| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 53.4 | Low | 77.2 | Confident | 228 Ų | 228 | 101.9 Ų | 101.9 | 100% | 1.123 | 60% | 0.595 | S | S | * | * | 0 | 50.5 | 0 | -66.6 | 175.1 | 176.4 | 0 | 0 | 111.6 | |||||
| 2 | A | 58.7 | Low | 78.2 | Confident | 80 Ų | 80 | 107.1 Ų | 107.1 | 66% | 0.661 | 60% | 0.599 | S | S | * | * | trans | -100.6 | -14.3 | -172.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | L6 | A2-L6 PolarHBondContact O-N 3.31Š| ||
| 3 | G | 61 | Low | 79 | Confident | 47 Ų | 47 | 104.3 Ų | 104.3 | 49% | 0.485 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -66.8 | -40.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | D5 V7 | G3-D5 PolarHBondContact O-N 3.17Å; G3-V7 WeakPolarHBondContact O-CG2 3.34Å; G3-V7 PolarHBondContact O-N 3.47Å |
| 4 | P | 68.5 | Low | 79.7 | Confident | 79 Ų | 79 | 102.9 Ų | 102.9 | 51% | 0.513 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66.8 | -35.1 | -178.7 | -20.7 | 32.3 | 0 | 0 | 0 | 113.5 | K8 | P4-K8 WeakPolarHBondContact O-CG 3.45Å; P4-K8 PolarHBondContact O-N 3.4Å |
| 5 | D | 78.4 | Confident | 80.3 | Confident | 96 Ų | 96 | 101.3 Ų | 101.3 | 51% | 0.513 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -79 | -34.9 | -177.4 | -67.8 | -28.6 | 0 | 0 | 0 | 112.1 | G3 V7 K8 T9 | G3-D5 PolarHBondContact O-N 3.17Å; D5-V7 PolarHBondContact O-N 3.36Å; D5-K8 PolarHBondContact O-N 2.93Å; D5-T9 WeakPolarHBondContact O-CB 3.36Å; D5-T9 PolarHBondContact O-N 3.39Å; D5-T9 PolarHBondContact O-OG1 3.01Å |
| 6 | L | 85.4 | Confident | 80.8 | Confident | 122 Ų | 122 | 99.7 Ų | 99.7 | 64% | 0.639 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -60.7 | -45.6 | 172.1 | -169.6 | 80.8 | 0 | 0 | 0 | 111.2 | A2 T9 V10 | A2-L6 PolarHBondContact O-N 3.31Å; L6-T9 PolarHBondContact O-N 3.49Å; L6-V10 VanDerWaalsContact O-CG2 3.29Å; L6-V10 WeakPolarHBondContact O-CG2 3.46Å; L6-V10 PolarHBondContact O-N 2.93Å |
| 7 | V | 86.3 | Confident | 81.1 | Confident | 92 Ų | 92 | 98.4 Ų | 98.4 | 56% | 0.558 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -63.7 | -43.7 | 179.1 | 174.2 | 0 | 0 | 0 | 0 | 110.9 | G3 D5 V10 V11 | G3-V7 WeakPolarHBondContact O-CG2 3.34Å; G3-V7 PolarHBondContact O-N 3.47Å; D5-V7 PolarHBondContact O-N 3.36Å; V7-V10 PolarHBondContact O-N 3.46Å; V7-V11 HydrophobicContact CG1-CG2 4.39Å; V7-V11 WeakPolarHBondContact O-CB 3.39Å; V7-V11 VanDerWaalsContact O-CG2 3.26Å; V7-V11 WeakPolarHBondContact O-CG2 3.29Å; V7-V11 PolarHBondContact O-N 3.39Å |
| 8 | K | 88.3 | Confident | 81.4 | Confident | 140 Ų | 140 | 98 Ų | 98 | 61% | 0.609 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.5 | -44.2 | 176.2 | -76 | 175.3 | -177.3 | 174.7 | 0 | 112.2 | P4 D5 V11 Y12 | P4-K8 WeakPolarHBondContact O-CG 3.45Å; P4-K8 PolarHBondContact O-N 3.4Å; D5-K8 PolarHBondContact O-N 2.93Å; K8-V11 PolarHBondContact O-N 3.39Å; K8-Y12 WeakPolarHBondContact O-CB 3.26Å; K8-Y12 PolarHBondContact O-N 2.88Å |
| 9 | T | 88.9 | Confident | 81.6 | Confident | 87 Ų | 87 | 101.1 Ų | 101.1 | 53% | 0.534 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.5 | -45.1 | 177.6 | -60.8 | 0 | 0 | 0 | 0 | 111.2 | D5 L6 V11 Y12 T13 | D5-T9 WeakPolarHBondContact O-CB 3.36Å; D5-T9 PolarHBondContact O-N 3.39Å; D5-T9 PolarHBondContact O-OG1 3.01Å; L6-T9 PolarHBondContact O-N 3.49Å; T9-V11 PolarHBondContact O-N 2.93Å; T9-Y12 PolarHBondContact O-N 3Å; T9-T13 PolarHBondContact O-N 2.89Å; T9-T13 PolarHBondContact O-OG1 3.36Å |
| 10 | V | 90.1 | Very high | 81.7 | Confident | 75 Ų | 75 | 100 Ų | 100 | 46% | 0.455 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 176.4 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | L6 V7 Y12 T13 I14 | L6-V10 VanDerWaalsContact O-CG2 3.29Å; L6-V10 WeakPolarHBondContact O-CG2 3.46Å; L6-V10 PolarHBondContact O-N 2.93Å; V7-V10 PolarHBondContact O-N 3.46Å; V10-Y12 VanDerWaalsContact C-N 3.34Å; V10-Y12 PolarHBondContact O-N 3.27Å; V10-T13 PolarHBondContact O-N 3.46Å; V10-I14 HydrophobicContact CG1-CD1 3.73Å; V10-I14 HydrophobicContact CG1-CG1 4.45Å; V10-I14 WeakPolarHBondContact O-CB 3.36Å; V10-I14 VanDerWaalsContact O-CG1 3.26Å; V10-I14 WeakPolarHBondContact O-CG1 3.49Å; V10-I14 PolarHBondContact O-N 3.47Å |
| 11 | V | 89.9 | Confident | 81.8 | Confident | 75 Ų | 75 | 102.6 Ų | 102.6 | 46% | 0.455 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.8 | -43.2 | 177.5 | 169.7 | 0 | 0 | 0 | 0 | 111.1 | V7 K8 T9 I14 N15 | V7-V11 HydrophobicContact CG1-CG2 4.39Å; V7-V11 WeakPolarHBondContact O-CB 3.39Å; V7-V11 VanDerWaalsContact O-CG2 3.26Å; V7-V11 WeakPolarHBondContact O-CG2 3.29Å; V7-V11 PolarHBondContact O-N 3.39Å; K8-V11 PolarHBondContact O-N 3.39Å; T9-V11 PolarHBondContact O-N 2.93Å; V11-I14 PolarHBondContact O-N 3.3Å; V11-N15 WeakPolarHBondContact O-CB 3.26Å; V11-N15 VanDerWaalsContact O-CG 3.26Å; V11-N15 PolarHBondContact O-N 2.94Å; V11-N15 PolarHBondContact O-ND2 3.37Å |
| 12 | Y | 89.9 | Confident | 83.2 | Confident | 164 Ų | 164 | 99.1 Ų | 99.1 | 64% | 0.643 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -61.2 | -47.9 | 176.7 | 177.6 | -96.5 | 0 | 0 | 0 | 111.8 | K8 T9 V10 I14 N15 N16 | K8-Y12 WeakPolarHBondContact O-CB 3.26Å; K8-Y12 PolarHBondContact O-N 2.88Å; T9-Y12 PolarHBondContact O-N 3Å; V10-Y12 VanDerWaalsContact C-N 3.34Å; V10-Y12 PolarHBondContact O-N 3.27Å; Y12-I14 PolarHBondContact O-N 2.92Å; Y12-N15 PolarHBondContact O-N 3.35Å; Y12-N16 WeakPolarHBondContact O-CB 3.49Å; Y12-N16 PolarHBondContact O-N 3.27Å |
| 13 | T | 88 | Confident | 84.4 | Confident | 71 Ų | 71 | 100 Ų | 100 | 44% | 0.436 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61 | -44.1 | 178 | -57.5 | 0 | 0 | 0 | 0 | 111.6 | T9 V10 N16 I17 | T9-T13 PolarHBondContact O-N 2.89Å; T9-T13 PolarHBondContact O-OG1 3.36Å; V10-T13 PolarHBondContact O-N 3.46Å; T13-N16 PolarHBondContact O-N 3.03Å; T13-I17 HydrophobicContact CG2-CD1 4.16Å; T13-I17 WeakPolarHBondContact O-CG1 3.4Å; T13-I17 PolarHBondContact O-N 3.43Å |
| 14 | I | 88.6 | Confident | 85.7 | Confident | 85 Ų | 85 | 104.1 Ų | 104.1 | 44% | 0.436 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.1 | -47.8 | 176.2 | -69.7 | 168.1 | 0 | 0 | 0 | 110.5 | V10 V11 Y12 N16 I17 L18 | V10-I14 HydrophobicContact CG1-CD1 3.73Å; V10-I14 HydrophobicContact CG1-CG1 4.45Å; V10-I14 WeakPolarHBondContact O-CB 3.36Å; V10-I14 VanDerWaalsContact O-CG1 3.26Å; V10-I14 WeakPolarHBondContact O-CG1 3.49Å; V10-I14 PolarHBondContact O-N 3.47Å; V11-I14 PolarHBondContact O-N 3.3Å; Y12-I14 PolarHBondContact O-N 2.92Å; I14-N16 VanDerWaalsContact C-N 3.29Å; I14-N16 PolarHBondContact O-N 3.2Å; I14-I17 PolarHBondContact O-N 3.15Å; I14-L18 HydrophobicContact CG2-CD1 3.94Å; I14-L18 HydrophobicContact CG2-CG 4.25Å; I14-L18 VanDerWaalsContact O-CG 3.29Å; I14-L18 WeakPolarHBondContact O-CG 3.38Å; I14-L18 PolarHBondContact O-N 3.23Å |
| 15 | N | 89.9 | Confident | 86.7 | Confident | 79 Ų | 79 | 102.1 Ų | 102.1 | 42% | 0.422 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.5 | -39.9 | 179.5 | -75.6 | -24.4 | 0 | 0 | 0 | 112.2 | V11 Y12 L18 Q19 | V11-N15 WeakPolarHBondContact O-CB 3.26Å; V11-N15 VanDerWaalsContact O-CG 3.26Å; V11-N15 PolarHBondContact O-N 2.94Å; V11-N15 PolarHBondContact O-ND2 3.37Å; Y12-N15 PolarHBondContact O-N 3.35Å; N15-L18 PolarHBondContact O-N 3.3Å; N15-Q19 WeakPolarHBondContact O-CG 3.29Å; N15-Q19 PolarHBondContact O-N 2.94Å; N15-Q19 VanDerWaalsContact O-N 3.15Å |
| 16 | N | 87.8 | Confident | 87.2 | Confident | 75 Ų | 75 | 100.3 Ų | 100.3 | 40% | 0.401 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.4 | -43.8 | 176.9 | -162.4 | 13.7 | 0 | 0 | 0 | 111.3 | Y12 T13 I14 L18 Q19 Q20 | Y12-N16 WeakPolarHBondContact O-CB 3.49Å; Y12-N16 PolarHBondContact O-N 3.27Å; T13-N16 PolarHBondContact O-N 3.03Å; I14-N16 VanDerWaalsContact C-N 3.29Å; I14-N16 PolarHBondContact O-N 3.2Å; N16-L18 VanDerWaalsContact C-N 3.31Å; N16-L18 PolarHBondContact O-N 3.4Å; N16-Q19 PolarHBondContact O-N 3.18Å; N16-Q20 WeakPolarHBondContact O-CG 3.46Å; N16-Q20 PolarHBondContact O-N 3.4Å |
| 17 | I | 85.7 | Confident | 87.6 | Confident | 77 Ų | 77 | 97 Ų | 97 | 40% | 0.395 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.2 | -41.1 | 174 | -67.7 | 167.2 | 0 | 0 | 0 | 111.3 | T13 I14 Q19 Q20 Y23 | T13-I17 HydrophobicContact CG2-CD1 4.16Å; T13-I17 WeakPolarHBondContact O-CG1 3.4Å; T13-I17 PolarHBondContact O-N 3.43Å; I14-I17 PolarHBondContact O-N 3.15Å; I17-Q19 PolarHBondContact O-N 2.9Å; I17-Q20 PolarHBondContact O-N 3.27Å; I17-Y23 HydrophobicContact CG2-CD2 4.26Å |
| 18 | L | 85.6 | Confident | 87.9 | Confident | 92 Ų | 92 | 94.4 Ų | 94.4 | 48% | 0.482 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.6 | -25.3 | 179 | -71.1 | 175.3 | 0 | 0 | 0 | 113.3 | I14 N15 N16 L27 | I14-L18 HydrophobicContact CG2-CD1 3.94Å; I14-L18 HydrophobicContact CG2-CG 4.25Å; I14-L18 VanDerWaalsContact O-CG 3.29Å; I14-L18 WeakPolarHBondContact O-CG 3.38Å; I14-L18 PolarHBondContact O-N 3.23Å; N15-L18 PolarHBondContact O-N 3.3Å; N16-L18 VanDerWaalsContact C-N 3.31Å; N16-L18 PolarHBondContact O-N 3.4Å; L18-L27 HydrophobicContact CD2-CD1 3.94Å; L18-L27 HydrophobicContact CD2-CD2 3.9Å; L18-L27 HydrophobicContact CD2-CG 4.49Å |
| 19 | Q | 86.1 | Confident | 88.3 | Confident | 156 Ų | 156 | 88.4 Ų | 88.4 | 73% | 0.729 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -87.1 | -12.1 | 179 | -71.3 | 176.5 | -2.4 | 0 | 0 | 113.3 | N15 N16 I17 E21 | N15-Q19 WeakPolarHBondContact O-CG 3.29Å; N15-Q19 PolarHBondContact O-N 2.94Å; N15-Q19 VanDerWaalsContact O-N 3.15Å; N16-Q19 PolarHBondContact O-N 3.18Å; I17-Q19 PolarHBondContact O-N 2.9Å; Q19-E21 PolarHBondContact O-N 3.48Å |
| 20 | Q | 84 | Confident | 88.6 | Confident | 79 Ų | 79 | 88.9 Ų | 88.9 | 37% | 0.369 | 46% | 0.458 | S | S | . | . | trans | -71.8 | 124.6 | -179.5 | -66.2 | -168.3 | 1.6 | 0 | 0 | 112.3 | N16 I17 K22 Y23 K24 | N16-Q20 WeakPolarHBondContact O-CG 3.46Å; N16-Q20 PolarHBondContact O-N 3.4Å; I17-Q20 PolarHBondContact O-N 3.27Å; Q20-K22 PolarHBondContact O-N 3.22Å; Q20-Y23 HydrophobicContact CB-CD2 4.08Å; Q20-Y23 PolarHBondContact O-N 2.86Å; Q20-K24 PolarHBondContact O-N 3.39Å | ||
| 21 | E | 82.7 | Confident | 88.8 | Confident | 155 Ų | 155 | 92.1 Ų | 92.1 | 72% | 0.724 | 47% | 0.466 | S | S | * | . | G | 310 helix | trans | -60.4 | -31.9 | 178.1 | -65.1 | -152.7 | 132.7 | 0 | 0 | 113.1 | Q19 Y23 K24 | Q19-E21 PolarHBondContact O-N 3.48Å; E21-Y23 PolarHBondContact O-N 3.12Å; E21-Y23 VanDerWaalsContact O-N 3.16Å; E21-K24 WeakPolarHBondContact O-CB 3.29Å; E21-K24 PolarHBondContact O-N 3.08Å; E21-K24 VanDerWaalsContact O-N 3.08Å |
| 22 | K | 83.1 | Confident | 89.1 | Confident | 155 Ų | 155 | 88.9 Ų | 88.9 | 67% | 0.674 | 45% | 0.448 | S | S | * | . | G | 310 helix | trans | -53.2 | -37.5 | 178.1 | -175 | -179.2 | 178.6 | -175.2 | 0 | 113 | Q20 | Q20-K22 PolarHBondContact O-N 3.22Š|
| 23 | Y | 84.8 | Confident | 89.5 | Confident | 98 Ų | 98 | 84.7 Ų | 84.7 | 38% | 0.384 | 43% | 0.433 | S | S | . | . | G | 310 helix | trans | -100.8 | -1.6 | -177.3 | -56.3 | -59.2 | 0 | 0 | 0 | 113.5 | I17 Q20 E21 A25 A26 L27 | I17-Y23 HydrophobicContact CG2-CD2 4.26Å; Q20-Y23 HydrophobicContact CB-CD2 4.08Å; Q20-Y23 PolarHBondContact O-N 2.86Å; E21-Y23 PolarHBondContact O-N 3.12Å; E21-Y23 VanDerWaalsContact O-N 3.16Å; Y23-A25 VanDerWaalsContact C-N 3.31Å; Y23-A25 PolarHBondContact O-N 3.2Å; Y23-A26 PolarHBondContact O-N 3.16Å; Y23-A26 VanDerWaalsContact O-N 3.12Å; Y23-L27 WeakPolarHBondContact O-CB 3.21Å; Y23-L27 VanDerWaalsContact O-CG 3.29Å; Y23-L27 WeakPolarHBondContact O-CG 3.33Å; Y23-L27 PolarHBondContact O-N 3.22Å |
| 24 | K | 88.3 | Confident | 89.9 | Confident | 134 Ų | 134 | 87.9 Ų | 87.9 | 58% | 0.583 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -53.9 | -43.4 | -172.8 | -170.9 | 176.1 | -176.1 | 177 | 0 | 113.1 | Q20 E21 A28 | Q20-K24 PolarHBondContact O-N 3.39Å; E21-K24 WeakPolarHBondContact O-CB 3.29Å; E21-K24 PolarHBondContact O-N 3.08Å; E21-K24 VanDerWaalsContact O-N 3.08Å; K24-A28 WeakPolarHBondContact O-CB 3.24Å; K24-A28 PolarHBondContact O-N 3.49Å |
| 25 | A | 88.6 | Confident | 90.4 | Very high | 37 Ų | 37 | 87.3 Ų | 87.3 | 31% | 0.306 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -64.6 | -48.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y23 A28 V29 A90 | Y23-A25 VanDerWaalsContact C-N 3.31Å; Y23-A25 PolarHBondContact O-N 3.2Å; A25-A28 PolarHBondContact O-N 3.47Å; A25-V29 WeakPolarHBondContact O-CG2 3.45Å; A25-V29 PolarHBondContact O-N 2.84Å; A25-A90 HydrophobicContact CB-CB 4.09Å |
| 26 | A | 90.3 | Very high | 90.6 | Very high | 58 Ų | 58 | 83.9 Ų | 83.9 | 48% | 0.479 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -64 | -43.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y23 A28 V29 V30 | Y23-A26 PolarHBondContact O-N 3.16Å; Y23-A26 VanDerWaalsContact O-N 3.12Å; A26-A28 VanDerWaalsContact C-N 3.31Å; A26-A28 PolarHBondContact O-N 2.89Å; A26-V29 WeakPolarHBondContact O-CB 3.42Å; A26-V29 PolarHBondContact O-N 3.41Å; A26-V30 WeakPolarHBondContact O-CG2 3.19Å; A26-V30 PolarHBondContact O-N 3.34Å |
| 27 | L | 92.8 | Very high | 91.1 | Very high | 53 Ų | 53 | 81.8 Ų | 81.8 | 28% | 0.277 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -63.4 | -36.8 | 175.6 | -67.3 | 173.6 | 0 | 0 | 0 | 111.9 | L18 Y23 V30 K31 | L18-L27 HydrophobicContact CD2-CD1 3.94Å; L18-L27 HydrophobicContact CD2-CD2 3.9Å; L18-L27 HydrophobicContact CD2-CG 4.49Å; Y23-L27 WeakPolarHBondContact O-CB 3.21Å; Y23-L27 VanDerWaalsContact O-CG 3.29Å; Y23-L27 WeakPolarHBondContact O-CG 3.33Å; Y23-L27 PolarHBondContact O-N 3.22Å; L27-V30 PolarHBondContact O-N 3.42Å; L27-K31 VanDerWaalsContact O-CB 3.24Å; L27-K31 WeakPolarHBondContact O-CB 3.41Å; L27-K31 PolarHBondContact O-N 3.43Å |
| 28 | A | 93.3 | Very high | 91.6 | Very high | 37 Ų | 37 | 80.2 Ų | 80.2 | 31% | 0.306 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -67 | -36.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | K24 A25 A26 G32 K86 | K24-A28 WeakPolarHBondContact O-CB 3.24Å; K24-A28 PolarHBondContact O-N 3.49Å; A25-A28 PolarHBondContact O-N 3.47Å; A26-A28 VanDerWaalsContact C-N 3.31Å; A26-A28 PolarHBondContact O-N 2.89Å; A28-G32 WeakPolarHBondContact O-CA 3.47Å; A28-G32 PolarHBondContact O-N 3Å; A28-K86 WeakPolarHBondContact O-CD 3.39Å |
| 29 | V | 95.1 | Very high | 92.1 | Very high | 14 Ų | 14 | 82.4 Ų | 82.4 | 9% | 0.085 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -63.2 | -49.6 | 172.6 | 171.2 | 0 | 0 | 0 | 0 | 110.3 | A25 A26 G32 F33 F83 K86 | A25-V29 WeakPolarHBondContact O-CG2 3.45Å; A25-V29 PolarHBondContact O-N 2.84Å; A26-V29 WeakPolarHBondContact O-CB 3.42Å; A26-V29 PolarHBondContact O-N 3.41Å; V29-G32 PolarHBondContact O-N 3.02Å; V29-F33 PolarHBondContact O-N 3.43Å; V29-F83 HydrophobicContact CG1-CD2 3.23Å; V29-F83 HydrophobicContact CG1-CE2 3.48Å; V29-F83 VanDerWaalsContact CG1-CE2 3.48Å; V29-F83 HydrophobicContact CG1-CG 4.02Å; V29-F83 HydrophobicContact CG1-CZ 4.43Å; V29-K86 HydrophobicContact CG2-CB 3.67Å |
| 30 | V | 95.4 | Very high | 92.5 | Very high | 97 Ų | 97 | 75 Ų | 75 | 59% | 0.588 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -62.9 | -47.8 | 179.6 | 174.5 | 0 | 0 | 0 | 0 | 111.6 | A26 L27 G32 F33 R34 | A26-V30 WeakPolarHBondContact O-CG2 3.19Å; A26-V30 PolarHBondContact O-N 3.34Å; L27-V30 PolarHBondContact O-N 3.42Å; V30-G32 VanDerWaalsContact C-N 3.29Å; V30-G32 PolarHBondContact O-N 3.02Å; V30-F33 PolarHBondContact O-N 3.02Å; V30-R34 PolarHBondContact O-N 3.23Å |
| 31 | K | 95.6 | Very high | 93.1 | Very high | 143 Ų | 143 | 73 Ų | 73 | 62% | 0.622 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -62.8 | -38.3 | 176.5 | -174.1 | 171.8 | -177.1 | 173.7 | 0 | 111.3 | L27 R34 N35 | L27-K31 VanDerWaalsContact O-CB 3.24Å; L27-K31 WeakPolarHBondContact O-CB 3.41Å; L27-K31 PolarHBondContact O-N 3.43Å; K31-R34 PolarHBondContact O-N 2.85Å; K31-N35 WeakPolarHBondContact O-CB 3.31Å; K31-N35 PolarHBondContact O-N 3.25Å; K31-N35 PolarHBondContact O-OD1 2.86Å |
