| 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 | 38.6 | Very low | 48.9 | Very low | 226 Ų | 226 | 147.4 Ų | 147.4 | 100% | 1.113 | 83% | 0.834 | S | S | * | * | 0 | 148 | 0 | -70.9 | 133 | 71.1 | 0 | 0 | 108.4 | |||||
| 2 | I | 49 | Very low | 49.9 | Very low | 172 Ų | 172 | 155.8 Ų | 155.8 | 88% | 0.882 | 84% | 0.843 | S | S | * | * | trans | 49.1 | 122.5 | 159.6 | -52.3 | 155.2 | 0 | 0 | 0 | 116.6 | ||||
| 3 | G | 47.7 | Very low | 50 | Low | 59 Ų | 59 | 151.9 Ų | 151.9 | 61% | 0.608 | 82% | 0.818 | S | S | * | * | cis | 151.1 | 132.4 | 1.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 4 | F | 49.5 | Very low | 51.3 | Low | 225 Ų | 225 | 146.1 Ų | 146.1 | 99% | 0.987 | 79% | 0.792 | S | S | * | * | trans | 56.1 | 92.5 | 172.6 | -66.5 | -84.8 | 0 | 0 | 0 | 118.4 | ||||
| 5 | G | 47.3 | Very low | 52.8 | Low | 78 Ų | 78 | 141.5 Ų | 141.5 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | trans | -130.3 | 118.3 | 152.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 6 | A | 47.7 | Very low | 54.5 | Low | 105 Ų | 105 | 142.9 Ų | 142.9 | 87% | 0.868 | 77% | 0.772 | S | S | * | * | trans | -76.1 | 137.4 | -162 | 0 | 0 | 0 | 0 | 0 | 114.4 | R8 | A6-R8 PolarHBondContact O-N 2.71Š| ||
| 7 | N | 46.7 | Very low | 56.3 | Low | 142 Ų | 142 | 139.2 Ų | 139.2 | 76% | 0.759 | 75% | 0.75 | S | S | * | * | trans | -64.6 | 123.7 | 170.8 | -102.2 | -37 | 0 | 0 | 0 | 111.6 | R9 | N7-R9 PolarHBondContact O-N 3.04Å; N7-R9 VanDerWaalsContact O-N 3.16Å | ||
| 8 | R | 52.3 | Low | 57.8 | Low | 229 Ų | 229 | 137 Ų | 137 | 86% | 0.864 | 74% | 0.738 | S | S | * | * | trans | 46.9 | 53.7 | 140 | -55.3 | -179.9 | -175.3 | -106.2 | 0.3 | 117.5 | A6 G10 | A6-R8 PolarHBondContact O-N 2.71Å; R8-G10 PolarHBondContact O-N 2.83Å; R8-G10 VanDerWaalsContact O-N 3.15Å | ||
| 9 | R | 52.3 | Low | 59.4 | Low | 257 Ų | 257 | 134.6 Ų | 134.6 | 97% | 0.97 | 73% | 0.728 | S | S | * | * | trans | -81.4 | 67.2 | 145.1 | -89.3 | -170.9 | 171.3 | 179.4 | -1.5 | 109.7 | N7 G11 | N7-R9 PolarHBondContact O-N 3.04Å; N7-R9 VanDerWaalsContact O-N 3.16Å; R9-G11 PolarHBondContact O-N 3.17Å | ||
| 10 | G | 53.3 | Low | 60.8 | Low | 72 Ų | 72 | 134.8 Ų | 134.8 | 74% | 0.742 | 72% | 0.722 | S | S | * | * | trans | -68 | 83.8 | 166.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | R8 R12 | R8-G10 PolarHBondContact O-N 2.83Å; R8-G10 VanDerWaalsContact O-N 3.15Å; G10-R12 PolarHBondContact O-N 2.69Å | ||
| 11 | G | 53.6 | Low | 62.2 | Low | 56 Ų | 56 | 132.4 Ų | 132.4 | 58% | 0.577 | 71% | 0.709 | S | S | * | * | trans | -55.5 | 125 | 179.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | R9 M13 | R9-G11 PolarHBondContact O-N 3.17Å; G11-M13 PolarHBondContact O-N 3.5Å | ||
| 12 | R | 60.6 | Low | 64.6 | Low | 249 Ų | 249 | 127.7 Ų | 127.7 | 94% | 0.94 | 69% | 0.686 | S | S | * | * | trans | -71.7 | 72.5 | 172.2 | 179.5 | 171.6 | 154.3 | 172.6 | -7.8 | 108.3 | G10 | G10-R12 PolarHBondContact O-N 2.69Š| ||
| 13 | M | 51.5 | Low | 66.6 | Low | 105 Ų | 105 | 123.6 Ų | 123.6 | 52% | 0.517 | 67% | 0.668 | S | S | . | * | trans | -49.1 | 128.6 | 172.3 | -62.9 | -65.3 | -93.1 | 0 | 0 | 107.2 | G11 S15 I17 L18 | G11-M13 PolarHBondContact O-N 3.5Å; M13-S15 PolarHBondContact O-N 2.92Å; M13-I17 HydrophobicContact CE-CG2 4.05Å; M13-L18 HydrophobicContact CB-CG 4.33Å | ||
| 14 | P | 68.1 | Low | 68.7 | Low | 71 Ų | 71 | 124.4 Ų | 124.4 | 46% | 0.461 | 66% | 0.658 | S | S | . | * | trans | -49.7 | 132.9 | 172.6 | -26 | 33 | 0 | 0 | 0 | 109 | F16 I17 | P14-F16 PolarHBondContact O-N 2.85Å; P14-I17 HydrophobicContact CB-CG1 4.28Å; P14-I17 HydrophobicContact CG-CD1 4.17Å; P14-I17 HydrophobicContact CG-CG1 4.42Å; P14-I17 PolarHBondContact O-N 3.4Å | ||
| 15 | S | 74.3 | Confident | 70.7 | Confident | 77 Ų | 77 | 117.7 Ų | 117.7 | 54% | 0.538 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -51.7 | -35.2 | -175.6 | 42.2 | 0 | 0 | 0 | 0 | 112 | M13 I17 L18 V19 | M13-S15 PolarHBondContact O-N 2.92Å; S15-I17 VanDerWaalsContact C-N 3.31Å; S15-I17 PolarHBondContact O-N 3.39Å; S15-L18 PolarHBondContact O-N 3.18Å; S15-L18 VanDerWaalsContact O-N 3.16Å; S15-V19 WeakPolarHBondContact O-CG2 3.33Å; S15-V19 PolarHBondContact O-N 2.8Å |
| 16 | F | 78.9 | Confident | 72.8 | Confident | 164 Ų | 164 | 116 Ų | 116 | 72% | 0.719 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -56.3 | -34.6 | 173.4 | -51.2 | -68.5 | 0 | 0 | 0 | 114.6 | P14 V19 F20 | P14-F16 PolarHBondContact O-N 2.85Å; F16-V19 PolarHBondContact O-N 3.23Å; F16-F20 VanDerWaalsContact O-CB 3.26Å; F16-F20 WeakPolarHBondContact O-CB 3.45Å; F16-F20 PolarHBondContact O-N 2.83Å |
| 17 | I | 85.3 | Confident | 75 | Confident | 79 Ų | 79 | 115.4 Ų | 115.4 | 41% | 0.405 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -70.7 | -39.5 | 176.6 | -57.7 | -172.4 | 0 | 0 | 0 | 110.6 | M13 P14 S15 F20 L21 | M13-I17 HydrophobicContact CE-CG2 4.05Å; P14-I17 HydrophobicContact CB-CG1 4.28Å; P14-I17 HydrophobicContact CG-CD1 4.17Å; P14-I17 HydrophobicContact CG-CG1 4.42Å; P14-I17 PolarHBondContact O-N 3.4Å; S15-I17 VanDerWaalsContact C-N 3.31Å; S15-I17 PolarHBondContact O-N 3.39Å; I17-F20 PolarHBondContact O-N 2.83Å; I17-L21 WeakPolarHBondContact O-CB 3.39Å; I17-L21 PolarHBondContact O-N 3.17Å |
| 18 | L | 83.9 | Confident | 77.2 | Confident | 100 Ų | 100 | 114 Ų | 114 | 52% | 0.524 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.1 | -39 | 175.4 | -64.2 | 175.2 | 0 | 0 | 0 | 111.4 | M13 S15 M22 | M13-L18 HydrophobicContact CB-CG 4.33Å; S15-L18 PolarHBondContact O-N 3.18Å; S15-L18 VanDerWaalsContact O-N 3.16Å; L18-M22 WeakPolarHBondContact O-CB 3.45Å; L18-M22 WeakPolarHBondContact O-CG 3.25Å; L18-M22 PolarHBondContact O-N 3.29Å |
| 19 | V | 87.3 | Confident | 79.2 | Confident | 92 Ų | 92 | 105.7 Ų | 105.7 | 56% | 0.558 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63.6 | -47.4 | 173.2 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | S15 F16 L21 M22 V23 | S15-V19 WeakPolarHBondContact O-CG2 3.33Å; S15-V19 PolarHBondContact O-N 2.8Å; F16-V19 PolarHBondContact O-N 3.23Å; V19-L21 PolarHBondContact O-N 2.94Å; V19-M22 PolarHBondContact O-N 3.24Å; V19-V23 WeakPolarHBondContact O-CG2 3.38Å; V19-V23 PolarHBondContact O-N 3.38Å |
