerWaalsContact O-N 3.11Å; T236-D240 PolarHBondContact O-N 2.72Å
237Y82.6Confident79.2Confident5 Ų527.8 Ų27.82%0.0216%0.156CC..Hα-helixtrans-55.4-43.7-173.8-161-108.9000114.4W233 V239 D240 V241 F276 R278 G279 L280 T283W233-Y237 WeakPolarHBondContact O-CA 3.48Å; W233-Y237 WeakPolarHBondContact O-CB 3.35Å; W233-Y237 PolarHBondContact O-N 3.31Å; Y237-V239 VanDerWaalsContact C-N 3.3Å; Y237-V239 PolarHBondContact O-N 3.19Å; Y237-D240 WeakPolarHBondContact O-CB 3.36Å; Y237-D240 PolarHBondContact O-N 3.45Å; Y237-D240 VanDerWaalsContact O-N 3.14Å; Y237-V241 HydrophobicContact CD1-CG2 4.19Å; Y237-V241 HydrophobicContact CE1-CG2 3.69Å; Y237-V241 WeakPolarHBondContact O-CG2 3.16Å; Y237-V241 PolarHBondContact O-N 3.2Å; Y237-F276 WeakPolarHBondContact CD1-O 3.27Å; Y237-F276 WeakPolarHBondContact CE1-O 2.9Å; Y237-R278 PolarHBondContact OH-O 3.47Å; Y237-G279 WeakPolarHBondContact OH-CA 3.29Å; Y237-G279 PolarHBondContact OH-N 3.47Å; Y237-G279 PolarHBondContact OH-O 2.92Å; Y237-L280 HydrophobicContact CD1-CB 4Å; Y237-L280 HydrophobicContact CD1-CD1 3.94Å; Y237-L280 HydrophobicContact CD1-CG 4.41Å; Y237-L280 HydrophobicContact CD2-CD1 3.75Å; Y237-L280 HydrophobicContact CE1-CB 3.67Å; Y237-L280 HydrophobicContact CE1-CD1 4.38Å; Y237-L280 HydrophobicContact CE2-CB 4.3Å; Y237-L280 HydrophobicContact CE2-CD1 4.19Å; Y237-L280 HydrophobicContact CG-CB 4.48Å; Y237-L280 HydrophobicContact CG-CD1 3.65Å; Y237-L280 VanDerWaalsContact CZ-CA 3.46Å; Y237-L280 VanDerWaalsContact CZ-N 3.27Å; Y237-L280 PolarHBondContact OH-N 3.14Å; Y237-T283 HydrophobicContact CE2-CG2 4.45Å; Y237-T283 WeakPolarHBondContact CE2-OG1 3.39Å
238P82.5Confident78.6Confident52 Ų5225.7 Ų25.734%0.33815%0.151SC..Hα-helixtrans-61-39.9178.6-2334.4000112.6T236 D240 V241 I242 F276T236-P238 VanDerWaalsContact C-CD 3.49Å; P238-D240 VanDerWaalsContact C-N 3.33Å; P238-V241 PolarHBondContact O-N 2.67Å; P238-I242 WeakPolarHBondContact O-CD1 3.37Å; P238-I242 VanDerWaalsContact O-CG1 3.3Å; P238-I242 WeakPolarHBondContact O-CG1 3.48Å; P238-I242 PolarHBondContact O-N 3.44Å; P238-F276 HydrophobicContact CB-CD1 4.02Å
239V82.1Confident78.2Confident29 Ų2926.1 Ų26.118%0.17615%0.153CC..Hα-helixtrans-67.6-37.4177.6-173.90000110.5L188 R189 T236 Y237 I242 K243L188-V239 HydrophobicContact CB-CG1 4.45Å; L188-V239 HydrophobicContact CD2-CG1 4.13Å; L188-V239 HydrophobicContact CD2-CG2 4.45Å; R189-V239 HydrophobicContact CB-CB 4.42Å; R189-V239 HydrophobicContact CB-CG1 3.86Å; T236-V239 PolarHBondContact O-N 3.47Å; T236-V239 VanDerWaalsContact O-N 3.11Å; Y237-V239 VanDerWaalsContact C-N 3.3Å; Y237-V239 PolarHBondContact O-N 3.19Å; V239-I242 PolarHBondContact O-N 2.95Å; V239-K243 WeakPolarHBondContact O-CB 3.46Å; V239-K243 PolarHBondContact O-N 3.21Å
240D80.1Confident77.6Confident4 Ų426.2 Ų26.22%0.02115%0.154CC..Hα-helixtrans-65.6-39.6177.3-164.768.2000112.4K51 R189 T236 Y237 P238 K243 S244K51-D240 WeakPolarHBondContact CE-OD2 3.34Å; K51-D240 IonicContact NZ-OD2 3.54Å; K51-D240 PolarHBondContact NZ-OD2 3.26Å; R189-D240 WeakPolarHBondContact CD-OD1 3.5Å; R189-D240 IonicContact CZ-OD1 2.96Å; R189-D240 IonicContact NE-OD1 3.52Å; R189-D240 IonicContact NH1-OD1 2.86Å; R189-D240 PolarHBondContact NH1-OD1 3.38Å; T236-D240 PolarHBondContact O-N 2.72Å; Y237-D240 WeakPolarHBondContact O-CB 3.36Å; Y237-D240 PolarHBondContact O-N 3.45Å; Y237-D240 VanDerWaalsContact O-N 3.14Å; P238-D240 VanDerWaalsContact C-N 3.33Å; D240-K243 PolarHBondContact O-N 3.28Å; D240-S244 PolarHBondContact O-N 3.28Å; D240-S244 PolarHBondContact O-OG 2.93Å
241V78.7Confident76.6Confident9 Ų927.5 Ų27.56%0.05516%0.164CC..Hα-helixtrans-62-44.2173.7173.70000111.1Y237 P238 S244 R245Y237-V241 HydrophobicContact CD1-CG2 4.19Å; Y237-V241 HydrophobicContact CE1-CG2 3.69Å; Y237-V241 WeakPolarHBondContact O-CG2 3.16Å; Y237-V241 PolarHBondContact O-N 3.2Å; P238-V241 PolarHBondContact O-N 2.67Å; V241-S244 PolarHBondContact O-N 3.06Å; V241-R245 WeakPolarHBondContact O-CG 3.25Å; V241-R245 PolarHBondContact O-N 2.88Å
242I80.6Confident75.3Confident24 Ų2428.6 Ų28.612%0.12318%0.178CC..Hα-helixtrans-64.8-43.3178-61.4158.6000110.5P238 V239 R245 L246 I260 V264 F276P238-I242 WeakPolarHBondContact O-CD1 3.37Å; P238-I242 VanDerWaalsContact O-CG1 3.3Å; P238-I242 WeakPolarHBondContact O-CG1 3.48Å; P238-I242 PolarHBondContact O-N 3.44Å; V239-I242 PolarHBondContact O-N 2.95Å; I242-R245 PolarHBondContact O-N 3.42Å; I242-L246 WeakPolarHBondContact O-CB 3.46Å; I242-L246 PolarHBondContact O-N 2.85Å; I242-I260 HydrophobicContact CG2-CG2 3.91Å; I242-V264 HydrophobicContact CD1-CG2 3.42Å; I242-V264 VanDerWaalsContact CD1-CG2 3.42Å; I242-V264 HydrophobicContact CG1-CG2 3.83Å; I242-V264 HydrophobicContact CG2-CG2 4.27Å; I242-F276 HydrophobicContact CD1-CE1 4.07Å; I242-F276 HydrophobicContact CG1-CE1 3.97Å
243K78.7Confident74.1Confident5 Ų530.3 Ų30.32%0.02220%0.197CC..Hα-helixtrans-56.5-52.1174.7175.9-179169.1164.30110.5E139 T186 V239 D240 R245 L246 Q247E139-K243 IonicContact OE2-NZ 3.48Å; E139-K243 PolarHBondContact OE2-NZ 3.01Å; T186-K243 WeakPolarHBondContact OG1-CD 3.25Å; T186-K243 WeakPolarHBondContact OG1-CE 3.35Å; T186-K243 PolarHBondContact OG1-NZ 2.81Å; V239-K243 WeakPolarHBondContact O-CB 3.46Å; V239-K243 PolarHBondContact O-N 3.21Å; D240-K243 PolarHBondContact O-N 3.28Å; K243-R245 VanDerWaalsContact C-N 3.33Å; K243-R245 PolarHBondContact O-N 2.78Å; K243-L246 PolarHBondContact O-N 3.36Å; K243-Q247 VanDerWaalsContact CE-NE2 3.29Å; K243-Q247 HydrophobicContact CG-CG 4.36Å; K243-Q247 WeakPolarHBondContact O-CB 3.22Å; K243-Q247 WeakPolarHBondContact O-CG 3.46Å; K243-Q247 PolarHBondContact O-N 3.22Å
244S73.8Confident73.3Confident29 Ų2933 Ų3320%0.20322%0.219CC..Hα-helixtrans-59.1-42.5-179.9-72.60000112.2Q55 D240 V241 Q247 A248Q55-S244 PolarHBondContact OE1-OG 3.02Å; D240-S244 PolarHBondContact O-N 3.28Å; D240-S244 PolarHBondContact O-OG 2.93Å; V241-S244 PolarHBondContact O-N 3.06Å; S244-Q247 PolarHBondContact O-N 2.88Å; S244-A248 VanDerWaalsContact O-CB 3.29Å; S244-A248 WeakPolarHBondContact O-CB 3.39Å; S244-A248 PolarHBondContact O-N 3.27Å