| 32 | G | 96.1 | Very high | 93.7 | Very high | 7 Ų | 7 | 72.7 Ų | 72.7 | 7% | 0.072 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -61.8 | -48.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | A28 V29 V30 R34 N35 G36 V82 | A28-G32 WeakPolarHBondContact O-CA 3.47Å; A28-G32 PolarHBondContact O-N 3Å; V29-G32 PolarHBondContact O-N 3.02Å; V30-G32 VanDerWaalsContact C-N 3.29Å; V30-G32 PolarHBondContact O-N 3.02Å; G32-R34 PolarHBondContact O-N 2.86Å; G32-N35 PolarHBondContact O-N 2.93Å; G32-G36 PolarHBondContact O-N 3.03Å; G32-V82 VanDerWaalsContact C-CG1 3.41Å; G32-V82 VanDerWaalsContact CA-CG1 3.46Å |
| 33 | F | 97.6 | Very high | 94.2 | Very high | 76 Ų | 76 | 69.7 Ų | 69.7 | 33% | 0.333 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -56.2 | -50.5 | 174.8 | 177.2 | -90.1 | 0 | 0 | 0 | 111.3 | V29 V30 N35 G36 A37 A79 Y80 F83 | V29-F33 PolarHBondContact O-N 3.43Å; V30-F33 PolarHBondContact O-N 3.02Å; F33-N35 VanDerWaalsContact C-N 3.3Å; F33-N35 PolarHBondContact O-N 3.46Å; F33-G36 PolarHBondContact O-N 3.38Å; F33-A37 PolarHBondContact O-N 2.97Å; F33-A79 HydrophobicContact CD1-CB 4.42Å; F33-A79 HydrophobicContact CD2-CB 3.56Å; F33-A79 WeakPolarHBondContact CD2-O 3.28Å; F33-A79 HydrophobicContact CE1-CB 4.37Å; F33-A79 HydrophobicContact CE2-CB 3.51Å; F33-A79 HydrophobicContact CG-CB 4.04Å; F33-A79 HydrophobicContact CZ-CB 3.94Å; F33-A79 WeakPolarHBondContact O-CB 3.39Å; F33-Y80 HydrophobicContact CE2-CD1 4.21Å; F33-Y80 HydrophobicContact CE2-CD2 4.41Å; F33-Y80 HydrophobicContact CE2-CE1 4.15Å; F33-Y80 HydrophobicContact CE2-CE2 4.35Å; F33-Y80 HydrophobicContact CE2-CG 4.34Å; F33-F83 HydrophobicContact CB-CB 4.34Å; F33-F83 HydrophobicContact CD2-CB 3.97Å |
| 34 | R | 97.5 | Very high | 94.6 | Very high | 139 Ų | 139 | 66.5 Ų | 66.5 | 53% | 0.525 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -58.2 | -42.8 | 176.4 | 178.5 | -89.5 | 175.5 | -157.5 | 0.8 | 111.6 | V30 K31 G32 A37 V38 | V30-R34 PolarHBondContact O-N 3.23Å; K31-R34 PolarHBondContact O-N 2.85Å; G32-R34 PolarHBondContact O-N 2.86Å; R34-A37 PolarHBondContact O-N 3.2Å; R34-V38 HydrophobicContact CG-CG2 4.46Å; R34-V38 WeakPolarHBondContact O-CB 3.4Å; R34-V38 WeakPolarHBondContact O-CG2 3.42Å; R34-V38 PolarHBondContact O-N 3.35Å |
| 35 | N | 97.5 | Very high | 94.9 | Very high | 73 Ų | 73 | 61.8 Ų | 61.8 | 39% | 0.39 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -65.3 | -41.5 | 179.2 | -76.3 | -7 | 0 | 0 | 0 | 111.7 | K31 G32 F33 V38 Y39 | K31-N35 WeakPolarHBondContact O-CB 3.31Å; K31-N35 PolarHBondContact O-N 3.25Å; K31-N35 PolarHBondContact O-OD1 2.86Å; G32-N35 PolarHBondContact O-N 2.93Å; F33-N35 VanDerWaalsContact C-N 3.3Å; F33-N35 PolarHBondContact O-N 3.46Å; N35-V38 PolarHBondContact O-N 3.17Å; N35-Y39 WeakPolarHBondContact O-CB 3.34Å; N35-Y39 PolarHBondContact O-N 3.25Å |
| 36 | G | 95.8 | Very high | 95.3 | Very high | 7 Ų | 7 | 63.5 Ų | 63.5 | 7% | 0.072 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.4 | -46.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | G32 F33 G40 | G32-G36 PolarHBondContact O-N 3.03Å; F33-G36 PolarHBondContact O-N 3.38Å; G36-G40 PolarHBondContact O-N 2.98Å |
| 37 | A | 96.9 | Very high | 95.3 | Very high | 31 Ų | 31 | 64.9 Ų | 64.9 | 26% | 0.256 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.9 | -49.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | F33 R34 A41 S75 A79 | F33-A37 PolarHBondContact O-N 2.97Å; R34-A37 PolarHBondContact O-N 3.2Å; A37-A41 WeakPolarHBondContact O-CB 3.43Å; A37-A41 PolarHBondContact O-N 2.88Å; A37-S75 WeakPolarHBondContact O-CB 3.27Å; A37-A79 HydrophobicContact CB-CB 3.99Å |
| 38 | V | 97.3 | Very high | 95.3 | Very high | 43 Ų | 43 | 62.6 Ų | 62.6 | 26% | 0.261 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -68.7 | -43.1 | -177.4 | 168.7 | 0 | 0 | 0 | 0 | 111.8 | R34 N35 A41 K42 | R34-V38 HydrophobicContact CG-CG2 4.46Å; R34-V38 WeakPolarHBondContact O-CB 3.4Å; R34-V38 WeakPolarHBondContact O-CG2 3.42Å; R34-V38 PolarHBondContact O-N 3.35Å; N35-V38 PolarHBondContact O-N 3.17Å; V38-A41 PolarHBondContact O-N 3.48Å; V38-K42 HydrophobicContact CG1-CD 4.06Å; V38-K42 HydrophobicContact CG1-CG 4.43Å; V38-K42 WeakPolarHBondContact O-CB 3.46Å; V38-K42 VanDerWaalsContact O-CG 3.28Å; V38-K42 WeakPolarHBondContact O-CG 3.37Å; V38-K42 PolarHBondContact O-N 2.86Å |
| 39 | Y | 96.1 | Very high | 95.3 | Very high | 139 Ų | 139 | 65 Ų | 65 | 55% | 0.545 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -64.2 | -46.4 | 178 | 178.8 | -102.2 | 0 | 0 | 0 | 111.1 | N35 A41 K42 I43 L78 | N35-Y39 WeakPolarHBondContact O-CB 3.34Å; N35-Y39 PolarHBondContact O-N 3.25Å; Y39-A41 VanDerWaalsContact C-N 3.3Å; Y39-A41 PolarHBondContact O-N 3.48Å; Y39-K42 PolarHBondContact O-N 3.3Å; Y39-I43 HydrophobicContact CD2-CG1 4.33Å; Y39-I43 HydrophobicContact CE1-CG1 4.27Å; Y39-I43 HydrophobicContact CE2-CD1 4.32Å; Y39-I43 HydrophobicContact CE2-CG1 3.87Å; Y39-I43 PolarHBondContact O-N 3.2Å; Y39-I43 VanDerWaalsContact O-N 3.12Å; Y39-L78 HydrophobicContact CD1-CD1 4.1Å |
| 40 | G | 94 | Very high | 95.2 | Very high | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -57.9 | -43 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G36 R44 H74 S75 | G36-G40 PolarHBondContact O-N 2.98Å; G40-R44 WeakPolarHBondContact O-CB 3.49Å; G40-R44 PolarHBondContact O-N 3.2Å; G40-H74 PolarHBondContact O-CD2 3.44Å; G40-S75 VanDerWaalsContact C-OG 3.26Å |
| 41 | A | 95.9 | Very high | 94.9 | Very high | 36 Ų | 36 | 65.7 Ų | 65.7 | 30% | 0.298 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -65.3 | -46 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | A37 V38 Y39 I43 A45 T71 S75 | A37-A41 WeakPolarHBondContact O-CB 3.43Å; A37-A41 PolarHBondContact O-N 2.88Å; V38-A41 PolarHBondContact O-N 3.48Å; Y39-A41 VanDerWaalsContact C-N 3.3Å; Y39-A41 PolarHBondContact O-N 3.48Å; A41-I43 VanDerWaalsContact C-N 3.31Å; A41-I43 PolarHBondContact O-N 3.31Å; A41-A45 WeakPolarHBondContact O-CB 3.12Å; A41-A45 PolarHBondContact O-N 3.03Å; A41-T71 HydrophobicContact CB-CG2 4.15Å; A41-S75 VanDerWaalsContact CA-OG 3.31Å; A41-S75 WeakPolarHBondContact CA-OG 3.4Å; A41-S75 PolarHBondContact N-OG 2.95Å |
| 42 | K | 95.6 | Very high | 94.6 | Very high | 150 Ų | 150 | 59.7 Ų | 59.7 | 65% | 0.652 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -60.1 | -36.7 | -178.6 | -79.1 | -178.8 | 175.4 | -165.8 | 0 | 113.5 | V38 Y39 P46 | V38-K42 HydrophobicContact CG1-CD 4.06Å; V38-K42 HydrophobicContact CG1-CG 4.43Å; V38-K42 WeakPolarHBondContact O-CB 3.46Å; V38-K42 VanDerWaalsContact O-CG 3.28Å; V38-K42 WeakPolarHBondContact O-CG 3.37Å; V38-K42 PolarHBondContact O-N 2.86Å; Y39-K42 PolarHBondContact O-N 3.3Å; K42-P46 WeakPolarHBondContact O-CD 3.33Å; K42-P46 VanDerWaalsContact O-CG 3.3Å; K42-P46 WeakPolarHBondContact O-CG 3.5Å |
| 43 | I | 92.9 | Very high | 94.2 | Very high | 91 Ų | 91 | 64 Ų | 64 | 47% | 0.467 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -87.5 | -44.6 | -179.9 | -59.9 | -58.9 | 0 | 0 | 0 | 111.1 | Y39 A41 | Y39-I43 HydrophobicContact CD2-CG1 4.33Å; Y39-I43 HydrophobicContact CE1-CG1 4.27Å; Y39-I43 HydrophobicContact CE2-CD1 4.32Å; Y39-I43 HydrophobicContact CE2-CG1 3.87Å; Y39-I43 PolarHBondContact O-N 3.2Å; Y39-I43 VanDerWaalsContact O-N 3.12Å; A41-I43 VanDerWaalsContact C-N 3.31Å; A41-I43 PolarHBondContact O-N 3.31Å |
| 44 | R | 93.5 | Very high | 93.6 | Very high | 32 Ų | 32 | 65.8 Ų | 65.8 | 12% | 0.121 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -76.7 | -35.5 | -172.2 | -171 | 59 | 173.5 | -175.8 | -4.2 | 113.3 | G40 H47 A48 H74 Q125 | G40-R44 WeakPolarHBondContact O-CB 3.49Å; G40-R44 PolarHBondContact O-N 3.2Å; R44-H47 PolarHBondContact NH1-CE1 2.87Å; R44-H47 PolarHBondContact NH1-ND1 2.95Å; R44-H47 VanDerWaalsContact NH1-ND1 3.18Å; R44-H47 PolarHBondContact O-N 3.25Å; R44-A48 WeakPolarHBondContact O-CB 3.45Å; R44-A48 PolarHBondContact O-N 3.32Å; R44-H74 HydrophobicContact CB-CB 4Å; R44-H74 HydrophobicContact CG-CB 3.75Å; R44-Q125 VanDerWaalsContact CZ-OE1 3.25Å |
| 45 | A | 95.4 | Very high | 93 | Very high | 34 Ų | 34 | 62.2 Ų | 62.2 | 28% | 0.281 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -62.3 | -49.9 | -177 | 0 | 0 | 0 | 0 | 0 | 112.3 | A41 H47 A48 L49 T71 | A41-A45 WeakPolarHBondContact O-CB 3.12Å; A41-A45 PolarHBondContact O-N 3.03Å; A45-H47 PolarHBondContact O-N 3.27Å; A45-A48 PolarHBondContact O-N 3.08Å; A45-L49 VanDerWaalsContact O-CB 3.26Å; A45-L49 WeakPolarHBondContact O-CB 3.32Å; A45-L49 PolarHBondContact O-N 3.5Å; A45-T71 WeakPolarHBondContact CA-OG1 3.3Å; A45-T71 HydrophobicContact CB-CG2 3.82Å |
| 46 | P | 95.9 | Very high | 92.3 | Very high | 73 Ų | 73 | 65 Ų | 65 | 47% | 0.474 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 176.7 | -22.9 | 34.9 | 0 | 0 | 0 | 112.4 | K42 L49 V50 | K42-P46 WeakPolarHBondContact O-CD 3.33Å; K42-P46 VanDerWaalsContact O-CG 3.3Å; K42-P46 WeakPolarHBondContact O-CG 3.5Å; P46-L49 WeakPolarHBondContact O-CB 3.47Å; P46-L49 PolarHBondContact O-N 2.8Å; P46-V50 WeakPolarHBondContact O-CG2 3.38Å; P46-V50 PolarHBondContact O-N 2.97Å |
| 47 | H | 91.8 | Very high | 91.5 | Very high | 87 Ų | 87 | 70.2 Ų | 70.2 | 40% | 0.403 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -62 | -48.8 | 178.7 | 175.8 | -83.9 | 0 | 0 | 0 | 112.1 | R44 A45 L49 V50 M51 | R44-H47 PolarHBondContact NH1-CE1 2.87Å; R44-H47 PolarHBondContact NH1-ND1 2.95Å; R44-H47 VanDerWaalsContact NH1-ND1 3.18Å; R44-H47 PolarHBondContact O-N 3.25Å; A45-H47 PolarHBondContact O-N 3.27Å; H47-L49 VanDerWaalsContact C-N 3.28Å; H47-L49 PolarHBondContact O-N 3.46Å; H47-V50 PolarHBondContact O-N 2.9Å; H47-M51 WeakPolarHBondContact O-CB 3.35Å; H47-M51 VanDerWaalsContact O-CG 3.27Å; H47-M51 WeakPolarHBondContact O-CG 3.38Å; H47-M51 PolarHBondContact O-N 3.46Å |
| 48 | A | 91.9 | Very high | 91 | Very high | 6 Ų | 6 | 71.3 Ų | 71.3 | 5% | 0.05 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -64.2 | -36.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | R44 A45 T52 I67 A70 | R44-A48 WeakPolarHBondContact O-CB 3.45Å; R44-A48 PolarHBondContact O-N 3.32Å; A45-A48 PolarHBondContact O-N 3.08Å; A48-T52 WeakPolarHBondContact O-CB 3.32Å; A48-T52 PolarHBondContact O-N 2.91Å; A48-T52 PolarHBondContact O-OG1 2.89Å; A48-I67 HydrophobicContact CB-CG2 4.27Å; A48-A70 HydrophobicContact CB-CB 4.33Å |
| 49 | L | 93.9 | Very high | 90.8 | Very high | 87 Ų | 87 | 71.9 Ų | 71.9 | 46% | 0.455 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.3 | -58.6 | 174.1 | -175.6 | 155.3 | 0 | 0 | 0 | 110.4 | A45 P46 H47 M51 T52 F53 I67 | A45-L49 VanDerWaalsContact O-CB 3.26Å; A45-L49 WeakPolarHBondContact O-CB 3.32Å; A45-L49 PolarHBondContact O-N 3.5Å; P46-L49 WeakPolarHBondContact O-CB 3.47Å; P46-L49 PolarHBondContact O-N 2.8Å; H47-L49 VanDerWaalsContact C-N 3.28Å; H47-L49 PolarHBondContact O-N 3.46Å; L49-M51 PolarHBondContact O-N 2.91Å; L49-T52 PolarHBondContact O-N 3.24Å; L49-F53 HydrophobicContact CD2-CD2 4.19Å; L49-F53 HydrophobicContact CG-CD2 4.11Å; L49-F53 HydrophobicContact CG-CE2 4.26Å; L49-F53 WeakPolarHBondContact O-CD2 3.46Å; L49-F53 PolarHBondContact O-N 2.94Å; L49-I67 HydrophobicContact CB-CD1 4.28Å; L49-I67 HydrophobicContact CG-CD1 4.42Å |
| 50 | V | 92.5 | Very high | 90.6 | Very high | 77 Ų | 77 | 71 Ų | 71 | 47% | 0.467 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -57.8 | -50.3 | -177.6 | 171.8 | 0 | 0 | 0 | 0 | 110.9 | P46 H47 T52 F53 L54 | P46-V50 WeakPolarHBondContact O-CG2 3.38Å; P46-V50 PolarHBondContact O-N 2.97Å; H47-V50 PolarHBondContact O-N 2.9Å; V50-T52 VanDerWaalsContact C-N 3.33Å; V50-T52 PolarHBondContact O-N 3.33Å; V50-F53 PolarHBondContact O-N 3.43Å; V50-L54 HydrophobicContact CG1-CD1 3.52Å; V50-L54 HydrophobicContact CG1-CG 4.29Å; V50-L54 WeakPolarHBondContact O-CB 3.27Å; V50-L54 VanDerWaalsContact O-CG 3.3Å; V50-L54 WeakPolarHBondContact O-CG 3.25Å; V50-L54 PolarHBondContact O-N 3.47Å |
| 51 | M | 88.9 | Confident | 90.5 | Very high | 49 Ų | 49 | 77.9 Ų | 77.9 | 24% | 0.241 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -63.7 | -36.9 | -178.9 | -67.2 | -58.3 | -69.9 | 0 | 0 | 113 | H47 L49 F55 | H47-M51 WeakPolarHBondContact O-CB 3.35Å; H47-M51 VanDerWaalsContact O-CG 3.27Å; H47-M51 WeakPolarHBondContact O-CG 3.38Å; H47-M51 PolarHBondContact O-N 3.46Å; L49-M51 PolarHBondContact O-N 2.91Å; M51-F55 HydrophobicContact CE-CD2 3.5Å; M51-F55 VanDerWaalsContact CE-CD2 3.5Å; M51-F55 HydrophobicContact CE-CE2 3.57Å; M51-F55 PolarHBondContact O-N 3.24Å; M51-F55 HydrophobicContact SD-CD2 4Å; M51-F55 HydrophobicContact SD-CE2 3.82Å |
| 52 | T | 89.3 | Confident | 90.3 | Very high | 16 Ų | 16 | 79.6 Ų | 79.6 | 10% | 0.098 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -71.6 | -38.4 | 179.5 | -60.3 | 0 | 0 | 0 | 0 | 111.6 | A48 L49 V50 R56 K63 I67 | A48-T52 WeakPolarHBondContact O-CB 3.32Å; A48-T52 PolarHBondContact O-N 2.91Å; A48-T52 PolarHBondContact O-OG1 2.89Å; L49-T52 PolarHBondContact O-N 3.24Å; V50-T52 VanDerWaalsContact C-N 3.33Å; V50-T52 PolarHBondContact O-N 3.33Å; T52-R56 HydrophobicContact CG2-CB 3.99Å; T52-R56 WeakPolarHBondContact O-CB 3.29Å; T52-R56 PolarHBondContact O-N 3.36Å; T52-R56 VanDerWaalsContact O-N 3.15Å; T52-K63 HydrophobicContact CG2-CB 3.68Å; T52-K63 HydrophobicContact CG2-CD 4.28Å; T52-K63 HydrophobicContact CG2-CG 3.79Å; T52-I67 HydrophobicContact CG2-CD1 4.35Å; T52-I67 HydrophobicContact CG2-CG1 4.25Å |
| 53 | F | 88.5 | Confident | 90.2 | Very high | 97 Ų | 97 | 73.9 Ų | 73.9 | 43% | 0.425 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -74.8 | -32.5 | 178.5 | -83.7 | -84.2 | 0 | 0 | 0 | 112.7 | L49 V50 L60 K63 I67 | L49-F53 HydrophobicContact CD2-CD2 4.19Å; L49-F53 HydrophobicContact CG-CD2 4.11Å; L49-F53 HydrophobicContact CG-CE2 4.26Å; L49-F53 WeakPolarHBondContact O-CD2 3.46Å; L49-F53 PolarHBondContact O-N 2.94Å; V50-F53 PolarHBondContact O-N 3.43Å; F53-L60 HydrophobicContact CE1-CD2 4.17Å; F53-L60 HydrophobicContact CZ-CD2 4.49Å; F53-K63 HydrophobicContact CD1-CD 4.34Å; F53-K63 HydrophobicContact CE1-CD 4.25Å; F53-I67 HydrophobicContact CD2-CD1 4.35Å; F53-I67 HydrophobicContact CE2-CD1 3.95Å |
| 54 | L | 85.6 | Confident | 90.3 | Very high | 114 Ų | 114 | 74.4 Ų | 74.4 | 60% | 0.597 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -73.7 | -48.8 | 176.8 | -73 | 172.8 | 0 | 0 | 0 | 113 | V50 | V50-L54 HydrophobicContact CG1-CD1 3.52Å; V50-L54 HydrophobicContact CG1-CG 4.29Å; V50-L54 WeakPolarHBondContact O-CB 3.27Å; V50-L54 VanDerWaalsContact O-CG 3.3Å; V50-L54 WeakPolarHBondContact O-CG 3.25Å; V50-L54 PolarHBondContact O-N 3.47Å |
| 55 | F | 83.3 | Confident | 90.3 | Very high | 65 Ų | 65 | 80.1 Ų | 80.1 | 29% | 0.285 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -116.1 | -8.6 | -164.2 | -59.6 | -63.9 | 0 | 0 | 0 | 114.9 | M51 S184 Y188 | M51-F55 HydrophobicContact CE-CD2 3.5Å; M51-F55 VanDerWaalsContact CE-CD2 3.5Å; M51-F55 HydrophobicContact CE-CE2 3.57Å; M51-F55 PolarHBondContact O-N 3.24Å; M51-F55 HydrophobicContact SD-CD2 4Å; M51-F55 HydrophobicContact SD-CE2 3.82Å; F55-S184 VanDerWaalsContact CD1-OG 3.25Å; F55-S184 WeakPolarHBondContact CD1-OG 3.13Å; F55-S184 WeakPolarHBondContact CG-OG 3.43Å; F55-Y188 HydrophobicContact CE1-CD2 4.21Å; F55-Y188 HydrophobicContact CE1-CG 4.07Å |
| 56 | R | 82.9 | Confident | 90.2 | Very high | 131 Ų | 131 | 79.3 Ų | 79.3 | 49% | 0.494 | 42% | 0.418 | S | S | . | . | trans | -105.6 | 126.8 | -178.8 | -162.3 | -178.6 | -178.1 | 149.9 | -2.2 | 112 | T52 K63 | T52-R56 HydrophobicContact CG2-CB 3.99Å; T52-R56 WeakPolarHBondContact O-CB 3.29Å; T52-R56 PolarHBondContact O-N 3.36Å; T52-R56 VanDerWaalsContact O-N 3.15Å; R56-K63 WeakPolarHBondContact O-CE 3.39Å; R56-K63 PolarHBondContact O-NZ 3.4Å | ||
| 57 | S | 80.2 | Confident | 90.1 | Very high | 116 Ų | 116 | 76.6 Ų | 76.6 | 81% | 0.811 | 40% | 0.399 | S | S | * | . | trans | -88.1 | 152 | 169.5 | -57.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 58 | G | 86.7 | Confident | 90.3 | Very high | 54 Ų | 54 | 77 Ų | 77 | 56% | 0.557 | 41% | 0.407 | S | S | * | . | S | Bend | trans | 133.4 | -179.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114 | K63 | G58-K63 WeakPolarHBondContact O-CE 3.34Š|
