A0A5K4FB96_SCHMA Loading...

Cx9C motif-containing protein 4

AlphaFold DB , UniProt , Accession A0A5K4FB96, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 65 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
1M64.2Low92.7Very high202 Ų20279.4 Ų79.4100%0.99542%0.421SS*.  0105.20-63.9-51.6-167.400109.2L3M1-L3 PolarHBondContact O-N 3.46Å
2D86.2Confident93.1Very high153 Ų15374.6 Ų74.682%0.81840%0.395SS*.  trans-96.675.2176.8-169.121.6000109
3L94.4Very high93.4Very high47 Ų4777.6 Ų77.625%0.24641%0.406CS..  trans-82.1132.3177.2-63.9177000108.6M1 C5 K6 Q45M1-L3 PolarHBondContact O-N 3.46Å; L3-C5 PolarHBondContact O-N 3.13Å; L3-K6 HydrophobicContact CB-CB 4.15Å; L3-K6 VanDerWaalsContact O-CB 3.31Å; L3-K6 WeakPolarHBondContact O-CB 3.39Å; L3-K6 PolarHBondContact O-N 2.85Å; L3-Q45 HydrophobicContact CB-CG 4.33Å; L3-Q45 HydrophobicContact CD1-CB 4.45Å; L3-Q45 HydrophobicContact CD1-CG 4.48Å; L3-Q45 HydrophobicContact CD2-CG 4.32Å
4P96.2Very high93.8Very high42 Ų4275.9 Ų75.927%0.27340%0.404SS..THydrogen-bonded Turntrans-60.1-30.5-16721-32.8000113.9F40 I43P4-F40 HydrophobicContact CB-CD1 4.17Å; P4-F40 HydrophobicContact CB-CD2 3.74Å; P4-F40 HydrophobicContact CB-CE1 4.15Å; P4-F40 HydrophobicContact CB-CE2 3.72Å; P4-F40 HydrophobicContact CB-CG 3.97Å; P4-F40 HydrophobicContact CB-CZ 3.92Å; P4-F40 HydrophobicContact CG-CB 3.99Å; P4-F40 HydrophobicContact CG-CD1 3.94Å; P4-F40 HydrophobicContact CG-CD2 3.92Å; P4-F40 HydrophobicContact CG-CE1 4.38Å; P4-F40 HydrophobicContact CG-CE2 4.37Å; P4-F40 HydrophobicContact CG-CG 3.68Å; P4-I43 HydrophobicContact CG-CD1 4.2Å
5C96.8Very high94.1Very high0 Ų071 Ų710%038%0.378CS..THydrogen-bonded Turntrans-98.1-3.5-179.2-47.60000114.1L3 L8 A9 L33 C36 Q45L3-C5 PolarHBondContact O-N 3.13Å; C5-L8 PolarHBondContact O-N 3.33Å; C5-L8 VanDerWaalsContact O-N 3.15Å; C5-A9 PolarHBondContact O-N 3.35Å; C5-A9 VanDerWaalsContact O-N 3.07Å; C5-L33 HydrophobicContact CB-CD1 3.75Å; C5-C36 WeakPolarHBondContact CA-SG 3.43Å; C5-C36 HydrophobicContact CB-CB 3.89Å; C5-C36 WeakPolarHBondContact CB-SG 3.12Å; C5-C36 WeakPolarHBondContact SG-CB 3.31Å; C5-C36 CovalentContact SG-SG 2.04Å; C5-C36 PolarHBondContact SG-SG 3.07Å; C5-Q45 PolarHBondContact SG-NE2 2.9Å; C5-Q45 VanDerWaalsContact SG-NE2 3.43Å; C5-Q45 PolarHBondContact SG-OE1 3Å; C5-Q45 VanDerWaalsContact SG-OE1 3.39Å
6K95.6Very high94.4Very high112 Ų11268.3 Ų68.349%0.48736%0.363SS..Hα-helixtrans-57.2-44.1176.8177.5-175.9178.1-171.90112.4L3 L8 A9 C10L3-K6 HydrophobicContact CB-CB 4.15Å; L3-K6 VanDerWaalsContact O-CB 3.31Å; L3-K6 WeakPolarHBondContact O-CB 3.39Å; L3-K6 PolarHBondContact O-N 2.85Å; K6-L8 PolarHBondContact O-N 2.78Å; K6-A9 PolarHBondContact O-N 2.88Å; K6-C10 PolarHBondContact O-N 3.31Å; K6-C10 PolarHBondContact O-SG 2.93Å; K6-C10 VanDerWaalsContact O-SG 3.41Å
7P97.3Very high94.6Very high69 Ų6970.9 Ų70.945%0.44838%0.376SS..Hα-helixtrans-59.8-33.6178-24.835.5000113.2C10 K11P7-C10 PolarHBondContact O-N 3.36Å; P7-K11 WeakPolarHBondContact O-CG 3.21Å; P7-K11 PolarHBondContact O-N 3.18Å; P7-K11 VanDerWaalsContact O-N 3.1Å
8L97.6Very high94.8Very high36 Ų3676.1 Ų76.119%0.18839%0.39CS..Hα-helixtrans-73.8-40.8178.8-60.9174.6000111.6C5 K6 C10 K11 I12 S32 L33 C36C5-L8 PolarHBondContact O-N 3.33Å; C5-L8 VanDerWaalsContact O-N 3.15Å; K6-L8 PolarHBondContact O-N 2.78Å; L8-C10 VanDerWaalsContact C-N 3.28Å; L8-C10 PolarHBondContact O-N 3.38Å; L8-K11 HydrophobicContact CD2-CD 4.2Å; L8-K11 WeakPolarHBondContact O-CB 3.28Å; L8-K11 PolarHBondContact O-N 2.89Å; L8-I12 PolarHBondContact O-N 3.2Å; L8-I12 VanDerWaalsContact O-N 3.14Å; L8-S32 WeakPolarHBondContact CD1-O 3.43Å; L8-L33 HydrophobicContact CB-CB 4.37Å; L8-L33 HydrophobicContact CB-CD1 4.13Å; L8-C36 HydrophobicContact CD1-CB 3.34Å
9A96.2Very high95Very high25 Ų2574.2 Ų74.221%0.20738%0.38CS..Hα-helixtrans-58.8-40.917200000111.7C5 K6 K11 I12 Q13 L33 C47C5-A9 PolarHBondContact O-N 3.35Å; C5-A9 VanDerWaalsContact O-N 3.07Å; K6-A9 PolarHBondContact O-N 2.88Å; A9-K11 VanDerWaalsContact C-N 3.34Å; A9-K11 PolarHBondContact O-N 3.38Å; A9-I12 PolarHBondContact O-N 3.13Å; A9-Q13 PolarHBondContact O-N 3.04Å; A9-L33 HydrophobicContact CB-CD1 4.47Å; A9-L33 HydrophobicContact CB-CD2 4.48Å; A9-C47 HydrophobicContact CB-CB 3.95Å