| 20 | F | 88.4 | Confident | 81.2 | Confident | 137 Ų | 137 | 100.3 Ų | 100.3 | 60% | 0.601 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.2 | -40.4 | 178.4 | -175.6 | -113.1 | 0 | 0 | 0 | 112.4 | F16 I17 V23 I24 | F16-F20 VanDerWaalsContact O-CB 3.26Å; F16-F20 WeakPolarHBondContact O-CB 3.45Å; F16-F20 PolarHBondContact O-N 2.83Å; I17-F20 PolarHBondContact O-N 2.83Å; F20-V23 PolarHBondContact O-N 3.29Å; F20-I24 HydrophobicContact CD1-CD1 3.82Å; F20-I24 HydrophobicContact CE1-CD1 3.48Å; F20-I24 VanDerWaalsContact CE1-CD1 3.48Å; F20-I24 HydrophobicContact CE1-CG1 4.46Å; F20-I24 HydrophobicContact CZ-CD1 3.91Å; F20-I24 WeakPolarHBondContact O-CG1 3.38Å; F20-I24 PolarHBondContact O-N 3.49Å |
| 21 | L | 89.6 | Confident | 83.1 | Confident | 86 Ų | 86 | 101.3 Ų | 101.3 | 45% | 0.45 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -65.1 | -37.5 | 174.3 | -178.8 | 138.9 | 0 | 0 | 0 | 112 | I17 V19 I24 I25 | I17-L21 WeakPolarHBondContact O-CB 3.39Å; I17-L21 PolarHBondContact O-N 3.17Å; V19-L21 PolarHBondContact O-N 2.94Å; L21-I24 PolarHBondContact O-N 3.06Å; L21-I25 HydrophobicContact CD2-CD1 3.6Å; L21-I25 HydrophobicContact CG-CD1 4.31Å; L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.36Å; L21-I25 PolarHBondContact O-N 3.41Å |
| 22 | M | 88.4 | Confident | 85 | Confident | 127 Ų | 127 | 106.6 Ų | 106.6 | 63% | 0.626 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -66.4 | -37.1 | 171.8 | -76.4 | -68.1 | 175.9 | 0 | 0 | 112.8 | L18 V19 I25 G26 | L18-M22 WeakPolarHBondContact O-CB 3.45Å; L18-M22 WeakPolarHBondContact O-CG 3.25Å; L18-M22 PolarHBondContact O-N 3.29Å; V19-M22 PolarHBondContact O-N 3.24Å; M22-I25 PolarHBondContact O-N 2.82Å; M22-G26 PolarHBondContact O-N 3.41Å |
| 23 | V | 91.6 | Very high | 86.6 | Confident | 85 Ų | 85 | 103.3 Ų | 103.3 | 52% | 0.515 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64 | -43.7 | 172.7 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | V19 F20 G26 V27 | V19-V23 WeakPolarHBondContact O-CG2 3.38Å; V19-V23 PolarHBondContact O-N 3.38Å; F20-V23 PolarHBondContact O-N 3.29Å; V23-G26 PolarHBondContact O-N 2.86Å; V23-V27 WeakPolarHBondContact O-CG2 3.34Å; V23-V27 PolarHBondContact O-N 3.34Å |
| 24 | I | 92.3 | Very high | 88.4 | Confident | 76 Ų | 76 | 100.7 Ų | 100.7 | 39% | 0.39 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.6 | -45.8 | 174.5 | -71.8 | 168.3 | 0 | 0 | 0 | 111 | F20 L21 G26 V27 L28 | F20-I24 HydrophobicContact CD1-CD1 3.82Å; F20-I24 HydrophobicContact CE1-CD1 3.48Å; F20-I24 VanDerWaalsContact CE1-CD1 3.48Å; F20-I24 HydrophobicContact CE1-CG1 4.46Å; F20-I24 HydrophobicContact CZ-CD1 3.91Å; F20-I24 WeakPolarHBondContact O-CG1 3.38Å; F20-I24 PolarHBondContact O-N 3.49Å; L21-I24 PolarHBondContact O-N 3.06Å; I24-G26 VanDerWaalsContact C-N 3.32Å; I24-G26 PolarHBondContact O-N 3.04Å; I24-V27 PolarHBondContact O-N 2.86Å; I24-L28 HydrophobicContact CG2-CD1 3.77Å; I24-L28 HydrophobicContact CG2-CG 4.27Å; I24-L28 WeakPolarHBondContact O-CB 3.49Å; I24-L28 WeakPolarHBondContact O-CG 3.48Å; I24-L28 PolarHBondContact O-N 2.88Å |
| 25 | I | 90.8 | Very high | 89.6 | Confident | 85 Ų | 85 | 101.2 Ų | 101.2 | 44% | 0.436 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.9 | -41.4 | 176.1 | -70.9 | 168 | 0 | 0 | 0 | 110.8 | L21 M22 L28 A29 | L21-I25 HydrophobicContact CD2-CD1 3.6Å; L21-I25 HydrophobicContact CG-CD1 4.31Å; L21-I25 VanDerWaalsContact O-CG1 3.31Å; L21-I25 WeakPolarHBondContact O-CG1 3.36Å; L21-I25 PolarHBondContact O-N 3.41Å; M22-I25 PolarHBondContact O-N 2.82Å; I25-L28 PolarHBondContact O-N 3.2Å; I25-A29 WeakPolarHBondContact O-CB 3.38Å; I25-A29 PolarHBondContact O-N 2.88Å |
| 26 | G | 93.1 | Very high | 90.4 | Very high | 42 Ų | 42 | 100.1 Ų | 100.1 | 43% | 0.433 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | M22 V23 I24 F30 | M22-G26 PolarHBondContact O-N 3.41Å; V23-G26 PolarHBondContact O-N 2.86Å; I24-G26 VanDerWaalsContact C-N 3.32Å; I24-G26 PolarHBondContact O-N 3.04Å; G26-F30 VanDerWaalsContact O-CB 3.32Å; G26-F30 WeakPolarHBondContact O-CB 3.45Å; G26-F30 PolarHBondContact O-N 3.47Å |
| 27 | V | 93.4 | Very high | 90.9 | Very high | 92 Ų | 92 | 97.7 Ų | 97.7 | 56% | 0.558 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -67.3 | -41.4 | 176.6 | 172.2 | 0 | 0 | 0 | 0 | 111.6 | V23 I24 F30 N31 | V23-V27 WeakPolarHBondContact O-CG2 3.34Å; V23-V27 PolarHBondContact O-N 3.34Å; I24-V27 PolarHBondContact O-N 2.86Å; V27-F30 PolarHBondContact O-N 3.12Å; V27-N31 VanDerWaalsContact O-CB 3.32Å; V27-N31 WeakPolarHBondContact O-CB 3.21Å; V27-N31 PolarHBondContact O-N 3.38Å |
| 28 | L | 93.2 | Very high | 91.2 | Very high | 112 Ų | 112 | 100.7 Ų | 100.7 | 59% | 0.586 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -67 | -41.4 | 176.1 | -71.9 | 173.6 | 0 | 0 | 0 | 111.9 | I24 I25 N31 Y32 | I24-L28 HydrophobicContact CG2-CD1 3.77Å; I24-L28 HydrophobicContact CG2-CG 4.27Å; I24-L28 WeakPolarHBondContact O-CB 3.49Å; I24-L28 WeakPolarHBondContact O-CG 3.48Å; I24-L28 PolarHBondContact O-N 2.88Å; I25-L28 PolarHBondContact O-N 3.2Å; L28-N31 PolarHBondContact O-N 2.89Å; L28-Y32 VanDerWaalsContact O-CB 3.28Å; L28-Y32 WeakPolarHBondContact O-CB 3.48Å; L28-Y32 PolarHBondContact O-N 3.23Å |
| 29 | A | 93.6 | Very high | 91.5 | Very high | 55 Ų | 55 | 101.2 Ų | 101.2 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.7 | -40.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | I25 W33 | I25-A29 WeakPolarHBondContact O-CB 3.38Å; I25-A29 PolarHBondContact O-N 2.88Å; A29-W33 WeakPolarHBondContact O-CB 3.11Å; A29-W33 PolarHBondContact O-N 3.49Å |
| 30 | F | 93.8 | Very high | 91.6 | Very high | 144 Ų | 144 | 98.6 Ų | 98.6 | 63% | 0.632 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -65.7 | -43.5 | 173.5 | -178.4 | -98.6 | 0 | 0 | 0 | 112 | G26 V27 W33 T34 | G26-F30 VanDerWaalsContact O-CB 3.32Å; G26-F30 WeakPolarHBondContact O-CB 3.45Å; G26-F30 PolarHBondContact O-N 3.47Å; V27-F30 PolarHBondContact O-N 3.12Å; F30-W33 PolarHBondContact O-N 3.5Å; F30-T34 HydrophobicContact CD1-CG2 4.28Å; F30-T34 HydrophobicContact CE1-CG2 3.84Å; F30-T34 HydrophobicContact CE2-CG2 4.21Å; F30-T34 HydrophobicContact CZ-CG2 3.8Å; F30-T34 WeakPolarHBondContact O-CG2 3.42Å; F30-T34 PolarHBondContact O-N 2.94Å; F30-T34 PolarHBondContact O-OG1 3.3Å |