| 59 | S | 91.9 | Very high | 90.5 | Very high | 55 Ų | 55 | 84.4 Ų | 84.4 | 39% | 0.385 | 44% | 0.438 | S | S | . | . | trans | -65.1 | 154.2 | -177.9 | 80 | 0 | 0 | 0 | 0 | 112.3 | K61 D62 K63 | S59-K61 PolarHBondContact O-N 3.43Å; S59-K61 PolarHBondContact OG-N 3.39Å; S59-D62 PolarHBondContact O-N 2.85Å; S59-D62 VanDerWaalsContact O-N 3.1Å; S59-D62 PolarHBondContact OG-N 3.39Å; S59-D62 VanDerWaalsContact OG-N 3.14Å; S59-D62 PolarHBondContact OG-OD2 3.45Å; S59-K63 WeakPolarHBondContact O-CG 3.3Å; S59-K63 PolarHBondContact O-N 2.94Å | ||
| 60 | L | 91.8 | Very high | 90.5 | Very high | 120 Ų | 120 | 81.1 Ų | 81.1 | 63% | 0.628 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -56.4 | -36.4 | 174.4 | -69.4 | 177 | 0 | 0 | 0 | 111.8 | F53 D62 K63 L64 | F53-L60 HydrophobicContact CE1-CD2 4.17Å; F53-L60 HydrophobicContact CZ-CD2 4.49Å; L60-D62 PolarHBondContact O-N 3.37Å; L60-K63 PolarHBondContact O-N 2.93Å; L60-L64 WeakPolarHBondContact O-CB 3.31Å; L60-L64 VanDerWaalsContact O-CG 3.29Å; L60-L64 WeakPolarHBondContact O-CG 3.21Å; L60-L64 PolarHBondContact O-N 2.86Å |
| 61 | K | 92.5 | Very high | 90.6 | Very high | 146 Ų | 146 | 78.3 Ų | 78.3 | 64% | 0.635 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -62.5 | -42.8 | 177.4 | -171.1 | 176.6 | -178.1 | 177.1 | 0 | 111.8 | S59 R65 | S59-K61 PolarHBondContact O-N 3.43Å; S59-K61 PolarHBondContact OG-N 3.39Å; K61-R65 VanDerWaalsContact O-CB 3.3Å; K61-R65 WeakPolarHBondContact O-CB 3.18Å; K61-R65 PolarHBondContact O-N 3.14Å |
| 62 | D | 91.9 | Very high | 91 | Very high | 71 Ų | 71 | 82.8 Ų | 82.8 | 38% | 0.38 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -70.2 | -38.6 | 179.1 | -62.5 | -43.7 | 0 | 0 | 0 | 112 | S59 L60 R65 A66 | S59-D62 PolarHBondContact O-N 2.85Å; S59-D62 VanDerWaalsContact O-N 3.1Å; S59-D62 PolarHBondContact OG-N 3.39Å; S59-D62 VanDerWaalsContact OG-N 3.14Å; S59-D62 PolarHBondContact OG-OD2 3.45Å; L60-D62 PolarHBondContact O-N 3.37Å; D62-R65 PolarHBondContact O-N 3.12Å; D62-A66 WeakPolarHBondContact O-CB 3.31Å; D62-A66 PolarHBondContact O-N 2.97Å |
| 63 | K | 92.3 | Very high | 91.2 | Very high | 31 Ų | 31 | 83.4 Ų | 83.4 | 14% | 0.135 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -61.6 | -49.8 | 174 | -66.8 | -170.2 | -171.6 | -156.5 | 0 | 111.2 | T52 F53 R56 G58 S59 L60 R65 A66 I67 | T52-K63 HydrophobicContact CG2-CB 3.68Å; T52-K63 HydrophobicContact CG2-CD 4.28Å; T52-K63 HydrophobicContact CG2-CG 3.79Å; F53-K63 HydrophobicContact CD1-CD 4.34Å; F53-K63 HydrophobicContact CE1-CD 4.25Å; R56-K63 WeakPolarHBondContact O-CE 3.39Å; R56-K63 PolarHBondContact O-NZ 3.4Å; G58-K63 WeakPolarHBondContact O-CE 3.34Å; S59-K63 WeakPolarHBondContact O-CG 3.3Å; S59-K63 PolarHBondContact O-N 2.94Å; L60-K63 PolarHBondContact O-N 2.93Å; K63-R65 PolarHBondContact O-N 2.87Å; K63-A66 WeakPolarHBondContact O-CB 3.17Å; K63-A66 PolarHBondContact O-N 2.98Å; K63-I67 WeakPolarHBondContact O-CD1 3.35Å; K63-I67 VanDerWaalsContact O-CG1 3.27Å; K63-I67 WeakPolarHBondContact O-CG1 3.29Å; K63-I67 PolarHBondContact O-N 3.42Å |
| 64 | L | 94.9 | Very high | 91.6 | Very high | 102 Ų | 102 | 79.9 Ų | 79.9 | 53% | 0.534 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 177.9 | -70.7 | 175.1 | 0 | 0 | 0 | 111.9 | L60 A66 I67 V68 | L60-L64 WeakPolarHBondContact O-CB 3.31Å; L60-L64 VanDerWaalsContact O-CG 3.29Å; L60-L64 WeakPolarHBondContact O-CG 3.21Å; L60-L64 PolarHBondContact O-N 2.86Å; L64-A66 VanDerWaalsContact C-N 3.29Å; L64-A66 PolarHBondContact O-N 2.84Å; L64-I67 PolarHBondContact O-N 2.86Å; L64-V68 WeakPolarHBondContact O-CG2 3.2Å; L64-V68 PolarHBondContact O-N 2.86Å |
| 65 | R | 94.3 | Very high | 92.1 | Very high | 152 Ų | 152 | 75 Ų | 75 | 57% | 0.574 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -59.5 | -41.4 | 176.4 | -176.3 | -177.6 | -75.4 | 161.1 | -12.4 | 111.6 | K61 D62 K63 K69 | K61-R65 VanDerWaalsContact O-CB 3.3Å; K61-R65 WeakPolarHBondContact O-CB 3.18Å; K61-R65 PolarHBondContact O-N 3.14Å; D62-R65 PolarHBondContact O-N 3.12Å; K63-R65 PolarHBondContact O-N 2.87Å; R65-K69 VanDerWaalsContact O-CB 3.25Å; R65-K69 WeakPolarHBondContact O-CB 3.38Å; R65-K69 PolarHBondContact O-N 2.99Å |
| 66 | A | 92.4 | Very high | 92.7 | Very high | 17 Ų | 17 | 76.2 Ų | 76.2 | 14% | 0.14 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -63.9 | -44.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.6 | D62 K63 L64 K69 A70 | D62-A66 WeakPolarHBondContact O-CB 3.31Å; D62-A66 PolarHBondContact O-N 2.97Å; K63-A66 WeakPolarHBondContact O-CB 3.17Å; K63-A66 PolarHBondContact O-N 2.98Å; L64-A66 VanDerWaalsContact C-N 3.29Å; L64-A66 PolarHBondContact O-N 2.84Å; A66-K69 PolarHBondContact O-N 3.23Å; A66-A70 VanDerWaalsContact O-CB 3.28Å; A66-A70 WeakPolarHBondContact O-CB 3.23Å; A66-A70 PolarHBondContact O-N 3.1Å |
| 67 | I | 94.7 | Very high | 93.3 | Very high | 15 Ų | 15 | 70.4 Ų | 70.4 | 8% | 0.077 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -60.9 | -49 | 177.8 | -66.2 | 161.3 | 0 | 0 | 0 | 110.2 | A48 L49 T52 F53 K63 L64 A70 T71 | A48-I67 HydrophobicContact CB-CG2 4.27Å; L49-I67 HydrophobicContact CB-CD1 4.28Å; L49-I67 HydrophobicContact CG-CD1 4.42Å; T52-I67 HydrophobicContact CG2-CD1 4.35Å; T52-I67 HydrophobicContact CG2-CG1 4.25Å; F53-I67 HydrophobicContact CD2-CD1 4.35Å; F53-I67 HydrophobicContact CE2-CD1 3.95Å; K63-I67 WeakPolarHBondContact O-CD1 3.35Å; K63-I67 VanDerWaalsContact O-CG1 3.27Å; K63-I67 WeakPolarHBondContact O-CG1 3.29Å; K63-I67 PolarHBondContact O-N 3.42Å; L64-I67 PolarHBondContact O-N 2.86Å; I67-A70 PolarHBondContact O-N 2.96Å; I67-T71 VanDerWaalsContact O-CB 3.29Å; I67-T71 WeakPolarHBondContact O-CB 3.42Å; I67-T71 PolarHBondContact O-N 3.41Å; I67-T71 PolarHBondContact O-OG1 2.92Å |
| 68 | V | 96.1 | Very high | 94 | Very high | 97 Ų | 97 | 66.4 Ų | 66.4 | 59% | 0.588 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -62.7 | -47.5 | 179.4 | 172.5 | 0 | 0 | 0 | 0 | 110.7 | L64 A70 T71 Y72 | L64-V68 WeakPolarHBondContact O-CG2 3.2Å; L64-V68 PolarHBondContact O-N 2.86Å; V68-A70 VanDerWaalsContact C-N 3.35Å; V68-A70 PolarHBondContact O-N 2.92Å; V68-T71 PolarHBondContact O-N 2.89Å; V68-Y72 VanDerWaalsContact O-CB 3.24Å; V68-Y72 WeakPolarHBondContact O-CB 3.44Å; V68-Y72 PolarHBondContact O-N 3.39Å |
| 69 | K | 95.1 | Very high | 94.5 | Very high | 160 Ų | 160 | 63.9 Ų | 63.9 | 70% | 0.696 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -60.1 | -44.6 | 178.7 | -174.9 | 175.9 | -179.2 | 178.6 | 0 | 111.6 | R65 A66 Q73 | R65-K69 VanDerWaalsContact O-CB 3.25Å; R65-K69 WeakPolarHBondContact O-CB 3.38Å; R65-K69 PolarHBondContact O-N 2.99Å; A66-K69 PolarHBondContact O-N 3.23Å; K69-Q73 WeakPolarHBondContact O-CB 3.37Å; K69-Q73 PolarHBondContact O-N 3.29Å |
| 70 | A | 93.9 | Very high | 94.8 | Very high | 18 Ų | 18 | 66.8 Ų | 66.8 | 15% | 0.149 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -67.5 | -40.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | A48 A66 I67 V68 H74 I122 | A48-A70 HydrophobicContact CB-CB 4.33Å; A66-A70 VanDerWaalsContact O-CB 3.28Å; A66-A70 WeakPolarHBondContact O-CB 3.23Å; A66-A70 PolarHBondContact O-N 3.1Å; I67-A70 PolarHBondContact O-N 2.96Å; V68-A70 VanDerWaalsContact C-N 3.35Å; V68-A70 PolarHBondContact O-N 2.92Å; A70-H74 WeakPolarHBondContact O-CB 3.46Å; A70-H74 PolarHBondContact O-N 3.21Å; A70-H74 VanDerWaalsContact O-N 3.13Å; A70-I122 HydrophobicContact CB-CD1 4.02Å; A70-I122 WeakPolarHBondContact O-CD1 3.32Å |
| 71 | T | 96.4 | Very high | 95 | Very high | 19 Ų | 19 | 63.6 Ų | 63.6 | 12% | 0.117 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.2 | -46.5 | 176.7 | -56.7 | 0 | 0 | 0 | 0 | 110.9 | A41 A45 I67 V68 H74 S75 | A41-T71 HydrophobicContact CB-CG2 4.15Å; A45-T71 WeakPolarHBondContact CA-OG1 3.3Å; A45-T71 HydrophobicContact CB-CG2 3.82Å; I67-T71 VanDerWaalsContact O-CB 3.29Å; I67-T71 WeakPolarHBondContact O-CB 3.42Å; I67-T71 PolarHBondContact O-N 3.41Å; I67-T71 PolarHBondContact O-OG1 2.92Å; V68-T71 PolarHBondContact O-N 2.89Å; T71-H74 PolarHBondContact O-N 2.95Å; T71-S75 VanDerWaalsContact O-CB 3.27Å; T71-S75 WeakPolarHBondContact O-CB 3.45Å; T71-S75 PolarHBondContact O-N 3.5Å; T71-S75 PolarHBondContact O-OG 3.23Å |
| 72 | Y | 96.2 | Very high | 95.2 | Very high | 143 Ų | 143 | 58.3 Ų | 58.3 | 56% | 0.561 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -60.5 | -51.1 | 178.5 | 177.4 | -103.3 | 0 | 0 | 0 | 111.3 | V68 H74 S75 R76 | V68-Y72 VanDerWaalsContact O-CB 3.24Å; V68-Y72 WeakPolarHBondContact O-CB 3.44Å; V68-Y72 PolarHBondContact O-N 3.39Å; Y72-H74 PolarHBondContact O-N 2.94Å; Y72-S75 PolarHBondContact O-N 3.22Å; Y72-R76 WeakPolarHBondContact O-CB 3.29Å; Y72-R76 PolarHBondContact O-N 3.45Å |
| 73 | Q | 94.6 | Very high | 95.4 | Very high | 28 Ų | 28 | 59.5 Ų | 59.5 | 13% | 0.131 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -56.9 | -48.5 | 179.3 | 179.3 | 68.4 | 5.6 | 0 | 0 | 111.5 | K69 R76 N77 I122 | K69-Q73 WeakPolarHBondContact O-CB 3.37Å; K69-Q73 PolarHBondContact O-N 3.29Å; Q73-R76 PolarHBondContact O-N 2.81Å; Q73-N77 PolarHBondContact NE2-ND2 3.39Å; Q73-N77 WeakPolarHBondContact O-CB 3.45Å; Q73-N77 PolarHBondContact O-N 2.99Å; Q73-N77 PolarHBondContact O-OD1 3.47Å; Q73-N77 VanDerWaalsContact O-OD1 3.11Å; Q73-I122 HydrophobicContact CB-CD1 3.68Å; Q73-I122 HydrophobicContact CG-CB 4.48Å; Q73-I122 HydrophobicContact CG-CD1 3.73Å; Q73-I122 HydrophobicContact CG-CG2 4.49Å |
| 74 | H | 95.3 | Very high | 95.5 | Very high | 23 Ų | 23 | 59.5 Ų | 59.5 | 11% | 0.106 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.5 | -46.6 | 180 | -175.7 | 75.1 | 0 | 0 | 0 | 112.5 | G40 R44 A70 T71 Y72 N77 L78 I122 I126 | G40-H74 PolarHBondContact O-CD2 3.44Å; R44-H74 HydrophobicContact CB-CB 4Å; R44-H74 HydrophobicContact CG-CB 3.75Å; A70-H74 WeakPolarHBondContact O-CB 3.46Å; A70-H74 PolarHBondContact O-N 3.21Å; A70-H74 VanDerWaalsContact O-N 3.13Å; T71-H74 PolarHBondContact O-N 2.95Å; Y72-H74 PolarHBondContact O-N 2.94Å; H74-N77 PolarHBondContact O-N 3.25Å; H74-L78 WeakPolarHBondContact NE2-CD1 3.1Å; H74-L78 PolarHBondContact O-N 2.91Å; H74-I122 HydrophobicContact CB-CG2 3.82Å; H74-I126 VanDerWaalsContact ND1-CD1 3.28Å; H74-I126 WeakPolarHBondContact ND1-CD1 3.48Å |
| 75 | S | 96.2 | Very high | 95.6 | Very high | 12 Ų | 12 | 57.7 Ų | 57.7 | 8% | 0.084 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.5 | -42.3 | -179.9 | -53.1 | 0 | 0 | 0 | 0 | 111.7 | A37 G40 A41 T71 Y72 L78 A79 | A37-S75 WeakPolarHBondContact O-CB 3.27Å; G40-S75 VanDerWaalsContact C-OG 3.26Å; A41-S75 VanDerWaalsContact CA-OG 3.31Å; A41-S75 WeakPolarHBondContact CA-OG 3.4Å; A41-S75 PolarHBondContact N-OG 2.95Å; T71-S75 VanDerWaalsContact O-CB 3.27Å; T71-S75 WeakPolarHBondContact O-CB 3.45Å; T71-S75 PolarHBondContact O-N 3.5Å; T71-S75 PolarHBondContact O-OG 3.23Å; Y72-S75 PolarHBondContact O-N 3.22Å; S75-L78 PolarHBondContact O-N 3.48Å; S75-A79 VanDerWaalsContact O-CB 3.29Å; S75-A79 WeakPolarHBondContact O-CB 3.25Å; S75-A79 PolarHBondContact O-N 3.37Å |
| 76 | R | 96.5 | Very high | 95.6 | Very high | 90 Ų | 90 | 54 Ų | 54 | 34% | 0.34 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -59.3 | -49.9 | 175.6 | -178.2 | 175.6 | 72.7 | 156.1 | 2.4 | 110.6 | Y72 Q73 L78 A79 Y80 | Y72-R76 WeakPolarHBondContact O-CB 3.29Å; Y72-R76 PolarHBondContact O-N 3.45Å; Q73-R76 PolarHBondContact O-N 2.81Å; R76-L78 PolarHBondContact O-N 3.33Å; R76-A79 PolarHBondContact O-N 3.42Å; R76-Y80 HydrophobicContact CG-CD2 3.48Å; R76-Y80 VanDerWaalsContact CG-CD2 3.48Å; R76-Y80 HydrophobicContact CG-CE2 3.51Å; R76-Y80 VanDerWaalsContact O-CD2 3.25Å; R76-Y80 WeakPolarHBondContact O-CD2 3.47Å; R76-Y80 PolarHBondContact O-N 2.64Å |
| 77 | N | 95.9 | Very high | 95.6 | Very high | 9 Ų | 9 | 54.5 Ų | 54.5 | 5% | 0.048 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.6 | -45.5 | -178.3 | -65.4 | 2.7 | 0 | 0 | 0 | 110.6 | Q73 H74 A79 Y80 F81 V115 F116 N123 | Q73-N77 PolarHBondContact NE2-ND2 3.39Å; Q73-N77 WeakPolarHBondContact O-CB 3.45Å; Q73-N77 PolarHBondContact O-N 2.99Å; Q73-N77 PolarHBondContact O-OD1 3.47Å; Q73-N77 VanDerWaalsContact O-OD1 3.11Å; H74-N77 PolarHBondContact O-N 3.25Å; N77-A79 PolarHBondContact O-N 2.73Å; N77-Y80 PolarHBondContact O-N 3.4Å; N77-F81 WeakPolarHBondContact O-CB 3.24Å; N77-F81 PolarHBondContact O-N 2.67Å; N77-V115 HydrophobicContact CB-CG1 3.74Å; N77-V115 WeakPolarHBondContact O-CG1 3.31Å; N77-F116 HydrophobicContact CB-CD1 4.25Å; N77-F116 HydrophobicContact CB-CE1 3.63Å; N77-F116 HydrophobicContact CB-CZ 4.22Å; N77-N123 PolarHBondContact ND2-OD1 3.23Å |
| 78 | L | 95.4 | Very high | 95.5 | Very high | 33 Ų | 33 | 55.9 Ų | 55.9 | 17% | 0.173 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.2 | -41.2 | 175.7 | -72.1 | 174.1 | 0 | 0 | 0 | 113.2 | Y39 H74 S75 R76 V82 F116 | Y39-L78 HydrophobicContact CD1-CD1 4.1Å; H74-L78 WeakPolarHBondContact NE2-CD1 3.1Å; H74-L78 PolarHBondContact O-N 2.91Å; S75-L78 PolarHBondContact O-N 3.48Å; R76-L78 PolarHBondContact O-N 3.33Å; L78-V82 WeakPolarHBondContact O-CG2 3.32Å; L78-V82 PolarHBondContact O-N 2.98Å; L78-V82 VanDerWaalsContact O-N 3.14Å; L78-F116 HydrophobicContact CD2-CZ 4.26Å |
| 79 | A | 96.8 | Very high | 95.3 | Very high | 1 Ų | 1 | 52.9 Ų | 52.9 | 1% | 0.008 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.4 | -49.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | F33 A37 S75 R76 N77 V82 F83 | F33-A79 HydrophobicContact CD1-CB 4.42Å; F33-A79 HydrophobicContact CD2-CB 3.56Å; F33-A79 WeakPolarHBondContact CD2-O 3.28Å; F33-A79 HydrophobicContact CE1-CB 4.37Å; F33-A79 HydrophobicContact CE2-CB 3.51Å; F33-A79 HydrophobicContact CG-CB 4.04Å; F33-A79 HydrophobicContact CZ-CB 3.94Å; F33-A79 WeakPolarHBondContact O-CB 3.39Å; A37-A79 HydrophobicContact CB-CB 3.99Å; S75-A79 VanDerWaalsContact O-CB 3.29Å; S75-A79 WeakPolarHBondContact O-CB 3.25Å; S75-A79 PolarHBondContact O-N 3.37Å; R76-A79 PolarHBondContact O-N 3.42Å; N77-A79 PolarHBondContact O-N 2.73Å; A79-V82 PolarHBondContact O-N 2.9Å; A79-F83 WeakPolarHBondContact O-CB 3.41Å; A79-F83 PolarHBondContact O-N 2.91Å |
| 80 | Y | 96.8 | Very high | 95.1 | Very high | 116 Ų | 116 | 46.1 Ų | 46.1 | 46% | 0.455 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -68.6 | -34.9 | 179.3 | -79.7 | -69.2 | 0 | 0 | 0 | 112.7 | F33 R76 N77 F83 T84 | F33-Y80 HydrophobicContact CE2-CD1 4.21Å; F33-Y80 HydrophobicContact CE2-CD2 4.41Å; F33-Y80 HydrophobicContact CE2-CE1 4.15Å; F33-Y80 HydrophobicContact CE2-CE2 4.35Å; F33-Y80 HydrophobicContact CE2-CG 4.34Å; R76-Y80 HydrophobicContact CG-CD2 3.48Å; R76-Y80 VanDerWaalsContact CG-CD2 3.48Å; R76-Y80 HydrophobicContact CG-CE2 3.51Å; R76-Y80 VanDerWaalsContact O-CD2 3.25Å; R76-Y80 WeakPolarHBondContact O-CD2 3.47Å; R76-Y80 PolarHBondContact O-N 2.64Å; N77-Y80 PolarHBondContact O-N 3.4Å; Y80-F83 PolarHBondContact O-N 2.97Å; Y80-T84 WeakPolarHBondContact O-CB 3.42Å; Y80-T84 PolarHBondContact O-N 3.11Å; Y80-T84 PolarHBondContact O-OG1 2.93Å |
| 81 | F | 97 | Very high | 94.9 | Very high | 53 Ų | 53 | 49.8 Ų | 49.8 | 23% | 0.232 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -60.5 | -49 | 174.3 | 177.7 | -98.3 | 0 | 0 | 0 | 111.3 | N77 F83 T84 Y85 A108 V115 F116 | N77-F81 WeakPolarHBondContact O-CB 3.24Å; N77-F81 PolarHBondContact O-N 2.67Å; F81-F83 VanDerWaalsContact C-N 3.33Å; F81-F83 PolarHBondContact O-N 3.39Å; F81-T84 PolarHBondContact O-N 3.32Å; F81-Y85 VanDerWaalsContact O-CB 3.23Å; F81-Y85 WeakPolarHBondContact O-CB 3.06Å; F81-Y85 PolarHBondContact O-N 3.46Å; F81-A108 HydrophobicContact CZ-CB 4.5Å; F81-V115 HydrophobicContact CB-CB 4.41Å; F81-V115 HydrophobicContact CB-CG1 4.12Å; F81-V115 HydrophobicContact CB-CG2 4.45Å; F81-F116 HydrophobicContact CB-CE2 3.69Å; F81-F116 HydrophobicContact CB-CZ 4.12Å; F81-F116 HydrophobicContact CD1-CE2 4.44Å; F81-F116 HydrophobicContact CD2-CD2 4.05Å; F81-F116 AromaticContact CD2-CE2 3.62Å; F81-F116 HydrophobicContact CD2-CE2 3.62Å; F81-F116 HydrophobicContact CE2-CE2 4.38Å; F81-F116 AromaticContact CG-CE2 3.65Å; F81-F116 HydrophobicContact CG-CE2 3.65Å; F81-F116 HydrophobicContact CG-CZ 4.45Å |