10C97.3Very high95.2Very high65 Ų6578 Ų7844%0.43940%0.401SS..Hα-helixtrans-63.4-36.8173.8-67.10000112.7K6 P7 L8 I12 Q13 S14K6-C10 PolarHBondContact O-N 3.31Å; K6-C10 PolarHBondContact O-SG 2.93Å; K6-C10 VanDerWaalsContact O-SG 3.41Å; P7-C10 PolarHBondContact O-N 3.36Å; L8-C10 VanDerWaalsContact C-N 3.28Å; L8-C10 PolarHBondContact O-N 3.38Å; C10-I12 VanDerWaalsContact C-N 3.31Å; C10-I12 PolarHBondContact O-N 3.03Å; C10-Q13 WeakPolarHBondContact O-CB 3.28Å; C10-Q13 PolarHBondContact O-N 3.47Å; C10-S14 PolarHBondContact O-N 2.88Å; C10-S14 PolarHBondContact O-OG 3.02Å
11K97.9Very high95.3Very high122 Ų12281.5 Ų81.553%0.5341%0.414SS..Hα-helixtrans-62.9-36.3175.3-73.7177.8-175.7-178.60112.5P7 L8 A9 S14 C15 E29P7-K11 WeakPolarHBondContact O-CG 3.21Å; P7-K11 PolarHBondContact O-N 3.18Å; P7-K11 VanDerWaalsContact O-N 3.1Å; L8-K11 HydrophobicContact CD2-CD 4.2Å; L8-K11 WeakPolarHBondContact O-CB 3.28Å; L8-K11 PolarHBondContact O-N 2.89Å; A9-K11 VanDerWaalsContact C-N 3.34Å; A9-K11 PolarHBondContact O-N 3.38Å; K11-S14 PolarHBondContact O-N 3.17Å; K11-C15 WeakPolarHBondContact O-CB 3.42Å; K11-C15 PolarHBondContact O-N 3.39Å; K11-E29 HydrophobicContact CB-CG 4.26Å
12I97.7Very high96.9Very high22 Ų2274.3 Ų74.311%0.11338%0.38CS..Hα-helixtrans-62.1-46.6174.1-64.5171.4000110.1L8 A9 C10 S14 C15 L16 E29 I30 L33L8-I12 PolarHBondContact O-N 3.2Å; L8-I12 VanDerWaalsContact O-N 3.14Å; A9-I12 PolarHBondContact O-N 3.13Å; C10-I12 VanDerWaalsContact C-N 3.31Å; C10-I12 PolarHBondContact O-N 3.03Å; I12-S14 VanDerWaalsContact C-N 3.33Å; I12-S14 PolarHBondContact O-N 2.92Å; I12-C15 WeakPolarHBondContact O-CA 3.3Å; I12-C15 WeakPolarHBondContact O-CB 3.39Å; I12-C15 PolarHBondContact O-N 3.31Å; I12-L16 HydrophobicContact CG2-CD1 4.09Å; I12-L16 HydrophobicContact CG2-CG 4.33Å; I12-L16 WeakPolarHBondContact O-CG 3.33Å; I12-L16 PolarHBondContact O-N 3.06Å; I12-E29 HydrophobicContact CG1-CB 3.7Å; I12-I30 HydrophobicContact CD1-CG1 4.1Å; I12-I30 HydrophobicContact CG1-CG1 4.44Å; I12-L33 HydrophobicContact CD1-CB 3.89Å; I12-L33 HydrophobicContact CD1-CD2 3.48Å; I12-L33 VanDerWaalsContact CD1-CD2 3.48Å; I12-L33 HydrophobicContact CD1-CG 4.31Å
13Q97.3Very high97.3Very high114 Ų11470.9 Ų70.953%0.53336%0.364SS..Hα-helixtrans-57.8-46176.9-64.6-61.9-30.200111.7A9 C10 C15 L16 I17A9-Q13 PolarHBondContact O-N 3.04Å; C10-Q13 WeakPolarHBondContact O-CB 3.28Å; C10-Q13 PolarHBondContact O-N 3.47Å; Q13-C15 VanDerWaalsContact C-N 3.29Å; Q13-C15 PolarHBondContact O-N 3.39Å; Q13-L16 PolarHBondContact O-N 3.39Å; Q13-I17 WeakPolarHBondContact O-CG1 3.48Å; Q13-I17 PolarHBondContact O-N 2.88Å; Q13-I17 VanDerWaalsContact O-N 3.13Å
14S98.2Very high97.5Very high54 Ų5473.3 Ų73.338%0.37838%0.381SS..Hα-helixtrans-64.3-33.3175.1-53.80000113.1C10 K11 I12 R18C10-S14 PolarHBondContact O-N 2.88Å; C10-S14 PolarHBondContact O-OG 3.02Å; K11-S14 PolarHBondContact O-N 3.17Å; I12-S14 VanDerWaalsContact C-N 3.33Å; I12-S14 PolarHBondContact O-N 2.92Å; S14-R18 WeakPolarHBondContact O-CG 3.41Å; S14-R18 PolarHBondContact O-N 3.33Å; S14-R18 PolarHBondContact O-NH1 3.31Å
15C98.7Very high97.5Very high2 Ų279 Ų791%0.01440%0.397CS..Hα-helixtrans-66.8-46.4175.7179.50000111.5K11 I12 Q13 I17 R18 N19 C26 E29K11-C15 WeakPolarHBondContact O-CB 3.42Å; K11-C15 PolarHBondContact O-N 3.39Å; I12-C15 WeakPolarHBondContact O-CA 3.3Å; I12-C15 WeakPolarHBondContact O-CB 3.39Å; I12-C15 PolarHBondContact O-N 3.31Å; Q13-C15 VanDerWaalsContact C-N 3.29Å; Q13-C15 PolarHBondContact O-N 3.39Å; C15-I17 PolarHBondContact O-N 3.1Å; C15-R18 PolarHBondContact O-N 3.17Å; C15-N19 WeakPolarHBondContact O-CB 3.4Å; C15-N19 PolarHBondContact O-N 3.49Å; C15-N19 VanDerWaalsContact O-N 3.13Å; C15-N19 PolarHBondContact O-ND2 2.89Å; C15-N19 PolarHBondContact SG-ND2 2.96Å; C15-C26 HydrophobicContact CB-CB 3.89Å; C15-C26 WeakPolarHBondContact CB-SG 3.07Å; C15-C26 WeakPolarHBondContact SG-CA 3.06Å; C15-C26 WeakPolarHBondContact SG-CB 3.36Å; C15-C26 CovalentContact SG-SG 2.04Å; C15-C26 PolarHBondContact SG-SG 3.43Å; C15-E29 HydrophobicContact CB-CG 4.19Å