245R75.7Confident72.4Confident47 Ų4732.8 Ų32.818%0.17722%0.218CC..Hα-helixtrans-66.2-41.4177.4-74-175174.6-126.6-17112.8V241 I242 K243 A248 D249 S267 E271V241-R245 WeakPolarHBondContact O-CG 3.25Å; V241-R245 PolarHBondContact O-N 2.88Å; I242-R245 PolarHBondContact O-N 3.42Å; K243-R245 VanDerWaalsContact C-N 3.33Å; K243-R245 PolarHBondContact O-N 2.78Å; R245-A248 PolarHBondContact O-N 3.35Å; R245-D249 PolarHBondContact O-N 3.02Å; R245-S267 WeakPolarHBondContact CD-OG 3.3Å; R245-S267 PolarHBondContact NH1-OG 3.43Å; R245-S267 VanDerWaalsContact NH1-OG 3.14Å; R245-E271 IonicContact CZ-OE1 3.2Å; R245-E271 IonicContact CZ-OE2 3.96Å; R245-E271 IonicContact NH1-OE1 2.76Å; R245-E271 PolarHBondContact NH1-OE1 2.86Å; R245-E271 IonicContact NH2-OE1 2.75Å; R245-E271 PolarHBondContact NH2-OE1 3.4Å; R245-E271 IonicContact NH2-OE2 2.93Å; R245-E271 PolarHBondContact NH2-OE2 2.87Å
246L75.3Confident71.6Confident9 Ų936.8 Ų36.85%0.04723%0.228CC..Hα-helixtrans-69.2-36.6178.2-166.669.8000111.7R181 T185 I242 K243 A248 D249 I260R181-L246 HydrophobicContact CG-CD2 4.46Å; R181-L246 HydrophobicContact CG-CG 4.29Å; T185-L246 HydrophobicContact CG2-CD2 4.28Å; I242-L246 WeakPolarHBondContact O-CB 3.46Å; I242-L246 PolarHBondContact O-N 2.85Å; K243-L246 PolarHBondContact O-N 3.36Å; L246-A248 VanDerWaalsContact C-N 3.33Å; L246-D249 WeakPolarHBondContact O-CB 3.13Å; L246-D249 PolarHBondContact O-N 3.39Å; L246-I260 HydrophobicContact CD2-CG1 4.16Å
247Q68.3Low71.1Confident11 Ų1137.8 Ų37.85%0.05123%0.231CC..Hα-helixtrans-71.5-27.6173.1-72-174.8-26.400112.4L140 R144 M147 K243 S244L140-Q247 HydrophobicContact CD1-CB 4.32Å; L140-Q247 HydrophobicContact CD1-CG 4.09Å; R144-Q247 PolarHBondContact NE-O 3.49Å; R144-Q247 VanDerWaalsContact NE-O 3.11Å; R144-Q247 PolarHBondContact NH1-O 2.97Å; R144-Q247 PolarHBondContact NH2-O 3.27Å; M147-Q247 WeakPolarHBondContact CE-O 3.36Å; K243-Q247 VanDerWaalsContact CE-NE2 3.29Å; K243-Q247 HydrophobicContact CG-CG 4.36Å; K243-Q247 WeakPolarHBondContact O-CB 3.22Å; K243-Q247 WeakPolarHBondContact O-CG 3.46Å; K243-Q247 PolarHBondContact O-N 3.22Å; S244-Q247 PolarHBondContact O-N 2.88Å
248A67.4Low70.4Confident35 Ų3541 Ų4129%0.28927%0.265SS..Hα-helixtrans-73.8-27.7170.700000113.2R144 M147 S244 R245 L246 G250 V251R144-A248 PolarHBondContact NH1-O 3.46Å; R144-A248 VanDerWaalsContact NH1-O 3.12Å; M147-A248 HydrophobicContact CE-CB 4.17Å; M147-A248 VanDerWaalsContact SD-CA 3.54Å; M147-A248 HydrophobicContact SD-CB 3.45Å; M147-A248 WeakPolarHBondContact SD-CB 3.02Å; S244-A248 VanDerWaalsContact O-CB 3.29Å; S244-A248 WeakPolarHBondContact O-CB 3.39Å; S244-A248 PolarHBondContact O-N 3.27Å; R245-A248 PolarHBondContact O-N 3.35Å; L246-A248 VanDerWaalsContact C-N 3.33Å; A248-G250 PolarHBondContact O-N 3.46Å; A248-V251 WeakPolarHBondContact O-CG2 3.43Å; A248-V251 PolarHBondContact O-N 3.49Å
249D67.4Low70.1Confident8 Ų841.3 Ų41.34%0.04327%0.269CS..THydrogen-bonded Turntrans-67127.6-176.3-169.333.3000112.9R144 R181 R245 L246 K256 Y257R144-D249 VanDerWaalsContact NH1-C 3.26Å; R144-D249 PolarHBondContact NH1-O 3.24Å; R144-D249 PolarHBondContact NH2-O 3.1Å; R181-D249 IonicContact CZ-OD2 3.67Å; R181-D249 IonicContact NH2-OD2 3.93Å; R181-D249 PolarHBondContact NH2-OD2 2.86Å; R245-D249 PolarHBondContact O-N 3.02Å; L246-D249 WeakPolarHBondContact O-CB 3.13Å; L246-D249 PolarHBondContact O-N 3.39Å; D249-K256 VanDerWaalsContact CG-N 3.35Å; D249-K256 WeakPolarHBondContact OD1-CA 2.96Å; D249-K256 WeakPolarHBondContact OD1-CB 3.36Å; D249-K256 PolarHBondContact OD1-N 2.9Å; D249-K256 PolarHBondContact OD2-N 3.43Å; D249-Y257 HydrophobicContact CB-CD2 3.7Å; D249-Y257 HydrophobicContact CB-CE2 4.27Å; D249-Y257 PolarHBondContact OD2-N 3.19Å
250G62.4Low69.9Low7 Ų743 Ų437%0.07228%0.276CS..THydrogen-bonded Turntrans99.4-7.7-171.500000115.1A248 G252 G253A248-G250 PolarHBondContact O-N 3.46Å; G250-G252 PolarHBondContact O-N 3.43Å; G250-G252 VanDerWaalsContact O-N 3.11Å; G250-G253 PolarHBondContact O-N 3Å
251V58.4Low69.9Low55 Ų5546.3 Ų46.333%0.33330%0.304SS..THydrogen-bonded Turntrans-67.1110.3165.2178.30000107.5R144 M147 M159 A248R144-V251 VanDerWaalsContact NH1-CG2 3.35Å; M147-V251 HydrophobicContact CE-CG2 3.97Å; M147-V251 HydrophobicContact SD-CG2 4.45Å; M159-V251 HydrophobicContact CE-CG1 3.75Å; A248-V251 WeakPolarHBondContact O-CG2 3.43Å; A248-V251 PolarHBondContact O-N 3.49Å
252G56Low70.1Confident56 Ų5648.3 Ų48.358%0.57732%0.315SS*.THydrogen-bonded Turntrans108.3-0.8-173.200000114.6G250G250-G252 PolarHBondContact O-N 3.43Å; G250-G252 VanDerWaalsContact O-N 3.11Å
253G56.2Low70.1Confident46 Ų4647.2 Ų47.247%0.47431%0.309SS..SBendtrans86.33.1170.500000116G250G250-G253 PolarHBondContact O-N 3Å
254V62.5Low70.3Confident107 Ų10748.9 Ų48.965%0.64832%0.319SS*.  trans-119.2128.7174.3-169.90000109
255N65.8Low70.8Confident80 Ų8055.5 Ų55.543%0.42834%0.34SS..  trans-86.7116.1174.6-71.2-26.5000109.2E174 R181E174-N255 PolarHBondContact OE1-OD1 3Å; R181-N255 PolarHBondContact NH1-ND2 3.14Å; R181-N255 PolarHBondContact NH1-OD1 2.96Å
256K67.2Low71.1Confident147 Ų14755 Ų5564%0.63934%0.34SS*.  trans-88.4-21.3178.5-70.8-177.7174.3178.20113.4D249 Q266D249-K256 VanDerWaalsContact CG-N 3.35Å; D249-K256 WeakPolarHBondContact OD1-CA 2.96Å; D249-K256 WeakPolarHBondContact OD1-CB 3.36Å; D249-K256 PolarHBondContact OD1-N 2.9Å; D249-K256 PolarHBondContact OD2-N 3.43Å; K256-Q266 PolarHBondContact O-NE2 2.91Å
257Y72.4Confident71.5Confident28 Ų2854.8 Ų54.811%0.1134%0.339CS..  trans-122.6120.7-176.6-53-63000112.5R181 D249 C263 Q266R181-Y257 PolarHBondContact NH2-O 3.22Å; D249-Y257 HydrophobicContact CB-CD2 3.7Å; D249-Y257 HydrophobicContact CB-CE2 4.27Å; D249-Y257 PolarHBondContact OD2-N 3.19Å; Y257-C263 HydrophobicContact CD1-CB 3.94Å; Y257-C263 HydrophobicContact CD2-CB 4.32Å; Y257-C263 HydrophobicContact CE1-CB 4.49Å; Y257-C263 HydrophobicContact CG-CB 3.84Å; Y257-Q266 HydrophobicContact CD1-CB 4.42Å; Y257-Q266 HydrophobicContact CE1-CB 3.96Å