| 31 | N | 94.4 | Very high | 91.7 | Very high | 94 Ų | 94 | 97.7 Ų | 97.7 | 50% | 0.503 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.4 | -52.7 | 175.5 | -169.8 | -65.3 | 0 | 0 | 0 | 110.5 | V27 L28 W33 T34 V35 | V27-N31 VanDerWaalsContact O-CB 3.32Å; V27-N31 WeakPolarHBondContact O-CB 3.21Å; V27-N31 PolarHBondContact O-N 3.38Å; L28-N31 PolarHBondContact O-N 2.89Å; N31-W33 VanDerWaalsContact C-N 3.29Å; N31-W33 PolarHBondContact O-N 3.19Å; N31-T34 PolarHBondContact O-N 3.14Å; N31-T34 VanDerWaalsContact O-N 3.1Å; N31-T34 PolarHBondContact O-OG1 2.9Å; N31-V35 WeakPolarHBondContact O-CG2 3.49Å; N31-V35 PolarHBondContact O-N 2.86Å |
| 32 | Y | 93.4 | Very high | 91.8 | Very high | 166 Ų | 166 | 98 Ų | 98 | 65% | 0.651 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -56.5 | -40.6 | 174.9 | -179.9 | -101.7 | 0 | 0 | 0 | 112.3 | L28 V35 S36 | L28-Y32 VanDerWaalsContact O-CB 3.28Å; L28-Y32 WeakPolarHBondContact O-CB 3.48Å; L28-Y32 PolarHBondContact O-N 3.23Å; Y32-V35 PolarHBondContact O-N 3Å; Y32-S36 WeakPolarHBondContact O-CA 3.47Å; Y32-S36 WeakPolarHBondContact O-CB 3.4Å; Y32-S36 PolarHBondContact O-N 2.95Å |
| 33 | W | 92.5 | Very high | 91.9 | Very high | 181 Ų | 181 | 96.4 Ų | 96.4 | 69% | 0.686 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.8 | -48 | 174.3 | -176.6 | -89.9 | 0 | 0 | 0 | 111.7 | A29 F30 N31 V35 S36 N37 | A29-W33 WeakPolarHBondContact O-CB 3.11Å; A29-W33 PolarHBondContact O-N 3.49Å; F30-W33 PolarHBondContact O-N 3.5Å; N31-W33 VanDerWaalsContact C-N 3.29Å; N31-W33 PolarHBondContact O-N 3.19Å; W33-V35 VanDerWaalsContact C-N 3.34Å; W33-V35 PolarHBondContact O-N 2.98Å; W33-S36 PolarHBondContact O-N 3.49Å; W33-N37 WeakPolarHBondContact O-CB 3.48Å; W33-N37 PolarHBondContact O-N 3.34Å |
| 34 | T | 91.3 | Very high | 91.8 | Very high | 50 Ų | 50 | 98.2 Ų | 98.2 | 31% | 0.307 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.6 | -32.1 | 178.4 | 61 | 0 | 0 | 0 | 0 | 113.6 | F30 N31 K38 | F30-T34 HydrophobicContact CD1-CG2 4.28Å; F30-T34 HydrophobicContact CE1-CG2 3.84Å; F30-T34 HydrophobicContact CE2-CG2 4.21Å; F30-T34 HydrophobicContact CZ-CG2 3.8Å; F30-T34 WeakPolarHBondContact O-CG2 3.42Å; F30-T34 PolarHBondContact O-N 2.94Å; F30-T34 PolarHBondContact O-OG1 3.3Å; N31-T34 PolarHBondContact O-N 3.14Å; N31-T34 VanDerWaalsContact O-N 3.1Å; N31-T34 PolarHBondContact O-OG1 2.9Å; T34-K38 VanDerWaalsContact O-CG 3.31Å; T34-K38 WeakPolarHBondContact O-CG 3.5Å; T34-K38 PolarHBondContact O-N 3.44Å |
| 35 | V | 93.3 | Very high | 91.9 | Very high | 81 Ų | 81 | 98.6 Ų | 98.6 | 49% | 0.491 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -76.2 | -43.9 | 175.1 | 173.4 | 0 | 0 | 0 | 0 | 110.9 | N31 Y32 W33 K38 H39 | N31-V35 WeakPolarHBondContact O-CG2 3.49Å; N31-V35 PolarHBondContact O-N 2.86Å; Y32-V35 PolarHBondContact O-N 3Å; W33-V35 VanDerWaalsContact C-N 3.34Å; W33-V35 PolarHBondContact O-N 2.98Å; V35-K38 PolarHBondContact O-N 2.89Å; V35-H39 WeakPolarHBondContact O-CB 3.29Å; V35-H39 PolarHBondContact O-N 3.35Å |
| 36 | S | 90.8 | Very high | 91.9 | Very high | 54 Ų | 54 | 99.8 Ų | 99.8 | 38% | 0.378 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.6 | -41 | 177.8 | -173.4 | 0 | 0 | 0 | 0 | 111.7 | Y32 W33 K38 H39 G40 | Y32-S36 WeakPolarHBondContact O-CA 3.47Å; Y32-S36 WeakPolarHBondContact O-CB 3.4Å; Y32-S36 PolarHBondContact O-N 2.95Å; W33-S36 PolarHBondContact O-N 3.49Å; S36-K38 VanDerWaalsContact C-N 3.34Å; S36-K38 PolarHBondContact O-N 3.42Å; S36-H39 PolarHBondContact O-N 3.47Å; S36-H39 VanDerWaalsContact O-N 3.15Å; S36-G40 PolarHBondContact O-N 2.9Å |
| 37 | N | 88.4 | Confident | 91.8 | Very high | 113 Ų | 113 | 99.9 Ų | 99.9 | 60% | 0.604 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63 | -39.4 | 175.1 | -167.6 | 60.5 | 0 | 0 | 0 | 112.1 | W33 H41 | W33-N37 WeakPolarHBondContact O-CB 3.48Å; W33-N37 PolarHBondContact O-N 3.34Å; N37-H41 PolarHBondContact O-N 3.16Å; N37-H41 VanDerWaalsContact O-N 3.15Å |
| 38 | K | 91.5 | Very high | 91.8 | Very high | 143 Ų | 143 | 101.9 Ų | 101.9 | 62% | 0.622 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.7 | -41.8 | 170.9 | -73.4 | 173.5 | 179.7 | -177.4 | 0 | 111.9 | T34 V35 S36 G40 H41 L42 | T34-K38 VanDerWaalsContact O-CG 3.31Å; T34-K38 WeakPolarHBondContact O-CG 3.5Å; T34-K38 PolarHBondContact O-N 3.44Å; V35-K38 PolarHBondContact O-N 2.89Å; S36-K38 VanDerWaalsContact C-N 3.34Å; S36-K38 PolarHBondContact O-N 3.42Å; K38-G40 VanDerWaalsContact C-N 3.31Å; K38-G40 PolarHBondContact O-N 3.38Å; K38-H41 WeakPolarHBondContact O-CB 3.46Å; K38-H41 PolarHBondContact O-N 2.92Å; K38-L42 VanDerWaalsContact O-CD1 3.3Å; K38-L42 WeakPolarHBondContact O-CD1 3.22Å; K38-L42 PolarHBondContact O-N 2.93Å |
| 39 | H | 91.1 | Very high | 91.8 | Very high | 110 Ų | 110 | 100.8 Ų | 100.8 | 51% | 0.509 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.2 | -36.5 | 178.8 | -167 | 9.7 | 0 | 0 | 0 | 111.7 | V35 S36 L42 L43 | V35-H39 WeakPolarHBondContact O-CB 3.29Å; V35-H39 PolarHBondContact O-N 3.35Å; S36-H39 PolarHBondContact O-N 3.47Å; S36-H39 VanDerWaalsContact O-N 3.15Å; H39-L42 PolarHBondContact O-N 3.22Å; H39-L43 WeakPolarHBondContact O-CB 3.44Å; H39-L43 VanDerWaalsContact O-CG 3.25Å; H39-L43 WeakPolarHBondContact O-CG 3.41Å; H39-L43 PolarHBondContact O-N 3.25Å |
| 40 | G | 89.3 | Confident | 91.7 | Very high | 37 Ų | 37 | 103.5 Ų | 103.5 | 38% | 0.381 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.3 | -46.8 | 170 | 0 | 0 | 0 | 0 | 0 | 112.3 | S36 K38 L42 L43 D44 | S36-G40 PolarHBondContact O-N 2.9Å; K38-G40 VanDerWaalsContact C-N 3.31Å; K38-G40 PolarHBondContact O-N 3.38Å; G40-L42 PolarHBondContact O-N 2.81Å; G40-L43 PolarHBondContact O-N 3.25Å; G40-D44 PolarHBondContact O-N 2.98Å |
| 41 | H | 90 | Very high | 91.5 | Very high | 119 Ų | 119 | 99.1 Ų | 99.1 | 55% | 0.551 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -58.6 | -46.2 | 174.2 | -161.9 | -80.8 | 0 | 0 | 0 | 112.1 | N37 K38 L43 D44 E45 | N37-H41 PolarHBondContact O-N 3.16Å; N37-H41 VanDerWaalsContact O-N 3.15Å; K38-H41 WeakPolarHBondContact O-CB 3.46Å; K38-H41 PolarHBondContact O-N 2.92Å; H41-L43 VanDerWaalsContact C-N 3.3Å; H41-L43 PolarHBondContact O-N 2.91Å; H41-D44 PolarHBondContact O-N 2.84Å; H41-E45 IonicContact CE1-OE1 3.04Å; H41-E45 PolarHBondContact CE1-OE1 3.44Å; H41-E45 IonicContact ND1-OE1 2.81Å; H41-E45 PolarHBondContact ND1-OE1 2.86Å; H41-E45 WeakPolarHBondContact O-CG 3.4Å; H41-E45 PolarHBondContact O-N 2.86Å |