16L98.6Very high97.6Very high28 Ų2879 Ų7915%0.14740%0.397CS..Hα-helixtrans-59.3-48.5179-69.4170.6000111.1I12 Q13 R18 N19 D20 F21 V23I12-L16 HydrophobicContact CG2-CD1 4.09Å; I12-L16 HydrophobicContact CG2-CG 4.33Å; I12-L16 WeakPolarHBondContact O-CG 3.33Å; I12-L16 PolarHBondContact O-N 3.06Å; Q13-L16 PolarHBondContact O-N 3.39Å; L16-R18 VanDerWaalsContact C-N 3.25Å; L16-R18 PolarHBondContact O-N 3.08Å; L16-N19 CarbonylContact O-C 3.51Å; L16-N19 PolarHBondContact O-N 3Å; L16-D20 PolarHBondContact O-N 3.31Å; L16-F21 HydrophobicContact CB-CD1 4.17Å; L16-F21 WeakPolarHBondContact O-CA 3.39Å; L16-F21 PolarHBondContact O-N 3.32Å; L16-V23 HydrophobicContact CD2-CB 4.25Å
17I98.4Very high97.7Very high113 Ų11377.8 Ų77.858%0.57940%0.399SS*.Hα-helixtrans-58.3-39179-67.3165.7000111.5Q13 C15 N19Q13-I17 WeakPolarHBondContact O-CG1 3.48Å; Q13-I17 PolarHBondContact O-N 2.88Å; Q13-I17 VanDerWaalsContact O-N 3.13Å; C15-I17 PolarHBondContact O-N 3.1Å; I17-N19 VanDerWaalsContact C-N 3.3Å; I17-N19 PolarHBondContact O-N 3.44Å
18R98.3Very high97.7Very high164 Ų16482.9 Ų82.962%0.61941%0.409SS*.Hα-helixtrans-75.4-16.9179.3-73.8-170.2-53-97.7-2.4114.4S14 C15 L16S14-R18 WeakPolarHBondContact O-CG 3.41Å; S14-R18 PolarHBondContact O-N 3.33Å; S14-R18 PolarHBondContact O-NH1 3.31Å; C15-R18 PolarHBondContact O-N 3.17Å; L16-R18 VanDerWaalsContact C-N 3.25Å; L16-R18 PolarHBondContact O-N 3.08Å
19N98.3Very high97.7Very high40 Ų4082.3 Ų82.321%0.21441%0.406CS..THydrogen-bonded Turntrans-119.428.9-172.1-71.7-72.6000111.6C15 L16 I17 F21 D22 R25C15-N19 WeakPolarHBondContact O-CB 3.4Å; C15-N19 PolarHBondContact O-N 3.49Å; C15-N19 VanDerWaalsContact O-N 3.13Å; C15-N19 PolarHBondContact O-ND2 2.89Å; C15-N19 PolarHBondContact SG-ND2 2.96Å; L16-N19 CarbonylContact O-C 3.51Å; L16-N19 PolarHBondContact O-N 3Å; I17-N19 VanDerWaalsContact C-N 3.3Å; I17-N19 PolarHBondContact O-N 3.44Å; N19-F21 PolarHBondContact O-N 3.4Å; N19-F21 VanDerWaalsContact O-N 3.09Å; N19-D22 WeakPolarHBondContact O-CB 3.38Å; N19-D22 PolarHBondContact O-N 2.83Å; N19-R25 HydrophobicContact CB-CB 4.02Å; N19-R25 WeakPolarHBondContact OD1-CD 3.43Å
20D97.8Very high97.8Very high150 Ų15083.5 Ų83.580%0.80241%0.408SS*.THydrogen-bonded Turntrans51.436.7-179.4-57.4-50.9000113.3L16 D22L16-D20 PolarHBondContact O-N 3.31Å; D20-D22 PolarHBondContact O-N 3.09Å
21F97.3Very high97.7Very high152 Ų15283.6 Ų83.667%0.66741%0.407SS*.THydrogen-bonded Turntrans63.515.7-176.3-54.3-89.6000115.4L16 N19 V23L16-F21 HydrophobicContact CB-CD1 4.17Å; L16-F21 WeakPolarHBondContact O-CA 3.39Å; L16-F21 PolarHBondContact O-N 3.32Å; N19-F21 PolarHBondContact O-N 3.4Å; N19-F21 VanDerWaalsContact O-N 3.09Å; F21-V23 PolarHBondContact O-N 3.48Å
22D97.7Very high97.7Very high51 Ų5179.7 Ų79.727%0.27340%0.395SS..  trans-71.797172.1-177-2.1000110.9N19 D20 T24 R25N19-D22 WeakPolarHBondContact O-CB 3.38Å; N19-D22 PolarHBondContact O-N 2.83Å; D20-D22 PolarHBondContact O-N 3.09Å; D22-T24 PolarHBondContact O-N 2.91Å; D22-T24 WeakPolarHBondContact OD1-CB 3.36Å; D22-T24 PolarHBondContact OD1-N 3.23Å; D22-T24 PolarHBondContact OD1-OG1 3.14Å; D22-T24 PolarHBondContact OD2-OG1 3.05Å; D22-R25 HydrophobicContact CB-CG 4.29Å; D22-R25 PolarHBondContact O-N 2.95Å; D22-R25 VanDerWaalsContact OD2-CD 3.31Å; D22-R25 WeakPolarHBondContact OD2-CD 3.49Å; D22-R25 WeakPolarHBondContact OD2-CG 3.32Å; D22-R25 IonicContact OD2-NE 3Å; D22-R25 PolarHBondContact OD2-NE 3.28Å
23V95.8Very high97.6Very high81 Ų8179.4 Ų79.449%0.49139%0.393SS..G310 helixtrans-61.3-25.9179.970.10000113L16 F21 R25 C26 I30L16-V23 HydrophobicContact CD2-CB 4.25Å; F21-V23 PolarHBondContact O-N 3.48Å; V23-R25 PolarHBondContact O-N 2.04Å; V23-C26 PolarHBondContact O-N 3.3Å; V23-I30 HydrophobicContact CG2-CD1 3.64Å
24T97.5Very high97.4Very high97 Ų9775.7 Ų75.760%0.59538%0.377SS*.G310 helixtrans-66.4-21.9-179.474.80000111.9D22 T27D22-T24 PolarHBondContact O-N 2.91Å; D22-T24 WeakPolarHBondContact OD1-CB 3.36Å; D22-T24 PolarHBondContact OD1-N 3.23Å; D22-T24 PolarHBondContact OD1-OG1 3.14Å; D22-T24 PolarHBondContact OD2-OG1 3.05Å; T24-T27 VanDerWaalsContact O-CG2 3.31Å; T24-T27 WeakPolarHBondContact O-CG2 3.01Å