258G67.1Low72.2Confident72 Ų7256.7 Ų56.774%0.74235%0.349SS*.SBendtrans-78.5-27.4178.700000113.9D262G258-D262 PolarHBondContact N-OD2 3.04Å
259S75.1Confident72.9Confident59 Ų5961.6 Ų61.641%0.41337%0.366SS..SBendtrans-152.6169.6-178.370.70000112.3A261 D262 C263S259-A261 VanDerWaalsContact C-N 3.31Å; S259-A261 PolarHBondContact O-N 3.35Å; S259-D262 PolarHBondContact O-N 2.85Å; S259-D262 VanDerWaalsContact OG-CB 3.3Å; S259-D262 WeakPolarHBondContact OG-CB 3.45Å; S259-D262 PolarHBondContact OG-N 3.23Å; S259-D262 VanDerWaalsContact OG-N 3.08Å; S259-C263 PolarHBondContact O-N 3.39Å
260I78.1Confident73.5Confident65 Ų6568 Ų6833%0.33339%0.394SS..Hα-helixtrans-60.1-44.3174.2-58.9166.7000110.1V184 T185 I242 L246 D262 C263 V264V184-I260 HydrophobicContact CB-CD1 4.43Å; V184-I260 HydrophobicContact CG1-CD1 4.23Å; T185-I260 HydrophobicContact CG2-CD1 3.49Å; T185-I260 VanDerWaalsContact CG2-CD1 3.49Å; T185-I260 HydrophobicContact CG2-CG1 3.71Å; T185-I260 HydrophobicContact CG2-CG2 4.08Å; I242-I260 HydrophobicContact CG2-CG2 3.91Å; L246-I260 HydrophobicContact CD2-CG1 4.16Å; I260-D262 VanDerWaalsContact C-N 3.35Å; I260-D262 PolarHBondContact O-N 2.95Å; I260-C263 WeakPolarHBondContact O-CB 3.37Å; I260-C263 PolarHBondContact O-N 3.47Å; I260-V264 WeakPolarHBondContact O-CG2 3.29Å; I260-V264 PolarHBondContact O-N 3.39Å
261A80.6Confident74.2Confident73 Ų7370 Ų7060%0.60340%0.401SS*.Hα-helixtrans-64.9-38179.200000112.4S259 V264 R265S259-A261 VanDerWaalsContact C-N 3.31Å; S259-A261 PolarHBondContact O-N 3.35Å; A261-V264 PolarHBondContact O-N 3.49Å; A261-R265 WeakPolarHBondContact O-CB 3.24Å; A261-R265 PolarHBondContact O-N 3.38Å
262D83.1Confident75.3Confident52 Ų5268.6 Ų68.628%0.27840%0.397SS..Hα-helixtrans-66.9-41.1175-179.130.6000111.6G258 S259 I260 V264 R265 Q266G258-D262 PolarHBondContact N-OD2 3.04Å; S259-D262 PolarHBondContact O-N 2.85Å; S259-D262 VanDerWaalsContact OG-CB 3.3Å; S259-D262 WeakPolarHBondContact OG-CB 3.45Å; S259-D262 PolarHBondContact OG-N 3.23Å; S259-D262 VanDerWaalsContact OG-N 3.08Å; I260-D262 VanDerWaalsContact C-N 3.35Å; I260-D262 PolarHBondContact O-N 2.95Å; D262-V264 VanDerWaalsContact C-N 3.34Å; D262-V264 PolarHBondContact O-N 3.47Å; D262-R265 PolarHBondContact O-N 2.83Å; D262-Q266 WeakPolarHBondContact O-CB 3.41Å; D262-Q266 PolarHBondContact O-N 3.44Å; D262-Q266 PolarHBondContact OD1-NE2 3.28Å; D262-Q266 PolarHBondContact OD2-NE2 2.88Å
263C80.4Confident76.3Confident0 Ų074.9 Ų74.90%041%0.405CS..Hα-helixtrans-58.8-44.3172.5-176.70000112.2Y257 S259 I260 S267Y257-C263 HydrophobicContact CD1-CB 3.94Å; Y257-C263 HydrophobicContact CD2-CB 4.32Å; Y257-C263 HydrophobicContact CE1-CB 4.49Å; Y257-C263 HydrophobicContact CG-CB 3.84Å; S259-C263 PolarHBondContact O-N 3.39Å; I260-C263 WeakPolarHBondContact O-CB 3.37Å; I260-C263 PolarHBondContact O-N 3.47Å; C263-S267 WeakPolarHBondContact O-CB 3.44Å; C263-S267 PolarHBondContact O-N 2.91Å; C263-S267 PolarHBondContact O-OG 3.07Å
264V83.2Confident77.2Confident40 Ų4083 Ų8324%0.24242%0.421CS..Hα-helixtrans-63.1-49.7176.6171.50000110.9I242 I260 A261 D262 S267 L268 F276I242-V264 HydrophobicContact CD1-CG2 3.42Å; I242-V264 VanDerWaalsContact CD1-CG2 3.42Å; I242-V264 HydrophobicContact CG1-CG2 3.83Å; I242-V264 HydrophobicContact CG2-CG2 4.27Å; I260-V264 WeakPolarHBondContact O-CG2 3.29Å; I260-V264 PolarHBondContact O-N 3.39Å; A261-V264 PolarHBondContact O-N 3.49Å; D262-V264 VanDerWaalsContact C-N 3.34Å; D262-V264 PolarHBondContact O-N 3.47Å; V264-S267 PolarHBondContact O-N 3.14Å; V264-L268 HydrophobicContact CG1-CD1 3.89Å; V264-L268 WeakPolarHBondContact O-CB 3.45Å; V264-L268 WeakPolarHBondContact O-CG 3.43Å; V264-L268 PolarHBondContact O-N 3.35Å; V264-F276 HydrophobicContact CG1-CZ 4.4Å
265R84.6Confident77.8Confident168 Ų16878.1 Ų78.163%0.63439%0.391SS*.Hα-helixtrans-62.3-48.7-178-173.2176.5-177.2149.10.4111.9A261 D262 S267 L268 Q269A261-R265 WeakPolarHBondContact O-CB 3.24Å; A261-R265 PolarHBondContact O-N 3.38Å; D262-R265 PolarHBondContact O-N 2.83Å; R265-S267 PolarHBondContact O-N 3.38Å; R265-L268 PolarHBondContact O-N 3.08Å; R265-Q269 WeakPolarHBondContact O-CB 3.34Å; R265-Q269 WeakPolarHBondContact O-CG 3.23Å; R265-Q269 PolarHBondContact O-N 2.99Å
266Q82.6Confident78.3Confident37 Ų3775.9 Ų75.917%0.17338%0.378CS..Hα-helixtrans-65.6-37.9178.2-76.4-171.251.200112.5K256 Y257 D262 Q269 K270K256-Q266 PolarHBondContact O-NE2 2.91Å; Y257-Q266 HydrophobicContact CD1-CB 4.42Å; Y257-Q266 HydrophobicContact CE1-CB 3.96Å; D262-Q266 WeakPolarHBondContact O-CB 3.41Å; D262-Q266 PolarHBondContact O-N 3.44Å; D262-Q266 PolarHBondContact OD1-NE2 3.28Å; D262-Q266 PolarHBondContact OD2-NE2 2.88Å; Q266-Q269 PolarHBondContact O-N 3.37Å; Q266-K270 WeakPolarHBondContact O-CB 3.44Å; Q266-K270 WeakPolarHBondContact O-CG 3.24Å; Q266-K270 PolarHBondContact O-N 2.72Å; Q266-K270 VanDerWaalsContact OE1-NZ 3.11Å
267S82.1Confident78.7Confident4 Ų473 Ų733%0.02837%0.373CS..Hα-helixtrans-66.6-40.8177.6-63.10000111.4R245 C263 V264 R265 E271R245-S267 WeakPolarHBondContact CD-OG 3.3Å; R245-S267 PolarHBondContact NH1-OG 3.43Å; R245-S267 VanDerWaalsContact NH1-OG 3.14Å; C263-S267 WeakPolarHBondContact O-CB 3.44Å; C263-S267 PolarHBondContact O-N 2.91Å; C263-S267 PolarHBondContact O-OG 3.07Å; V264-S267 PolarHBondContact O-N 3.14Å; R265-S267 PolarHBondContact O-N 3.38Å; S267-E271 PolarHBondContact O-N 2.92Å
268L84.3Confident78.5Confident52 Ų5275.9 Ų75.927%0.27238%0.384SS..Hα-helixtrans-63.8-43.9173.8-83.8167.8000112.3V264 R265 G272 Y273 F276V264-L268 HydrophobicContact CG1-CD1 3.89Å; V264-L268 WeakPolarHBondContact O-CB 3.45Å; V264-L268 WeakPolarHBondContact O-CG 3.43Å; V264-L268 PolarHBondContact O-N 3.35Å; R265-L268 PolarHBondContact O-N 3.08Å; L268-G272 WeakPolarHBondContact O-CA 3.37Å; L268-G272 PolarHBondContact O-N 3.43Å; L268-Y273 HydrophobicContact CD2-CD1 3.65Å; L268-Y273 HydrophobicContact CD2-CD2 4.46Å; L268-Y273 HydrophobicContact CD2-CE1 3.65Å; L268-Y273 HydrophobicContact CD2-CE2 4.44Å; L268-Y273 HydrophobicContact CD2-CG 4.08Å; L268-F276 HydrophobicContact CD1-CE2 4.47Å; L268-F276 HydrophobicContact CD2-CD2 4.5Å; L268-F276 HydrophobicContact CD2-CE2 3.63Å; L268-F276 HydrophobicContact CD2-CZ 4.48Å; L268-F276 HydrophobicContact CG-CE2 3.84Å; L268-F276 HydrophobicContact CG-CZ 4.22Å