| 42 | L | 91.5 | Very high | 91.4 | Very high | 91 Ų | 91 | 100.4 Ų | 100.4 | 48% | 0.476 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.5 | -30.6 | 176.6 | -91.7 | 69.8 | 0 | 0 | 0 | 113 | K38 H39 G40 L46 | K38-L42 VanDerWaalsContact O-CD1 3.3Å; K38-L42 WeakPolarHBondContact O-CD1 3.22Å; K38-L42 PolarHBondContact O-N 2.93Å; H39-L42 PolarHBondContact O-N 3.22Å; G40-L42 PolarHBondContact O-N 2.81Å; L42-L46 WeakPolarHBondContact O-CB 3.35Å; L42-L46 WeakPolarHBondContact O-CG 3.32Å; L42-L46 PolarHBondContact O-N 3.21Å |
| 43 | L | 90.4 | Very high | 91.4 | Very high | 95 Ų | 95 | 95.7 Ų | 95.7 | 50% | 0.497 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -73.5 | -34.3 | 174.5 | -74.3 | 166.8 | 0 | 0 | 0 | 111.8 | H39 G40 H41 A47 | H39-L43 WeakPolarHBondContact O-CB 3.44Å; H39-L43 VanDerWaalsContact O-CG 3.25Å; H39-L43 WeakPolarHBondContact O-CG 3.41Å; H39-L43 PolarHBondContact O-N 3.25Å; G40-L43 PolarHBondContact O-N 3.25Å; H41-L43 VanDerWaalsContact C-N 3.3Å; H41-L43 PolarHBondContact O-N 2.91Å; L43-A47 WeakPolarHBondContact O-CB 3.39Å; L43-A47 PolarHBondContact O-N 3.5Å |
| 44 | D | 90.8 | Very high | 91.4 | Very high | 123 Ų | 123 | 92.7 Ų | 92.7 | 66% | 0.658 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -72.8 | -42.4 | 175.3 | -152.1 | 31.4 | 0 | 0 | 0 | 111.2 | G40 H41 L46 A47 E48 | G40-D44 PolarHBondContact O-N 2.98Å; H41-D44 PolarHBondContact O-N 2.84Å; D44-L46 VanDerWaalsContact C-N 3.35Å; D44-L46 PolarHBondContact O-N 2.81Å; D44-A47 CarbonylContact O-C 3.6Å; D44-A47 WeakPolarHBondContact O-CB 3.49Å; D44-A47 PolarHBondContact O-N 3.49Å; D44-A47 VanDerWaalsContact O-N 3.12Å; D44-E48 PolarHBondContact O-N 2.86Å |
| 45 | E | 93.8 | Very high | 91.4 | Very high | 84 Ų | 84 | 98 Ų | 98 | 39% | 0.393 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -55.3 | -47 | 168.5 | -75.5 | 170.8 | -179.4 | 0 | 0 | 111.6 | H41 A47 E48 I49 | H41-E45 IonicContact CE1-OE1 3.04Å; H41-E45 PolarHBondContact CE1-OE1 3.44Å; H41-E45 IonicContact ND1-OE1 2.81Å; H41-E45 PolarHBondContact ND1-OE1 2.86Å; H41-E45 WeakPolarHBondContact O-CG 3.4Å; H41-E45 PolarHBondContact O-N 2.86Å; E45-A47 VanDerWaalsContact C-N 3.33Å; E45-A47 PolarHBondContact O-N 2.73Å; E45-E48 PolarHBondContact O-N 3.19Å; E45-I49 WeakPolarHBondContact O-CB 3.39Å; E45-I49 WeakPolarHBondContact O-CD1 3.25Å; E45-I49 VanDerWaalsContact O-CG1 3.22Å; E45-I49 WeakPolarHBondContact O-CG1 3.48Å; E45-I49 PolarHBondContact O-N 2.87Å |
| 46 | L | 91.2 | Very high | 91.3 | Very high | 110 Ų | 110 | 97.2 Ų | 97.2 | 58% | 0.576 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.5 | -36.3 | 176.3 | -77.5 | 171.4 | 0 | 0 | 0 | 112.1 | L42 D44 Q50 | L42-L46 WeakPolarHBondContact O-CB 3.35Å; L42-L46 WeakPolarHBondContact O-CG 3.32Å; L42-L46 PolarHBondContact O-N 3.21Å; D44-L46 VanDerWaalsContact C-N 3.35Å; D44-L46 PolarHBondContact O-N 2.81Å; L46-Q50 VanDerWaalsContact O-CB 3.23Å; L46-Q50 WeakPolarHBondContact O-CB 3.28Å; L46-Q50 PolarHBondContact O-N 3.15Å |
| 47 | A | 91.1 | Very high | 91.4 | Very high | 44 Ų | 44 | 98.6 Ų | 98.6 | 36% | 0.364 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.2 | -45.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L43 D44 E45 Q50 T51 | L43-A47 WeakPolarHBondContact O-CB 3.39Å; L43-A47 PolarHBondContact O-N 3.5Å; D44-A47 CarbonylContact O-C 3.6Å; D44-A47 WeakPolarHBondContact O-CB 3.49Å; D44-A47 PolarHBondContact O-N 3.49Å; D44-A47 VanDerWaalsContact O-N 3.12Å; E45-A47 VanDerWaalsContact C-N 3.33Å; E45-A47 PolarHBondContact O-N 2.73Å; A47-Q50 PolarHBondContact O-N 3.39Å; A47-T51 WeakPolarHBondContact O-CG2 3.33Å; A47-T51 PolarHBondContact O-N 2.88Å |
| 48 | E | 92.4 | Very high | 91.5 | Very high | 134 Ų | 134 | 95.7 Ų | 95.7 | 63% | 0.626 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -59.8 | -52.7 | 176 | -179 | 167.7 | -149.3 | 0 | 0 | 110.8 | D44 E45 Q50 T51 Q52 | D44-E48 PolarHBondContact O-N 2.86Å; E45-E48 PolarHBondContact O-N 3.19Å; E48-Q50 VanDerWaalsContact C-N 3.27Å; E48-Q50 PolarHBondContact O-N 2.92Å; E48-T51 CarbonylContact O-C 3.54Å; E48-T51 WeakPolarHBondContact O-CA 3.5Å; E48-T51 PolarHBondContact O-N 3.32Å; E48-T51 PolarHBondContact O-OG1 2.98Å; E48-Q52 PolarHBondContact O-N 3Å |
| 49 | I | 93.4 | Very high | 91.5 | Very high | 89 Ų | 89 | 91.8 Ų | 91.8 | 46% | 0.456 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -56.5 | -41.8 | 176.4 | -68.7 | 166.1 | 0 | 0 | 0 | 110.4 | E45 T51 Q52 V53 | E45-I49 WeakPolarHBondContact O-CB 3.39Å; E45-I49 WeakPolarHBondContact O-CD1 3.25Å; E45-I49 VanDerWaalsContact O-CG1 3.22Å; E45-I49 WeakPolarHBondContact O-CG1 3.48Å; E45-I49 PolarHBondContact O-N 2.87Å; I49-T51 VanDerWaalsContact C-N 3.32Å; I49-T51 PolarHBondContact O-N 3.33Å; I49-Q52 WeakPolarHBondContact O-CB 3.47Å; I49-Q52 PolarHBondContact O-N 3.19Å; I49-Q52 VanDerWaalsContact O-N 3.15Å; I49-V53 HydrophobicContact CG2-CG2 4.33Å; I49-V53 WeakPolarHBondContact O-CG2 3.32Å; I49-V53 PolarHBondContact O-N 2.91Å |
| 50 | Q | 92.3 | Very high | 91.7 | Very high | 111 Ų | 111 | 94.7 Ų | 94.7 | 52% | 0.519 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.3 | -34.5 | 176.2 | -158.4 | -162.2 | 47.3 | 0 | 0 | 112.3 | L46 A47 E48 K54 | L46-Q50 VanDerWaalsContact O-CB 3.23Å; L46-Q50 WeakPolarHBondContact O-CB 3.28Å; L46-Q50 PolarHBondContact O-N 3.15Å; A47-Q50 PolarHBondContact O-N 3.39Å; E48-Q50 VanDerWaalsContact C-N 3.27Å; E48-Q50 PolarHBondContact O-N 2.92Å; Q50-K54 WeakPolarHBondContact O-CB 3.34Å; Q50-K54 WeakPolarHBondContact O-CD 3.38Å; Q50-K54 WeakPolarHBondContact O-CG 3.15Å; Q50-K54 PolarHBondContact O-N 3.03Å; Q50-K54 VanDerWaalsContact O-N 3.14Å |