25R98.1Very high97.3Very high161 Ų16178.6 Ų78.661%0.60838%0.384SS*.G310 helixtrans-84.8-7.5175.3-64175.5-178.3-104.3-0.2114N19 D22 V23N19-R25 HydrophobicContact CB-CB 4.02Å; N19-R25 WeakPolarHBondContact OD1-CD 3.43Å; D22-R25 HydrophobicContact CB-CG 4.29Å; D22-R25 PolarHBondContact O-N 2.95Å; D22-R25 VanDerWaalsContact OD2-CD 3.31Å; D22-R25 WeakPolarHBondContact OD2-CD 3.49Å; D22-R25 WeakPolarHBondContact OD2-CG 3.32Å; D22-R25 IonicContact OD2-NE 3Å; D22-R25 PolarHBondContact OD2-NE 3.28Å; V23-R25 PolarHBondContact O-N 2.04Å
26C98.3Very high97.2Very high0 Ų079 Ų790%039%0.387CS..G310 helixtrans-109.318.1-177.2-59.30000113.2C15 V23 R28 E29 I30C15-C26 HydrophobicContact CB-CB 3.89Å; C15-C26 WeakPolarHBondContact CB-SG 3.07Å; C15-C26 WeakPolarHBondContact SG-CA 3.06Å; C15-C26 WeakPolarHBondContact SG-CB 3.36Å; C15-C26 CovalentContact SG-SG 2.04Å; C15-C26 PolarHBondContact SG-SG 3.43Å; V23-C26 PolarHBondContact O-N 3.3Å; C26-R28 VanDerWaalsContact C-N 3.29Å; C26-R28 PolarHBondContact O-N 2.92Å; C26-E29 PolarHBondContact O-N 2.91Å; C26-I30 VanDerWaalsContact O-CG1 3.31Å; C26-I30 WeakPolarHBondContact O-CG1 3.14Å; C26-I30 PolarHBondContact O-N 2.85Å
27T97.5Very high97Very high87 Ų8778.2 Ų78.253%0.53438%0.384SS..Hα-helixtrans-55.2-42.3-178.145.90000112.3T24 I30 T31T24-T27 VanDerWaalsContact O-CG2 3.31Å; T24-T27 WeakPolarHBondContact O-CG2 3.01Å; T27-I30 PolarHBondContact O-N 3.39Å; T27-T31 WeakPolarHBondContact O-CB 3.09Å; T27-T31 PolarHBondContact O-N 3.34Å; T27-T31 PolarHBondContact O-OG1 3.27Å
28R97.8Very high96.7Very high177 Ų17778.5 Ų78.567%0.66838%0.383SS*.Hα-helixtrans-62.4-45.6178.2-175.1-174.865.8-178.4-1.7112.7C26 I30 T31 S32C26-R28 VanDerWaalsContact C-N 3.29Å; C26-R28 PolarHBondContact O-N 2.92Å; R28-I30 VanDerWaalsContact C-N 3.32Å; R28-T31 PolarHBondContact O-N 2.99Å; R28-S32 PolarHBondContact O-N 3.35Å; R28-S32 PolarHBondContact O-OG 2.05Å
29E98.1Very high96.5Very high24 Ų2477.9 Ų77.911%0.11238%0.384CS..Hα-helixtrans-65.9-38.3178.5-70.968.8-156.900110.9K11 I12 C15 C26 S32 L33K11-E29 HydrophobicContact CB-CG 4.26Å; I12-E29 HydrophobicContact CG1-CB 3.7Å; C15-E29 HydrophobicContact CB-CG 4.19Å; C26-E29 PolarHBondContact O-N 2.91Å; E29-S32 PolarHBondContact O-N 3.41Å; E29-L33 PolarHBondContact O-N 3.49Å; E29-L33 VanDerWaalsContact O-N 3.09Å
30I96.6Very high96.3Very high50 Ų5078.6 Ų78.626%0.25639%0.386SS..Hα-helixtrans-62.2-54.7173-67.3164.5000109.7I12 V23 C26 T27 R28 S32 L33 I34I12-I30 HydrophobicContact CD1-CG1 4.1Å; I12-I30 HydrophobicContact CG1-CG1 4.44Å; V23-I30 HydrophobicContact CG2-CD1 3.64Å; C26-I30 VanDerWaalsContact O-CG1 3.31Å; C26-I30 WeakPolarHBondContact O-CG1 3.14Å; C26-I30 PolarHBondContact O-N 2.85Å; T27-I30 PolarHBondContact O-N 3.39Å; R28-I30 VanDerWaalsContact C-N 3.32Å; I30-S32 PolarHBondContact O-N 3.26Å; I30-L33 CarbonylContact O-C 3.6Å; I30-L33 WeakPolarHBondContact O-CA 3.33Å; I30-L33 WeakPolarHBondContact O-CB 3.31Å; I30-L33 PolarHBondContact O-N 3.1Å; I30-I34 HydrophobicContact CG2-CD1 4.12Å; I30-I34 HydrophobicContact CG2-CG1 4.21Å; I30-I34 WeakPolarHBondContact O-CG1 3.31Å; I30-I34 PolarHBondContact O-N 3.17Å
31T95.9Very high96Very high67 Ų6781.2 Ų81.241%0.41138%0.384SS..Hα-helixtrans-51.7-44.2177.2-60.80000111.7T27 R28 L33 I34 E35T27-T31 WeakPolarHBondContact O-CB 3.09Å; T27-T31 PolarHBondContact O-N 3.34Å; T27-T31 PolarHBondContact O-OG1 3.27Å; R28-T31 PolarHBondContact O-N 2.99Å; T31-L33 VanDerWaalsContact C-N 3.33Å; T31-L33 PolarHBondContact O-N 3.01Å; T31-I34 WeakPolarHBondContact O-CB 3.38Å; T31-I34 PolarHBondContact O-N 3.1Å; T31-I34 VanDerWaalsContact O-N 3.14Å; T31-E35 HydrophobicContact CG2-CG 4.49Å; T31-E35 WeakPolarHBondContact O-CG 3.36Å; T31-E35 PolarHBondContact O-N 3.24Å
32S97.1Very high95.6Very high40 Ų4081 Ų8128%0.2839%0.385SS..Hα-helixtrans-61.1-41.1176.8-58.70000112.1L8 R28 E29 I30 C36L8-S32 WeakPolarHBondContact CD1-O 3.43Å; R28-S32 PolarHBondContact O-N 3.35Å; R28-S32 PolarHBondContact O-OG 2.05Å; E29-S32 PolarHBondContact O-N 3.41Å; I30-S32 PolarHBondContact O-N 3.26Å; S32-C36 WeakPolarHBondContact O-CB 3.4Å; S32-C36 PolarHBondContact O-N 3.15Å