269Q82.4Confident78.6Confident138 Ų13873.2 Ų73.265%0.64536%0.356SS*.Hα-helixtrans-68.6-34.2-179.3-75.5-179.8-20.900113.2R265 Q266R265-Q269 WeakPolarHBondContact O-CB 3.34Å; R265-Q269 WeakPolarHBondContact O-CG 3.23Å; R265-Q269 PolarHBondContact O-N 2.99Å; Q266-Q269 PolarHBondContact O-N 3.37Å
270K80Confident78.7Confident143 Ų14371.9 Ų71.962%0.62234%0.344SS*.Hα-helixtrans-87.8-38.8-177.3-70.6173.1178.2163.90113.7Q266Q266-K270 WeakPolarHBondContact O-CB 3.44Å; Q266-K270 WeakPolarHBondContact O-CG 3.24Å; Q266-K270 PolarHBondContact O-N 2.72Å; Q266-K270 VanDerWaalsContact OE1-NZ 3.11Å
271E75.6Confident78.5Confident49 Ų4973.3 Ų73.323%0.22936%0.356CS..Hα-helixtrans-124.5-6.5-169.9-70.4176.8-11100114V59 R245 S267 V275 R278V59-E271 HydrophobicContact CG1-CG 4.02Å; V59-E271 HydrophobicContact CG2-CG 4.41Å; V59-E271 WeakPolarHBondContact CG2-OE1 3.38Å; V59-E271 WeakPolarHBondContact CG2-OE2 3.5Å; R245-E271 IonicContact CZ-OE1 3.2Å; R245-E271 IonicContact CZ-OE2 3.96Å; R245-E271 IonicContact NH1-OE1 2.76Å; R245-E271 PolarHBondContact NH1-OE1 2.86Å; R245-E271 IonicContact NH2-OE1 2.75Å; R245-E271 PolarHBondContact NH2-OE1 3.4Å; R245-E271 IonicContact NH2-OE2 2.93Å; R245-E271 PolarHBondContact NH2-OE2 2.87Å; S267-E271 PolarHBondContact O-N 2.92Å; E271-V275 HydrophobicContact CB-CB 3.95Å; E271-V275 HydrophobicContact CB-CG2 3.7Å; E271-V275 HydrophobicContact CG-CG2 4.29Å; E271-V275 WeakPolarHBondContact OE2-CG2 3.42Å; E271-R278 IonicContact OE2-NH1 3.25Å
272G82.1Confident77.8Confident24 Ų2469.9 Ų69.925%0.24733%0.327CS..  trans68.5-167.6-179.500000114.4L268 R274 V275L268-G272 WeakPolarHBondContact O-CA 3.37Å; L268-G272 PolarHBondContact O-N 3.43Å; G272-R274 VanDerWaalsContact C-N 3.28Å; G272-R274 PolarHBondContact O-N 2.98Å; G272-V275 WeakPolarHBondContact O-CB 3.33Å; G272-V275 PolarHBondContact O-N 2.96Å
273Y77.3Confident77.3Confident188 Ų18867.4 Ų67.474%0.73731%0.314SS*.G310 helixtrans-69.1-21.6-176.5-67.2-81.5000114.3L268 V275 F276L268-Y273 HydrophobicContact CD2-CD1 3.65Å; L268-Y273 HydrophobicContact CD2-CD2 4.46Å; L268-Y273 HydrophobicContact CD2-CE1 3.65Å; L268-Y273 HydrophobicContact CD2-CE2 4.44Å; L268-Y273 HydrophobicContact CD2-CG 4.08Å; Y273-V275 PolarHBondContact O-N 3.29Å; Y273-V275 VanDerWaalsContact O-N 3.15Å; Y273-F276 PolarHBondContact O-N 3.39Å
274R74.6Confident77Confident217 Ų21769.3 Ų69.382%0.81932%0.324SS*.G310 helixtrans-64.4-17.4177.1-73.2-174.9174.7-164.8-1.1112.9G272 F276 T277 R278G272-R274 VanDerWaalsContact C-N 3.28Å; G272-R274 PolarHBondContact O-N 2.98Å; R274-F276 PolarHBondContact O-N 2.88Å; R274-T277 PolarHBondContact O-N 3.24Å; R274-T277 PolarHBondContact O-OG1 3.29Å; R274-R278 PolarHBondContact O-N 3.18Å
275V75.6Confident76.4Confident4 Ų470.8 Ų70.82%0.02433%0.33CS..G310 helixtrans-63.2-33.5177.197.40000112.2E271 G272 Y273 T277 R278E271-V275 HydrophobicContact CB-CB 3.95Å; E271-V275 HydrophobicContact CB-CG2 3.7Å; E271-V275 HydrophobicContact CG-CG2 4.29Å; E271-V275 WeakPolarHBondContact OE2-CG2 3.42Å; G272-V275 WeakPolarHBondContact O-CB 3.33Å; G272-V275 PolarHBondContact O-N 2.96Å; Y273-V275 PolarHBondContact O-N 3.29Å; Y273-V275 VanDerWaalsContact O-N 3.15Å; V275-T277 VanDerWaalsContact C-N 3.3Å; V275-T277 PolarHBondContact O-N 3.26Å; V275-R278 PolarHBondContact O-N 2.92Å
276F75.8Confident75.7Confident34 Ų3464.7 Ų64.715%0.14931%0.307CS..G310 helixtrans-77.8-12.2-178.6-63.1-72.3000113.4Y237 P238 I242 V264 L268 Y273 R274Y237-F276 WeakPolarHBondContact CD1-O 3.27Å; Y237-F276 WeakPolarHBondContact CE1-O 2.9Å; P238-F276 HydrophobicContact CB-CD1 4.02Å; I242-F276 HydrophobicContact CD1-CE1 4.07Å; I242-F276 HydrophobicContact CG1-CE1 3.97Å; V264-F276 HydrophobicContact CG1-CZ 4.4Å; L268-F276 HydrophobicContact CD1-CE2 4.47Å; L268-F276 HydrophobicContact CD2-CD2 4.5Å; L268-F276 HydrophobicContact CD2-CE2 3.63Å; L268-F276 HydrophobicContact CD2-CZ 4.48Å; L268-F276 HydrophobicContact CG-CE2 3.84Å; L268-F276 HydrophobicContact CG-CZ 4.22Å; Y273-F276 PolarHBondContact O-N 3.39Å; R274-F276 PolarHBondContact O-N 2.88Å
277T75.2Confident74.9Confident86 Ų8663.1 Ų63.153%0.52830%0.3SS..G310 helixtrans-105.9-5.4176.658.80000112.5R274 V275 G279 L280R274-T277 PolarHBondContact O-N 3.24Å; R274-T277 PolarHBondContact O-OG1 3.29Å; V275-T277 VanDerWaalsContact C-N 3.3Å; V275-T277 PolarHBondContact O-N 3.26Å; T277-G279 PolarHBondContact O-N 2.71Å; T277-G279 VanDerWaalsContact O-N 3.09Å; T277-L280 VanDerWaalsContact O-CB 3.31Å; T277-L280 WeakPolarHBondContact O-CB 3.35Å; T277-L280 PolarHBondContact O-N 3.06Å; T277-L280 VanDerWaalsContact O-N 3.15Å
278R69.2Low74.3Confident89 Ų8968.9 Ų68.934%0.33633%0.325SS..THydrogen-bonded Turntrans-71.9103.1-175.2-170176.6177.3170.91.1111.9Y237 E271 R274 V275Y237-R278 PolarHBondContact OH-O 3.47Å; E271-R278 IonicContact OE2-NH1 3.25Å; R274-R278 PolarHBondContact O-N 3.18Å; V275-R278 PolarHBondContact O-N 2.92Å
279G69.3Low73.5Confident16 Ų1668.4 Ų68.417%0.16533%0.325CS..THydrogen-bonded Turntrans105.71.7-179.200000114Y237 T277 T281 S282 T283Y237-G279 WeakPolarHBondContact OH-CA 3.29Å; Y237-G279 PolarHBondContact OH-N 3.47Å; Y237-G279 PolarHBondContact OH-O 2.92Å; T277-G279 PolarHBondContact O-N 2.71Å; T277-G279 VanDerWaalsContact O-N 3.09Å; G279-T281 VanDerWaalsContact C-N 3.3Å; G279-T281 PolarHBondContact O-N 2.99Å; G279-S282 WeakPolarHBondContact O-CB 3.08Å; G279-S282 PolarHBondContact O-N 3.02Å; G279-S282 VanDerWaalsContact O-N 3.16Å; G279-T283 PolarHBondContact O-N 3.35Å; G279-T283 PolarHBondContact O-OG1 3.07Å; G279-T283 VanDerWaalsContact O-OG1 3.06Å