| 82 | V | 96.6 | Very high | 94.5 | Very high | 35 Ų | 35 | 50.7 Ų | 50.7 | 21% | 0.212 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -65 | -39.2 | 179.1 | 177.7 | 0 | 0 | 0 | 0 | 111.3 | G32 L78 A79 K86 | G32-V82 VanDerWaalsContact C-CG1 3.41Å; G32-V82 VanDerWaalsContact CA-CG1 3.46Å; L78-V82 WeakPolarHBondContact O-CG2 3.32Å; L78-V82 PolarHBondContact O-N 2.98Å; L78-V82 VanDerWaalsContact O-N 3.14Å; A79-V82 PolarHBondContact O-N 2.9Å; V82-K86 HydrophobicContact CG1-CD 3.98Å; V82-K86 HydrophobicContact CG1-CG 4.36Å; V82-K86 WeakPolarHBondContact O-CB 3.26Å; V82-K86 WeakPolarHBondContact O-CG 3.38Å; V82-K86 PolarHBondContact O-N 3.13Å |
| 83 | F | 96.6 | Very high | 94.1 | Very high | 96 Ų | 96 | 48 Ų | 48 | 42% | 0.421 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -59.9 | -53 | 175.2 | 176.7 | -89.1 | 0 | 0 | 0 | 111.5 | V29 F33 A79 Y80 F81 G87 | V29-F83 HydrophobicContact CG1-CD2 3.23Å; V29-F83 HydrophobicContact CG1-CE2 3.48Å; V29-F83 VanDerWaalsContact CG1-CE2 3.48Å; V29-F83 HydrophobicContact CG1-CG 4.02Å; V29-F83 HydrophobicContact CG1-CZ 4.43Å; F33-F83 HydrophobicContact CB-CB 4.34Å; F33-F83 HydrophobicContact CD2-CB 3.97Å; A79-F83 WeakPolarHBondContact O-CB 3.41Å; A79-F83 PolarHBondContact O-N 2.91Å; Y80-F83 PolarHBondContact O-N 2.97Å; F81-F83 VanDerWaalsContact C-N 3.33Å; F81-F83 PolarHBondContact O-N 3.39Å; F83-G87 WeakPolarHBondContact O-CA 3.21Å; F83-G87 PolarHBondContact O-N 2.97Å |
| 84 | T | 94.9 | Very high | 93.7 | Very high | 30 Ų | 30 | 56 Ų | 56 | 18% | 0.184 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -63.1 | -46.8 | -179.5 | -60.4 | 0 | 0 | 0 | 0 | 111 | Y80 F81 G87 L88 L114 | Y80-T84 WeakPolarHBondContact O-CB 3.42Å; Y80-T84 PolarHBondContact O-N 3.11Å; Y80-T84 PolarHBondContact O-OG1 2.93Å; F81-T84 PolarHBondContact O-N 3.32Å; T84-G87 PolarHBondContact O-N 3.42Å; T84-L88 HydrophobicContact CG2-CD1 3.8Å; T84-L88 HydrophobicContact CG2-CG 4.28Å; T84-L88 VanDerWaalsContact O-CB 3.31Å; T84-L88 WeakPolarHBondContact O-CB 3.37Å; T84-L88 WeakPolarHBondContact O-CG 3.42Å; T84-L88 PolarHBondContact O-N 2.97Å; T84-L114 HydrophobicContact CG2-CD1 4.23Å |
| 85 | Y | 95.2 | Very high | 93.3 | Very high | 64 Ų | 64 | 60.9 Ų | 60.9 | 25% | 0.251 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -59.2 | -53.2 | 178.9 | 172 | -107.5 | 0 | 0 | 0 | 112.3 | F81 G87 L88 Q89 S104 A107 A108 | F81-Y85 VanDerWaalsContact O-CB 3.23Å; F81-Y85 WeakPolarHBondContact O-CB 3.06Å; F81-Y85 PolarHBondContact O-N 3.46Å; Y85-G87 VanDerWaalsContact C-N 3.34Å; Y85-G87 PolarHBondContact O-N 3.33Å; Y85-L88 PolarHBondContact O-N 3.22Å; Y85-Q89 HydrophobicContact CE2-CG 4.21Å; Y85-Q89 VanDerWaalsContact CZ-NE2 3.29Å; Y85-Q89 WeakPolarHBondContact O-CG 3.4Å; Y85-Q89 PolarHBondContact O-N 3.4Å; Y85-Q89 PolarHBondContact OH-NE2 3.42Å; Y85-S104 WeakPolarHBondContact CE2-O 3.5Å; Y85-A107 HydrophobicContact CD2-CB 4.01Å; Y85-A107 HydrophobicContact CE2-CB 4.33Å; Y85-A108 HydrophobicContact CD2-CB 4.06Å; Y85-A108 HydrophobicContact CE2-CB 4.1Å |
| 86 | K | 94.3 | Very high | 92.7 | Very high | 74 Ų | 74 | 65.4 Ų | 65.4 | 32% | 0.322 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -68.3 | -34.5 | -179.9 | -73.5 | -175.2 | 167.9 | -71.7 | 0 | 112.4 | A28 V29 V82 A90 | A28-K86 WeakPolarHBondContact O-CD 3.39Å; V29-K86 HydrophobicContact CG2-CB 3.67Å; V82-K86 HydrophobicContact CG1-CD 3.98Å; V82-K86 HydrophobicContact CG1-CG 4.36Å; V82-K86 WeakPolarHBondContact O-CB 3.26Å; V82-K86 WeakPolarHBondContact O-CG 3.38Å; V82-K86 PolarHBondContact O-N 3.13Å; K86-A90 WeakPolarHBondContact O-CB 3.27Å; K86-A90 PolarHBondContact O-N 3.42Å |
| 87 | G | 93.4 | Very high | 91.9 | Very high | 28 Ų | 28 | 64.2 Ų | 64.2 | 29% | 0.289 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.3 | -46 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | F83 T84 Y85 A90 L91 | F83-G87 WeakPolarHBondContact O-CA 3.21Å; F83-G87 PolarHBondContact O-N 2.97Å; T84-G87 PolarHBondContact O-N 3.42Å; Y85-G87 VanDerWaalsContact C-N 3.34Å; Y85-G87 PolarHBondContact O-N 3.33Å; G87-A90 PolarHBondContact O-N 2.93Å; G87-L91 WeakPolarHBondContact O-CB 3.28Å; G87-L91 PolarHBondContact O-N 2.96Å |
| 88 | L | 93.3 | Very high | 91 | Very high | 44 Ų | 44 | 71.2 Ų | 71.2 | 23% | 0.23 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -64.1 | -43.3 | 175.6 | -72.1 | 174.7 | 0 | 0 | 0 | 111.8 | T84 Y85 L91 Q92 A107 L110 | T84-L88 HydrophobicContact CG2-CD1 3.8Å; T84-L88 HydrophobicContact CG2-CG 4.28Å; T84-L88 VanDerWaalsContact O-CB 3.31Å; T84-L88 WeakPolarHBondContact O-CB 3.37Å; T84-L88 WeakPolarHBondContact O-CG 3.42Å; T84-L88 PolarHBondContact O-N 2.97Å; Y85-L88 PolarHBondContact O-N 3.22Å; L88-L91 PolarHBondContact O-N 3.08Å; L88-Q92 WeakPolarHBondContact O-CB 3.11Å; L88-Q92 WeakPolarHBondContact O-CG 3.32Å; L88-Q92 PolarHBondContact O-N 3.43Å; L88-A107 HydrophobicContact CB-CB 3.81Å; L88-A107 HydrophobicContact CD1-CB 4.31Å; L88-L110 HydrophobicContact CD1-CB 3.93Å; L88-L110 HydrophobicContact CD1-CD1 4.23Å |
| 89 | Q | 91.8 | Very high | 90.1 | Very high | 35 Ų | 35 | 73.4 Ų | 73.4 | 16% | 0.164 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -60 | -49.2 | 175 | -77.7 | -172.3 | -47.5 | 0 | 0 | 112 | Y85 L91 Q92 E93 S104 A107 | Y85-Q89 HydrophobicContact CE2-CG 4.21Å; Y85-Q89 VanDerWaalsContact CZ-NE2 3.29Å; Y85-Q89 WeakPolarHBondContact O-CG 3.4Å; Y85-Q89 PolarHBondContact O-N 3.4Å; Y85-Q89 PolarHBondContact OH-NE2 3.42Å; Q89-L91 PolarHBondContact O-N 2.95Å; Q89-Q92 PolarHBondContact O-N 2.81Å; Q89-E93 WeakPolarHBondContact O-CB 3.31Å; Q89-E93 WeakPolarHBondContact O-CG 3.28Å; Q89-E93 PolarHBondContact O-N 3.45Å; Q89-S104 PolarHBondContact NE2-OG 3.05Å; Q89-A107 HydrophobicContact CG-CB 4.31Å |
| 90 | A | 90.1 | Very high | 89.2 | Confident | 18 Ų | 18 | 77.1 Ų | 77.1 | 15% | 0.149 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -61.8 | -35 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | A25 K86 G87 R94 | A25-A90 HydrophobicContact CB-CB 4.09Å; K86-A90 WeakPolarHBondContact O-CB 3.27Å; K86-A90 PolarHBondContact O-N 3.42Å; G87-A90 PolarHBondContact O-N 2.93Å; A90-R94 VanDerWaalsContact O-CG 3.31Å; A90-R94 WeakPolarHBondContact O-CG 3.05Å; A90-R94 PolarHBondContact O-N 3.37Å |
| 91 | L | 90.2 | Very high | 88.6 | Confident | 95 Ų | 95 | 77 Ų | 77 | 50% | 0.497 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -69.3 | -45.8 | 174.9 | -178.8 | 61.3 | 0 | 0 | 0 | 111.6 | G87 L88 Q89 R94 I95 | G87-L91 WeakPolarHBondContact O-CB 3.28Å; G87-L91 PolarHBondContact O-N 2.96Å; L88-L91 PolarHBondContact O-N 3.08Å; Q89-L91 PolarHBondContact O-N 2.95Å; L91-R94 PolarHBondContact O-N 3.45Å; L91-I95 HydrophobicContact CD1-CD1 3.92Å; L91-I95 HydrophobicContact CD1-CG1 4.39Å; L91-I95 HydrophobicContact CG-CD1 3.89Å; L91-I95 VanDerWaalsContact O-CG1 3.32Å; L91-I95 WeakPolarHBondContact O-CG1 3.22Å; L91-I95 PolarHBondContact O-N 3.48Å |
| 92 | Q | 88.3 | Confident | 88 | Confident | 37 Ų | 37 | 77.3 Ų | 77.3 | 17% | 0.173 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -63 | -42.8 | 178.8 | -73.8 | 167.1 | -20.9 | 0 | 0 | 111.8 | L88 Q89 R94 I95 Q96 Q103 | L88-Q92 WeakPolarHBondContact O-CB 3.11Å; L88-Q92 WeakPolarHBondContact O-CG 3.32Å; L88-Q92 PolarHBondContact O-N 3.43Å; Q89-Q92 PolarHBondContact O-N 2.81Å; Q92-R94 VanDerWaalsContact C-N 3.33Å; Q92-R94 PolarHBondContact O-N 2.98Å; Q92-I95 PolarHBondContact O-N 3.07Å; Q92-Q96 WeakPolarHBondContact O-CB 3.4Å; Q92-Q96 PolarHBondContact O-N 2.8Å; Q92-Q103 HydrophobicContact CB-CG 4.37Å; Q92-Q103 PolarHBondContact OE1-O 2.94Å |
| 93 | E | 87.1 | Confident | 87.5 | Confident | 88 Ų | 88 | 76.1 Ų | 76.1 | 41% | 0.411 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -61.3 | -40.8 | 175.1 | -75.8 | 176.5 | 176.9 | 0 | 0 | 111.8 | Q89 G97 | Q89-E93 WeakPolarHBondContact O-CB 3.31Å; Q89-E93 WeakPolarHBondContact O-CG 3.28Å; Q89-E93 PolarHBondContact O-N 3.45Å; E93-G97 VanDerWaalsContact O-CA 3.32Å; E93-G97 WeakPolarHBondContact O-CA 3.3Å; E93-G97 PolarHBondContact O-N 3.29Å |
| 94 | R | 86.8 | Confident | 87.1 | Confident | 196 Ų | 196 | 73 Ų | 73 | 74% | 0.74 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -65.9 | -36 | 176 | -78.6 | -178.5 | 179.2 | -166.3 | 0.2 | 113.1 | A90 L91 Q92 | A90-R94 VanDerWaalsContact O-CG 3.31Å; A90-R94 WeakPolarHBondContact O-CG 3.05Å; A90-R94 PolarHBondContact O-N 3.37Å; L91-R94 PolarHBondContact O-N 3.45Å; Q92-R94 VanDerWaalsContact C-N 3.33Å; Q92-R94 PolarHBondContact O-N 2.98Å |
| 95 | I | 87 | Confident | 86.9 | Confident | 125 Ų | 125 | 78 Ų | 78 | 64% | 0.641 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -78.6 | -43.5 | -178.5 | -66.9 | 168.2 | 0 | 0 | 0 | 111.3 | L91 Q92 | L91-I95 HydrophobicContact CD1-CD1 3.92Å; L91-I95 HydrophobicContact CD1-CG1 4.39Å; L91-I95 HydrophobicContact CG-CD1 3.89Å; L91-I95 VanDerWaalsContact O-CG1 3.32Å; L91-I95 WeakPolarHBondContact O-CG1 3.22Å; L91-I95 PolarHBondContact O-N 3.48Å; Q92-I95 PolarHBondContact O-N 3.07Å |
| 96 | Q | 83.9 | Confident | 86.7 | Confident | 106 Ų | 106 | 80.8 Ų | 80.8 | 50% | 0.495 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -95.9 | -14.1 | -171.7 | -61.9 | -173.9 | 24.7 | 0 | 0 | 113.6 | Q92 K98 | Q92-Q96 WeakPolarHBondContact O-CB 3.4Å; Q92-Q96 PolarHBondContact O-N 2.8Å; Q96-K98 PolarHBondContact O-N 3.14Å; Q96-K98 VanDerWaalsContact O-N 3.08Å |
| 97 | G | 78.8 | Confident | 86.6 | Confident | 66 Ų | 66 | 77.3 Ų | 77.3 | 68% | 0.68 | 41% | 0.412 | S | S | * | . | S | Bend | trans | 67.9 | 1.7 | -178 | 0 | 0 | 0 | 0 | 0 | 114.9 | E93 | E93-G97 VanDerWaalsContact O-CA 3.32Å; E93-G97 WeakPolarHBondContact O-CA 3.3Å; E93-G97 PolarHBondContact O-N 3.29Å |
| 98 | K | 77.6 | Confident | 86.6 | Confident | 156 Ų | 156 | 77.5 Ų | 77.5 | 68% | 0.678 | 41% | 0.411 | S | S | * | . | S | Bend | trans | -143 | 144.8 | 179.3 | -64.5 | -177.1 | -178.2 | 177.3 | 0 | 110.7 | Q96 Q103 | Q96-K98 PolarHBondContact O-N 3.14Å; Q96-K98 VanDerWaalsContact O-N 3.08Å; K98-Q103 PolarHBondContact O-NE2 3.04Å; K98-Q103 PolarHBondContact O-OE1 3.33Å |
| 99 | S | 75.1 | Confident | 86.7 | Confident | 79 Ų | 79 | 78.3 Ų | 78.3 | 55% | 0.552 | 42% | 0.42 | S | S | * | . | trans | -88.6 | 114.5 | 171.4 | 161.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 100 | L | 79.4 | Confident | 86.8 | Confident | 78 Ų | 78 | 80.9 Ų | 80.9 | 41% | 0.408 | 43% | 0.434 | S | S | . | . | trans | -105.2 | 143.1 | 174.7 | -66.7 | 168.5 | 0 | 0 | 0 | 110.6 | S102 Q103 | L100-S102 PolarHBondContact O-N 3.43Å; L100-Q103 HydrophobicContact CB-CG 4Å; L100-Q103 VanDerWaalsContact O-CB 3.32Å; L100-Q103 WeakPolarHBondContact O-CB 3.47Å; L100-Q103 PolarHBondContact O-N 3.29Å; L100-Q103 VanDerWaalsContact O-N 3.1Å | ||
| 101 | P | 83.6 | Confident | 87 | Confident | 114 Ų | 114 | 80 Ų | 80 | 74% | 0.74 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -56.8 | -36.1 | 177 | -26.3 | 34.8 | 0 | 0 | 0 | 113.7 | Q103 S104 F105 | P101-Q103 VanDerWaalsContact C-N 3.32Å; P101-Q103 PolarHBondContact O-N 3.44Å; P101-S104 WeakPolarHBondContact O-CB 3.37Å; P101-S104 PolarHBondContact O-N 3.16Å; P101-F105 PolarHBondContact O-N 3.4Å |
| 102 | S | 83.9 | Confident | 87.2 | Confident | 60 Ų | 60 | 76.6 Ų | 76.6 | 42% | 0.42 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.1 | -35 | 178.1 | 54.2 | 0 | 0 | 0 | 0 | 113 | L100 S104 F105 F106 | L100-S102 PolarHBondContact O-N 3.43Å; S102-S104 VanDerWaalsContact C-N 3.29Å; S102-S104 PolarHBondContact O-N 2.86Å; S102-F105 WeakPolarHBondContact O-CB 3.47Å; S102-F105 PolarHBondContact O-N 2.95Å; S102-F105 VanDerWaalsContact O-N 3.16Å; S102-F106 WeakPolarHBondContact O-CD2 3.33Å; S102-F106 PolarHBondContact O-N 3.14Å |
| 103 | Q | 85.9 | Confident | 87.5 | Confident | 9 Ų | 9 | 84.4 Ų | 84.4 | 4% | 0.042 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -59 | -43.2 | 175.7 | -70.1 | 166.4 | -7.8 | 0 | 0 | 111 | Q92 K98 L100 P101 F105 F106 A107 | Q92-Q103 HydrophobicContact CB-CG 4.37Å; Q92-Q103 PolarHBondContact OE1-O 2.94Å; K98-Q103 PolarHBondContact O-NE2 3.04Å; K98-Q103 PolarHBondContact O-OE1 3.33Å; L100-Q103 HydrophobicContact CB-CG 4Å; L100-Q103 VanDerWaalsContact O-CB 3.32Å; L100-Q103 WeakPolarHBondContact O-CB 3.47Å; L100-Q103 PolarHBondContact O-N 3.29Å; L100-Q103 VanDerWaalsContact O-N 3.1Å; P101-Q103 VanDerWaalsContact C-N 3.32Å; P101-Q103 PolarHBondContact O-N 3.44Å; Q103-F105 VanDerWaalsContact C-N 3.32Å; Q103-F105 PolarHBondContact O-N 3.41Å; Q103-F106 PolarHBondContact O-N 3.1Å; Q103-A107 WeakPolarHBondContact O-CB 3.19Å; Q103-A107 PolarHBondContact O-N 2.96Å |
| 104 | S | 88.8 | Confident | 87.8 | Confident | 31 Ų | 31 | 86.1 Ų | 86.1 | 22% | 0.217 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -62.8 | -40.2 | 177.1 | -62.9 | 0 | 0 | 0 | 0 | 111.8 | Y85 Q89 P101 S102 A108 | Y85-S104 WeakPolarHBondContact CE2-O 3.5Å; Q89-S104 PolarHBondContact NE2-OG 3.05Å; P101-S104 WeakPolarHBondContact O-CB 3.37Å; P101-S104 PolarHBondContact O-N 3.16Å; S102-S104 VanDerWaalsContact C-N 3.29Å; S102-S104 PolarHBondContact O-N 2.86Å; S104-A108 VanDerWaalsContact O-CB 3.3Å; S104-A108 WeakPolarHBondContact O-CB 3.28Å; S104-A108 PolarHBondContact O-N 2.88Å |
| 105 | F | 91.7 | Very high | 88.2 | Confident | 135 Ų | 135 | 77.7 Ų | 77.7 | 59% | 0.592 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -63.9 | -52.1 | 175.9 | -179.5 | -101.9 | 0 | 0 | 0 | 111.6 | P101 S102 Q103 A107 A108 C109 | P101-F105 PolarHBondContact O-N 3.4Å; S102-F105 WeakPolarHBondContact O-CB 3.47Å; S102-F105 PolarHBondContact O-N 2.95Å; S102-F105 VanDerWaalsContact O-N 3.16Å; Q103-F105 VanDerWaalsContact C-N 3.32Å; Q103-F105 PolarHBondContact O-N 3.41Å; F105-A107 PolarHBondContact O-N 3.4Å; F105-A108 PolarHBondContact O-N 3.3Å; F105-A108 VanDerWaalsContact O-N 3.14Å; F105-C109 VanDerWaalsContact CE1-SG 3.57Å; F105-C109 VanDerWaalsContact CZ-SG 3.59Å; F105-C109 PolarHBondContact O-N 3.15Å; F105-C109 PolarHBondContact O-SG 2.66Å; F105-C109 VanDerWaalsContact O-SG 3.33Å |
| 106 | F | 90.3 | Very high | 88.5 | Confident | 123 Ų | 123 | 72.7 Ų | 72.7 | 54% | 0.539 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -64.7 | -39.1 | -179.5 | -69.3 | -63 | 0 | 0 | 0 | 112.9 | S102 Q103 A108 C109 L110 | S102-F106 WeakPolarHBondContact O-CD2 3.33Å; S102-F106 PolarHBondContact O-N 3.14Å; Q103-F106 PolarHBondContact O-N 3.1Å; F106-A108 VanDerWaalsContact C-N 3.31Å; F106-A108 PolarHBondContact O-N 3.49Å; F106-C109 PolarHBondContact O-N 3.04Å; F106-L110 WeakPolarHBondContact O-CG 3.08Å; F106-L110 PolarHBondContact O-N 2.94Å |
| 107 | A | 92.4 | Very high | 88.7 | Confident | 0 Ų | 0 | 70.1 Ų | 70.1 | 0% | 0 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -60.9 | -40.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y85 L88 Q89 Q103 F105 G111 | Y85-A107 HydrophobicContact CD2-CB 4.01Å; Y85-A107 HydrophobicContact CE2-CB 4.33Å; L88-A107 HydrophobicContact CB-CB 3.81Å; L88-A107 HydrophobicContact CD1-CB 4.31Å; Q89-A107 HydrophobicContact CG-CB 4.31Å; Q103-A107 WeakPolarHBondContact O-CB 3.19Å; Q103-A107 PolarHBondContact O-N 2.96Å; F105-A107 PolarHBondContact O-N 3.4Å; A107-G111 PolarHBondContact O-N 2.96Å |
| 108 | A | 93.9 | Very high | 89.3 | Confident | 32 Ų | 32 | 73 Ų | 73 | 26% | 0.264 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -68.9 | -38.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | F81 Y85 S104 F105 F106 G112 | F81-A108 HydrophobicContact CZ-CB 4.5Å; Y85-A108 HydrophobicContact CD2-CB 4.06Å; Y85-A108 HydrophobicContact CE2-CB 4.1Å; S104-A108 VanDerWaalsContact O-CB 3.3Å; S104-A108 WeakPolarHBondContact O-CB 3.28Å; S104-A108 PolarHBondContact O-N 2.88Å; F105-A108 PolarHBondContact O-N 3.3Å; F105-A108 VanDerWaalsContact O-N 3.14Å; F106-A108 VanDerWaalsContact C-N 3.31Å; F106-A108 PolarHBondContact O-N 3.49Å; A108-G112 PolarHBondContact O-N 2.99Å |