33L96Very high95.4Very high15 Ų1581.6 Ų81.68%0.07939%0.388CS..Hα-helixtrans-65.1-40.2174.9-179.362.4000111.5C5 L8 A9 I12 E29 I30 T31 C36 C37 C47C5-L33 HydrophobicContact CB-CD1 3.75Å; L8-L33 HydrophobicContact CB-CB 4.37Å; L8-L33 HydrophobicContact CB-CD1 4.13Å; A9-L33 HydrophobicContact CB-CD1 4.47Å; A9-L33 HydrophobicContact CB-CD2 4.48Å; I12-L33 HydrophobicContact CD1-CB 3.89Å; I12-L33 HydrophobicContact CD1-CD2 3.48Å; I12-L33 VanDerWaalsContact CD1-CD2 3.48Å; I12-L33 HydrophobicContact CD1-CG 4.31Å; E29-L33 PolarHBondContact O-N 3.49Å; E29-L33 VanDerWaalsContact O-N 3.09Å; I30-L33 CarbonylContact O-C 3.6Å; I30-L33 WeakPolarHBondContact O-CA 3.33Å; I30-L33 WeakPolarHBondContact O-CB 3.31Å; I30-L33 PolarHBondContact O-N 3.1Å; T31-L33 VanDerWaalsContact C-N 3.33Å; T31-L33 PolarHBondContact O-N 3.01Å; L33-C36 WeakPolarHBondContact O-CB 3.33Å; L33-C36 PolarHBondContact O-N 3.14Å; L33-C37 PolarHBondContact O-N 3.24Å; L33-C37 PolarHBondContact O-SG 2.97Å; L33-C37 VanDerWaalsContact O-SG 3.35Å; L33-C47 HydrophobicContact CD1-CB 4.43Å
34I94Very high95.1Very high36 Ų3686 Ų8619%0.18540%0.4CS..Hα-helixtrans-57.2-54.2175.7-48.1-154.9000110.3I30 T31 C36 C37 Q38 W51I30-I34 HydrophobicContact CG2-CD1 4.12Å; I30-I34 HydrophobicContact CG2-CG1 4.21Å; I30-I34 WeakPolarHBondContact O-CG1 3.31Å; I30-I34 PolarHBondContact O-N 3.17Å; T31-I34 WeakPolarHBondContact O-CB 3.38Å; T31-I34 PolarHBondContact O-N 3.1Å; T31-I34 VanDerWaalsContact O-N 3.14Å; I34-C36 PolarHBondContact O-N 3.38Å; I34-C37 PolarHBondContact O-N 3.2Å; I34-C37 VanDerWaalsContact O-N 3.13Å; I34-Q38 HydrophobicContact CG2-CG 4.42Å; I34-Q38 WeakPolarHBondContact O-CG 3.33Å; I34-Q38 PolarHBondContact O-N 3.49Å; I34-W51 HydrophobicContact CB-CH2 3.89Å; I34-W51 HydrophobicContact CB-CZ3 3.82Å; I34-W51 HydrophobicContact CD1-CH2 3.43Å; I34-W51 VanDerWaalsContact CD1-CH2 3.43Å; I34-W51 HydrophobicContact CD1-CZ3 3.63Å; I34-W51 HydrophobicContact CG1-CH2 3.22Å; I34-W51 HydrophobicContact CG1-CZ2 4.17Å; I34-W51 HydrophobicContact CG1-CZ3 3.58Å; I34-W51 HydrophobicContact CG2-CE3 4.17Å; I34-W51 HydrophobicContact CG2-CH2 4.08Å; I34-W51 HydrophobicContact CG2-CZ3 3.47Å; I34-W51 VanDerWaalsContact CG2-CZ3 3.47Å
35E95.2Very high94.9Very high115 Ų11581.4 Ų81.454%0.53737%0.372SS..Hα-helixtrans-59.2-38.1-179.4-70.8174.3175.900111.3T31 Q38 K39T31-E35 HydrophobicContact CG2-CG 4.49Å; T31-E35 WeakPolarHBondContact O-CG 3.36Å; T31-E35 PolarHBondContact O-N 3.24Å; E35-Q38 PolarHBondContact O-N 2.96Å; E35-K39 VanDerWaalsContact O-CB 3.3Å; E35-K39 WeakPolarHBondContact O-CB 3Å; E35-K39 PolarHBondContact O-N 3.2Å
36C96.6Very high94.7Very high12 Ų1278 Ų788%0.08137%0.371CS..Hα-helixtrans-64.8-48.3174.7-172.70000112.3C5 L8 S32 L33 I34 Q38 K39 F40C5-C36 WeakPolarHBondContact CA-SG 3.43Å; C5-C36 HydrophobicContact CB-CB 3.89Å; C5-C36 WeakPolarHBondContact CB-SG 3.12Å; C5-C36 WeakPolarHBondContact SG-CB 3.31Å; C5-C36 CovalentContact SG-SG 2.04Å; C5-C36 PolarHBondContact SG-SG 3.07Å; L8-C36 HydrophobicContact CD1-CB 3.34Å; S32-C36 WeakPolarHBondContact O-CB 3.4Å; S32-C36 PolarHBondContact O-N 3.15Å; L33-C36 WeakPolarHBondContact O-CB 3.33Å; L33-C36 PolarHBondContact O-N 3.14Å; I34-C36 PolarHBondContact O-N 3.38Å; C36-Q38 VanDerWaalsContact C-N 3.28Å; C36-Q38 PolarHBondContact O-N 2.6Å; C36-K39 PolarHBondContact O-N 3.02Å; C36-K39 VanDerWaalsContact O-N 3.17Å; C36-F40 WeakPolarHBondContact O-CD2 3.4Å; C36-F40 PolarHBondContact O-N 3.34Å
37C94.6Very high94.4Very high10 Ų1079.8 Ų79.87%0.06838%0.383CS..Hα-helixtrans-61.5-37.8177.7-66.90000111.4L33 I34 F40 R41 C48 W51L33-C37 PolarHBondContact O-N 3.24Å; L33-C37 PolarHBondContact O-SG 2.97Å; L33-C37 VanDerWaalsContact O-SG 3.35Å; I34-C37 PolarHBondContact O-N 3.2Å; I34-C37 VanDerWaalsContact O-N 3.13Å; C37-F40 CarbonylContact O-C 3.53Å; C37-R41 WeakPolarHBondContact O-CA 3.48Å; C37-R41 PolarHBondContact O-N 3.25Å; C37-C48 VanDerWaalsContact CA-SG 3.54Å; C37-C48 HydrophobicContact CB-CB 3.75Å; C37-C48 WeakPolarHBondContact CB-SG 3.33Å; C37-C48 VanDerWaalsContact SG-CA 3.56Å; C37-C48 WeakPolarHBondContact SG-CB 3.48Å; C37-C48 CovalentContact SG-SG 2.05Å; C37-C48 PolarHBondContact SG-SG 3.06Å; C37-W51 HydrophobicContact CB-CD2 4.4Å; C37-W51 HydrophobicContact CB-CG 4.45Å