280L75.9Confident72.6Confident31 Ų3162.8 Ų62.816%0.16230%0.3CS..Hα-helixtrans-59.3-44.6179.1177.360.3000110.2L234 Y237 T277 S282 T283 L284L234-L280 HydrophobicContact CD2-CD1 3.98Å; L234-L280 HydrophobicContact CD2-CD2 3.76Å; L234-L280 HydrophobicContact CD2-CG 4.36Å; Y237-L280 HydrophobicContact CD1-CB 4Å; Y237-L280 HydrophobicContact CD1-CD1 3.94Å; Y237-L280 HydrophobicContact CD1-CG 4.41Å; Y237-L280 HydrophobicContact CD2-CD1 3.75Å; Y237-L280 HydrophobicContact CE1-CB 3.67Å; Y237-L280 HydrophobicContact CE1-CD1 4.38Å; Y237-L280 HydrophobicContact CE2-CB 4.3Å; Y237-L280 HydrophobicContact CE2-CD1 4.19Å; Y237-L280 HydrophobicContact CG-CB 4.48Å; Y237-L280 HydrophobicContact CG-CD1 3.65Å; Y237-L280 VanDerWaalsContact CZ-CA 3.46Å; Y237-L280 VanDerWaalsContact CZ-N 3.27Å; Y237-L280 PolarHBondContact OH-N 3.14Å; T277-L280 VanDerWaalsContact O-CB 3.31Å; T277-L280 WeakPolarHBondContact O-CB 3.35Å; T277-L280 PolarHBondContact O-N 3.06Å; T277-L280 VanDerWaalsContact O-N 3.15Å; L280-S282 VanDerWaalsContact C-N 3.29Å; L280-S282 PolarHBondContact O-N 3.18Å; L280-T283 CarbonylContact O-C 3.59Å; L280-T283 WeakPolarHBondContact O-CA 3.4Å; L280-T283 WeakPolarHBondContact O-CB 3.18Å; L280-T283 PolarHBondContact O-N 3.12Å; L280-L284 HydrophobicContact CD1-CD1 4.13Å; L280-L284 HydrophobicContact CD1-CD2 4.29Å; L280-L284 HydrophobicContact CD1-CG 3.95Å; L280-L284 HydrophobicContact CD2-CD1 4.46Å; L280-L284 HydrophobicContact CG-CD1 3.88Å; L280-L284 HydrophobicContact CG-CG 4.15Å; L280-L284 WeakPolarHBondContact O-CG 3.47Å; L280-L284 PolarHBondContact O-N 3.34Å
281T74.2Confident71.9Confident94 Ų9457.7 Ų57.758%0.57728%0.28SS*.Hα-helixtrans-55.3-41.2176.2-470000112.6G279 T283 L285G279-T281 VanDerWaalsContact C-N 3.3Å; G279-T281 PolarHBondContact O-N 2.99Å; T281-T283 VanDerWaalsContact C-N 3.26Å; T281-T283 PolarHBondContact O-N 2.9Å; T281-L285 WeakPolarHBondContact O-CB 3.12Å; T281-L285 PolarHBondContact O-N 2.96Å
282S66.9Low71.3Confident1 Ų157.7 Ų57.71%0.00729%0.288CS..Hα-helixtrans-66.7-30.9176.9-169.80000112.3T67 G279 L280 R286T67-S282 WeakPolarHBondContact CG2-OG 3.49Å; G279-S282 WeakPolarHBondContact O-CB 3.08Å; G279-S282 PolarHBondContact O-N 3.02Å; G279-S282 VanDerWaalsContact O-N 3.16Å; L280-S282 VanDerWaalsContact C-N 3.29Å; L280-S282 PolarHBondContact O-N 3.18Å; S282-R286 WeakPolarHBondContact O-CB 3.45Å; S282-R286 PolarHBondContact O-N 2.59Å
283T71.8Confident70.5Confident0 Ų057.8 Ų57.80%028%0.284CS..Hα-helixtrans-80.1-39.5-178.2-49.30000110.8W233 Y237 G279 L280 T281 R286 A287W233-T283 HydrophobicContact CD2-CG2 3.57Å; W233-T283 HydrophobicContact CE3-CG2 3.37Å; W233-T283 HydrophobicContact CG-CG2 4.14Å; W233-T283 HydrophobicContact CH2-CG2 4.23Å; W233-T283 HydrophobicContact CZ2-CG2 4.41Å; W233-T283 HydrophobicContact CZ3-CG2 3.73Å; Y237-T283 HydrophobicContact CE2-CG2 4.45Å; Y237-T283 WeakPolarHBondContact CE2-OG1 3.39Å; G279-T283 PolarHBondContact O-N 3.35Å; G279-T283 PolarHBondContact O-OG1 3.07Å; G279-T283 VanDerWaalsContact O-OG1 3.06Å; L280-T283 CarbonylContact O-C 3.59Å; L280-T283 WeakPolarHBondContact O-CA 3.4Å; L280-T283 WeakPolarHBondContact O-CB 3.18Å; L280-T283 PolarHBondContact O-N 3.12Å; T281-T283 VanDerWaalsContact C-N 3.26Å; T281-T283 PolarHBondContact O-N 2.9Å; T283-R286 WeakPolarHBondContact O-CB 3.41Å; T283-R286 PolarHBondContact O-N 3.01Å; T283-A287 PolarHBondContact O-N 3.48Å
284L73.5Confident69.8Low41 Ų4150.7 Ų50.722%0.21526%0.26CS..Hα-helixtrans-67.3-41.9173-64.8179.1000111.7I230 L234 L280 R286 A287I230-L284 HydrophobicContact CB-CD2 4.33Å; I230-L284 HydrophobicContact CG1-CD2 4.38Å; I230-L284 HydrophobicContact CG2-CD2 3.76Å; L234-L284 HydrophobicContact CG-CD2 4.47Å; L280-L284 HydrophobicContact CD1-CD1 4.13Å; L280-L284 HydrophobicContact CD1-CD2 4.29Å; L280-L284 HydrophobicContact CD1-CG 3.95Å; L280-L284 HydrophobicContact CD2-CD1 4.46Å; L280-L284 HydrophobicContact CG-CD1 3.88Å; L280-L284 HydrophobicContact CG-CG 4.15Å; L280-L284 WeakPolarHBondContact O-CG 3.47Å; L280-L284 PolarHBondContact O-N 3.34Å; L284-R286 PolarHBondContact O-N 2.97Å; L284-A287 WeakPolarHBondContact O-CB 3.28Å; L284-A287 PolarHBondContact O-N 3.37Å; L284-A287 VanDerWaalsContact O-N 3.08Å
285L72.4Confident69.1Low70 Ų7042.2 Ų42.237%0.36623%0.229SC..Hα-helixtrans-62.7-32175.9-164.678.5000111.8F47 F68 T281 P289F47-L285 HydrophobicContact CD1-CD2 4.45Å; F47-L285 HydrophobicContact CE1-CD2 3.85Å; F47-L285 HydrophobicContact CE1-CG 4.08Å; F68-L285 HydrophobicContact CZ-CD2 4.33Å; T281-L285 WeakPolarHBondContact O-CB 3.12Å; T281-L285 PolarHBondContact O-N 2.96Å; L285-P289 WeakPolarHBondContact O-CD 3.25Å
286R69.9Low68.5Low41 Ų4144.5 Ų44.516%0.15525%0.249CC..Hα-helixtrans-70.1-34.1173.5-173.4-176.392.4102.319112.9F47 D48 S282 T283 L284 F288 P289 V290F47-R286 HydrophobicContact CB-CB 3.64Å; F47-R286 HydrophobicContact CB-CG 3.49Å; F47-R286 VanDerWaalsContact CB-CG 3.49Å; F47-R286 HydrophobicContact CD1-CB 4.29Å; F47-R286 HydrophobicContact CD2-CB 4.39Å; F47-R286 HydrophobicContact CD2-CG 4.11Å; F47-R286 HydrophobicContact CG-CB 3.87Å; F47-R286 HydrophobicContact CG-CG 3.91Å; D48-R286 WeakPolarHBondContact OD1-CD 3.39Å; D48-R286 IonicContact OD1-CZ 3.03Å; D48-R286 IonicContact OD1-NE 3.89Å; D48-R286 IonicContact OD1-NH1 3.26Å; D48-R286 PolarHBondContact OD1-NH1 3.41Å; D48-R286 IonicContact OD2-NH1 2.85Å; S282-R286 WeakPolarHBondContact O-CB 3.45Å; S282-R286 PolarHBondContact O-N 2.59Å; T283-R286 WeakPolarHBondContact O-CB 3.41Å; T283-R286 PolarHBondContact O-N 3.01Å; L284-R286 PolarHBondContact O-N 2.97Å; R286-F288 VanDerWaalsContact C-N 3.3Å; R286-F288 PolarHBondContact O-N 3.38Å; R286-P289 WeakPolarHBondContact O-CD 3.44Å; R286-V290 HydrophobicContact CG-CG2 3.78Å; R286-V290 WeakPolarHBondContact O-CB 2.94Å; R286-V290 VanDerWaalsContact O-CG2 3.29Å; R286-V290 WeakPolarHBondContact O-CG2 3.11Å; R286-V290 PolarHBondContact O-N 2.83Å
287A65.7Low67.8Low3 Ų344 Ų443%0.02525%0.249CC..Hα-helixtrans-60.3-41.8-173.500000111.5T283 L284 N291T283-A287 PolarHBondContact O-N 3.48Å; L284-A287 WeakPolarHBondContact O-CB 3.28Å; L284-A287 PolarHBondContact O-N 3.37Å; L284-A287 VanDerWaalsContact O-N 3.08Å; A287-N291 WeakPolarHBondContact O-CB 3.32Å; A287-N291 PolarHBondContact O-N 3.39Å; A287-N291 PolarHBondContact O-ND2 2.98Å; A287-N291 PolarHBondContact O-OD1 2.85Å