| 51 | T | 89.4 | Confident | 91.9 | Very high | 53 Ų | 53 | 95.5 Ų | 95.5 | 33% | 0.325 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -72.2 | -35.1 | 171.4 | 70.4 | 0 | 0 | 0 | 0 | 112.6 | A47 E48 I49 K54 R55 | A47-T51 WeakPolarHBondContact O-CG2 3.33Å; A47-T51 PolarHBondContact O-N 2.88Å; E48-T51 CarbonylContact O-C 3.54Å; E48-T51 WeakPolarHBondContact O-CA 3.5Å; E48-T51 PolarHBondContact O-N 3.32Å; E48-T51 PolarHBondContact O-OG1 2.98Å; I49-T51 VanDerWaalsContact C-N 3.32Å; I49-T51 PolarHBondContact O-N 3.33Å; T51-K54 PolarHBondContact O-N 2.97Å; T51-R55 VanDerWaalsContact O-CG 3.27Å; T51-R55 WeakPolarHBondContact O-CG 3.22Å; T51-R55 PolarHBondContact O-N 2.82Å; T51-R55 PolarHBondContact OG1-NH1 2.66Å |
| 52 | Q | 91.4 | Very high | 92.1 | Very high | 120 Ų | 120 | 98.8 Ų | 98.8 | 56% | 0.561 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -63.8 | -47.4 | 176.1 | -167.5 | -176.7 | 22.5 | 0 | 0 | 110.7 | E48 I49 R55 S56 | E48-Q52 PolarHBondContact O-N 3Å; I49-Q52 WeakPolarHBondContact O-CB 3.47Å; I49-Q52 PolarHBondContact O-N 3.19Å; I49-Q52 VanDerWaalsContact O-N 3.15Å; Q52-R55 WeakPolarHBondContact O-CB 3.41Å; Q52-R55 PolarHBondContact O-N 2.81Å; Q52-R55 VanDerWaalsContact O-N 3.15Å; Q52-S56 PolarHBondContact O-N 3.36Å; Q52-S56 PolarHBondContact O-OG 2.93Å |
| 53 | V | 93.9 | Very high | 92.2 | Very high | 67 Ų | 67 | 100.1 Ų | 100.1 | 41% | 0.406 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.2 | -49.2 | 174.6 | 170.7 | 0 | 0 | 0 | 0 | 110.8 | I49 R55 S56 D57 | I49-V53 HydrophobicContact CG2-CG2 4.33Å; I49-V53 WeakPolarHBondContact O-CG2 3.32Å; I49-V53 PolarHBondContact O-N 2.91Å; V53-R55 VanDerWaalsContact C-N 3.26Å; V53-R55 PolarHBondContact O-N 3.23Å; V53-S56 WeakPolarHBondContact CA-OG 3.08Å; V53-S56 PolarHBondContact O-N 2.96Å; V53-S56 VanDerWaalsContact O-N 3.1Å; V53-S56 PolarHBondContact O-OG 3.21Å; V53-D57 WeakPolarHBondContact CG1-OD2 3.5Å; V53-D57 WeakPolarHBondContact O-CB 3.31Å; V53-D57 PolarHBondContact O-N 2.95Å |
| 54 | K | 93 | Very high | 92.5 | Very high | 119 Ų | 119 | 101.1 Ų | 101.1 | 52% | 0.517 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.4 | -35.4 | 175.9 | -72.7 | 165 | -176.6 | 166.3 | 0 | 113 | Q50 T51 A58 | Q50-K54 WeakPolarHBondContact O-CB 3.34Å; Q50-K54 WeakPolarHBondContact O-CD 3.38Å; Q50-K54 WeakPolarHBondContact O-CG 3.15Å; Q50-K54 PolarHBondContact O-N 3.03Å; Q50-K54 VanDerWaalsContact O-N 3.14Å; T51-K54 PolarHBondContact O-N 2.97Å; K54-A58 WeakPolarHBondContact O-CB 3.22Å; K54-A58 PolarHBondContact O-N 2.86Å |
| 55 | R | 90.3 | Very high | 92.7 | Very high | 162 Ų | 162 | 101.3 Ų | 101.3 | 61% | 0.611 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -70.9 | -43.3 | 174.3 | -70.4 | 169.8 | -170.4 | 128.6 | 1 | 111.8 | T51 Q52 V53 A58 A59 | T51-R55 VanDerWaalsContact O-CG 3.27Å; T51-R55 WeakPolarHBondContact O-CG 3.22Å; T51-R55 PolarHBondContact O-N 2.82Å; T51-R55 PolarHBondContact OG1-NH1 2.66Å; Q52-R55 WeakPolarHBondContact O-CB 3.41Å; Q52-R55 PolarHBondContact O-N 2.81Å; Q52-R55 VanDerWaalsContact O-N 3.15Å; V53-R55 VanDerWaalsContact C-N 3.26Å; V53-R55 PolarHBondContact O-N 3.23Å; R55-A58 PolarHBondContact O-N 3.48Å; R55-A59 PolarHBondContact O-N 3.08Å; R55-A59 VanDerWaalsContact O-N 3.13Å |
| 56 | S | 90.9 | Very high | 92.8 | Very high | 64 Ų | 64 | 105.6 Ų | 105.6 | 45% | 0.448 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68 | -35.9 | 177.4 | 55.6 | 0 | 0 | 0 | 0 | 112.5 | Q52 V53 A59 R60 | Q52-S56 PolarHBondContact O-N 3.36Å; Q52-S56 PolarHBondContact O-OG 2.93Å; V53-S56 WeakPolarHBondContact CA-OG 3.08Å; V53-S56 PolarHBondContact O-N 2.96Å; V53-S56 VanDerWaalsContact O-N 3.1Å; V53-S56 PolarHBondContact O-OG 3.21Å; S56-A59 PolarHBondContact O-N 3.18Å; S56-R60 VanDerWaalsContact O-CB 3.31Å; S56-R60 WeakPolarHBondContact O-CB 3.34Å; S56-R60 PolarHBondContact O-N 2.81Å |
| 57 | D | 92.6 | Very high | 93.1 | Very high | 82 Ų | 82 | 104.4 Ų | 104.4 | 44% | 0.439 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.1 | -39.4 | 176.9 | -67.3 | -20.7 | 0 | 0 | 0 | 111.4 | V53 A59 R60 S61 | V53-D57 WeakPolarHBondContact CG1-OD2 3.5Å; V53-D57 WeakPolarHBondContact O-CB 3.31Å; V53-D57 PolarHBondContact O-N 2.95Å; D57-A59 VanDerWaalsContact C-N 3.3Å; D57-A59 PolarHBondContact O-N 3.13Å; D57-R60 PolarHBondContact O-N 2.83Å; D57-S61 WeakPolarHBondContact O-CB 3.43Å; D57-S61 PolarHBondContact O-N 3.04Å |
| 58 | A | 91.6 | Very high | 93.4 | Very high | 52 Ų | 52 | 105.3 Ų | 105.3 | 43% | 0.43 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.8 | -33.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | K54 R55 R62 | K54-A58 WeakPolarHBondContact O-CB 3.22Å; K54-A58 PolarHBondContact O-N 2.86Å; R55-A58 PolarHBondContact O-N 3.48Å; A58-R62 WeakPolarHBondContact O-CD 3.49Å; A58-R62 VanDerWaalsContact O-CG 3.31Å; A58-R62 WeakPolarHBondContact O-CG 3.48Å; A58-R62 PolarHBondContact O-N 2.96Å |
| 59 | A | 91.9 | Very high | 93.6 | Very high | 61 Ų | 61 | 103.9 Ų | 103.9 | 50% | 0.504 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -72.8 | -44.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | R55 S56 D57 R62 L63 | R55-A59 PolarHBondContact O-N 3.08Å; R55-A59 VanDerWaalsContact O-N 3.13Å; S56-A59 PolarHBondContact O-N 3.18Å; D57-A59 VanDerWaalsContact C-N 3.3Å; D57-A59 PolarHBondContact O-N 3.13Å; A59-R62 PolarHBondContact O-N 2.82Å; A59-L63 PolarHBondContact O-N 3.07Å |
| 60 | R | 94 | Very high | 93.8 | Very high | 172 Ų | 172 | 104.3 Ų | 104.3 | 65% | 0.649 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -58.9 | -48.1 | 177.2 | -177.5 | 176.7 | 178.7 | 151 | 2.7 | 111.3 | S56 D57 R62 L63 E64 | S56-R60 VanDerWaalsContact O-CB 3.31Å; S56-R60 WeakPolarHBondContact O-CB 3.34Å; S56-R60 PolarHBondContact O-N 2.81Å; D57-R60 PolarHBondContact O-N 2.83Å; R60-R62 VanDerWaalsContact C-N 3.29Å; R60-R62 PolarHBondContact O-N 3.37Å; R60-L63 PolarHBondContact O-N 3.32Å; R60-L63 VanDerWaalsContact O-N 3.09Å; R60-E64 VanDerWaalsContact O-CB 3.28Å; R60-E64 WeakPolarHBondContact O-CB 3.46Å; R60-E64 PolarHBondContact O-N 3.46Å |
| 61 | S | 94.1 | Very high | 94.1 | Very high | 54 Ų | 54 | 103.2 Ų | 103.2 | 38% | 0.378 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.2 | -34.3 | 178 | -176.5 | 0 | 0 | 0 | 0 | 112.9 | D57 K65 | D57-S61 WeakPolarHBondContact O-CB 3.43Å; D57-S61 PolarHBondContact O-N 3.04Å; S61-K65 WeakPolarHBondContact O-CG 3.18Å; S61-K65 PolarHBondContact O-N 2.99Å |