| 109 | C | 94.3 | Very high | 89.8 | Confident | 61 Ų | 61 | 73 Ų | 73 | 41% | 0.412 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.5 | -48.6 | 174.6 | -70.5 | 0 | 0 | 0 | 0 | 111.8 | F105 F106 G112 W113 | F105-C109 VanDerWaalsContact CE1-SG 3.57Å; F105-C109 VanDerWaalsContact CZ-SG 3.59Å; F105-C109 PolarHBondContact O-N 3.15Å; F105-C109 PolarHBondContact O-SG 2.66Å; F105-C109 VanDerWaalsContact O-SG 3.33Å; F106-C109 PolarHBondContact O-N 3.04Å; C109-G112 PolarHBondContact O-N 3.01Å; C109-W113 PolarHBondContact O-N 3.18Å |
| 110 | L | 94.3 | Very high | 90.5 | Very high | 90 Ų | 90 | 71.1 Ų | 71.1 | 47% | 0.471 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -63.3 | -46.6 | 177.6 | -71.3 | 174.2 | 0 | 0 | 0 | 111.5 | L88 F106 G112 W113 L114 | L88-L110 HydrophobicContact CD1-CB 3.93Å; L88-L110 HydrophobicContact CD1-CD1 4.23Å; F106-L110 WeakPolarHBondContact O-CG 3.08Å; F106-L110 PolarHBondContact O-N 2.94Å; L110-G112 VanDerWaalsContact C-N 3.28Å; L110-G112 PolarHBondContact O-N 3.11Å; L110-W113 PolarHBondContact O-N 3.28Å; L110-L114 WeakPolarHBondContact O-CB 3.31Å; L110-L114 VanDerWaalsContact O-CG 3.27Å; L110-L114 WeakPolarHBondContact O-CG 3.3Å; L110-L114 PolarHBondContact O-N 3.41Å |
| 111 | G | 93.7 | Very high | 90.9 | Very high | 0 Ų | 0 | 73 Ų | 73 | 0% | 0 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -59.7 | -40.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | A107 V115 | A107-G111 PolarHBondContact O-N 2.96Å; G111-V115 VanDerWaalsContact O-CB 3.28Å; G111-V115 WeakPolarHBondContact O-CB 3.38Å; G111-V115 VanDerWaalsContact O-CG2 3.31Å; G111-V115 WeakPolarHBondContact O-CG2 3.48Å; G111-V115 PolarHBondContact O-N 3.34Å; G111-V115 VanDerWaalsContact O-N 3.08Å |
| 112 | G | 94.4 | Very high | 91.1 | Very high | 22 Ų | 22 | 68.4 Ų | 68.4 | 23% | 0.227 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.5 | -47.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | A108 C109 L110 F116 G117 | A108-G112 PolarHBondContact O-N 2.99Å; C109-G112 PolarHBondContact O-N 3.01Å; L110-G112 VanDerWaalsContact C-N 3.28Å; L110-G112 PolarHBondContact O-N 3.11Å; G112-F116 CarbonylContact O-C 3.41Å; G112-F116 WeakPolarHBondContact O-CA 3.23Å; G112-F116 WeakPolarHBondContact O-CB 3.42Å; G112-F116 PolarHBondContact O-N 3.15Å; G112-G117 PolarHBondContact O-N 3.33Å |
| 113 | W | 94 | Very high | 91.6 | Very high | 202 Ų | 202 | 65.6 Ų | 65.6 | 77% | 0.765 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -59.4 | -49.2 | 176.2 | -179.2 | -89.2 | 0 | 0 | 0 | 112.1 | C109 L110 V115 G117 | C109-W113 PolarHBondContact O-N 3.18Å; L110-W113 PolarHBondContact O-N 3.28Å; W113-V115 VanDerWaalsContact C-N 3.33Å; W113-V115 PolarHBondContact O-N 2.89Å; W113-G117 WeakPolarHBondContact O-CA 3.29Å; W113-G117 PolarHBondContact O-N 3.04Å |
| 114 | L | 94.2 | Very high | 91.8 | Very high | 123 Ų | 123 | 66.6 Ų | 66.6 | 64% | 0.644 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -67.9 | -31 | -175.5 | -69.6 | 172.9 | 0 | 0 | 0 | 113.5 | T84 L110 | T84-L114 HydrophobicContact CG2-CD1 4.23Å; L110-L114 WeakPolarHBondContact O-CB 3.31Å; L110-L114 VanDerWaalsContact O-CG 3.27Å; L110-L114 WeakPolarHBondContact O-CG 3.3Å; L110-L114 PolarHBondContact O-N 3.41Å |
| 115 | V | 94.4 | Very high | 91.9 | Very high | 20 Ų | 20 | 67.3 Ų | 67.3 | 12% | 0.121 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -108 | -35.5 | -169.6 | 179.4 | 0 | 0 | 0 | 0 | 113 | N77 F81 G111 W113 | N77-V115 HydrophobicContact CB-CG1 3.74Å; N77-V115 WeakPolarHBondContact O-CG1 3.31Å; F81-V115 HydrophobicContact CB-CB 4.41Å; F81-V115 HydrophobicContact CB-CG1 4.12Å; F81-V115 HydrophobicContact CB-CG2 4.45Å; G111-V115 VanDerWaalsContact O-CB 3.28Å; G111-V115 WeakPolarHBondContact O-CB 3.38Å; G111-V115 VanDerWaalsContact O-CG2 3.31Å; G111-V115 WeakPolarHBondContact O-CG2 3.48Å; G111-V115 PolarHBondContact O-N 3.34Å; G111-V115 VanDerWaalsContact O-N 3.08Å; W113-V115 VanDerWaalsContact C-N 3.33Å; W113-V115 PolarHBondContact O-N 2.89Å |
| 116 | F | 93.3 | Very high | 91.9 | Very high | 19 Ų | 19 | 61.8 Ų | 61.8 | 8% | 0.083 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -112.3 | 7.5 | -176.6 | -59.8 | -69 | 0 | 0 | 0 | 113.4 | N77 L78 F81 G112 E118 I126 | N77-F116 HydrophobicContact CB-CD1 4.25Å; N77-F116 HydrophobicContact CB-CE1 3.63Å; N77-F116 HydrophobicContact CB-CZ 4.22Å; L78-F116 HydrophobicContact CD2-CZ 4.26Å; F81-F116 HydrophobicContact CB-CE2 3.69Å; F81-F116 HydrophobicContact CB-CZ 4.12Å; F81-F116 HydrophobicContact CD1-CE2 4.44Å; F81-F116 HydrophobicContact CD2-CD2 4.05Å; F81-F116 AromaticContact CD2-CE2 3.62Å; F81-F116 HydrophobicContact CD2-CE2 3.62Å; F81-F116 HydrophobicContact CE2-CE2 4.38Å; F81-F116 AromaticContact CG-CE2 3.65Å; F81-F116 HydrophobicContact CG-CE2 3.65Å; F81-F116 HydrophobicContact CG-CZ 4.45Å; G112-F116 CarbonylContact O-C 3.41Å; G112-F116 WeakPolarHBondContact O-CA 3.23Å; G112-F116 WeakPolarHBondContact O-CB 3.42Å; G112-F116 PolarHBondContact O-N 3.15Å; F116-E118 VanDerWaalsContact C-N 3.34Å; F116-E118 PolarHBondContact O-N 3.09Å; F116-I126 HydrophobicContact CD1-CD1 4.14Å; F116-I126 HydrophobicContact CE1-CD1 3.57Å; F116-I126 HydrophobicContact CE1-CG2 4.23Å |
| 117 | G | 89.4 | Confident | 92.1 | Very high | 53 Ų | 53 | 59.2 Ų | 59.2 | 55% | 0.546 | 32% | 0.323 | S | S | . | . | trans | -69.1 | -24.9 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | G112 W113 N119 | G112-G117 PolarHBondContact O-N 3.33Å; W113-G117 WeakPolarHBondContact O-CA 3.29Å; W113-G117 PolarHBondContact O-N 3.04Å; G117-N119 PolarHBondContact O-N 3.04Å | ||
| 118 | E | 90.4 | Very high | 92.1 | Very high | 127 Ų | 127 | 64.3 Ų | 64.3 | 59% | 0.593 | 35% | 0.348 | S | S | * | . | S | Bend | trans | -70.2 | 127.3 | 175.9 | -69.5 | -178.7 | 178.6 | 0 | 0 | 111.6 | F116 N120 N123 | F116-E118 VanDerWaalsContact C-N 3.34Å; F116-E118 PolarHBondContact O-N 3.09Å; E118-N120 PolarHBondContact O-N 2.8Å; E118-N123 VanDerWaalsContact O-CB 3.23Å; E118-N123 WeakPolarHBondContact O-CB 3.34Å; E118-N123 PolarHBondContact O-ND2 3.4Å |
| 119 | N | 88.3 | Confident | 92.1 | Very high | 156 Ų | 156 | 68.3 Ų | 68.3 | 83% | 0.834 | 36% | 0.357 | S | S | * | . | trans | -79.5 | 82.3 | 174.5 | -170.1 | 9.8 | 0 | 0 | 0 | 111.4 | G117 | G117-N119 PolarHBondContact O-N 3.04Š| ||
| 120 | N | 90.2 | Very high | 92.1 | Very high | 38 Ų | 38 | 69 Ų | 69 | 20% | 0.203 | 36% | 0.357 | C | S | . | . | trans | -121.3 | 162.3 | 171.7 | 65.6 | 63 | 0 | 0 | 0 | 110.8 | E118 I122 N123 S124 | E118-N120 PolarHBondContact O-N 2.8Å; N120-I122 PolarHBondContact O-N 3.49Å; N120-I122 WeakPolarHBondContact OD1-CB 3.45Å; N120-I122 PolarHBondContact OD1-N 2.84Å; N120-I122 VanDerWaalsContact OD1-N 3.09Å; N120-N123 PolarHBondContact ND2-ND2 2.85Å; N120-N123 VanDerWaalsContact ND2-ND2 3.11Å; N120-N123 PolarHBondContact O-N 3.37Å; N120-N123 VanDerWaalsContact O-N 3.15Å; N120-N123 PolarHBondContact OD1-N 3.39Å; N120-S124 WeakPolarHBondContact O-CB 3.38Å; N120-S124 PolarHBondContact O-N 3.45Å | ||
| 121 | N | 87.7 | Confident | 92.2 | Very high | 117 Ų | 117 | 69.3 Ų | 69.3 | 63% | 0.626 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -54.9 | -30.1 | -176.2 | -67.8 | -16.5 | 0 | 0 | 0 | 113.9 | Q125 | N121-Q125 WeakPolarHBondContact O-CB 3.37Å; N121-Q125 WeakPolarHBondContact O-CG 3.27Å; N121-Q125 PolarHBondContact O-N 3.19Å |
| 122 | I | 88.8 | Confident | 92.2 | Very high | 19 Ų | 19 | 72.5 Ų | 72.5 | 10% | 0.097 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -78.5 | -47.5 | -179 | -66.7 | 165.9 | 0 | 0 | 0 | 110.3 | A70 Q73 H74 N120 S124 Q125 I126 | A70-I122 HydrophobicContact CB-CD1 4.02Å; A70-I122 WeakPolarHBondContact O-CD1 3.32Å; Q73-I122 HydrophobicContact CB-CD1 3.68Å; Q73-I122 HydrophobicContact CG-CB 4.48Å; Q73-I122 HydrophobicContact CG-CD1 3.73Å; Q73-I122 HydrophobicContact CG-CG2 4.49Å; H74-I122 HydrophobicContact CB-CG2 3.82Å; N120-I122 PolarHBondContact O-N 3.49Å; N120-I122 WeakPolarHBondContact OD1-CB 3.45Å; N120-I122 PolarHBondContact OD1-N 2.84Å; N120-I122 VanDerWaalsContact OD1-N 3.09Å; I122-S124 VanDerWaalsContact C-N 3.34Å; I122-Q125 PolarHBondContact O-N 3.39Å; I122-I126 HydrophobicContact CG2-CD1 4.1Å; I122-I126 VanDerWaalsContact O-CG1 3.31Å; I122-I126 WeakPolarHBondContact O-CG1 3.19Å; I122-I126 PolarHBondContact O-N 3.01Å |
| 123 | N | 92.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 78.5 Ų | 78.5 | 0% | 0 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 177.4 | -72.4 | 0.1 | 0 | 0 | 0 | 111 | N77 E118 N120 Q125 I126 N127 | N77-N123 PolarHBondContact ND2-OD1 3.23Å; E118-N123 VanDerWaalsContact O-CB 3.23Å; E118-N123 WeakPolarHBondContact O-CB 3.34Å; E118-N123 PolarHBondContact O-ND2 3.4Å; N120-N123 PolarHBondContact ND2-ND2 2.85Å; N120-N123 VanDerWaalsContact ND2-ND2 3.11Å; N120-N123 PolarHBondContact O-N 3.37Å; N120-N123 VanDerWaalsContact O-N 3.15Å; N120-N123 PolarHBondContact OD1-N 3.39Å; N123-Q125 PolarHBondContact O-N 2.83Å; N123-I126 PolarHBondContact O-N 2.92Å; N123-N127 WeakPolarHBondContact O-CB 3.42Å; N123-N127 VanDerWaalsContact O-CG 3.27Å; N123-N127 PolarHBondContact O-N 2.86Å |
| 124 | S | 91.1 | Very high | 92.4 | Very high | 30 Ų | 30 | 73.1 Ų | 73.1 | 21% | 0.21 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -59.6 | -44.7 | 175.4 | -175.1 | 0 | 0 | 0 | 0 | 111.8 | N120 I122 I126 N127 M128 Q179 | N120-S124 WeakPolarHBondContact O-CB 3.38Å; N120-S124 PolarHBondContact O-N 3.45Å; I122-S124 VanDerWaalsContact C-N 3.34Å; S124-I126 PolarHBondContact O-N 3.28Å; S124-N127 PolarHBondContact O-N 3.43Å; S124-M128 WeakPolarHBondContact O-CB 3.47Å; S124-M128 WeakPolarHBondContact O-CG 3.46Å; S124-M128 PolarHBondContact O-N 3.08Å; S124-Q179 PolarHBondContact OG-NE2 3.19Å; S124-Q179 VanDerWaalsContact OG-NE2 3.15Å |
| 125 | Q | 90.4 | Very high | 92.5 | Very high | 47 Ų | 47 | 71.9 Ų | 71.9 | 22% | 0.22 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -59.4 | -45.2 | 174.4 | -78.5 | 172.8 | 8.2 | 0 | 0 | 112.6 | R44 N121 I122 N123 Y129 | R44-Q125 VanDerWaalsContact CZ-OE1 3.25Å; N121-Q125 WeakPolarHBondContact O-CB 3.37Å; N121-Q125 WeakPolarHBondContact O-CG 3.27Å; N121-Q125 PolarHBondContact O-N 3.19Å; I122-Q125 PolarHBondContact O-N 3.39Å; N123-Q125 PolarHBondContact O-N 2.83Å; Q125-Y129 WeakPolarHBondContact O-CB 3.22Å; Q125-Y129 PolarHBondContact O-N 3.45Å; Q125-Y129 VanDerWaalsContact O-N 3.08Å |
| 126 | I | 92.1 | Very high | 92.4 | Very high | 18 Ų | 18 | 76.8 Ų | 76.8 | 9% | 0.092 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -64.8 | -48.1 | 178.3 | -64.1 | 165.9 | 0 | 0 | 0 | 110.9 | H74 F116 I122 N123 S124 Y129 L130 | H74-I126 VanDerWaalsContact ND1-CD1 3.28Å; H74-I126 WeakPolarHBondContact ND1-CD1 3.48Å; F116-I126 HydrophobicContact CD1-CD1 4.14Å; F116-I126 HydrophobicContact CE1-CD1 3.57Å; F116-I126 HydrophobicContact CE1-CG2 4.23Å; I122-I126 HydrophobicContact CG2-CD1 4.1Å; I122-I126 VanDerWaalsContact O-CG1 3.31Å; I122-I126 WeakPolarHBondContact O-CG1 3.19Å; I122-I126 PolarHBondContact O-N 3.01Å; N123-I126 PolarHBondContact O-N 2.92Å; S124-I126 PolarHBondContact O-N 3.28Å; I126-Y129 PolarHBondContact O-N 3.39Å; I126-L130 HydrophobicContact CG2-CD1 3.95Å; I126-L130 HydrophobicContact CG2-CG 4.39Å; I126-L130 WeakPolarHBondContact O-CB 3.44Å; I126-L130 WeakPolarHBondContact O-CG 3.29Å; I126-L130 PolarHBondContact O-N 3.04Å |
| 127 | N | 94 | Very high | 92.5 | Very high | 69 Ų | 69 | 78.6 Ų | 78.6 | 37% | 0.369 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -66.1 | -42.7 | -175.3 | -72.4 | -14.9 | 0 | 0 | 0 | 111.4 | N123 S124 L130 L131 | N123-N127 WeakPolarHBondContact O-CB 3.42Å; N123-N127 VanDerWaalsContact O-CG 3.27Å; N123-N127 PolarHBondContact O-N 2.86Å; S124-N127 PolarHBondContact O-N 3.43Å; N127-L130 PolarHBondContact O-N 2.8Å; N127-L131 WeakPolarHBondContact O-CB 3.38Å; N127-L131 PolarHBondContact O-N 3.42Å |
| 128 | M | 92.4 | Very high | 92.8 | Very high | 108 Ų | 108 | 80.7 Ų | 80.7 | 53% | 0.532 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -68.5 | -38.3 | 176.7 | -67.1 | -175.2 | 82.8 | 0 | 0 | 111.9 | S124 L131 S132 Q179 | S124-M128 WeakPolarHBondContact O-CB 3.47Å; S124-M128 WeakPolarHBondContact O-CG 3.46Å; S124-M128 PolarHBondContact O-N 3.08Å; M128-L131 PolarHBondContact O-N 3.48Å; M128-S132 PolarHBondContact O-N 2.8Å; M128-S132 VanDerWaalsContact O-N 3.11Å; M128-S132 PolarHBondContact O-OG 2.86Å; M128-Q179 HydrophobicContact SD-CG 4.23Å; M128-Q179 PolarHBondContact SD-NE2 3.39Å |
| 129 | Y | 93.4 | Very high | 93 | Very high | 115 Ų | 115 | 78.2 Ų | 78.2 | 45% | 0.451 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.6 | -46.7 | 172.4 | 171.3 | -98.8 | 0 | 0 | 0 | 112 | Q125 I126 S132 R133 | Q125-Y129 WeakPolarHBondContact O-CB 3.22Å; Q125-Y129 PolarHBondContact O-N 3.45Å; Q125-Y129 VanDerWaalsContact O-N 3.08Å; I126-Y129 PolarHBondContact O-N 3.39Å; Y129-S132 PolarHBondContact O-OG 3.41Å; Y129-R133 PolarHBondContact O-N 2.84Å; Y129-R133 PolarHBondContact OH-NE 3.36Å; Y129-R133 PolarHBondContact OH-NH1 3.31Å; Y129-R133 PolarHBondContact OH-NH2 3.14Å |
| 130 | L | 95 | Very high | 93.1 | Very high | 77 Ų | 77 | 79 Ų | 79 | 40% | 0.403 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -67.2 | -41.7 | 177.4 | -73.4 | 178.1 | 0 | 0 | 0 | 111.7 | I126 N127 S132 R133 I134 | I126-L130 HydrophobicContact CG2-CD1 3.95Å; I126-L130 HydrophobicContact CG2-CG 4.39Å; I126-L130 WeakPolarHBondContact O-CB 3.44Å; I126-L130 WeakPolarHBondContact O-CG 3.29Å; I126-L130 PolarHBondContact O-N 3.04Å; N127-L130 PolarHBondContact O-N 2.8Å; L130-S132 PolarHBondContact O-N 3.2Å; L130-R133 PolarHBondContact O-N 2.8Å; L130-R133 VanDerWaalsContact O-N 3.14Å; L130-I134 HydrophobicContact CB-CD1 4.32Å; L130-I134 WeakPolarHBondContact O-CB 3.46Å; L130-I134 VanDerWaalsContact O-CG1 3.22Å; L130-I134 WeakPolarHBondContact O-CG1 3.38Å; L130-I134 PolarHBondContact O-N 3.44Å |
| 131 | L | 96.1 | Very high | 93.3 | Very high | 96 Ų | 96 | 81 Ų | 81 | 50% | 0.503 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -55.5 | -51 | 178.9 | 177.2 | 62.8 | 0 | 0 | 0 | 111.2 | N127 M128 R133 I134 L135 | N127-L131 WeakPolarHBondContact O-CB 3.38Å; N127-L131 PolarHBondContact O-N 3.42Å; M128-L131 PolarHBondContact O-N 3.48Å; L131-R133 VanDerWaalsContact C-N 3.28Å; L131-R133 PolarHBondContact O-N 3.31Å; L131-I134 PolarHBondContact O-N 3.08Å; L131-L135 HydrophobicContact CD1-CD1 4.14Å; L131-L135 HydrophobicContact CD1-CG 4.13Å; L131-L135 HydrophobicContact CG-CD1 4.1Å; L131-L135 HydrophobicContact CG-CG 4.48Å; L131-L135 WeakPolarHBondContact O-CG 3.41Å; L131-L135 PolarHBondContact O-N 3.39Å |
| 132 | S | 94.1 | Very high | 93.7 | Very high | 67 Ų | 67 | 76.4 Ų | 76.4 | 47% | 0.469 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -57.4 | -41.4 | 178.2 | 64.3 | 0 | 0 | 0 | 0 | 112.5 | M128 Y129 L130 F136 | M128-S132 PolarHBondContact O-N 2.8Å; M128-S132 VanDerWaalsContact O-N 3.11Å; M128-S132 PolarHBondContact O-OG 2.86Å; Y129-S132 PolarHBondContact O-OG 3.41Å; L130-S132 PolarHBondContact O-N 3.2Å; S132-F136 WeakPolarHBondContact O-CB 3.26Å; S132-F136 PolarHBondContact O-N 2.88Å |
| 133 | R | 95.5 | Very high | 93.9 | Very high | 147 Ų | 147 | 77.7 Ų | 77.7 | 56% | 0.555 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -71.1 | -37 | 178.1 | -72.6 | -174.8 | 167.9 | -132 | -1.8 | 113.2 | Y129 L130 L131 F136 A137 | Y129-R133 PolarHBondContact O-N 2.84Å; Y129-R133 PolarHBondContact OH-NE 3.36Å; Y129-R133 PolarHBondContact OH-NH1 3.31Å; Y129-R133 PolarHBondContact OH-NH2 3.14Å; L130-R133 PolarHBondContact O-N 2.8Å; L130-R133 VanDerWaalsContact O-N 3.14Å; L131-R133 VanDerWaalsContact C-N 3.28Å; L131-R133 PolarHBondContact O-N 3.31Å; R133-F136 PolarHBondContact O-N 2.89Å; R133-A137 VanDerWaalsContact O-CB 3.29Å; R133-A137 WeakPolarHBondContact O-CB 3.23Å; R133-A137 PolarHBondContact O-N 3.19Å |