288F68.4Low66.9Low126 Ų12640.7 Ų40.755%0.55323%0.228SC*.Hα-helixtrans-62.4-55.6-179.5-80.1-82.5000113.9I230 R286 V290 N291 A292I230-F288 HydrophobicContact CD1-CE2 3.62Å; I230-F288 HydrophobicContact CD1-CZ 3.66Å; R286-F288 VanDerWaalsContact C-N 3.3Å; R286-F288 PolarHBondContact O-N 3.38Å; F288-V290 PolarHBondContact O-N 3.3Å; F288-N291 PolarHBondContact O-N 3.43Å; F288-A292 WeakPolarHBondContact O-CB 3.42Å; F288-A292 PolarHBondContact O-N 3.23Å
289P68.6Low66.5Low42 Ų4239 Ų3927%0.27323%0.228SC..Hα-helixtrans-61.8-39.5177.9-24.933.8000113.7V43 F47 L285 R286 A292 T293V43-P289 HydrophobicContact CG1-CB 3.72Å; F47-P289 HydrophobicContact CE2-CB 4.07Å; F47-P289 HydrophobicContact CE2-CG 3.81Å; F47-P289 HydrophobicContact CZ-CG 3.82Å; L285-P289 WeakPolarHBondContact O-CD 3.25Å; R286-P289 WeakPolarHBondContact O-CD 3.44Å; P289-A292 PolarHBondContact O-N 3.24Å; P289-T293 WeakPolarHBondContact O-CB 3.49Å; P289-T293 PolarHBondContact O-N 2.9Å; P289-T293 PolarHBondContact O-OG1 3.04Å
290V63.1Low66.1Low20 Ų2043.9 Ų43.912%0.12125%0.25CC..Hα-helixtrans-65.3-47.7179.6172.30000110.2R286 F288 A292 T293 T294R286-V290 HydrophobicContact CG-CG2 3.78Å; R286-V290 WeakPolarHBondContact O-CB 2.94Å; R286-V290 VanDerWaalsContact O-CG2 3.29Å; R286-V290 WeakPolarHBondContact O-CG2 3.11Å; R286-V290 PolarHBondContact O-N 2.83Å; F288-V290 PolarHBondContact O-N 3.3Å; V290-A292 PolarHBondContact O-N 2.9Å; V290-T293 PolarHBondContact O-N 2.92Å; V290-T294 PolarHBondContact O-N 3.18Å; V290-T294 PolarHBondContact O-OG1 2.74Å
291N65.5Low65.5Low36 Ų3644.3 Ų44.319%0.19325%0.25CS..Hα-helixtrans-62.3-45.6177.8-67.7-13.1000111A287 F288 T293 T294 F295A287-N291 WeakPolarHBondContact O-CB 3.32Å; A287-N291 PolarHBondContact O-N 3.39Å; A287-N291 PolarHBondContact O-ND2 2.98Å; A287-N291 PolarHBondContact O-OD1 2.85Å; F288-N291 PolarHBondContact O-N 3.43Å; N291-T293 VanDerWaalsContact C-N 3.29Å; N291-T293 PolarHBondContact O-N 3.13Å; N291-T294 PolarHBondContact O-N 3.44Å; N291-F295 WeakPolarHBondContact O-CD2 3.31Å; N291-F295 PolarHBondContact O-N 2.96Å
292A62.6Low64.8Low49 Ų4944 Ų4441%0.40524%0.244SC..Hα-helixtrans-57.9-41176.700000112.7F288 P289 V290 F295 A296F288-A292 WeakPolarHBondContact O-CB 3.42Å; F288-A292 PolarHBondContact O-N 3.23Å; P289-A292 PolarHBondContact O-N 3.24Å; V290-A292 PolarHBondContact O-N 2.9Å; A292-F295 PolarHBondContact O-N 2.96Å; A292-A296 WeakPolarHBondContact O-CB 3.43Å; A292-A296 PolarHBondContact O-N 3Å
293T65.6Low64.5Low25 Ų2549.8 Ų49.815%0.15327%0.273CS..Hα-helixtrans-68.5-42.4178.1-55.40000111.8A39 V43 P289 V290 N291 F295 A296 T297A39-T293 HydrophobicContact CB-CG2 3.89Å; V43-T293 HydrophobicContact CB-CG2 4.15Å; V43-T293 WeakPolarHBondContact CB-OG1 3.45Å; V43-T293 WeakPolarHBondContact CG1-OG1 3.44Å; V43-T293 HydrophobicContact CG2-CG2 3.69Å; V43-T293 WeakPolarHBondContact CG2-OG1 3.24Å; P289-T293 WeakPolarHBondContact O-CB 3.49Å; P289-T293 PolarHBondContact O-N 2.9Å; P289-T293 PolarHBondContact O-OG1 3.04Å; V290-T293 PolarHBondContact O-N 2.92Å; N291-T293 VanDerWaalsContact C-N 3.29Å; N291-T293 PolarHBondContact O-N 3.13Å; T293-F295 VanDerWaalsContact C-N 3.33Å; T293-F295 PolarHBondContact O-N 3.3Å; T293-A296 PolarHBondContact O-N 2.87Å; T293-T297 WeakPolarHBondContact O-CB 3.45Å; T293-T297 PolarHBondContact O-N 3.47Å; T293-T297 PolarHBondContact O-OG1 2.97Å
294T61.8Low64.2Low39 Ų3956.4 Ų56.424%0.23930%0.299CS..Hα-helixtrans-57.3-48.7175.2-670000110.6F3 T36 V290 N291 T297 V298F3-T294 HydrophobicContact CE2-CG2 3.86Å; T36-T294 HydrophobicContact CG2-CG2 4.21Å; V290-T294 PolarHBondContact O-N 3.18Å; V290-T294 PolarHBondContact O-OG1 2.74Å; N291-T294 PolarHBondContact O-N 3.44Å; T294-T297 PolarHBondContact O-N 3.31Å; T294-V298 VanDerWaalsContact O-CG2 3.3Å; T294-V298 WeakPolarHBondContact O-CG2 3.41Å; T294-V298 PolarHBondContact O-N 3.01Å
295F61.1Low63.6Low39 Ų3955.9 Ų55.917%0.17130%0.296CS..Hα-helixtrans-64.1-46.6177.4-77.7-68.6000112.9L222 N291 A292 T293 T297 V298 T299L222-F295 HydrophobicContact CB-CD2 4.44Å; L222-F295 HydrophobicContact CB-CE2 4.48Å; L222-F295 HydrophobicContact CD1-CB 3.92Å; L222-F295 HydrophobicContact CD1-CD2 3.86Å; L222-F295 HydrophobicContact CD1-CG 3.97Å; L222-F295 HydrophobicContact CG-CD2 3.88Å; L222-F295 HydrophobicContact CG-CE2 4.22Å; L222-F295 HydrophobicContact CG-CG 4.38Å; N291-F295 WeakPolarHBondContact O-CD2 3.31Å; N291-F295 PolarHBondContact O-N 2.96Å; A292-F295 PolarHBondContact O-N 2.96Å; T293-F295 VanDerWaalsContact C-N 3.33Å; T293-F295 PolarHBondContact O-N 3.3Å; F295-T297 PolarHBondContact O-N 3.03Å; F295-V298 PolarHBondContact O-N 3.2Å; F295-T299 WeakPolarHBondContact O-CB 3.37Å; F295-T299 PolarHBondContact O-N 3.43Å; F295-T299 PolarHBondContact O-OG1 3.44Å; F295-T299 VanDerWaalsContact O-OG1 3.06Å
296A61.7Low63Low52 Ų5260.6 Ų60.643%0.4331%0.308SS..Hα-helixtrans-57-41.3177.200000111.8A292 T293 L300A292-A296 WeakPolarHBondContact O-CB 3.43Å; A292-A296 PolarHBondContact O-N 3Å; T293-A296 PolarHBondContact O-N 2.87Å; A296-L300 WeakPolarHBondContact O-CB 3.24Å; A296-L300 VanDerWaalsContact O-CG 3.24Å; A296-L300 WeakPolarHBondContact O-CG 3.41Å; A296-L300 PolarHBondContact O-N 3.19Å
297T61Low62.3Low24 Ų2467.6 Ų67.615%0.14734%0.335CS..Hα-helixtrans-69.4-42.7179.7-46.20000111.7T36 A39 T293 T294 F295 L300 F301T36-T297 HydrophobicContact CG2-CG2 4.08Å; T36-T297 WeakPolarHBondContact OG1-CG2 3.5Å; A39-T297 HydrophobicContact CB-CG2 4.33Å; A39-T297 WeakPolarHBondContact CB-OG1 3.43Å; T293-T297 WeakPolarHBondContact O-CB 3.45Å; T293-T297 PolarHBondContact O-N 3.47Å; T293-T297 PolarHBondContact O-OG1 2.97Å; T294-T297 PolarHBondContact O-N 3.31Å; F295-T297 PolarHBondContact O-N 3.03Å; T297-L300 PolarHBondContact O-N 3.14Å; T297-F301 VanDerWaalsContact O-CB 3.25Å; T297-F301 WeakPolarHBondContact O-CB 3.49Å; T297-F301 PolarHBondContact O-N 3.29Å