| 62 | R | 94.1 | Very high | 94.5 | Very high | 188 Ų | 188 | 105 Ų | 105 | 71% | 0.709 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -69.5 | -38.5 | 173.6 | -71.1 | 170.8 | -179.6 | -167.8 | -0 | 112.4 | A58 A59 R60 R66 | A58-R62 WeakPolarHBondContact O-CD 3.49Å; A58-R62 VanDerWaalsContact O-CG 3.31Å; A58-R62 WeakPolarHBondContact O-CG 3.48Å; A58-R62 PolarHBondContact O-N 2.96Å; A59-R62 PolarHBondContact O-N 2.82Å; R60-R62 VanDerWaalsContact C-N 3.29Å; R60-R62 PolarHBondContact O-N 3.37Å; R62-R66 PolarHBondContact O-N 3.4Å |
| 63 | L | 94.8 | Very high | 94.8 | Very high | 119 Ų | 119 | 104.3 Ų | 104.3 | 62% | 0.623 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -71 | -40.7 | 176.4 | -173 | 150 | 0 | 0 | 0 | 111.2 | A59 R60 R66 N67 | A59-L63 PolarHBondContact O-N 3.07Å; R60-L63 PolarHBondContact O-N 3.32Å; R60-L63 VanDerWaalsContact O-N 3.09Å; L63-R66 PolarHBondContact O-N 2.89Å; L63-N67 WeakPolarHBondContact O-CB 3.39Å; L63-N67 PolarHBondContact O-N 3.24Å |
| 64 | E | 95.3 | Very high | 95 | Very high | 115 Ų | 115 | 105.8 Ų | 105.8 | 54% | 0.537 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62 | -41.8 | 176.4 | -175.3 | 167.4 | -144.1 | 0 | 0 | 112 | R60 N67 S68 | R60-E64 VanDerWaalsContact O-CB 3.28Å; R60-E64 WeakPolarHBondContact O-CB 3.46Å; R60-E64 PolarHBondContact O-N 3.46Å; E64-N67 WeakPolarHBondContact O-CB 3.41Å; E64-N67 PolarHBondContact O-N 3.45Å; E64-S68 PolarHBondContact O-N 2.87Å; E64-S68 PolarHBondContact O-OG 3.43Å |
| 65 | K | 96.4 | Very high | 95.3 | Very high | 127 Ų | 127 | 103.9 Ų | 103.9 | 55% | 0.552 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -57.8 | -53.8 | 170.8 | -77.3 | 178.6 | -179.3 | -168.4 | 0 | 112.1 | S61 N67 S68 E69 | S61-K65 WeakPolarHBondContact O-CG 3.18Å; S61-K65 PolarHBondContact O-N 2.99Å; K65-N67 PolarHBondContact O-N 3.25Å; K65-S68 PolarHBondContact O-N 2.99Å; K65-S68 VanDerWaalsContact O-N 3.08Å; K65-S68 PolarHBondContact O-OG 3.01Å; K65-E69 VanDerWaalsContact O-CG 3.32Å; K65-E69 WeakPolarHBondContact O-CG 3.39Å; K65-E69 PolarHBondContact O-N 2.87Å |
| 66 | R | 95.9 | Very high | 95.7 | Very high | 175 Ų | 175 | 99.2 Ų | 99.2 | 66% | 0.66 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -59.1 | -35.4 | 175.9 | -71 | -177.7 | -176.5 | 167.8 | -0.8 | 113.1 | R62 L63 E69 L70 | R62-R66 PolarHBondContact O-N 3.4Å; L63-R66 PolarHBondContact O-N 2.89Å; R66-E69 PolarHBondContact O-N 3.33Å; R66-L70 WeakPolarHBondContact O-CB 3.39Å; R66-L70 VanDerWaalsContact O-CG 3.25Å; R66-L70 WeakPolarHBondContact O-CG 3.45Å; R66-L70 PolarHBondContact O-N 2.81Å |
| 67 | N | 97.3 | Very high | 96 | Very high | 85 Ų | 85 | 101.3 Ų | 101.3 | 46% | 0.455 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66 | -45 | 175.5 | -164.6 | 11.3 | 0 | 0 | 0 | 110.6 | L63 E64 K65 E69 L70 I71 | L63-N67 WeakPolarHBondContact O-CB 3.39Å; L63-N67 PolarHBondContact O-N 3.24Å; E64-N67 WeakPolarHBondContact O-CB 3.41Å; E64-N67 PolarHBondContact O-N 3.45Å; K65-N67 PolarHBondContact O-N 3.25Å; N67-E69 PolarHBondContact O-N 3.39Å; N67-L70 PolarHBondContact O-N 2.74Å; N67-I71 WeakPolarHBondContact O-CB 3.23Å; N67-I71 WeakPolarHBondContact O-CD1 3.46Å; N67-I71 VanDerWaalsContact O-CG1 3.24Å; N67-I71 WeakPolarHBondContact O-CG1 3.35Å; N67-I71 PolarHBondContact O-N 2.63Å |
| 68 | S | 97.1 | Very high | 96.3 | Very high | 62 Ų | 62 | 103.2 Ų | 103.2 | 43% | 0.434 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64 | -36.9 | 174.2 | 68.4 | 0 | 0 | 0 | 0 | 113.2 | E64 K65 I71 V72 | E64-S68 PolarHBondContact O-N 2.87Å; E64-S68 PolarHBondContact O-OG 3.43Å; K65-S68 PolarHBondContact O-N 2.99Å; K65-S68 VanDerWaalsContact O-N 3.08Å; K65-S68 PolarHBondContact O-OG 3.01Å; S68-I71 PolarHBondContact O-N 3.5Å; S68-V72 WeakPolarHBondContact O-CG2 3.31Å; S68-V72 PolarHBondContact O-N 2.86Å |
| 69 | E | 96.8 | Very high | 96.6 | Very high | 104 Ų | 104 | 107.5 Ų | 107.5 | 49% | 0.486 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 173.2 | -69.5 | 156.8 | -161.3 | 0 | 0 | 111.2 | K65 R66 N67 V72 Q73 | K65-E69 VanDerWaalsContact O-CG 3.32Å; K65-E69 WeakPolarHBondContact O-CG 3.39Å; K65-E69 PolarHBondContact O-N 2.87Å; R66-E69 PolarHBondContact O-N 3.33Å; N67-E69 PolarHBondContact O-N 3.39Å; E69-V72 PolarHBondContact O-N 3.11Å; E69-Q73 WeakPolarHBondContact O-CG 3.34Å; E69-Q73 PolarHBondContact O-N 2.88Å |
| 70 | L | 97.9 | Very high | 96.9 | Very high | 99 Ų | 99 | 109.7 Ų | 109.7 | 52% | 0.518 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.3 | -39.3 | 176.5 | -73.8 | 167.5 | 0 | 0 | 0 | 112.6 | R66 N67 Q73 V74 | R66-L70 WeakPolarHBondContact O-CB 3.39Å; R66-L70 VanDerWaalsContact O-CG 3.25Å; R66-L70 WeakPolarHBondContact O-CG 3.45Å; R66-L70 PolarHBondContact O-N 2.81Å; N67-L70 PolarHBondContact O-N 2.74Å; L70-Q73 PolarHBondContact O-N 2.71Å; L70-V74 WeakPolarHBondContact O-CG2 3.42Å; L70-V74 PolarHBondContact O-N 2.71Å |
| 71 | I | 97.3 | Very high | 97.1 | Very high | 88 Ų | 88 | 106.1 Ų | 106.1 | 45% | 0.451 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.4 | -45.9 | 174.8 | -70.8 | 162.5 | 0 | 0 | 0 | 110.2 | N67 S68 Q73 V74 D75 | N67-I71 WeakPolarHBondContact O-CB 3.23Å; N67-I71 WeakPolarHBondContact O-CD1 3.46Å; N67-I71 VanDerWaalsContact O-CG1 3.24Å; N67-I71 WeakPolarHBondContact O-CG1 3.35Å; N67-I71 PolarHBondContact O-N 2.63Å; S68-I71 PolarHBondContact O-N 3.5Å; I71-Q73 VanDerWaalsContact C-N 3.33Å; I71-Q73 PolarHBondContact O-N 3.31Å; I71-V74 PolarHBondContact O-N 3.02Å; I71-D75 PolarHBondContact O-N 3.32Å |
| 72 | V | 97.6 | Very high | 97.3 | Very high | 91 Ų | 91 | 107.8 Ų | 107.8 | 55% | 0.552 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.1 | -38.6 | 176 | 171 | 0 | 0 | 0 | 0 | 111.6 | S68 E69 D75 T76 | S68-V72 WeakPolarHBondContact O-CG2 3.31Å; S68-V72 PolarHBondContact O-N 2.86Å; E69-V72 PolarHBondContact O-N 3.11Å; V72-D75 PolarHBondContact O-N 2.9Å; V72-T76 WeakPolarHBondContact O-CB 3.49Å; V72-T76 PolarHBondContact O-N 3.37Å; V72-T76 PolarHBondContact O-OG1 3.19Å; V72-T76 VanDerWaalsContact O-OG1 3.05Å |