| 134 | I | 96.4 | Very high | 94 | Very high | 90 Ų | 90 | 84.8 Ų | 84.8 | 46% | 0.462 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.7 | -48.7 | 175.7 | -71.3 | 163.9 | 0 | 0 | 0 | 109.2 | L130 L131 F136 A137 L138 | L130-I134 HydrophobicContact CB-CD1 4.32Å; L130-I134 WeakPolarHBondContact O-CB 3.46Å; L130-I134 VanDerWaalsContact O-CG1 3.22Å; L130-I134 WeakPolarHBondContact O-CG1 3.38Å; L130-I134 PolarHBondContact O-N 3.44Å; L131-I134 PolarHBondContact O-N 3.08Å; I134-F136 VanDerWaalsContact C-N 3.31Å; I134-F136 PolarHBondContact O-N 3.47Å; I134-A137 PolarHBondContact O-N 3.37Å; I134-L138 HydrophobicContact CG2-CD1 3.71Å; I134-L138 HydrophobicContact CG2-CG 4.12Å; I134-L138 WeakPolarHBondContact O-CB 3.41Å; I134-L138 VanDerWaalsContact O-CG 3.26Å; I134-L138 WeakPolarHBondContact O-CG 3.45Å; I134-L138 PolarHBondContact O-N 3.48Å |
| 135 | L | 95.8 | Very high | 94.1 | Very high | 97 Ų | 97 | 90.2 Ų | 90.2 | 51% | 0.508 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -57.1 | -47.2 | 176.6 | -69 | 173.9 | 0 | 0 | 0 | 110.8 | L131 A137 L138 S139 | L131-L135 HydrophobicContact CD1-CD1 4.14Å; L131-L135 HydrophobicContact CD1-CG 4.13Å; L131-L135 HydrophobicContact CG-CD1 4.1Å; L131-L135 HydrophobicContact CG-CG 4.48Å; L131-L135 WeakPolarHBondContact O-CG 3.41Å; L131-L135 PolarHBondContact O-N 3.39Å; L135-A137 PolarHBondContact O-N 2.84Å; L135-L138 PolarHBondContact O-N 2.98Å; L135-S139 PolarHBondContact O-N 3.44Å; L135-S139 PolarHBondContact O-OG 3.29Å |
| 136 | F | 93.6 | Very high | 94.2 | Very high | 122 Ų | 122 | 91 Ų | 91 | 54% | 0.535 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.2 | -43.4 | 177 | -166.5 | -96.2 | 0 | 0 | 0 | 112.8 | S132 R133 I134 S139 R140 | S132-F136 WeakPolarHBondContact O-CB 3.26Å; S132-F136 PolarHBondContact O-N 2.88Å; R133-F136 PolarHBondContact O-N 2.89Å; I134-F136 VanDerWaalsContact C-N 3.31Å; I134-F136 PolarHBondContact O-N 3.47Å; F136-S139 PolarHBondContact O-N 3.31Å; F136-R140 HydrophobicContact CD1-CG 4.49Å; F136-R140 HydrophobicContact CE1-CG 4.29Å; F136-R140 WeakPolarHBondContact O-CG 3.27Å; F136-R140 PolarHBondContact O-N 3.15Å; F136-R140 VanDerWaalsContact O-N 3.08Å |
| 137 | A | 95.4 | Very high | 94.3 | Very high | 57 Ų | 57 | 96.4 Ų | 96.4 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.8 | -41.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | R133 I134 L135 R140 L141 | R133-A137 VanDerWaalsContact O-CB 3.29Å; R133-A137 WeakPolarHBondContact O-CB 3.23Å; R133-A137 PolarHBondContact O-N 3.19Å; I134-A137 PolarHBondContact O-N 3.37Å; L135-A137 PolarHBondContact O-N 2.84Å; A137-R140 PolarHBondContact O-N 3.37Å; A137-L141 WeakPolarHBondContact O-CB 3.33Å; A137-L141 PolarHBondContact O-N 3.48Å |
| 138 | L | 95.9 | Very high | 94.2 | Very high | 98 Ų | 98 | 96.4 Ų | 96.4 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.8 | -41 | 175.9 | -71.4 | 174.9 | 0 | 0 | 0 | 111.5 | I134 L135 R140 L141 A142 | I134-L138 HydrophobicContact CG2-CD1 3.71Å; I134-L138 HydrophobicContact CG2-CG 4.12Å; I134-L138 WeakPolarHBondContact O-CB 3.41Å; I134-L138 VanDerWaalsContact O-CG 3.26Å; I134-L138 WeakPolarHBondContact O-CG 3.45Å; I134-L138 PolarHBondContact O-N 3.48Å; L135-L138 PolarHBondContact O-N 2.98Å; L138-R140 VanDerWaalsContact C-N 3.34Å; L138-R140 PolarHBondContact O-N 3.26Å; L138-L141 PolarHBondContact O-N 3.33Å; L138-A142 WeakPolarHBondContact O-CB 3.48Å; L138-A142 PolarHBondContact O-N 2.93Å |
| 139 | S | 93 | Very high | 94.1 | Very high | 75 Ų | 75 | 96.6 Ų | 96.6 | 52% | 0.524 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60 | -43.9 | 173.8 | -60.4 | 0 | 0 | 0 | 0 | 111.6 | L135 F136 A142 V143 | L135-S139 PolarHBondContact O-N 3.44Å; L135-S139 PolarHBondContact O-OG 3.29Å; F136-S139 PolarHBondContact O-N 3.31Å; S139-A142 PolarHBondContact O-N 3.27Å; S139-V143 WeakPolarHBondContact O-CG2 3.25Å; S139-V143 PolarHBondContact O-N 3.05Å; S139-V143 VanDerWaalsContact O-N 3.15Å |
| 140 | R | 91.7 | Very high | 93.9 | Very high | 173 Ų | 173 | 99 Ų | 99 | 65% | 0.653 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.7 | -42.3 | 175.9 | -72 | -177.1 | 66.9 | 177.2 | 3.2 | 112.3 | F136 A137 L138 A142 V143 E144 | F136-R140 HydrophobicContact CD1-CG 4.49Å; F136-R140 HydrophobicContact CE1-CG 4.29Å; F136-R140 WeakPolarHBondContact O-CG 3.27Å; F136-R140 PolarHBondContact O-N 3.15Å; F136-R140 VanDerWaalsContact O-N 3.08Å; A137-R140 PolarHBondContact O-N 3.37Å; L138-R140 VanDerWaalsContact C-N 3.34Å; L138-R140 PolarHBondContact O-N 3.26Å; R140-A142 VanDerWaalsContact C-N 3.32Å; R140-A142 PolarHBondContact O-N 2.87Å; R140-V143 PolarHBondContact O-N 3.3Å; R140-E144 PolarHBondContact O-N 2.75Å |
| 141 | L | 94.8 | Very high | 93.5 | Very high | 79 Ų | 79 | 98.6 Ų | 98.6 | 41% | 0.414 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.9 | -38.3 | 177 | -177 | 63.1 | 0 | 0 | 0 | 111.6 | A137 L138 V143 E144 K145 | A137-L141 WeakPolarHBondContact O-CB 3.33Å; A137-L141 PolarHBondContact O-N 3.48Å; L138-L141 PolarHBondContact O-N 3.33Å; L141-V143 VanDerWaalsContact C-N 3.32Å; L141-V143 PolarHBondContact O-N 3.32Å; L141-E144 PolarHBondContact O-N 3.34Å; L141-K145 HydrophobicContact CD1-CG 4.18Å; L141-K145 HydrophobicContact CG-CG 4.39Å; L141-K145 WeakPolarHBondContact O-CB 3.06Å; L141-K145 WeakPolarHBondContact O-CG 3.25Å; L141-K145 PolarHBondContact O-N 3.47Å |
| 142 | A | 94.8 | Very high | 93 | Very high | 21 Ų | 21 | 104.4 Ų | 104.4 | 17% | 0.174 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -64.1 | -37.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L138 S139 R140 G146 I147 V148 | L138-A142 WeakPolarHBondContact O-CB 3.48Å; L138-A142 PolarHBondContact O-N 2.93Å; S139-A142 PolarHBondContact O-N 3.27Å; R140-A142 VanDerWaalsContact C-N 3.32Å; R140-A142 PolarHBondContact O-N 2.87Å; A142-G146 PolarHBondContact O-N 2.82Å; A142-I147 HydrophobicContact CB-CB 4.38Å; A142-I147 WeakPolarHBondContact O-CB 3.4Å; A142-I147 PolarHBondContact O-N 3.2Å; A142-V148 HydrophobicContact CB-CG2 3.98Å; A142-V148 PolarHBondContact O-N 2.92Å |
| 143 | V | 93.7 | Very high | 92.8 | Very high | 45 Ų | 45 | 111.5 Ų | 111.5 | 27% | 0.273 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.5 | -45.3 | 172.1 | 174.6 | 0 | 0 | 0 | 0 | 111 | S139 R140 L141 K145 G146 V148 Q150 | S139-V143 WeakPolarHBondContact O-CG2 3.25Å; S139-V143 PolarHBondContact O-N 3.05Å; S139-V143 VanDerWaalsContact O-N 3.15Å; R140-V143 PolarHBondContact O-N 3.3Å; L141-V143 VanDerWaalsContact C-N 3.32Å; L141-V143 PolarHBondContact O-N 3.32Å; V143-K145 VanDerWaalsContact C-N 3.3Å; V143-K145 PolarHBondContact O-N 2.87Å; V143-G146 PolarHBondContact O-N 3.25Å; V143-V148 HydrophobicContact CG2-CB 4.08Å; V143-V148 HydrophobicContact CG2-CG1 4.14Å; V143-Q150 HydrophobicContact CG1-CB 4.13Å; V143-Q150 HydrophobicContact CG1-CG 4.19Å |
| 144 | E | 93.8 | Very high | 92.4 | Very high | 149 Ų | 149 | 109.9 Ų | 109.9 | 70% | 0.696 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -61.2 | -37.9 | 178.5 | -171.8 | -172.7 | 149.1 | 0 | 0 | 112.4 | R140 L141 G146 | R140-E144 PolarHBondContact O-N 2.75Å; L141-E144 PolarHBondContact O-N 3.34Å; E144-G146 PolarHBondContact O-N 2.59Å |
| 145 | K | 94.6 | Very high | 92.1 | Very high | 145 Ų | 145 | 109.1 Ų | 109.1 | 63% | 0.63 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | 0.2 | 176.7 | -66.6 | -64 | -177.8 | -171.6 | 0 | 113.9 | L141 V143 I147 | L141-K145 HydrophobicContact CD1-CG 4.18Å; L141-K145 HydrophobicContact CG-CG 4.39Å; L141-K145 WeakPolarHBondContact O-CB 3.06Å; L141-K145 WeakPolarHBondContact O-CG 3.25Å; L141-K145 PolarHBondContact O-N 3.47Å; V143-K145 VanDerWaalsContact C-N 3.3Å; V143-K145 PolarHBondContact O-N 2.87Å; K145-I147 HydrophobicContact CB-CD1 4.23Å; K145-I147 HydrophobicContact CB-CG1 4.15Å; K145-I147 PolarHBondContact O-N 2.91Å |
| 146 | G | 92.2 | Very high | 91.9 | Very high | 62 Ų | 62 | 110.2 Ų | 110.2 | 64% | 0.639 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 70 | 13.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | A142 V143 E144 | A142-G146 PolarHBondContact O-N 2.82Å; V143-G146 PolarHBondContact O-N 3.25Å; E144-G146 PolarHBondContact O-N 2.59Å |
| 147 | I | 94.3 | Very high | 92 | Very high | 133 Ų | 133 | 108 Ų | 108 | 68% | 0.682 | 57% | 0.567 | S | S | * | * | S | Bend | trans | -70.5 | -38.9 | 174.6 | -59.3 | 173.6 | 0 | 0 | 0 | 109.6 | A142 K145 | A142-I147 HydrophobicContact CB-CB 4.38Å; A142-I147 WeakPolarHBondContact O-CB 3.4Å; A142-I147 PolarHBondContact O-N 3.2Å; K145-I147 HydrophobicContact CB-CD1 4.23Å; K145-I147 HydrophobicContact CB-CG1 4.15Å; K145-I147 PolarHBondContact O-N 2.91Å |
| 148 | V | 91.4 | Very high | 91.9 | Very high | 69 Ų | 69 | 110.9 Ų | 110.9 | 42% | 0.418 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -114.1 | 131.5 | 176.6 | 178.7 | 0 | 0 | 0 | 0 | 108.2 | A142 V143 | A142-V148 HydrophobicContact CB-CG2 3.98Å; A142-V148 PolarHBondContact O-N 2.92Å; V143-V148 HydrophobicContact CG2-CB 4.08Å; V143-V148 HydrophobicContact CG2-CG1 4.14Å |
| 149 | P | 89.7 | Confident | 91.7 | Very high | 112 Ų | 112 | 111.7 Ų | 111.7 | 73% | 0.727 | 57% | 0.573 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 141.3 | 177.6 | 25.1 | -33.7 | 0 | 0 | 0 | 110.6 | P151 | P149-P151 WeakPolarHBondContact O-CD 3.4Š|
| 150 | Q | 89 | Confident | 91.8 | Very high | 166 Ų | 166 | 109.3 Ų | 109.3 | 78% | 0.776 | 56% | 0.558 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 125 | 175.7 | -168.4 | 178.4 | 20.8 | 0 | 0 | 109.3 | V143 K152 | V143-Q150 HydrophobicContact CG1-CB 4.13Å; V143-Q150 HydrophobicContact CG1-CG 4.19Å; Q150-K152 PolarHBondContact O-N 3.18Å |
| 151 | P | 86.9 | Confident | 92 | Very high | 67 Ų | 67 | 105.8 Ų | 105.8 | 44% | 0.435 | 56% | 0.555 | S | S | . | * | P | Polyproline II helix | trans | -67.1 | 134.3 | -177.8 | 26.3 | -33 | 0 | 0 | 0 | 110.2 | P149 R153 P155 | P149-P151 WeakPolarHBondContact O-CD 3.4Å; P151-R153 WeakPolarHBondContact CB-O 3.14Å; P151-R153 PolarHBondContact O-N 2.92Å; P151-P155 HydrophobicContact CG-CG 4.24Å |
| 152 | K | 86.9 | Confident | 92.1 | Very high | 218 Ų | 218 | 106.6 Ų | 106.6 | 95% | 0.948 | 56% | 0.56 | S | S | * | * | S | Bend | trans | -67.6 | -21.5 | -179.2 | -64.8 | -177.6 | 179.5 | -179.7 | 0 | 113.5 | Q150 | Q150-K152 PolarHBondContact O-N 3.18Š|
| 153 | R | 88.3 | Confident | 92.1 | Very high | 217 Ų | 217 | 108.7 Ų | 108.7 | 82% | 0.819 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -132.7 | 155.3 | 177.8 | -67.6 | -176.2 | 177.3 | 169.5 | -0.8 | 108.4 | P151 P155 | P151-R153 WeakPolarHBondContact CB-O 3.14Å; P151-R153 PolarHBondContact O-N 2.92Å; R153-P155 VanDerWaalsContact O-CD 3.31Å; R153-P155 WeakPolarHBondContact O-CD 3.39Å |
| 154 | D | 89.1 | Confident | 92.2 | Very high | 113 Ų | 113 | 113.8 Ų | 113.8 | 60% | 0.604 | 59% | 0.585 | S | S | * | * | trans | -58.6 | 119.5 | 175.6 | -175.9 | 5.6 | 0 | 0 | 0 | 110.1 | F156 P157 | D154-F156 PolarHBondContact O-N 3.43Å; D154-F156 VanDerWaalsContact OD1-CB 3.23Å; D154-F156 WeakPolarHBondContact OD1-CB 3.39Å; D154-F156 PolarHBondContact OD1-N 2.86Å; D154-P157 VanDerWaalsContact O-CD 3.23Å; D154-P157 WeakPolarHBondContact O-CD 3.35Å | ||
| 155 | P | 90.2 | Very high | 92.3 | Very high | 74 Ų | 74 | 108.8 Ų | 108.8 | 48% | 0.481 | 57% | 0.574 | S | S | . | * | S | Bend | trans | -74.2 | -11 | 178.2 | 30.9 | -36.3 | 0 | 0 | 0 | 113 | P151 R153 L158 F159 | P151-P155 HydrophobicContact CG-CG 4.24Å; R153-P155 VanDerWaalsContact O-CD 3.31Å; R153-P155 WeakPolarHBondContact O-CD 3.39Å; P155-L158 PolarHBondContact O-N 2.99Å; P155-F159 PolarHBondContact O-N 3.26Å |
| 156 | F | 91.5 | Very high | 92.4 | Very high | 119 Ų | 119 | 106.5 Ų | 106.5 | 52% | 0.522 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -56.5 | -40.9 | -173.9 | -172.2 | -101.4 | 0 | 0 | 0 | 114.9 | D154 L158 F159 A160 | D154-F156 PolarHBondContact O-N 3.43Å; D154-F156 VanDerWaalsContact OD1-CB 3.23Å; D154-F156 WeakPolarHBondContact OD1-CB 3.39Å; D154-F156 PolarHBondContact OD1-N 2.86Å; F156-L158 PolarHBondContact O-N 3.45Å; F156-F159 HydrophobicContact CD2-CD1 4.11Å; F156-F159 HydrophobicContact CE2-CD1 4.13Å; F156-F159 HydrophobicContact CE2-CE1 4.39Å; F156-F159 WeakPolarHBondContact O-CB 3.49Å; F156-F159 PolarHBondContact O-N 3.06Å; F156-A160 WeakPolarHBondContact O-CB 3.33Å; F156-A160 PolarHBondContact O-N 3.15Å |
| 157 | P | 94.8 | Very high | 92.6 | Very high | 77 Ų | 77 | 105 Ų | 105 | 50% | 0.5 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.3 | -43 | 177.1 | -24.8 | 36.2 | 0 | 0 | 0 | 113 | D154 A160 T161 | D154-P157 VanDerWaalsContact O-CD 3.23Å; D154-P157 WeakPolarHBondContact O-CD 3.35Å; P157-A160 PolarHBondContact O-N 2.94Å; P157-T161 PolarHBondContact O-N 2.89Å; P157-T161 PolarHBondContact O-OG1 2.84Å |
| 158 | L | 92.5 | Very high | 92.6 | Very high | 117 Ų | 117 | 101.2 Ų | 101.2 | 61% | 0.613 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65 | -43.6 | 177.1 | 179.3 | 63.7 | 0 | 0 | 0 | 110.9 | P155 F156 A160 T161 L162 | P155-L158 PolarHBondContact O-N 2.99Å; F156-L158 PolarHBondContact O-N 3.45Å; L158-A160 PolarHBondContact O-N 3.11Å; L158-T161 PolarHBondContact O-N 3.01Å; L158-L162 HydrophobicContact CD1-CD1 4.23Å; L158-L162 HydrophobicContact CD1-CG 4.33Å; L158-L162 HydrophobicContact CG-CD1 4.16Å; L158-L162 WeakPolarHBondContact O-CG 3.42Å; L158-L162 PolarHBondContact O-N 3.49Å |
| 159 | F | 92.6 | Very high | 92.9 | Very high | 114 Ų | 114 | 104.3 Ų | 104.3 | 50% | 0.5 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -56.8 | -49 | 174.4 | 168.4 | -100.8 | 0 | 0 | 0 | 111.5 | P155 F156 T161 L162 V163 | P155-F159 PolarHBondContact O-N 3.26Å; F156-F159 HydrophobicContact CD2-CD1 4.11Å; F156-F159 HydrophobicContact CE2-CD1 4.13Å; F156-F159 HydrophobicContact CE2-CE1 4.39Å; F156-F159 WeakPolarHBondContact O-CB 3.49Å; F156-F159 PolarHBondContact O-N 3.06Å; F159-T161 PolarHBondContact O-N 3.29Å; F159-L162 PolarHBondContact O-N 2.97Å; F159-V163 HydrophobicContact CD1-CG2 4.46Å; F159-V163 HydrophobicContact CD2-CG2 3.92Å; F159-V163 HydrophobicContact CE1-CG2 4.1Å; F159-V163 HydrophobicContact CE2-CG2 3.52Å; F159-V163 HydrophobicContact CG-CG2 4.38Å; F159-V163 HydrophobicContact CZ-CG2 3.63Å; F159-V163 WeakPolarHBondContact O-CB 3.23Å; F159-V163 VanDerWaalsContact O-CG2 3.27Å; F159-V163 WeakPolarHBondContact O-CG2 3.22Å; F159-V163 PolarHBondContact O-N 3.35Å |
| 160 | A | 95.1 | Very high | 93.2 | Very high | 25 Ų | 25 | 101.1 Ų | 101.1 | 21% | 0.207 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -60.4 | -46.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | F156 P157 L158 L162 V163 W164 | F156-A160 WeakPolarHBondContact O-CB 3.33Å; F156-A160 PolarHBondContact O-N 3.15Å; P157-A160 PolarHBondContact O-N 2.94Å; L158-A160 PolarHBondContact O-N 3.11Å; A160-L162 PolarHBondContact O-N 3.47Å; A160-V163 PolarHBondContact O-N 3.45Å; A160-W164 WeakPolarHBondContact O-CB 3.31Å; A160-W164 VanDerWaalsContact O-CD1 3.24Å; A160-W164 PolarHBondContact O-N 3.4Å |
| 161 | T | 95.9 | Very high | 93.5 | Very high | 99 Ų | 99 | 93.3 Ų | 93.3 | 61% | 0.607 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -57.9 | -46.6 | 177.8 | -61 | 0 | 0 | 0 | 0 | 111.9 | P157 L158 F159 G165 | P157-T161 PolarHBondContact O-N 2.89Å; P157-T161 PolarHBondContact O-OG1 2.84Å; L158-T161 PolarHBondContact O-N 3.01Å; F159-T161 PolarHBondContact O-N 3.29Å; T161-G165 PolarHBondContact O-N 2.89Å |
| 162 | L | 96.2 | Very high | 93.8 | Very high | 96 Ų | 96 | 94.8 Ų | 94.8 | 50% | 0.503 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -68.1 | -43.8 | -179.7 | -68.2 | 175.2 | 0 | 0 | 0 | 112 | L158 F159 A160 W164 G165 I166 | L158-L162 HydrophobicContact CD1-CD1 4.23Å; L158-L162 HydrophobicContact CD1-CG 4.33Å; L158-L162 HydrophobicContact CG-CD1 4.16Å; L158-L162 WeakPolarHBondContact O-CG 3.42Å; L158-L162 PolarHBondContact O-N 3.49Å; F159-L162 PolarHBondContact O-N 2.97Å; A160-L162 PolarHBondContact O-N 3.47Å; L162-W164 PolarHBondContact O-N 3.21Å; L162-G165 PolarHBondContact O-N 3.43Å; L162-I166 WeakPolarHBondContact O-CB 3.49Å; L162-I166 WeakPolarHBondContact O-CD1 3.46Å; L162-I166 WeakPolarHBondContact O-CG1 3.42Å; L162-I166 PolarHBondContact O-N 3.11Å |