38Q92.5Very high94.2Very high119 Ų11976.5 Ų76.556%0.55636%0.363SS*.Hα-helixtrans-63.7-43.9173.6-72.1177.2-15.400112.4I34 E35 C36I34-Q38 HydrophobicContact CG2-CG 4.42Å; I34-Q38 WeakPolarHBondContact O-CG 3.33Å; I34-Q38 PolarHBondContact O-N 3.49Å; E35-Q38 PolarHBondContact O-N 2.96Å; C36-Q38 VanDerWaalsContact C-N 3.28Å; C36-Q38 PolarHBondContact O-N 2.6Å
39K95Very high93.7Very high151 Ų15173.5 Ų73.566%0.65736%0.357SS*.Hα-helixtrans-65.4-40.9178.8-177.8174180175.30112.3E35 C36E35-K39 VanDerWaalsContact O-CB 3.3Å; E35-K39 WeakPolarHBondContact O-CB 3Å; E35-K39 PolarHBondContact O-N 3.2Å; C36-K39 PolarHBondContact O-N 3.02Å; C36-K39 VanDerWaalsContact O-N 3.17Å
40F93.9Very high92.7Very high55 Ų5574.5 Ų74.524%0.24137%0.374CS..THydrogen-bonded Turntrans-105.429.9-176.4-62.9-75.7000113.3P4 C36 C37 H42 I43P4-F40 HydrophobicContact CB-CD1 4.17Å; P4-F40 HydrophobicContact CB-CD2 3.74Å; P4-F40 HydrophobicContact CB-CE1 4.15Å; P4-F40 HydrophobicContact CB-CE2 3.72Å; P4-F40 HydrophobicContact CB-CG 3.97Å; P4-F40 HydrophobicContact CB-CZ 3.92Å; P4-F40 HydrophobicContact CG-CB 3.99Å; P4-F40 HydrophobicContact CG-CD1 3.94Å; P4-F40 HydrophobicContact CG-CD2 3.92Å; P4-F40 HydrophobicContact CG-CE1 4.38Å; P4-F40 HydrophobicContact CG-CE2 4.37Å; P4-F40 HydrophobicContact CG-CG 3.68Å; C36-F40 WeakPolarHBondContact O-CD2 3.4Å; C36-F40 PolarHBondContact O-N 3.34Å; C37-F40 CarbonylContact O-C 3.53Å; F40-H42 PolarHBondContact O-N 3.16Å; F40-I43 HydrophobicContact CB-CD1 4.4Å; F40-I43 HydrophobicContact CD1-CD1 3.87Å; F40-I43 PolarHBondContact O-N 2.86Å
41R90.3Very high91.4Very high206 Ų20675.4 Ų75.478%0.77737%0.374SS*.THydrogen-bonded Turntrans-52.6-23.1-178.768.1175.7-175.5-98.62.9115.8C37 I43C37-R41 WeakPolarHBondContact O-CA 3.48Å; C37-R41 PolarHBondContact O-N 3.25Å; R41-I43 VanDerWaalsContact C-N 3.32Å
42H90.2Very high90Very high148 Ų14878.5 Ų78.569%0.68539%0.388SS*.THydrogen-bonded Turntrans-85.2-6.3179.759.5-82.1000113F40F40-H42 PolarHBondContact O-N 3.16Å
43I92Very high88.5Confident62 Ų6281.8 Ų81.832%0.31840%0.403SS..SBendtrans-108.5117.4178.5-54.9-178000107.3P4 F40 R41 Q45P4-I43 HydrophobicContact CG-CD1 4.2Å; F40-I43 HydrophobicContact CB-CD1 4.4Å; F40-I43 HydrophobicContact CD1-CD1 3.87Å; F40-I43 PolarHBondContact O-N 2.86Å; R41-I43 VanDerWaalsContact C-N 3.32Å; I43-Q45 HydrophobicContact CG2-CG 4.03Å; I43-Q45 PolarHBondContact O-N 3.23Å
44K91.1Very high87Confident173 Ų17386.2 Ų86.275%0.75242%0.419SS*.  trans-68.2125.2174.9-174175179.4177.60109.9E49K44-E49 WeakPolarHBondContact CE-OE1 3.31Å; K44-E49 IonicContact NZ-OE1 3.93Å
45Q92.8Very high85.4Confident2 Ų290.3 Ų90.31%0.00944%0.435CS..  trans-138.9132-178.7-60.2176.7-109.800109.8L3 C5 I43 C47 C48 E49L3-Q45 HydrophobicContact CB-CG 4.33Å; L3-Q45 HydrophobicContact CD1-CB 4.45Å; L3-Q45 HydrophobicContact CD1-CG 4.48Å; L3-Q45 HydrophobicContact CD2-CG 4.32Å; C5-Q45 PolarHBondContact SG-NE2 2.9Å; C5-Q45 VanDerWaalsContact SG-NE2 3.43Å; C5-Q45 PolarHBondContact SG-OE1 3Å; C5-Q45 VanDerWaalsContact SG-OE1 3.39Å; I43-Q45 HydrophobicContact CG2-CG 4.03Å; I43-Q45 PolarHBondContact O-N 3.23Å; Q45-C47 PolarHBondContact O-N 3.38Å; Q45-C47 VanDerWaalsContact O-N 3.16Å; Q45-C48 HydrophobicContact CB-CB 4.13Å; Q45-C48 CarbonylContact O-C 3.5Å; Q45-C48 WeakPolarHBondContact O-CA 3.41Å; Q45-C48 PolarHBondContact O-N 2.82Å; Q45-E49 PolarHBondContact O-N 3.39Å
46P92.8Very high83.6Confident89 Ų8990.6 Ų90.658%0.57844%0.437SS*.G310 helixtrans-56.1-34.6-179.8-28.235.9000114.3C48 E49P46-C48 PolarHBondContact O-N 3.34Å; P46-E49 PolarHBondContact O-N 3.03Å
47C92.9Very high81.8Confident37 Ų3795.2 Ų95.225%0.2546%0.457CS..G310 helixtrans-71.8-15.2176.762.40000114.1A9 L33 Q45 W51A9-C47 HydrophobicContact CB-CB 3.95Å; L33-C47 HydrophobicContact CD1-CB 4.43Å; Q45-C47 PolarHBondContact O-N 3.38Å; Q45-C47 VanDerWaalsContact O-N 3.16Å; C47-W51 PolarHBondContact O-NE1 3.48Å