| 73 | Q | 98.2 | Very high | 97.6 | Very high | 104 Ų | 104 | 104.4 Ų | 104.4 | 49% | 0.486 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.9 | -44.1 | 172.9 | -73.2 | 171.4 | 20.8 | 0 | 0 | 112.1 | E69 L70 I71 T76 H77 | E69-Q73 WeakPolarHBondContact O-CG 3.34Å; E69-Q73 PolarHBondContact O-N 2.88Å; L70-Q73 PolarHBondContact O-N 2.71Å; I71-Q73 VanDerWaalsContact C-N 3.33Å; I71-Q73 PolarHBondContact O-N 3.31Å; Q73-T76 PolarHBondContact O-N 3.38Å; Q73-H77 WeakPolarHBondContact O-CB 3.36Å; Q73-H77 PolarHBondContact O-CD2 2.99Å; Q73-H77 PolarHBondContact O-N 3.48Å |
| 74 | V | 98.4 | Very high | 97.7 | Very high | 98 Ų | 98 | 104.5 Ų | 104.5 | 59% | 0.594 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63 | -44.4 | 176.9 | 169.1 | 0 | 0 | 0 | 0 | 111.2 | L70 I71 T76 H77 K78 | L70-V74 WeakPolarHBondContact O-CG2 3.42Å; L70-V74 PolarHBondContact O-N 2.71Å; I71-V74 PolarHBondContact O-N 3.02Å; V74-T76 VanDerWaalsContact C-N 3.33Å; V74-T76 PolarHBondContact O-N 2.86Å; V74-H77 PolarHBondContact O-N 3.43Å; V74-K78 VanDerWaalsContact O-CB 3.3Å; V74-K78 WeakPolarHBondContact O-CB 3.33Å; V74-K78 PolarHBondContact O-N 2.87Å |
| 75 | D | 98.2 | Very high | 97.9 | Very high | 79 Ų | 79 | 103.4 Ų | 103.4 | 42% | 0.422 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.4 | -37.1 | 174.9 | -82.2 | -19.3 | 0 | 0 | 0 | 112.4 | I71 V72 K79 | I71-D75 PolarHBondContact O-N 3.32Å; V72-D75 PolarHBondContact O-N 2.9Å; D75-K79 WeakPolarHBondContact O-CD 3.32Å; D75-K79 VanDerWaalsContact O-CG 3.28Å; D75-K79 WeakPolarHBondContact O-CG 3.48Å; D75-K79 PolarHBondContact O-N 2.93Å |
| 76 | T | 98.3 | Very high | 98 | Very high | 65 Ų | 65 | 99.2 Ų | 99.2 | 40% | 0.399 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.5 | -45.9 | 175 | -69.6 | 0 | 0 | 0 | 0 | 111.7 | V72 Q73 V74 K79 Q80 | V72-T76 WeakPolarHBondContact O-CB 3.49Å; V72-T76 PolarHBondContact O-N 3.37Å; V72-T76 PolarHBondContact O-OG1 3.19Å; V72-T76 VanDerWaalsContact O-OG1 3.05Å; Q73-T76 PolarHBondContact O-N 3.38Å; V74-T76 VanDerWaalsContact C-N 3.33Å; V74-T76 PolarHBondContact O-N 2.86Å; T76-K79 PolarHBondContact O-N 3.06Å; T76-Q80 WeakPolarHBondContact O-CG 3.44Å; T76-Q80 PolarHBondContact O-N 3.34Å |
| 77 | H | 98.4 | Very high | 98.1 | Very high | 108 Ų | 108 | 93.7 Ų | 93.7 | 50% | 0.5 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.3 | -39 | 175.9 | -77.9 | -60.6 | 0 | 0 | 0 | 112 | Q73 V74 Q80 I81 | Q73-H77 WeakPolarHBondContact O-CB 3.36Å; Q73-H77 PolarHBondContact O-CD2 2.99Å; Q73-H77 PolarHBondContact O-N 3.48Å; V74-H77 PolarHBondContact O-N 3.43Å; H77-Q80 WeakPolarHBondContact O-CB 3.39Å; H77-Q80 PolarHBondContact O-N 2.72Å; H77-I81 WeakPolarHBondContact O-CG1 3.35Å; H77-I81 PolarHBondContact O-N 3.24Å |
| 78 | K | 98.5 | Very high | 98.1 | Very high | 122 Ų | 122 | 97 Ų | 97 | 53% | 0.53 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.7 | -48.6 | 174.2 | -175.8 | 177.4 | 175.4 | -179.1 | 0 | 111.3 | V74 Q80 I81 D82 | V74-K78 VanDerWaalsContact O-CB 3.3Å; V74-K78 WeakPolarHBondContact O-CB 3.33Å; V74-K78 PolarHBondContact O-N 2.87Å; K78-Q80 VanDerWaalsContact C-N 3.26Å; K78-Q80 PolarHBondContact O-N 3.34Å; K78-I81 CarbonylContact O-C 3.59Å; K78-I81 WeakPolarHBondContact O-CA 3.42Å; K78-I81 WeakPolarHBondContact O-CB 3.45Å; K78-I81 PolarHBondContact O-N 3.29Å; K78-D82 VanDerWaalsContact O-CG 3.24Å; K78-D82 PolarHBondContact O-N 3.4Å |
| 79 | K | 98.3 | Very high | 98.2 | Very high | 141 Ų | 141 | 97.5 Ų | 97.5 | 61% | 0.613 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.8 | -33 | 175.5 | -72.4 | 165.2 | -175.1 | 167.2 | 0 | 113.2 | D75 T76 Q83 | D75-K79 WeakPolarHBondContact O-CD 3.32Å; D75-K79 VanDerWaalsContact O-CG 3.28Å; D75-K79 WeakPolarHBondContact O-CG 3.48Å; D75-K79 PolarHBondContact O-N 2.93Å; T76-K79 PolarHBondContact O-N 3.06Å; K79-Q83 VanDerWaalsContact O-CB 3.28Å; K79-Q83 WeakPolarHBondContact O-CB 3.41Å; K79-Q83 PolarHBondContact O-N 3.22Å |
| 80 | Q | 98.4 | Very high | 98.3 | Very high | 107 Ų | 107 | 97.3 Ų | 97.3 | 50% | 0.5 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.4 | -37.7 | 173 | -71.8 | 173.6 | 20 | 0 | 0 | 112.1 | T76 H77 K78 K84 | T76-Q80 WeakPolarHBondContact O-CG 3.44Å; T76-Q80 PolarHBondContact O-N 3.34Å; H77-Q80 WeakPolarHBondContact O-CB 3.39Å; H77-Q80 PolarHBondContact O-N 2.72Å; K78-Q80 VanDerWaalsContact C-N 3.26Å; K78-Q80 PolarHBondContact O-N 3.34Å; Q80-K84 WeakPolarHBondContact O-CB 3.36Å; Q80-K84 WeakPolarHBondContact O-CG 3.34Å; Q80-K84 PolarHBondContact O-N 2.95Å |
| 81 | I | 98.5 | Very high | 98.3 | Very high | 98 Ų | 98 | 97.7 Ų | 97.7 | 50% | 0.503 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.7 | -52.9 | 173.3 | -65.9 | 162.5 | 0 | 0 | 0 | 109.8 | H77 K78 Q83 K84 D85 | H77-I81 WeakPolarHBondContact O-CG1 3.35Å; H77-I81 PolarHBondContact O-N 3.24Å; K78-I81 CarbonylContact O-C 3.59Å; K78-I81 WeakPolarHBondContact O-CA 3.42Å; K78-I81 WeakPolarHBondContact O-CB 3.45Å; K78-I81 PolarHBondContact O-N 3.29Å; I81-Q83 PolarHBondContact O-N 3.17Å; I81-K84 CarbonylContact O-C 3.57Å; I81-K84 WeakPolarHBondContact O-CA 3.38Å; I81-K84 PolarHBondContact O-N 2.96Å; I81-D85 WeakPolarHBondContact CG2-OD2 3.49Å; I81-D85 PolarHBondContact O-N 2.95Å |
| 82 | D | 98.4 | Very high | 98.4 | Very high | 89 Ų | 89 | 99.9 Ų | 99.9 | 48% | 0.476 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -53.9 | -40 | 178.3 | -60.6 | -32.3 | 0 | 0 | 0 | 111.6 | K78 G86 | K78-D82 VanDerWaalsContact O-CG 3.24Å; K78-D82 PolarHBondContact O-N 3.4Å; D82-G86 PolarHBondContact O-N 3.46Å |
| 83 | Q | 98.4 | Very high | 98.4 | Very high | 117 Ų | 117 | 97.3 Ų | 97.3 | 55% | 0.547 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.2 | -45.3 | 173.6 | 179.3 | 64 | 56.3 | 0 | 0 | 112.4 | K79 I81 D85 G86 D87 | K79-Q83 VanDerWaalsContact O-CB 3.28Å; K79-Q83 WeakPolarHBondContact O-CB 3.41Å; K79-Q83 PolarHBondContact O-N 3.22Å; I81-Q83 PolarHBondContact O-N 3.17Å; Q83-D85 VanDerWaalsContact C-N 3.35Å; Q83-D85 PolarHBondContact O-N 3.41Å; Q83-G86 PolarHBondContact O-N 2.94Å; Q83-D87 PolarHBondContact NE2-OD1 3.29Å; Q83-D87 VanDerWaalsContact O-CG 3.26Å; Q83-D87 PolarHBondContact O-N 3.09Å |