298V56.9Low62Low17 Ų1771.2 Ų71.210%0.10335%0.351CS..Hα-helixtrans-60.9-47.3175.3171.30000110.8F3 M10 T294 F295 F301 L302F3-V298 HydrophobicContact CE1-CG2 4.1Å; F3-V298 HydrophobicContact CE2-CG2 4.37Å; F3-V298 HydrophobicContact CZ-CG2 3.46Å; F3-V298 VanDerWaalsContact CZ-CG2 3.46Å; M10-V298 HydrophobicContact CE-CG1 4.01Å; M10-V298 HydrophobicContact SD-CG1 4.01Å; T294-V298 VanDerWaalsContact O-CG2 3.3Å; T294-V298 WeakPolarHBondContact O-CG2 3.41Å; T294-V298 PolarHBondContact O-N 3.01Å; F295-V298 PolarHBondContact O-N 3.2Å; V298-F301 PolarHBondContact O-N 3Å; V298-L302 HydrophobicContact CG1-CD1 3.8Å; V298-L302 HydrophobicContact CG1-CG 4.25Å; V298-L302 WeakPolarHBondContact O-CB 3.46Å; V298-L302 VanDerWaalsContact O-CG 3.32Å; V298-L302 WeakPolarHBondContact O-CG 3.23Å; V298-L302 PolarHBondContact O-N 3.41Å
299T60.3Low61.4Low52 Ų5271 Ų7132%0.31935%0.352SS..Hα-helixtrans-61.4-48179.4-58.90000111.4F295 F301 L302 M303F295-T299 WeakPolarHBondContact O-CB 3.37Å; F295-T299 PolarHBondContact O-N 3.43Å; F295-T299 PolarHBondContact O-OG1 3.44Å; F295-T299 VanDerWaalsContact O-OG1 3.06Å; T299-F301 VanDerWaalsContact C-N 3.27Å; T299-F301 PolarHBondContact O-N 2.9Å; T299-L302 PolarHBondContact O-N 2.95Å; T299-M303 HydrophobicContact CG2-CG 4.44Å; T299-M303 HydrophobicContact CG2-SD 4.05Å; T299-M303 WeakPolarHBondContact O-CB 3.44Å; T299-M303 VanDerWaalsContact O-CG 3.23Å; T299-M303 WeakPolarHBondContact O-CG 3.36Å; T299-M303 PolarHBondContact O-N 2.95Å
300L61.9Low60.5Low120 Ų12074.5 Ų74.563%0.62837%0.365SS*.Hα-helixtrans-61.3-38.3177.1-73.4172.1000111.9A296 T297 Y304A296-L300 WeakPolarHBondContact O-CB 3.24Å; A296-L300 VanDerWaalsContact O-CG 3.24Å; A296-L300 WeakPolarHBondContact O-CG 3.41Å; A296-L300 PolarHBondContact O-N 3.19Å; T297-L300 PolarHBondContact O-N 3.14Å; L300-Y304 WeakPolarHBondContact O-CB 3.39Å; L300-Y304 PolarHBondContact O-N 2.89Å
301F62.8Low59.4Low40 Ų4077.4 Ų77.418%0.17539%0.385CS..Hα-helixtrans-67.1-45.2176.9-177.6-93.5000112.3K28 S32 T297 V298 T299 M303 Y304 M305K28-F301 WeakPolarHBondContact O-CZ 3.18Å; S32-F301 VanDerWaalsContact CB-CE1 3.41Å; S32-F301 VanDerWaalsContact CB-CE2 3.5Å; S32-F301 WeakPolarHBondContact OG-CD1 3.3Å; S32-F301 WeakPolarHBondContact OG-CD2 3.46Å; S32-F301 WeakPolarHBondContact OG-CE1 3.04Å; S32-F301 WeakPolarHBondContact OG-CG 3.34Å; S32-F301 WeakPolarHBondContact OG-CZ 2.93Å; T297-F301 VanDerWaalsContact O-CB 3.25Å; T297-F301 WeakPolarHBondContact O-CB 3.49Å; T297-F301 PolarHBondContact O-N 3.29Å; V298-F301 PolarHBondContact O-N 3Å; T299-F301 VanDerWaalsContact C-N 3.27Å; T299-F301 PolarHBondContact O-N 2.9Å; F301-M303 VanDerWaalsContact C-N 3.34Å; F301-M303 PolarHBondContact O-N 3.31Å; F301-Y304 WeakPolarHBondContact O-CB 3.37Å; F301-Y304 PolarHBondContact O-N 3.37Å; F301-M305 HydrophobicContact CD1-CG 4.02Å; F301-M305 HydrophobicContact CE1-CG 3.47Å; F301-M305 VanDerWaalsContact CE1-CG 3.47Å; F301-M305 HydrophobicContact CE1-SD 4.25Å; F301-M305 HydrophobicContact CE2-CG 4.35Å; F301-M305 HydrophobicContact CZ-CG 3.64Å; F301-M305 HydrophobicContact CZ-SD 3.91Å; F301-M305 WeakPolarHBondContact O-CG 3.42Å; F301-M305 PolarHBondContact O-N 3.49Å
302L58.8Low58.2Low87 Ų8777.4 Ų77.446%0.45539%0.394SS..Hα-helixtrans-64-39.7176.8-69.7174000111.5V298 T299 Y304 M305 R306V298-L302 HydrophobicContact CG1-CD1 3.8Å; V298-L302 HydrophobicContact CG1-CG 4.25Å; V298-L302 WeakPolarHBondContact O-CB 3.46Å; V298-L302 VanDerWaalsContact O-CG 3.32Å; V298-L302 WeakPolarHBondContact O-CG 3.23Å; V298-L302 PolarHBondContact O-N 3.41Å; T299-L302 PolarHBondContact O-N 2.95Å; L302-Y304 VanDerWaalsContact C-N 3.33Å; L302-M305 PolarHBondContact O-N 3.36Å; L302-R306 WeakPolarHBondContact O-CG 3.46Å; L302-R306 PolarHBondContact O-N 3.21Å
303M62.1Low57.3Low122 Ų12281.6 Ų81.660%0.60141%0.406SS*.Hα-helixtrans-63.2-39.6173.4-70178.98700111.9T299 F301 R307T299-M303 HydrophobicContact CG2-CG 4.44Å; T299-M303 HydrophobicContact CG2-SD 4.05Å; T299-M303 WeakPolarHBondContact O-CB 3.44Å; T299-M303 VanDerWaalsContact O-CG 3.23Å; T299-M303 WeakPolarHBondContact O-CG 3.36Å; T299-M303 PolarHBondContact O-N 2.95Å; F301-M303 VanDerWaalsContact C-N 3.34Å; F301-M303 PolarHBondContact O-N 3.31Å; M303-R307 WeakPolarHBondContact O-CB 3.41Å; M303-R307 PolarHBondContact O-N 3.04Å; M303-R307 VanDerWaalsContact O-N 3.16Å
304Y64.4Low56.1Low139 Ų13987.5 Ų87.555%0.54543%0.433SS..Hα-helixtrans-65.4-42.9175.6-176.9-97.6000112.1L300 F301 L302 R307 E308L300-Y304 WeakPolarHBondContact O-CB 3.39Å; L300-Y304 PolarHBondContact O-N 2.89Å; F301-Y304 WeakPolarHBondContact O-CB 3.37Å; F301-Y304 PolarHBondContact O-N 3.37Å; L302-Y304 VanDerWaalsContact C-N 3.33Å; Y304-R307 WeakPolarHBondContact O-CB 3.35Å; Y304-R307 PolarHBondContact O-N 3.48Å; Y304-E308 HydrophobicContact CE1-CG 4.35Å; Y304-E308 PolarHBondContact O-N 2.67Å; Y304-E308 VanDerWaalsContact O-N 3.14Å
305M61.2Low55.1Low31 Ų3192.2 Ų92.215%0.15346%0.456CS..Hα-helixtrans-64.4-45.2177.3-77.2-69.7-56.100112.7K28 F301 L302 R307 E308 E309K28-M305 HydrophobicContact CB-CE 4.5Å; K28-M305 HydrophobicContact CB-SD 4.33Å; K28-M305 HydrophobicContact CD-CE 3.81Å; K28-M305 HydrophobicContact CD-SD 3.89Å; K28-M305 HydrophobicContact CG-SD 4.39Å; F301-M305 HydrophobicContact CD1-CG 4.02Å; F301-M305 HydrophobicContact CE1-CG 3.47Å; F301-M305 VanDerWaalsContact CE1-CG 3.47Å; F301-M305 HydrophobicContact CE1-SD 4.25Å; F301-M305 HydrophobicContact CE2-CG 4.35Å; F301-M305 HydrophobicContact CZ-CG 3.64Å; F301-M305 HydrophobicContact CZ-SD 3.91Å; F301-M305 WeakPolarHBondContact O-CG 3.42Å; F301-M305 PolarHBondContact O-N 3.49Å; L302-M305 PolarHBondContact O-N 3.36Å; M305-R307 PolarHBondContact O-N 3.1Å; M305-E308 PolarHBondContact O-N 3.34Å; M305-E308 VanDerWaalsContact O-N 3.1Å; M305-E309 PolarHBondContact O-N 3.29Å; M305-E309 VanDerWaalsContact O-N 3.08Å
306R58.8Low54.2Low168 Ų16895.7 Ų95.763%0.63448%0.481SS*.Hα-helixtrans-59-38.2175.1-73.7179.670.61433.9111.8L302 E308 E309 E310L302-R306 WeakPolarHBondContact O-CG 3.46Å; L302-R306 PolarHBondContact O-N 3.21Å; R306-E308 VanDerWaalsContact C-N 3.34Å; R306-E308 PolarHBondContact O-N 3.16Å; R306-E309 PolarHBondContact O-N 3.08Å; R306-E310 WeakPolarHBondContact O-CG 3.48Å; R306-E310 PolarHBondContact O-N 3.32Å