48C92.8Very high80.3Confident19 Ų1997.7 Ų97.713%0.12847%0.469CS..G310 helixtrans-107.76.3179.2-570000112C37 Q45 P46 W51C37-C48 VanDerWaalsContact CA-SG 3.54Å; C37-C48 HydrophobicContact CB-CB 3.75Å; C37-C48 WeakPolarHBondContact CB-SG 3.33Å; C37-C48 VanDerWaalsContact SG-CA 3.56Å; C37-C48 WeakPolarHBondContact SG-CB 3.48Å; C37-C48 CovalentContact SG-SG 2.05Å; C37-C48 PolarHBondContact SG-SG 3.06Å; Q45-C48 HydrophobicContact CB-CB 4.13Å; Q45-C48 CarbonylContact O-C 3.5Å; Q45-C48 WeakPolarHBondContact O-CA 3.41Å; Q45-C48 PolarHBondContact O-N 2.82Å; P46-C48 PolarHBondContact O-N 3.34Å; C48-W51 PolarHBondContact O-N 3.42Å
49E87.7Confident78.9Confident113 Ų11395.2 Ų95.253%0.52846%0.46SS..THydrogen-bonded Turntrans-70.9135.1174.7-70179.3-17900110.1K44 Q45 P46K44-E49 WeakPolarHBondContact CE-OE1 3.31Å; K44-E49 IonicContact NZ-OE1 3.93Å; Q45-E49 PolarHBondContact O-N 3.39Å; P46-E49 PolarHBondContact O-N 3.03Å
50G76.9Confident77.3Confident46 Ų4690.7 Ų90.747%0.47444%0.443SS..THydrogen-bonded Turntrans91.7-12.9-176.200000115.4D52 N53G50-D52 VanDerWaalsContact C-N 3.3Å; G50-D52 PolarHBondContact O-N 2.88Å; G50-N53 PolarHBondContact O-N 3.27Å
51W68.4Low75.7Confident69 Ų6993.6 Ų93.626%0.26146%0.457SS..Hα-helixtrans-68.5-27.5177.6-71.672.9000113.6I34 C37 C47 C48 N53 Y54 K55I34-W51 HydrophobicContact CB-CH2 3.89Å; I34-W51 HydrophobicContact CB-CZ3 3.82Å; I34-W51 HydrophobicContact CD1-CH2 3.43Å; I34-W51 VanDerWaalsContact CD1-CH2 3.43Å; I34-W51 HydrophobicContact CD1-CZ3 3.63Å; I34-W51 HydrophobicContact CG1-CH2 3.22Å; I34-W51 HydrophobicContact CG1-CZ2 4.17Å; I34-W51 HydrophobicContact CG1-CZ3 3.58Å; I34-W51 HydrophobicContact CG2-CE3 4.17Å; I34-W51 HydrophobicContact CG2-CH2 4.08Å; I34-W51 HydrophobicContact CG2-CZ3 3.47Å; I34-W51 VanDerWaalsContact CG2-CZ3 3.47Å; C37-W51 HydrophobicContact CB-CD2 4.4Å; C37-W51 HydrophobicContact CB-CG 4.45Å; C47-W51 PolarHBondContact O-NE1 3.48Å; C48-W51 PolarHBondContact O-N 3.42Å; W51-N53 PolarHBondContact O-N 3.27Å; W51-Y54 HydrophobicContact CE3-CD1 4.18Å; W51-Y54 HydrophobicContact CZ3-CD1 4.06Å; W51-Y54 HydrophobicContact CZ3-CE1 4.38Å; W51-Y54 PolarHBondContact O-N 3.04Å; W51-Y54 VanDerWaalsContact O-N 3.1Å; W51-K55 PolarHBondContact O-N 3.46Å
52D66.8Low74.2Confident132 Ų13289.1 Ų89.171%0.70645%0.452SS*.Hα-helixtrans-57.1-34.5175-65.2-32.2000111.4G50 H56G50-D52 VanDerWaalsContact C-N 3.3Å; G50-D52 PolarHBondContact O-N 2.88Å; D52-H56 PolarHBondContact O-N 3.44Å
53N66.2Low72.7Confident109 Ų10989.7 Ų89.758%0.58345%0.453SS*.Hα-helixtrans-75.9-39.6176.3-61.9-29.2000111.8G50 W51 K55 H56 E57G50-N53 PolarHBondContact O-N 3.27Å; W51-N53 PolarHBondContact O-N 3.27Å; N53-K55 VanDerWaalsContact C-N 3.32Å; N53-K55 PolarHBondContact O-N 3.07Å; N53-H56 WeakPolarHBondContact O-CB 3.17Å; N53-H56 PolarHBondContact O-N 2.91Å; N53-H56 VanDerWaalsContact O-N 3.1Å; N53-E57 PolarHBondContact O-N 3.38Å
54Y63.9Low70.9Confident108 Ų10892.3 Ų92.342%0.42447%0.472SS..Hα-helixtrans-61.8-38.7178.4-176.6-107.8000112.4W51 E57 L58W51-Y54 HydrophobicContact CE3-CD1 4.18Å; W51-Y54 HydrophobicContact CZ3-CD1 4.06Å; W51-Y54 HydrophobicContact CZ3-CE1 4.38Å; W51-Y54 PolarHBondContact O-N 3.04Å; W51-Y54 VanDerWaalsContact O-N 3.1Å; Y54-E57 PolarHBondContact O-N 3.38Å; Y54-L58 HydrophobicContact CD1-CD1 3.85Å; Y54-L58 HydrophobicContact CD1-CG 4.43Å; Y54-L58 HydrophobicContact CE1-CD1 3.26Å; Y54-L58 HydrophobicContact CE1-CG 3.99Å; Y54-L58 HydrophobicContact CE2-CG 4.46Å; Y54-L58 PolarHBondContact O-N 3.39Å
55K60.5Low68.9Low122 Ų12294 Ų9453%0.5349%0.489SS..Hα-helixtrans-65.2-40.7173.1-177.6171.1167.348.80111.8W51 N53 E57 L58 D59W51-K55 PolarHBondContact O-N 3.46Å; N53-K55 VanDerWaalsContact C-N 3.32Å; N53-K55 PolarHBondContact O-N 3.07Å; K55-E57 VanDerWaalsContact C-N 3.25Å; K55-E57 PolarHBondContact O-N 3.23Å; K55-L58 PolarHBondContact O-N 3.21Å; K55-D59 VanDerWaalsContact CE-OD2 3.28Å; K55-D59 WeakPolarHBondContact CE-OD2 3.42Å; K55-D59 WeakPolarHBondContact CG-OD2 3.02Å; K55-D59 VanDerWaalsContact NZ-CG 3.32Å; K55-D59 IonicContact NZ-OD1 2.78Å; K55-D59 PolarHBondContact NZ-OD1 3.27Å; K55-D59 IonicContact NZ-OD2 2.91Å; K55-D59 PolarHBondContact NZ-OD2 3.27Å; K55-D59 VanDerWaalsContact O-CB 3.28Å; K55-D59 WeakPolarHBondContact O-CB 3.4Å; K55-D59 VanDerWaalsContact O-CG 3.26Å; K55-D59 PolarHBondContact O-N 3.35Å