| 163 | V | 95.5 | Very high | 94.2 | Very high | 65 Ų | 65 | 92 Ų | 92 | 39% | 0.394 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60 | -47.6 | 178.3 | 168.5 | 0 | 0 | 0 | 0 | 111.1 | F159 A160 V167 | F159-V163 HydrophobicContact CD1-CG2 4.46Å; F159-V163 HydrophobicContact CD2-CG2 3.92Å; F159-V163 HydrophobicContact CE1-CG2 4.1Å; F159-V163 HydrophobicContact CE2-CG2 3.52Å; F159-V163 HydrophobicContact CG-CG2 4.38Å; F159-V163 HydrophobicContact CZ-CG2 3.63Å; F159-V163 WeakPolarHBondContact O-CB 3.23Å; F159-V163 VanDerWaalsContact O-CG2 3.27Å; F159-V163 WeakPolarHBondContact O-CG2 3.22Å; F159-V163 PolarHBondContact O-N 3.35Å; A160-V163 PolarHBondContact O-N 3.45Å; V163-V167 WeakPolarHBondContact O-CB 3.49Å; V163-V167 WeakPolarHBondContact O-CG1 3.3Å; V163-V167 PolarHBondContact O-N 3.29Å |
| 164 | W | 95.4 | Very high | 94.5 | Very high | 152 Ų | 152 | 85.2 Ų | 85.2 | 58% | 0.576 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -68.6 | -41.3 | -179.9 | -81.3 | 111 | 0 | 0 | 0 | 112.8 | A160 L162 V167 L168 | A160-W164 WeakPolarHBondContact O-CB 3.31Å; A160-W164 VanDerWaalsContact O-CD1 3.24Å; A160-W164 PolarHBondContact O-N 3.4Å; L162-W164 PolarHBondContact O-N 3.21Å; W164-V167 HydrophobicContact CE3-CG1 3.98Å; W164-V167 WeakPolarHBondContact O-CG1 3.47Å; W164-L168 PolarHBondContact O-N 2.92Å |
| 165 | G | 96.8 | Very high | 94.6 | Very high | 45 Ų | 45 | 82.2 Ų | 82.2 | 46% | 0.464 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.3 | -45.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | T161 L162 W169 | T161-G165 PolarHBondContact O-N 2.89Å; L162-G165 PolarHBondContact O-N 3.43Å; G165-W169 WeakPolarHBondContact O-CB 3.1Å; G165-W169 PolarHBondContact O-N 2.79Å; G165-W169 VanDerWaalsContact O-N 3.08Å |
| 166 | I | 96.5 | Very high | 94.6 | Very high | 97 Ų | 97 | 85.6 Ų | 85.6 | 50% | 0.497 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -68.7 | -44.6 | -179.2 | -67.1 | 166.1 | 0 | 0 | 0 | 111.4 | L162 L168 W169 L170 | L162-I166 WeakPolarHBondContact O-CB 3.49Å; L162-I166 WeakPolarHBondContact O-CD1 3.46Å; L162-I166 WeakPolarHBondContact O-CG1 3.42Å; L162-I166 PolarHBondContact O-N 3.11Å; I166-L168 PolarHBondContact O-N 3.41Å; I166-W169 PolarHBondContact O-N 2.89Å; I166-L170 HydrophobicContact CG2-CD1 3.89Å; I166-L170 HydrophobicContact CG2-CG 4.28Å; I166-L170 WeakPolarHBondContact O-CB 3.27Å; I166-L170 WeakPolarHBondContact O-CG 3.3Å; I166-L170 PolarHBondContact O-N 2.93Å |
| 167 | V | 95.9 | Very high | 94.6 | Very high | 29 Ų | 29 | 83.9 Ų | 83.9 | 18% | 0.176 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -66.5 | -38.5 | -176.7 | 73.5 | 0 | 0 | 0 | 0 | 112.2 | V163 W164 L170 F171 L178 L182 M186 | V163-V167 WeakPolarHBondContact O-CB 3.49Å; V163-V167 WeakPolarHBondContact O-CG1 3.3Å; V163-V167 PolarHBondContact O-N 3.29Å; W164-V167 HydrophobicContact CE3-CG1 3.98Å; W164-V167 WeakPolarHBondContact O-CG1 3.47Å; V167-L170 PolarHBondContact O-N 2.9Å; V167-F171 WeakPolarHBondContact O-CB 3.21Å; V167-F171 PolarHBondContact O-N 3.24Å; V167-L178 HydrophobicContact CG2-CD2 4.46Å; V167-L182 HydrophobicContact CG2-CD2 3.9Å; V167-M186 HydrophobicContact CG2-SD 4.25Å |
| 168 | L | 95.4 | Very high | 94.4 | Very high | 54 Ų | 54 | 81.3 Ų | 81.3 | 28% | 0.283 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -68.7 | -43.4 | 175.3 | -79.8 | 170.9 | 0 | 0 | 0 | 111.3 | W164 I166 L170 F171 E172 M186 Y190 | W164-L168 PolarHBondContact O-N 2.92Å; I166-L168 PolarHBondContact O-N 3.41Å; L168-L170 VanDerWaalsContact C-N 3.32Å; L168-L170 PolarHBondContact O-N 2.94Å; L168-F171 WeakPolarHBondContact O-CB 3.26Å; L168-F171 PolarHBondContact O-N 2.94Å; L168-F171 VanDerWaalsContact O-N 3.11Å; L168-E172 WeakPolarHBondContact O-CG 3.46Å; L168-E172 PolarHBondContact O-N 3.1Å; L168-M186 HydrophobicContact CD2-CE 3.5Å; L168-M186 HydrophobicContact CG-CE 4.23Å; L168-Y190 HydrophobicContact CD2-CD2 4.17Å; L168-Y190 HydrophobicContact CD2-CE1 4.3Å; L168-Y190 HydrophobicContact CD2-CE2 3.73Å |
| 169 | W | 96.6 | Very high | 94.1 | Very high | 135 Ų | 135 | 78 Ų | 78 | 51% | 0.511 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -59.1 | -43.7 | 174.7 | 179.1 | 79.7 | 0 | 0 | 0 | 112.2 | G165 I166 F171 E172 Y173 H174 | G165-W169 WeakPolarHBondContact O-CB 3.1Å; G165-W169 PolarHBondContact O-N 2.79Å; G165-W169 VanDerWaalsContact O-N 3.08Å; I166-W169 PolarHBondContact O-N 2.89Å; W169-F171 VanDerWaalsContact C-N 3.32Å; W169-F171 PolarHBondContact O-N 2.97Å; W169-E172 PolarHBondContact O-N 3.49Å; W169-Y173 AromaticContact CD1-CD2 3.34Å; W169-Y173 AromaticContact CD1-CE2 3.6Å; W169-Y173 HydrophobicContact CG-CD2 4.05Å; W169-Y173 AromaticContact NE1-CD2 3.42Å; W169-Y173 AromaticContact NE1-CE2 3.86Å; W169-Y173 WeakPolarHBondContact O-CD2 3.25Å; W169-Y173 PolarHBondContact O-N 2.98Å; W169-H174 AromaticContact CH2-CD2 3.6Å; W169-H174 AromaticContact CH2-NE2 3.67Å; W169-H174 AromaticContact CZ2-NE2 3.93Å; W169-H174 AromaticContact CZ3-CD2 3.92Å |
| 170 | L | 95.9 | Very high | 93.8 | Very high | 44 Ų | 44 | 76.5 Ų | 76.5 | 23% | 0.23 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -63.2 | -37.5 | 174.5 | -73.8 | 173.5 | 0 | 0 | 0 | 112.4 | I166 V167 L168 H174 P175 L178 | I166-L170 HydrophobicContact CG2-CD1 3.89Å; I166-L170 HydrophobicContact CG2-CG 4.28Å; I166-L170 WeakPolarHBondContact O-CB 3.27Å; I166-L170 WeakPolarHBondContact O-CG 3.3Å; I166-L170 PolarHBondContact O-N 2.93Å; V167-L170 PolarHBondContact O-N 2.9Å; L168-L170 VanDerWaalsContact C-N 3.32Å; L168-L170 PolarHBondContact O-N 2.94Å; L170-H174 HydrophobicContact CD2-CB 4.35Å; L170-H174 CarbonylContact O-C 2.86Å; L170-H174 WeakPolarHBondContact O-CA 3.33Å; L170-H174 PolarHBondContact O-N 2.98Å; L170-P175 VanDerWaalsContact O-N 3.16Å; L170-L178 HydrophobicContact CB-CD1 4.35Å; L170-L178 HydrophobicContact CB-CD2 4.03Å; L170-L178 HydrophobicContact CB-CG 4.27Å; L170-L178 HydrophobicContact CD1-CD2 4.13Å |
| 171 | F | 95.6 | Very high | 93.3 | Very high | 2 Ų | 2 | 77.3 Ų | 77.3 | 1% | 0.009 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -65.8 | -44.4 | 178 | 169.7 | -106.3 | 0 | 0 | 0 | 112.4 | V167 L168 W169 P175 L178 M186 N187 Y190 H191 | V167-F171 WeakPolarHBondContact O-CB 3.21Å; V167-F171 PolarHBondContact O-N 3.24Å; L168-F171 WeakPolarHBondContact O-CB 3.26Å; L168-F171 PolarHBondContact O-N 2.94Å; L168-F171 VanDerWaalsContact O-N 3.11Å; W169-F171 VanDerWaalsContact C-N 3.32Å; W169-F171 PolarHBondContact O-N 2.97Å; F171-P175 WeakPolarHBondContact O-CB 3.24Å; F171-P175 WeakPolarHBondContact O-CD 3.36Å; F171-L178 HydrophobicContact CB-CD1 3.79Å; F171-M186 HydrophobicContact CB-CE 3.33Å; F171-M186 HydrophobicContact CB-SD 3.83Å; F171-M186 HydrophobicContact CD1-CB 4.33Å; F171-M186 HydrophobicContact CD1-CE 3.75Å; F171-M186 HydrophobicContact CD2-CB 3.52Å; F171-M186 HydrophobicContact CD2-CE 4.07Å; F171-M186 HydrophobicContact CD2-CG 4.32Å; F171-M186 HydrophobicContact CD2-SD 3.93Å; F171-M186 HydrophobicContact CE1-CB 4.19Å; F171-M186 HydrophobicContact CE2-CB 3.36Å; F171-M186 HydrophobicContact CG-CB 4.01Å; F171-M186 HydrophobicContact CG-CE 3.44Å; F171-M186 VanDerWaalsContact CG-CE 3.44Å; F171-M186 HydrophobicContact CG-SD 3.89Å; F171-M186 HydrophobicContact CZ-CB 3.72Å; F171-N187 WeakPolarHBondContact CE2-OD1 3.44Å; F171-Y190 HydrophobicContact CE1-CD2 4.27Å; F171-H191 AromaticContact CE1-CE1 3.65Å; F171-H191 AromaticContact CE1-NE2 3.67Å; F171-H191 AromaticContact CZ-CE1 3.38Å; F171-H191 WeakPolarHBondContact CZ-CE1 3.48Å; F171-H191 AromaticContact CZ-ND1 3.51Å; F171-H191 AromaticContact CZ-NE2 3.85Å |
| 172 | E | 93.9 | Very high | 92.9 | Very high | 98 Ų | 98 | 75.8 Ų | 75.8 | 46% | 0.458 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -71.7 | -44.5 | -178.5 | -65.2 | -61.2 | 157.8 | 0 | 0 | 112.4 | L168 W169 H191 | L168-E172 WeakPolarHBondContact O-CG 3.46Å; L168-E172 PolarHBondContact O-N 3.1Å; W169-E172 PolarHBondContact O-N 3.49Å; E172-H191 IonicContact OE2-NE2 3.24Å |
| 173 | Y | 95.1 | Very high | 92.6 | Very high | 160 Ų | 160 | 73.3 Ų | 73.3 | 63% | 0.627 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -102.4 | -25.3 | -170.4 | -63.1 | -79 | 0 | 0 | 0 | 114.1 | W169 | W169-Y173 AromaticContact CD1-CD2 3.34Å; W169-Y173 AromaticContact CD1-CE2 3.6Å; W169-Y173 HydrophobicContact CG-CD2 4.05Å; W169-Y173 AromaticContact NE1-CD2 3.42Å; W169-Y173 AromaticContact NE1-CE2 3.86Å; W169-Y173 WeakPolarHBondContact O-CD2 3.25Å; W169-Y173 PolarHBondContact O-N 2.98Å |
| 174 | H | 94.4 | Very high | 92.2 | Very high | 74 Ų | 74 | 72.1 Ų | 72.1 | 34% | 0.343 | 37% | 0.366 | S | S | . | . | trans | -139.4 | 48.6 | -175.1 | -59.1 | -59.9 | 0 | 0 | 0 | 113.8 | W169 L170 H176 T177 | W169-H174 AromaticContact CH2-CD2 3.6Å; W169-H174 AromaticContact CH2-NE2 3.67Å; W169-H174 AromaticContact CZ2-NE2 3.93Å; W169-H174 AromaticContact CZ3-CD2 3.92Å; L170-H174 HydrophobicContact CD2-CB 4.35Å; L170-H174 CarbonylContact O-C 2.86Å; L170-H174 WeakPolarHBondContact O-CA 3.33Å; L170-H174 PolarHBondContact O-N 2.98Å; H174-H176 PolarHBondContact O-N 3.4Å; H174-T177 HydrophobicContact CB-CG2 4.05Å; H174-T177 WeakPolarHBondContact O-CB 3.47Å; H174-T177 PolarHBondContact O-N 3.03Å; H174-T177 PolarHBondContact O-OG1 3.29Å | ||
| 175 | P | 90.1 | Very high | 91.8 | Very high | 50 Ų | 50 | 66.5 Ų | 66.5 | 33% | 0.325 | 35% | 0.35 | S | S | . | . | G | 310 helix | trans | -58.1 | -33.1 | -168.5 | 19.1 | -31.6 | 0 | 0 | 0 | 113.8 | L170 F171 T177 L178 Q183 | L170-P175 VanDerWaalsContact O-N 3.16Å; F171-P175 WeakPolarHBondContact O-CB 3.24Å; F171-P175 WeakPolarHBondContact O-CD 3.36Å; P175-T177 PolarHBondContact O-N 3.3Å; P175-T177 VanDerWaalsContact O-N 3.11Å; P175-L178 PolarHBondContact O-N 3.41Å; P175-L178 VanDerWaalsContact O-N 3.07Å; P175-Q183 WeakPolarHBondContact O-CG 3.3Å; P175-Q183 PolarHBondContact O-NE2 3.43Å |
| 176 | H | 90.7 | Very high | 91.5 | Very high | 146 Ų | 146 | 64.7 Ų | 64.7 | 68% | 0.676 | 33% | 0.33 | S | S | * | . | G | 310 helix | trans | -61.2 | -19.2 | 179.4 | 66.5 | -85.4 | 0 | 0 | 0 | 114.2 | H174 | H174-H176 PolarHBondContact O-N 3.4Š|
| 177 | T | 91 | Very high | 91.1 | Very high | 83 Ų | 83 | 62.8 Ų | 62.8 | 51% | 0.509 | 32% | 0.321 | S | S | . | . | G | 310 helix | trans | -80 | -20.8 | 177.8 | 66.5 | 0 | 0 | 0 | 0 | 112.9 | H174 P175 | H174-T177 HydrophobicContact CB-CG2 4.05Å; H174-T177 WeakPolarHBondContact O-CB 3.47Å; H174-T177 PolarHBondContact O-N 3.03Å; H174-T177 PolarHBondContact O-OG1 3.29Å; P175-T177 PolarHBondContact O-N 3.3Å; P175-T177 VanDerWaalsContact O-N 3.11Å |
| 178 | L | 90.4 | Very high | 90.6 | Very high | 22 Ų | 22 | 66.5 Ų | 66.5 | 12% | 0.115 | 33% | 0.332 | C | S | . | . | S | Bend | trans | -82.7 | 159.3 | -179.2 | -64.5 | 178.8 | 0 | 0 | 0 | 111.5 | V167 L170 F171 P175 L182 Q183 M186 | V167-L178 HydrophobicContact CG2-CD2 4.46Å; L170-L178 HydrophobicContact CB-CD1 4.35Å; L170-L178 HydrophobicContact CB-CD2 4.03Å; L170-L178 HydrophobicContact CB-CG 4.27Å; L170-L178 HydrophobicContact CD1-CD2 4.13Å; F171-L178 HydrophobicContact CB-CD1 3.79Å; P175-L178 PolarHBondContact O-N 3.41Å; P175-L178 VanDerWaalsContact O-N 3.07Å; L178-L182 HydrophobicContact CD1-CD2 4.4Å; L178-L182 HydrophobicContact CD2-CD2 4.24Å; L178-Q183 HydrophobicContact CB-CG 3.85Å; L178-Q183 PolarHBondContact O-NE2 3.18Å; L178-M186 HydrophobicContact CD1-SD 4.27Å |
| 179 | Q | 87.9 | Confident | 90.3 | Very high | 47 Ų | 47 | 68.7 Ų | 68.7 | 22% | 0.22 | 34% | 0.344 | C | S | . | . | trans | -64.3 | 139.3 | 174.2 | -71.8 | -159.1 | -7.7 | 0 | 0 | 111.3 | S124 M128 S181 L182 Q183 | S124-Q179 PolarHBondContact OG-NE2 3.19Å; S124-Q179 VanDerWaalsContact OG-NE2 3.15Å; M128-Q179 HydrophobicContact SD-CG 4.23Å; M128-Q179 PolarHBondContact SD-NE2 3.39Å; Q179-S181 PolarHBondContact O-N 3.03Å; Q179-S181 VanDerWaalsContact O-N 3.1Å; Q179-L182 WeakPolarHBondContact O-CB 3.48Å; Q179-L182 PolarHBondContact O-N 2.83Å; Q179-Q183 PolarHBondContact O-N 3.32Å | ||
| 180 | P | 86.1 | Confident | 89.9 | Confident | 84 Ų | 84 | 66.2 Ų | 66.2 | 55% | 0.545 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -54.9 | -34.6 | -178.9 | -28.8 | 34.7 | 0 | 0 | 0 | 114.4 | Q183 S184 | P180-Q183 PolarHBondContact O-N 3.15Å; P180-S184 PolarHBondContact O-N 3.44Å |
| 181 | S | 83.2 | Confident | 89.5 | Confident | 41 Ų | 41 | 67.6 Ų | 67.6 | 29% | 0.287 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -67.1 | -37 | 176.5 | 51 | 0 | 0 | 0 | 0 | 112.9 | Q179 S185 | Q179-S181 PolarHBondContact O-N 3.03Å; Q179-S181 VanDerWaalsContact O-N 3.1Å; S181-S185 PolarHBondContact O-N 2.85Å; S181-S185 PolarHBondContact O-OG 2.91Å |
| 182 | L | 88.4 | Confident | 89 | Confident | 68 Ų | 68 | 69.3 Ų | 69.3 | 36% | 0.356 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -71 | -43.8 | 176.3 | 178.8 | 60.5 | 0 | 0 | 0 | 110.4 | V167 L178 Q179 S184 S185 M186 | V167-L182 HydrophobicContact CG2-CD2 3.9Å; L178-L182 HydrophobicContact CD1-CD2 4.4Å; L178-L182 HydrophobicContact CD2-CD2 4.24Å; Q179-L182 WeakPolarHBondContact O-CB 3.48Å; Q179-L182 PolarHBondContact O-N 2.83Å; L182-S184 VanDerWaalsContact C-N 3.31Å; L182-S184 PolarHBondContact O-N 3.37Å; L182-S185 PolarHBondContact O-N 3.17Å; L182-M186 HydrophobicContact CD1-CG 4Å; L182-M186 HydrophobicContact CD1-SD 3.91Å; L182-M186 HydrophobicContact CD2-SD 4.36Å; L182-M186 HydrophobicContact CG-CG 4.3Å; L182-M186 HydrophobicContact CG-SD 3.83Å; L182-M186 WeakPolarHBondContact O-CG 3.38Å; L182-M186 PolarHBondContact O-N 2.73Å |
| 183 | Q | 88.9 | Confident | 88.5 | Confident | 43 Ų | 43 | 67.8 Ų | 67.8 | 20% | 0.201 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -56.1 | -45.3 | 175 | -65.3 | 179 | 46 | 0 | 0 | 111.6 | P175 L178 Q179 P180 S185 M186 N187 | P175-Q183 WeakPolarHBondContact O-CG 3.3Å; P175-Q183 PolarHBondContact O-NE2 3.43Å; L178-Q183 HydrophobicContact CB-CG 3.85Å; L178-Q183 PolarHBondContact O-NE2 3.18Å; Q179-Q183 PolarHBondContact O-N 3.32Å; P180-Q183 PolarHBondContact O-N 3.15Å; Q183-S185 VanDerWaalsContact C-N 3.34Å; Q183-S185 PolarHBondContact O-N 3.01Å; Q183-M186 PolarHBondContact O-N 3.25Å; Q183-N187 WeakPolarHBondContact O-CB 3.48Å; Q183-N187 PolarHBondContact O-N 2.83Å; Q183-N187 PolarHBondContact O-ND2 2.88Å |
| 184 | S | 87 | Confident | 87.9 | Confident | 40 Ų | 40 | 65.5 Ų | 65.5 | 28% | 0.28 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.1 | -43.3 | 177.9 | -172.1 | 0 | 0 | 0 | 0 | 112.3 | F55 P180 L182 Y188 | F55-S184 VanDerWaalsContact CD1-OG 3.25Å; F55-S184 WeakPolarHBondContact CD1-OG 3.13Å; F55-S184 WeakPolarHBondContact CG-OG 3.43Å; P180-S184 PolarHBondContact O-N 3.44Å; L182-S184 VanDerWaalsContact C-N 3.31Å; L182-S184 PolarHBondContact O-N 3.37Å; S184-Y188 WeakPolarHBondContact O-CB 3.44Å; S184-Y188 PolarHBondContact O-N 3.48Å; S184-Y188 VanDerWaalsContact O-N 3.15Å |
| 185 | S | 87.4 | Confident | 87.1 | Confident | 34 Ų | 34 | 66.3 Ų | 66.3 | 24% | 0.238 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -67.3 | -42.6 | 177.3 | -61.4 | 0 | 0 | 0 | 0 | 111.8 | S181 L182 Q183 Y188 L189 | S181-S185 PolarHBondContact O-N 2.85Å; S181-S185 PolarHBondContact O-OG 2.91Å; L182-S185 PolarHBondContact O-N 3.17Å; Q183-S185 VanDerWaalsContact C-N 3.34Å; Q183-S185 PolarHBondContact O-N 3.01Å; S185-Y188 PolarHBondContact O-N 3.38Å; S185-L189 VanDerWaalsContact O-CG 3.24Å; S185-L189 WeakPolarHBondContact O-CG 3.4Å; S185-L189 PolarHBondContact O-N 2.94Å |