307R56.9Low52.9Low189 Ų189100.6 Ų100.671%0.71350%0.495SS*.Hα-helixtrans-66.8-32.3176.6-168175.6178.5165.10.9112.9M303 Y304 M305 C311M303-R307 WeakPolarHBondContact O-CB 3.41Å; M303-R307 PolarHBondContact O-N 3.04Å; M303-R307 VanDerWaalsContact O-N 3.16Å; Y304-R307 WeakPolarHBondContact O-CB 3.35Å; Y304-R307 PolarHBondContact O-N 3.48Å; M305-R307 PolarHBondContact O-N 3.1Å; R307-C311 WeakPolarHBondContact O-CB 3.4Å; R307-C311 PolarHBondContact O-N 3.23Å
308E58.6Low51.8Low78 Ų78104.6 Ų104.636%0.36452%0.521SS..Hα-helixtrans-72.3-37.2172.3-76.2-153.3152.700112.7K28 Y304 M305 R306 C311 G312K28-E308 WeakPolarHBondContact CE-OE2 3.47Å; K28-E308 IonicContact NZ-OE2 2.67Å; K28-E308 PolarHBondContact NZ-OE2 3.33Å; Y304-E308 HydrophobicContact CE1-CG 4.35Å; Y304-E308 PolarHBondContact O-N 2.67Å; Y304-E308 VanDerWaalsContact O-N 3.14Å; M305-E308 PolarHBondContact O-N 3.34Å; M305-E308 VanDerWaalsContact O-N 3.1Å; R306-E308 VanDerWaalsContact C-N 3.34Å; R306-E308 PolarHBondContact O-N 3.16Å; E308-C311 PolarHBondContact O-N 3.14Å; E308-G312 PolarHBondContact O-N 3.14Å
309E56Low50.9Low121 Ų121109.6 Ų109.657%0.56555%0.554SS**Hα-helixtrans-65.7-40.7177.1-71.8175.9171.900111.8M305 R306 G312 M313M305-E309 PolarHBondContact O-N 3.29Å; M305-E309 VanDerWaalsContact O-N 3.08Å; R306-E309 PolarHBondContact O-N 3.08Å; E309-G312 PolarHBondContact O-N 2.91Å; E309-M313 PolarHBondContact O-N 3.37Å; E309-M313 VanDerWaalsContact O-N 3.14Å
310E48.6Very low49.8Very low117 Ų117111.7 Ų111.755%0.54758%0.577SS.*Hα-helixtrans-63.3-41173.5-72.7169.6-176.400112R306 Q314R306-E310 WeakPolarHBondContact O-CG 3.48Å; R306-E310 PolarHBondContact O-N 3.32Å; E310-Q314 PolarHBondContact O-N 3.38Å
311C41.5Very low48.7Very low80 Ų80112.2 Ų112.254%0.54158%0.584SS.*Hα-helixtrans-72.2-28.8178-151.40000112.5R307 E308 N315R307-C311 WeakPolarHBondContact O-CB 3.4Å; R307-C311 PolarHBondContact O-N 3.23Å; E308-C311 PolarHBondContact O-N 3.14Å; C311-N315 PolarHBondContact O-ND2 3.47Å
312G40.5Very low47.4Very low37 Ų37119.1 Ų119.138%0.38162%0.617SS.*Hα-helixtrans-71.1-40.3175.200000113.2E308 E309 Q314 N315 T316E308-G312 PolarHBondContact O-N 3.14Å; E309-G312 PolarHBondContact O-N 2.91Å; G312-Q314 VanDerWaalsContact C-N 3.35Å; G312-Q314 PolarHBondContact O-N 2.99Å; G312-N315 PolarHBondContact O-N 3.15Å; G312-T316 PolarHBondContact O-OG1 3.45Å
313M43.3Very low46.5Very low136 Ų136123 Ų12367%0.6764%0.638SS**Hα-helixtrans-65.9-35.8177.4-78.3-165.5-7500112.6E309 N315 T316E309-M313 PolarHBondContact O-N 3.37Å; E309-M313 VanDerWaalsContact O-N 3.14Å; M313-N315 PolarHBondContact O-N 3.26Å; M313-T316 PolarHBondContact O-N 2.81Å; M313-T316 VanDerWaalsContact O-N 3.15Å
314Q40.6Very low45.2Very low150 Ų150125.8 Ų125.870%0.70165%0.649SS**Hα-helixtrans-69.5-18.7-179.5-160.2131.43600114.2E310 G312E310-Q314 PolarHBondContact O-N 3.38Å; G312-Q314 VanDerWaalsContact C-N 3.35Å; G312-Q314 PolarHBondContact O-N 2.99Å
315N40.7Very low43.9Very low138 Ų138125 Ų12574%0.73866%0.661SS**THydrogen-bonded Turntrans-90.1-0.6175.9-72.3-63.8000113.5C311 G312 M313C311-N315 PolarHBondContact O-ND2 3.47Å; G312-N315 PolarHBondContact O-N 3.15Å; M313-N315 PolarHBondContact O-N 3.26Å
316T41.8Very low42.7Very low111 Ų111132.1 Ų132.168%0.68169%0.694SS**SBendtrans-110.5-2.6-175.8-29.90000113.3G312 M313 P318G312-T316 PolarHBondContact O-OG1 3.45Å; M313-T316 PolarHBondContact O-N 2.81Å; M313-T316 VanDerWaalsContact O-N 3.15Å; T316-P318 VanDerWaalsContact O-CD 3.28Å; T316-P318 WeakPolarHBondContact O-CD 3.28Å
317E33.2Very low41.7Very low155 Ų155129.5 Ų129.572%0.72470%0.699SS**  trans-78.3115.4168.3-80.6-176107.200109.8
318P39.3Very low40.8Very low109 Ų109127.7 Ų127.771%0.70871%0.709SS**PPolyproline II helixtrans-66.1146.9168.628-31.6000109.5T316 A320T316-P318 VanDerWaalsContact O-CD 3.28Å; T316-P318 WeakPolarHBondContact O-CD 3.28Å; P318-A320 PolarHBondContact O-N 3.32Å
319P37.3Very low39.8Very low122 Ų122129.3 Ų129.379%0.79273%0.729SS**PPolyproline II helixtrans-59.1132-177.723.7-32.1000110.5V321P319-V321 PolarHBondContact O-N 3.18Å
320A37.3Very low38.8Very low96 Ų96136.3 Ų136.379%0.79377%0.765SS**PPolyproline II helixtrans-49.9121.6176.900000110.7P318 Q322P318-A320 PolarHBondContact O-N 3.32Å; A320-Q322 PolarHBondContact O-N 3.15Å
321V39.6Very low38.3Very low130 Ų130137.3 Ų137.379%0.78878%0.776SS**  trans-61.9109.4170.8174.50000107.5P319 L323P319-V321 PolarHBondContact O-N 3.18Å; V321-L323 PolarHBondContact O-N 3.05Å; V321-L323 VanDerWaalsContact O-N 3.15Å
322Q34.9Very low38.2Very low186 Ų186140.3 Ų140.387%0.86979%0.788SS**  trans-64.3110.2168.9-71.6-170.2-21.400108.6A320 Q324A320-Q322 PolarHBondContact O-N 3.15Å; Q322-Q324 PolarHBondContact O-N 3.27Å
323L39.7Very low38Very low168 Ų168146 Ų14688%0.8881%0.811SS**  trans-69.1113164.1-95.3106.9000108.8V321V321-L323 PolarHBondContact O-N 3.05Å; V321-L323 VanDerWaalsContact O-N 3.15Å
324Q35.4Very low37.7Very low180 Ų180146.6 Ų146.684%0.84182%0.819SS**PPolyproline II helixtrans-64.1137.6167.2-114.8169-40.400110.2Q322 Q326Q322-Q324 PolarHBondContact O-N 3.27Å; Q324-Q326 PolarHBondContact O-N 3.49Å
325P37.6Very low37.5Very low123 Ų123146.4 Ų146.480%0.79983%0.826SS**PPolyproline II helixtrans-70.3129.7173.5-7.221.7000110.4
326Q35.1Very low37.3Very low181 Ų181146.9 Ų146.985%0.84683%0.832SS**PPolyproline II helixtrans-68.2146.7167-91.6-150.815.600111.2Q324Q324-Q326 PolarHBondContact O-N 3.49Å
327P37.6Very low37Very low113 Ų113149.5 Ų149.573%0.73484%0.843SS**PPolyproline II helixtrans-76.1124.9177.729.8-30.8000111.2S329P327-S329 PolarHBondContact O-N 3.33Å
328T38Very low37.3Very low150 Ų150149.1 Ų149.192%0.9285%0.852SS**PPolyproline II helixtrans-66.8118.1169.3-3.30000109.4
329S37.8Very low37.1Very low113 Ų113152.4 Ų152.479%0.7986%0.864SS**  trans-97.6107.2164.739.10000108.5P327P327-S329 PolarHBondContact O-N 3.33Å
330M35.1Very low37.1Very low267 Ų267155.2 Ų155.2100%1.31587%0.87SS**  trans1730139.1-93.3-167.7-162.600108.9

Retrieved 330 of 330 residues in 128.4 ms (Link to these results)