56H57.5Low67.7Low121 Ų12198.6 Ų98.656%0.5651%0.513SS*.Hα-helixtrans-59.9-39.2175.7-172.1-116000111.1D52 N53 N60D52-H56 PolarHBondContact O-N 3.44Å; N53-H56 WeakPolarHBondContact O-CB 3.17Å; N53-H56 PolarHBondContact O-N 2.91Å; N53-H56 VanDerWaalsContact O-N 3.1Å; H56-N60 PolarHBondContact CD2-ND2 3.25Å; H56-N60 PolarHBondContact CE1-ND2 3.06Å; H56-N60 PolarHBondContact ND1-ND2 3.48Å; H56-N60 PolarHBondContact NE2-ND2 3.13Å; H56-N60 VanDerWaalsContact NE2-ND2 3.17Å; H56-N60 WeakPolarHBondContact O-CB 3.38Å; H56-N60 PolarHBondContact O-N 3.41Å; H56-N60 PolarHBondContact O-ND2 3.04Å
57E59.8Low66.4Low109 Ų10999.1 Ų99.151%0.50951%0.51SS..Hα-helixtrans-67.4-45.1175.8-70.5172.1-166.300112.9N53 Y54 K55 N60 Q61N53-E57 PolarHBondContact O-N 3.38Å; Y54-E57 PolarHBondContact O-N 3.38Å; K55-E57 VanDerWaalsContact C-N 3.25Å; K55-E57 PolarHBondContact O-N 3.23Å; E57-N60 PolarHBondContact O-N 3.03Å; E57-Q61 WeakPolarHBondContact O-CG 3.45Å; E57-Q61 PolarHBondContact O-N 3.27Å
58L61.7Low64.9Low62 Ų62102.6 Ų102.633%0.32553%0.525SS..Hα-helixtrans-66.7-43.2177.3-74176.9000113Y54 K55 N60 Q61 T62Y54-L58 HydrophobicContact CD1-CD1 3.85Å; Y54-L58 HydrophobicContact CD1-CG 4.43Å; Y54-L58 HydrophobicContact CE1-CD1 3.26Å; Y54-L58 HydrophobicContact CE1-CG 3.99Å; Y54-L58 HydrophobicContact CE2-CG 4.46Å; Y54-L58 PolarHBondContact O-N 3.39Å; K55-L58 PolarHBondContact O-N 3.21Å; L58-N60 PolarHBondContact O-N 3.47Å; L58-Q61 PolarHBondContact O-N 2.04Å; L58-T62 PolarHBondContact O-N 2.89Å; L58-T62 PolarHBondContact O-OG1 3.09Å
59D63.8Low63.3Low66 Ų66107.5 Ų107.535%0.35355%0.548SS..Hα-helixtrans-64.8-30.5176.7-70.4-9.9000110.5K55 K63K55-D59 VanDerWaalsContact CE-OD2 3.28Å; K55-D59 WeakPolarHBondContact CE-OD2 3.42Å; K55-D59 WeakPolarHBondContact CG-OD2 3.02Å; K55-D59 VanDerWaalsContact NZ-CG 3.32Å; K55-D59 IonicContact NZ-OD1 2.78Å; K55-D59 PolarHBondContact NZ-OD1 3.27Å; K55-D59 IonicContact NZ-OD2 2.91Å; K55-D59 PolarHBondContact NZ-OD2 3.27Å; K55-D59 VanDerWaalsContact O-CB 3.28Å; K55-D59 WeakPolarHBondContact O-CB 3.4Å; K55-D59 VanDerWaalsContact O-CG 3.26Å; K55-D59 PolarHBondContact O-N 3.35Å; D59-K63 WeakPolarHBondContact O-CG 3.36Å
60N61.2Low61.8Low57 Ų57107.1 Ų107.131%0.30555%0.549SS..Hα-helixtrans-80.1-34.5175.6-72.4-30.2000113.1H56 E57 L58 T62 K63 T64H56-N60 PolarHBondContact CD2-ND2 3.25Å; H56-N60 PolarHBondContact CE1-ND2 3.06Å; H56-N60 PolarHBondContact ND1-ND2 3.48Å; H56-N60 PolarHBondContact NE2-ND2 3.13Å; H56-N60 VanDerWaalsContact NE2-ND2 3.17Å; H56-N60 WeakPolarHBondContact O-CB 3.38Å; H56-N60 PolarHBondContact O-N 3.41Å; H56-N60 PolarHBondContact O-ND2 3.04Å; E57-N60 PolarHBondContact O-N 3.03Å; L58-N60 PolarHBondContact O-N 3.47Å; N60-T62 PolarHBondContact O-N 3.21Å; N60-K63 PolarHBondContact O-N 2.84Å; N60-K63 VanDerWaalsContact O-N 3.13Å; N60-T64 PolarHBondContact O-OG1 2.87Å
61Q61.1Low60.8Low116 Ų116111.2 Ų111.254%0.54255%0.554SS.*Hα-helixtrans-60-35.8171.8-75.817328.600111.8E57 L58 K63 T64E57-Q61 WeakPolarHBondContact O-CG 3.45Å; E57-Q61 PolarHBondContact O-N 3.27Å; L58-Q61 PolarHBondContact O-N 2.04Å; Q61-K63 VanDerWaalsContact C-N 3.3Å; Q61-K63 PolarHBondContact O-N 3.34Å; Q61-T64 PolarHBondContact O-OG1 3.13Å
62T57.3Low60.2Low111 Ų111114.2 Ų114.268%0.68158%0.575SS**THydrogen-bonded Turntrans-75.4-16.7178.5-41.70000113.1L58 N60L58-T62 PolarHBondContact O-N 2.89Å; L58-T62 PolarHBondContact O-OG1 3.09Å; N60-T62 PolarHBondContact O-N 3.21Å
63K59.2Low59.7Low160 Ų160112.8 Ų112.870%0.69657%0.565SS**THydrogen-bonded Turntrans-88.2-12.5178-73.8173.6-171.4168.70113.8D59 N60 Q61D59-K63 WeakPolarHBondContact O-CG 3.36Å; N60-K63 PolarHBondContact O-N 2.84Å; N60-K63 VanDerWaalsContact O-N 3.13Å; Q61-K63 VanDerWaalsContact C-N 3.3Å; Q61-K63 PolarHBondContact O-N 3.34Å
64T53.6Low59.2Low118 Ų118113.2 Ų113.272%0.72456%0.563SS**  trans-104.94-178.832.40000114.5N60 Q61N60-T64 PolarHBondContact O-OG1 2.87Å; Q61-T64 PolarHBondContact O-OG1 3.13Å
65N50.6Low58.7Low208 Ų208113.6 Ų113.6100%1.11258%0.576SS**  trans-115.20173.3-73.1-14000112

Retrieved 65 of 65 residues in 103.9 ms (Link to these results)