| 186 | M | 90.7 | Very high | 86.6 | Confident | 8 Ų | 8 | 71.5 Ų | 71.5 | 4% | 0.039 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -69.5 | -39.6 | -179.7 | -68.1 | -176.6 | 78.4 | 0 | 0 | 111.9 | V167 L168 F171 L178 L182 Q183 Y188 L189 Y190 | V167-M186 HydrophobicContact CG2-SD 4.25Å; L168-M186 HydrophobicContact CD2-CE 3.5Å; L168-M186 HydrophobicContact CG-CE 4.23Å; F171-M186 HydrophobicContact CB-CE 3.33Å; F171-M186 HydrophobicContact CB-SD 3.83Å; F171-M186 HydrophobicContact CD1-CB 4.33Å; F171-M186 HydrophobicContact CD1-CE 3.75Å; F171-M186 HydrophobicContact CD2-CB 3.52Å; F171-M186 HydrophobicContact CD2-CE 4.07Å; F171-M186 HydrophobicContact CD2-CG 4.32Å; F171-M186 HydrophobicContact CD2-SD 3.93Å; F171-M186 HydrophobicContact CE1-CB 4.19Å; F171-M186 HydrophobicContact CE2-CB 3.36Å; F171-M186 HydrophobicContact CG-CB 4.01Å; F171-M186 HydrophobicContact CG-CE 3.44Å; F171-M186 VanDerWaalsContact CG-CE 3.44Å; F171-M186 HydrophobicContact CG-SD 3.89Å; F171-M186 HydrophobicContact CZ-CB 3.72Å; L178-M186 HydrophobicContact CD1-SD 4.27Å; L182-M186 HydrophobicContact CD1-CG 4Å; L182-M186 HydrophobicContact CD1-SD 3.91Å; L182-M186 HydrophobicContact CD2-SD 4.36Å; L182-M186 HydrophobicContact CG-CG 4.3Å; L182-M186 HydrophobicContact CG-SD 3.83Å; L182-M186 WeakPolarHBondContact O-CG 3.38Å; L182-M186 PolarHBondContact O-N 2.73Å; Q183-M186 PolarHBondContact O-N 3.25Å; M186-Y188 VanDerWaalsContact C-N 3.33Å; M186-Y188 PolarHBondContact O-N 2.93Å; M186-L189 PolarHBondContact O-N 3.43Å; M186-Y190 HydrophobicContact CB-CD2 4.04Å; M186-Y190 HydrophobicContact CB-CE2 4.41Å; M186-Y190 HydrophobicContact CE-CD2 4.31Å; M186-Y190 HydrophobicContact CE-CE2 4.03Å; M186-Y190 HydrophobicContact CG-CD2 4.44Å; M186-Y190 HydrophobicContact CG-CE2 4.31Å; M186-Y190 WeakPolarHBondContact O-CB 3.43Å; M186-Y190 VanDerWaalsContact O-CD2 3.3Å; M186-Y190 WeakPolarHBondContact O-CD2 3.27Å; M186-Y190 PolarHBondContact O-N 3.48Å |
| 187 | N | 88.7 | Confident | 85.8 | Confident | 57 Ų | 57 | 70.8 Ų | 70.8 | 31% | 0.305 | 37% | 0.368 | S | S | . | . | I | π-helix | trans | -58.5 | -46.1 | 172.2 | -79 | -37.2 | 0 | 0 | 0 | 111.5 | F171 Q183 L189 H191 D192 | F171-N187 WeakPolarHBondContact CE2-OD1 3.44Å; Q183-N187 WeakPolarHBondContact O-CB 3.48Å; Q183-N187 PolarHBondContact O-N 2.83Å; Q183-N187 PolarHBondContact O-ND2 2.88Å; N187-L189 VanDerWaalsContact C-N 3.3Å; N187-L189 PolarHBondContact O-N 3.35Å; N187-H191 PolarHBondContact O-N 3Å; N187-H191 PolarHBondContact OD1-ND1 3.04Å; N187-D192 PolarHBondContact O-N 2.96Å |
| 188 | Y | 85.7 | Confident | 85 | Confident | 106 Ų | 106 | 70.6 Ų | 70.6 | 42% | 0.416 | 36% | 0.363 | S | S | . | . | I | π-helix | trans | -59.5 | -40.7 | 176.5 | -179.8 | -86.7 | 0 | 0 | 0 | 112.2 | F55 S184 S185 M186 N206 | F55-Y188 HydrophobicContact CE1-CD2 4.21Å; F55-Y188 HydrophobicContact CE1-CG 4.07Å; S184-Y188 WeakPolarHBondContact O-CB 3.44Å; S184-Y188 PolarHBondContact O-N 3.48Å; S184-Y188 VanDerWaalsContact O-N 3.15Å; S185-Y188 PolarHBondContact O-N 3.38Å; M186-Y188 VanDerWaalsContact C-N 3.33Å; M186-Y188 PolarHBondContact O-N 2.93Å; Y188-N206 HydrophobicContact CD2-CB 4.34Å; Y188-N206 WeakPolarHBondContact CD2-ND2 3.44Å; Y188-N206 HydrophobicContact CE2-CB 3.57Å; Y188-N206 VanDerWaalsContact CE2-CG 3.45Å; Y188-N206 VanDerWaalsContact CE2-ND2 3.3Å; Y188-N206 WeakPolarHBondContact CE2-ND2 3.39Å |
| 189 | L | 88.5 | Confident | 84.4 | Confident | 101 Ų | 101 | 76 Ų | 76 | 53% | 0.529 | 39% | 0.391 | S | S | . | . | I | π-helix | trans | -79.1 | -39.5 | -176.4 | -69.4 | 171.2 | 0 | 0 | 0 | 113.8 | S185 M186 N187 S193 | S185-L189 VanDerWaalsContact O-CG 3.24Å; S185-L189 WeakPolarHBondContact O-CG 3.4Å; S185-L189 PolarHBondContact O-N 2.94Å; M186-L189 PolarHBondContact O-N 3.43Å; N187-L189 VanDerWaalsContact C-N 3.3Å; N187-L189 PolarHBondContact O-N 3.35Å; L189-S193 WeakPolarHBondContact O-CB 3.38Å; L189-S193 PolarHBondContact O-OG 3.06Å |
| 190 | Y | 89.3 | Confident | 83.6 | Confident | 83 Ų | 83 | 76.5 Ų | 76.5 | 33% | 0.325 | 40% | 0.4 | S | S | . | . | I | π-helix | trans | -113.6 | -34.8 | -165.8 | -61.6 | -68.2 | 0 | 0 | 0 | 114.4 | L168 F171 M186 S193 N194 | L168-Y190 HydrophobicContact CD2-CD2 4.17Å; L168-Y190 HydrophobicContact CD2-CE1 4.3Å; L168-Y190 HydrophobicContact CD2-CE2 3.73Å; F171-Y190 HydrophobicContact CE1-CD2 4.27Å; M186-Y190 HydrophobicContact CB-CD2 4.04Å; M186-Y190 HydrophobicContact CB-CE2 4.41Å; M186-Y190 HydrophobicContact CE-CD2 4.31Å; M186-Y190 HydrophobicContact CE-CE2 4.03Å; M186-Y190 HydrophobicContact CG-CD2 4.44Å; M186-Y190 HydrophobicContact CG-CE2 4.31Å; M186-Y190 WeakPolarHBondContact O-CB 3.43Å; M186-Y190 VanDerWaalsContact O-CD2 3.3Å; M186-Y190 WeakPolarHBondContact O-CD2 3.27Å; M186-Y190 PolarHBondContact O-N 3.48Å; Y190-S193 WeakPolarHBondContact CA-OG 3.5Å; Y190-S193 PolarHBondContact O-OG 3.28Å; Y190-N194 PolarHBondContact O-ND2 2.86Å |
| 191 | H | 87.4 | Confident | 83 | Confident | 73 Ų | 73 | 73.2 Ų | 73.2 | 34% | 0.338 | 38% | 0.377 | S | S | . | . | I | π-helix | trans | -94.1 | -48 | -178.9 | -71.6 | 162.7 | 0 | 0 | 0 | 111.9 | F171 E172 N187 S193 N194 | F171-H191 AromaticContact CE1-CE1 3.65Å; F171-H191 AromaticContact CE1-NE2 3.67Å; F171-H191 AromaticContact CZ-CE1 3.38Å; F171-H191 WeakPolarHBondContact CZ-CE1 3.48Å; F171-H191 AromaticContact CZ-ND1 3.51Å; F171-H191 AromaticContact CZ-NE2 3.85Å; E172-H191 IonicContact OE2-NE2 3.24Å; N187-H191 PolarHBondContact O-N 3Å; N187-H191 PolarHBondContact OD1-ND1 3.04Å; H191-S193 PolarHBondContact O-N 2.99Å; H191-N194 WeakPolarHBondContact O-CB 3.38Å; H191-N194 PolarHBondContact O-N 3.12Å; H191-N194 VanDerWaalsContact O-N 3.12Å |
| 192 | D | 83.5 | Confident | 82.5 | Confident | 38 Ų | 38 | 77.7 Ų | 77.7 | 20% | 0.203 | 39% | 0.392 | C | S | . | . | G | 310 helix | trans | -65.5 | -26.2 | 179.5 | -71.6 | -17.4 | 0 | 0 | 0 | 111 | N187 N194 V195 N206 K207 | N187-D192 PolarHBondContact O-N 2.96Å; D192-N194 PolarHBondContact O-N 3.04Å; D192-V195 PolarHBondContact O-N 3.39Å; D192-N206 VanDerWaalsContact CB-ND2 3.27Å; D192-N206 WeakPolarHBondContact CB-ND2 3.21Å; D192-N206 PolarHBondContact OD2-ND2 2.88Å; D192-K207 VanDerWaalsContact OD1-CE 3.25Å; D192-K207 WeakPolarHBondContact OD1-CE 3.35Å; D192-K207 IonicContact OD1-NZ 3.51Å; D192-K207 PolarHBondContact OD1-NZ 2.96Å; D192-K207 WeakPolarHBondContact OD2-CE 3.34Å; D192-K207 IonicContact OD2-NZ 2.94Å; D192-K207 PolarHBondContact OD2-NZ 3.45Å |
| 193 | S | 83.6 | Confident | 81.9 | Confident | 65 Ų | 65 | 80.5 Ų | 80.5 | 46% | 0.455 | 41% | 0.407 | S | S | . | . | G | 310 helix | trans | -71 | -10.9 | 175.2 | 55.5 | 0 | 0 | 0 | 0 | 114.8 | L189 Y190 H191 | L189-S193 WeakPolarHBondContact O-CB 3.38Å; L189-S193 PolarHBondContact O-OG 3.06Å; Y190-S193 WeakPolarHBondContact CA-OG 3.5Å; Y190-S193 PolarHBondContact O-OG 3.28Å; H191-S193 PolarHBondContact O-N 2.99Å |
| 194 | N | 83 | Confident | 81.1 | Confident | 112 Ų | 112 | 83.2 Ų | 83.2 | 60% | 0.599 | 43% | 0.426 | S | S | * | . | G | 310 helix | trans | -87.8 | -1.4 | 177.3 | -66.2 | -36.9 | 0 | 0 | 0 | 113.6 | Y190 H191 D192 | Y190-N194 PolarHBondContact O-ND2 2.86Å; H191-N194 WeakPolarHBondContact O-CB 3.38Å; H191-N194 PolarHBondContact O-N 3.12Å; H191-N194 VanDerWaalsContact O-N 3.12Å; D192-N194 PolarHBondContact O-N 3.04Å |
| 195 | V | 77.7 | Confident | 80.2 | Confident | 91 Ų | 91 | 86.5 Ų | 86.5 | 55% | 0.552 | 43% | 0.433 | S | S | * | . | trans | -130.2 | 123.8 | -174.1 | -174.2 | 0 | 0 | 0 | 0 | 110 | D192 | D192-V195 PolarHBondContact O-N 3.39Š| ||
| 196 | W | 78.6 | Confident | 79.2 | Confident | 160 Ų | 160 | 87.5 Ų | 87.5 | 61% | 0.606 | 44% | 0.436 | S | S | * | . | trans | -145 | 149.4 | 173.5 | 61.3 | 89.3 | 0 | 0 | 0 | 110.4 | F202 | W196-F202 HydrophobicContact CB-CD2 4.11Å; W196-F202 HydrophobicContact CD2-CD2 4.5Å; W196-F202 HydrophobicContact CG-CD2 4.1Å | ||
| 197 | H | 73.8 | Confident | 77.8 | Confident | 131 Ų | 131 | 93.1 Ų | 93.1 | 61% | 0.606 | 46% | 0.46 | S | S | * | . | trans | -127 | -29 | -177.9 | -49.7 | 82.6 | 0 | 0 | 0 | 112.2 | D201 | H197-D201 WeakPolarHBondContact CA-OD2 3.46Å; H197-D201 VanDerWaalsContact CB-OD2 3.3Å; H197-D201 WeakPolarHBondContact CB-OD2 3.46Å; H197-D201 IonicContact CG-OD2 3.68Å; H197-D201 PolarHBondContact N-OD1 3.11Å; H197-D201 PolarHBondContact N-OD2 3.08Å; H197-D201 IonicContact ND1-OD2 2.94Å; H197-D201 PolarHBondContact ND1-OD2 3.36Å | ||
| 198 | D | 75.9 | Confident | 76.4 | Confident | 78 Ų | 78 | 93.8 Ų | 93.8 | 42% | 0.417 | 47% | 0.468 | S | S | . | . | S | Bend | trans | -152 | 173.7 | -179.5 | 65.3 | 42.2 | 0 | 0 | 0 | 113.5 | S200 D201 F202 | D198-S200 PolarHBondContact O-N 3Å; D198-S200 VanDerWaalsContact OD1-CA 3.27Å; D198-S200 WeakPolarHBondContact OD1-CA 3.46Å; D198-S200 VanDerWaalsContact OD1-CB 3.25Å; D198-S200 WeakPolarHBondContact OD1-CB 3.36Å; D198-S200 PolarHBondContact OD1-N 2.76Å; D198-S200 PolarHBondContact OD1-OG 3Å; D198-S200 PolarHBondContact OD2-OG 2.92Å; D198-D201 PolarHBondContact N-OD1 3.49Å; D198-D201 PolarHBondContact O-N 2.94Å; D198-D201 PolarHBondContact OD1-N 3.44Å; D198-F202 VanDerWaalsContact O-CB 3.26Å; D198-F202 WeakPolarHBondContact O-CB 3.36Å; D198-F202 PolarHBondContact O-N 3.4Å |
| 199 | I | 76.6 | Confident | 74.9 | Confident | 136 Ų | 136 | 97.7 Ų | 97.7 | 70% | 0.697 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -65.1 | -26.8 | -179.7 | -62.4 | 172.8 | 0 | 0 | 0 | 111.3 | L203 | I199-L203 HydrophobicContact CG2-CD1 3.95Å; I199-L203 HydrophobicContact CG2-CG 4.47Å; I199-L203 WeakPolarHBondContact O-CB 3.33Å; I199-L203 PolarHBondContact O-N 3.18Å |
| 200 | S | 71.1 | Confident | 73.2 | Confident | 57 Ų | 57 | 99.4 Ų | 99.4 | 40% | 0.399 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -73.5 | -37.7 | -179.8 | 85.2 | 0 | 0 | 0 | 0 | 111.4 | D198 V204 Y205 | D198-S200 PolarHBondContact O-N 3Å; D198-S200 VanDerWaalsContact OD1-CA 3.27Å; D198-S200 WeakPolarHBondContact OD1-CA 3.46Å; D198-S200 VanDerWaalsContact OD1-CB 3.25Å; D198-S200 WeakPolarHBondContact OD1-CB 3.36Å; D198-S200 PolarHBondContact OD1-N 2.76Å; D198-S200 PolarHBondContact OD1-OG 3Å; D198-S200 PolarHBondContact OD2-OG 2.92Å; S200-V204 CarbonylContact O-C 3.6Å; S200-V204 VanDerWaalsContact O-CA 3.31Å; S200-V204 WeakPolarHBondContact O-CA 3.45Å; S200-V204 VanDerWaalsContact O-CB 3.29Å; S200-V204 WeakPolarHBondContact O-CB 3.35Å; S200-V204 PolarHBondContact O-N 3.07Å; S200-Y205 PolarHBondContact O-N 3.11Å |
| 201 | D | 73.5 | Confident | 71.2 | Confident | 15 Ų | 15 | 102 Ų | 102 | 8% | 0.08 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -80 | -30 | 175.8 | 78.9 | 0.4 | 0 | 0 | 0 | 113 | H197 D198 Y205 | H197-D201 WeakPolarHBondContact CA-OD2 3.46Å; H197-D201 VanDerWaalsContact CB-OD2 3.3Å; H197-D201 WeakPolarHBondContact CB-OD2 3.46Å; H197-D201 IonicContact CG-OD2 3.68Å; H197-D201 PolarHBondContact N-OD1 3.11Å; H197-D201 PolarHBondContact N-OD2 3.08Å; H197-D201 IonicContact ND1-OD2 2.94Å; H197-D201 PolarHBondContact ND1-OD2 3.36Å; D198-D201 PolarHBondContact N-OD1 3.49Å; D198-D201 PolarHBondContact O-N 2.94Å; D198-D201 PolarHBondContact OD1-N 3.44Å; D201-Y205 CarbonylContact C-O 3.48Å; D201-Y205 WeakPolarHBondContact CA-O 3.41Å; D201-Y205 WeakPolarHBondContact CB-O 3.18Å; D201-Y205 CarbonylContact O-C 3.57Å |
| 202 | F | 73.6 | Confident | 68.7 | Low | 135 Ų | 135 | 102.2 Ų | 102.2 | 59% | 0.592 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -69.4 | -37.8 | 174.9 | -171.3 | -105.6 | 0 | 0 | 0 | 113.6 | W196 D198 | W196-F202 HydrophobicContact CB-CD2 4.11Å; W196-F202 HydrophobicContact CD2-CD2 4.5Å; W196-F202 HydrophobicContact CG-CD2 4.1Å; D198-F202 VanDerWaalsContact O-CB 3.26Å; D198-F202 WeakPolarHBondContact O-CB 3.36Å; D198-F202 PolarHBondContact O-N 3.4Å |
| 203 | L | 76.4 | Confident | 66.8 | Low | 127 Ų | 127 | 106.5 Ų | 106.5 | 67% | 0.665 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -114.3 | -27.2 | -174.3 | -62.7 | 179.9 | 0 | 0 | 0 | 115.5 | I199 | I199-L203 HydrophobicContact CG2-CD1 3.95Å; I199-L203 HydrophobicContact CG2-CG 4.47Å; I199-L203 WeakPolarHBondContact O-CB 3.33Å; I199-L203 PolarHBondContact O-N 3.18Å |
| 204 | V | 70.5 | Confident | 64.4 | Low | 101 Ų | 101 | 116.7 Ų | 116.7 | 61% | 0.612 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.5 | -38.1 | -167 | -171 | 0 | 0 | 0 | 0 | 112.7 | S200 | S200-V204 CarbonylContact O-C 3.6Å; S200-V204 VanDerWaalsContact O-CA 3.31Å; S200-V204 WeakPolarHBondContact O-CA 3.45Å; S200-V204 VanDerWaalsContact O-CB 3.29Å; S200-V204 WeakPolarHBondContact O-CB 3.35Å; S200-V204 PolarHBondContact O-N 3.07Å |
| 205 | Y | 68.8 | Low | 63.5 | Low | 109 Ų | 109 | 117 Ų | 117 | 43% | 0.427 | 60% | 0.601 | S | S | . | * | trans | -135.3 | 117.2 | -174.4 | -66.1 | -68 | 0 | 0 | 0 | 112.8 | S200 D201 K207 R209 | S200-Y205 PolarHBondContact O-N 3.11Å; D201-Y205 CarbonylContact C-O 3.48Å; D201-Y205 WeakPolarHBondContact CA-O 3.41Å; D201-Y205 WeakPolarHBondContact CB-O 3.18Å; D201-Y205 CarbonylContact O-C 3.57Å; Y205-K207 PolarHBondContact O-N 3.47Å; Y205-R209 PolarHBondContact OH-NH2 3.03Å | ||
| 206 | N | 65.7 | Low | 62.7 | Low | 55 Ų | 55 | 118.3 Ų | 118.3 | 29% | 0.294 | 60% | 0.604 | S | S | . | * | S | Bend | trans | -60.9 | -14.6 | -179 | -166.8 | 59.7 | 0 | 0 | 0 | 115.9 | Y188 D192 | Y188-N206 HydrophobicContact CD2-CB 4.34Å; Y188-N206 WeakPolarHBondContact CD2-ND2 3.44Å; Y188-N206 HydrophobicContact CE2-CB 3.57Å; Y188-N206 VanDerWaalsContact CE2-CG 3.45Å; Y188-N206 VanDerWaalsContact CE2-ND2 3.3Å; Y188-N206 WeakPolarHBondContact CE2-ND2 3.39Å; D192-N206 VanDerWaalsContact CB-ND2 3.27Å; D192-N206 WeakPolarHBondContact CB-ND2 3.21Å; D192-N206 PolarHBondContact OD2-ND2 2.88Å |
| 207 | K | 62.5 | Low | 61.8 | Low | 125 Ų | 125 | 116 Ų | 116 | 54% | 0.543 | 60% | 0.604 | S | S | . | * | S | Bend | trans | -138.7 | 143.4 | 173.2 | -64.6 | -169.3 | -179.8 | -167.8 | 0 | 109.9 | D192 Y205 R209 | D192-K207 VanDerWaalsContact OD1-CE 3.25Å; D192-K207 WeakPolarHBondContact OD1-CE 3.35Å; D192-K207 IonicContact OD1-NZ 3.51Å; D192-K207 PolarHBondContact OD1-NZ 2.96Å; D192-K207 WeakPolarHBondContact OD2-CE 3.34Å; D192-K207 IonicContact OD2-NZ 2.94Å; D192-K207 PolarHBondContact OD2-NZ 3.45Å; Y205-K207 PolarHBondContact O-N 3.47Å; K207-R209 PolarHBondContact O-N 3.07Å |
| 208 | P | 58 | Low | 61.1 | Low | 72 Ų | 72 | 115.1 Ų | 115.1 | 47% | 0.468 | 60% | 0.604 | S | S | . | * | trans | -56.3 | 137.6 | 172.6 | 20.7 | -29.7 | 0 | 0 | 0 | 109.2 | T210 | P208-T210 PolarHBondContact O-N 2.96Š| ||
| 209 | R | 54.9 | Low | 60.2 | Low | 188 Ų | 188 | 117.4 Ų | 117.4 | 71% | 0.709 | 62% | 0.615 | S | S | * | * | trans | -59.6 | 109.3 | 171.3 | -77 | -177.2 | -178.3 | 177.9 | 2.3 | 106.7 | Y205 K207 V211 | Y205-R209 PolarHBondContact OH-NH2 3.03Å; K207-R209 PolarHBondContact O-N 3.07Å; R209-V211 PolarHBondContact O-N 2.73Å | ||
| 210 | T | 53.5 | Low | 59.1 | Low | 136 Ų | 136 | 116.2 Ų | 116.2 | 83% | 0.834 | 61% | 0.61 | S | S | * | * | trans | -55.8 | 109.2 | 169.9 | 34 | 0 | 0 | 0 | 0 | 107.6 | P208 A212 | P208-T210 PolarHBondContact O-N 2.96Å; T210-A212 PolarHBondContact O-N 3.44Å; T210-A212 VanDerWaalsContact O-N 3.11Å | ||
| 211 | V | 46.4 | Very low | 58.3 | Low | 139 Ų | 139 | 120.4 Ų | 120.4 | 84% | 0.842 | 63% | 0.625 | S | S | * | * | trans | -61.1 | 115.9 | 166.5 | -173.6 | 0 | 0 | 0 | 0 | 104.8 | R209 | R209-V211 PolarHBondContact O-N 2.73Š| ||
| 212 | A | 35.4 | Very low | 57.1 | Low | 77 Ų | 77 | 128.5 Ų | 128.5 | 64% | 0.636 | 67% | 0.667 | S | S | * | * | trans | -52.2 | 134.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 108.8 | T210 K214 | T210-A212 PolarHBondContact O-N 3.44Å; T210-A212 VanDerWaalsContact O-N 3.11Å; A212-K214 PolarHBondContact O-N 2.88Å | ||
| 213 | P | 42.6 | Very low | 55.7 | Low | 128 Ų | 128 | 128 Ų | 128 | 83% | 0.831 | 67% | 0.673 | S | S | * | * | trans | -60.1 | 131.3 | 171.9 | 25.1 | -29.5 | 0 | 0 | 0 | 107.9 | ||||
| 214 | K | 34 | Very low | 53.8 | Low | 279 Ų | 279 | 128.1 Ų | 128.1 | 100% | 1.213 | 67% | 0.674 | S | S | * | * | trans | -62.5 | 0 | 172.1 | -78.6 | -176.2 | 176.2 | 179.3 | 0 | 111 | A212 | A212-K214 PolarHBondContact O-N 2.88Š|
Retrieved 214 of 214 residues in 156.9 ms
(Link to these results)