| 84 | K | 98.3 | Very high | 98.4 | Very high | 120 Ų | 120 | 98 Ų | 98 | 52% | 0.522 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.6 | -39.9 | 179.5 | -78.9 | -70.3 | -180 | -170.5 | 0 | 112.1 | Q80 I81 G86 D87 Y88 | Q80-K84 WeakPolarHBondContact O-CB 3.36Å; Q80-K84 WeakPolarHBondContact O-CG 3.34Å; Q80-K84 PolarHBondContact O-N 2.95Å; I81-K84 CarbonylContact O-C 3.57Å; I81-K84 WeakPolarHBondContact O-CA 3.38Å; I81-K84 PolarHBondContact O-N 2.96Å; K84-G86 VanDerWaalsContact C-N 3.32Å; K84-D87 PolarHBondContact O-N 3.02Å; K84-Y88 HydrophobicContact CB-CD2 4.48Å; K84-Y88 HydrophobicContact CB-CE2 4.49Å; K84-Y88 WeakPolarHBondContact O-CB 3.33Å; K84-Y88 WeakPolarHBondContact O-CD2 3.19Å; K84-Y88 PolarHBondContact O-N 3Å |
| 85 | D | 98.4 | Very high | 98.4 | Very high | 92 Ų | 92 | 99 Ų | 99 | 49% | 0.492 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67 | -36.7 | 177.3 | -65.7 | -11.7 | 0 | 0 | 0 | 110.7 | I81 Q83 Y88 S89 | I81-D85 WeakPolarHBondContact CG2-OD2 3.49Å; I81-D85 PolarHBondContact O-N 2.95Å; Q83-D85 VanDerWaalsContact C-N 3.35Å; Q83-D85 PolarHBondContact O-N 3.41Å; D85-Y88 PolarHBondContact O-N 3.32Å; D85-S89 WeakPolarHBondContact O-CB 3.49Å; D85-S89 PolarHBondContact O-N 3.25Å |
| 86 | G | 98.6 | Very high | 98.4 | Very high | 39 Ų | 39 | 101.8 Ų | 101.8 | 40% | 0.402 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 168.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | D82 Q83 K84 S89 M90 | D82-G86 PolarHBondContact O-N 3.46Å; Q83-G86 PolarHBondContact O-N 2.94Å; K84-G86 VanDerWaalsContact C-N 3.32Å; G86-S89 PolarHBondContact O-N 3.03Å; G86-M90 WeakPolarHBondContact O-CB 3.45Å; G86-M90 PolarHBondContact O-N 3.12Å |
| 87 | D | 98.3 | Very high | 98.4 | Very high | 59 Ų | 59 | 101.9 Ų | 101.9 | 32% | 0.316 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63 | -41.9 | 175.4 | -65.5 | -23.1 | 0 | 0 | 0 | 111.4 | Q83 K84 M90 L91 | Q83-D87 PolarHBondContact NE2-OD1 3.29Å; Q83-D87 VanDerWaalsContact O-CG 3.26Å; Q83-D87 PolarHBondContact O-N 3.09Å; K84-D87 PolarHBondContact O-N 3.02Å; D87-M90 PolarHBondContact O-N 3.38Å; D87-L91 WeakPolarHBondContact O-CB 3.46Å; D87-L91 PolarHBondContact O-N 3.37Å |
| 88 | Y | 98.5 | Very high | 98.4 | Very high | 155 Ų | 155 | 105.6 Ų | 105.6 | 61% | 0.608 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.8 | -47.5 | 176.5 | -82.4 | -59 | 0 | 0 | 0 | 111.7 | K84 D85 M90 L91 E92 | K84-Y88 HydrophobicContact CB-CD2 4.48Å; K84-Y88 HydrophobicContact CB-CE2 4.49Å; K84-Y88 WeakPolarHBondContact O-CB 3.33Å; K84-Y88 WeakPolarHBondContact O-CD2 3.19Å; K84-Y88 PolarHBondContact O-N 3Å; D85-Y88 PolarHBondContact O-N 3.32Å; Y88-M90 VanDerWaalsContact C-N 3.28Å; Y88-M90 PolarHBondContact O-N 2.88Å; Y88-L91 CarbonylContact O-C 3.59Å; Y88-L91 PolarHBondContact O-N 3.42Å; Y88-E92 WeakPolarHBondContact O-CB 3.47Å; Y88-E92 PolarHBondContact O-N 2.89Å |
| 89 | S | 98.5 | Very high | 98.4 | Very high | 73 Ų | 73 | 105.9 Ų | 105.9 | 51% | 0.51 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.7 | -36.1 | 177.2 | -173.9 | 0 | 0 | 0 | 0 | 112 | D85 G86 G93 | D85-S89 WeakPolarHBondContact O-CB 3.49Å; D85-S89 PolarHBondContact O-N 3.25Å; G86-S89 PolarHBondContact O-N 3.03Å; S89-G93 PolarHBondContact O-N 3.02Å |
| 90 | M | 98.4 | Very high | 98.4 | Very high | 99 Ų | 99 | 100.9 Ų | 100.9 | 49% | 0.488 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.7 | -37.8 | 172.3 | -167.6 | -139.6 | -55.2 | 0 | 0 | 112.3 | G86 D87 Y88 K94 | G86-M90 WeakPolarHBondContact O-CB 3.45Å; G86-M90 PolarHBondContact O-N 3.12Å; D87-M90 PolarHBondContact O-N 3.38Å; Y88-M90 VanDerWaalsContact C-N 3.28Å; Y88-M90 PolarHBondContact O-N 2.88Å; M90-K94 WeakPolarHBondContact O-CD 3.46Å; M90-K94 VanDerWaalsContact O-CG 3.28Å; M90-K94 WeakPolarHBondContact O-CG 3.28Å; M90-K94 PolarHBondContact O-N 3.24Å; M90-K94 VanDerWaalsContact O-N 3.15Å; M90-K94 PolarHBondContact SD-NZ 3.04Å |
| 91 | L | 98.4 | Very high | 98.4 | Very high | 108 Ų | 108 | 98.2 Ų | 98.2 | 57% | 0.565 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -72.5 | -39.4 | 177.4 | -175.7 | 61 | 0 | 0 | 0 | 111.9 | D87 Y88 K94 L95 | D87-L91 WeakPolarHBondContact O-CB 3.46Å; D87-L91 PolarHBondContact O-N 3.37Å; Y88-L91 CarbonylContact O-C 3.59Å; Y88-L91 PolarHBondContact O-N 3.42Å; L91-K94 WeakPolarHBondContact O-CB 3.48Å; L91-K94 PolarHBondContact O-N 3.34Å; L91-L95 WeakPolarHBondContact O-CB 3.37Å; L91-L95 PolarHBondContact O-N 3.38Å |
| 92 | E | 98.4 | Very high | 98.4 | Very high | 134 Ų | 134 | 99.1 Ų | 99.1 | 63% | 0.626 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -60.9 | -48.5 | 173.2 | -178.2 | 179.7 | -149.8 | 0 | 0 | 111.1 | Y88 K94 L95 Q96 | Y88-E92 WeakPolarHBondContact O-CB 3.47Å; Y88-E92 PolarHBondContact O-N 2.89Å; E92-K94 VanDerWaalsContact C-N 3.29Å; E92-K94 PolarHBondContact O-N 3.38Å; E92-L95 WeakPolarHBondContact O-CB 3.44Å; E92-L95 PolarHBondContact O-N 3.02Å; E92-L95 VanDerWaalsContact O-N 3.07Å; E92-Q96 WeakPolarHBondContact O-CB 3.49Å; E92-Q96 PolarHBondContact O-N 2.93Å |
| 93 | G | 98.5 | Very high | 98.4 | Very high | 36 Ų | 36 | 101.5 Ų | 101.5 | 37% | 0.371 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.8 | -35.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S89 A97 | S89-G93 PolarHBondContact O-N 3.02Å; G93-A97 VanDerWaalsContact O-CB 3.28Å; G93-A97 WeakPolarHBondContact O-CB 3.4Å; G93-A97 PolarHBondContact O-N 3.41Å |
| 94 | K | 98.5 | Very high | 98.4 | Very high | 119 Ų | 119 | 102.4 Ų | 102.4 | 52% | 0.517 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -68.4 | -39.3 | 172 | -75.8 | 167.1 | 178.4 | 172.8 | 0 | 112.2 | M90 L91 E92 A97 R98 | M90-K94 WeakPolarHBondContact O-CD 3.46Å; M90-K94 VanDerWaalsContact O-CG 3.28Å; M90-K94 WeakPolarHBondContact O-CG 3.28Å; M90-K94 PolarHBondContact O-N 3.24Å; M90-K94 VanDerWaalsContact O-N 3.15Å; M90-K94 PolarHBondContact SD-NZ 3.04Å; L91-K94 WeakPolarHBondContact O-CB 3.48Å; L91-K94 PolarHBondContact O-N 3.34Å; E92-K94 VanDerWaalsContact C-N 3.29Å; E92-K94 PolarHBondContact O-N 3.38Å; K94-A97 PolarHBondContact O-N 3.03Å; K94-R98 WeakPolarHBondContact O-CG 3.5Å; K94-R98 PolarHBondContact O-N 2.74Å |
| 95 | L | 98.4 | Very high | 98.4 | Very high | 118 Ų | 118 | 100.5 Ų | 100.5 | 62% | 0.618 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.1 | -49.5 | 177.2 | -177.3 | 60 | 0 | 0 | 0 | 110.6 | L91 E92 A97 R98 E99 | L91-L95 WeakPolarHBondContact O-CB 3.37Å; L91-L95 PolarHBondContact O-N 3.38Å; E92-L95 WeakPolarHBondContact O-CB 3.44Å; E92-L95 PolarHBondContact O-N 3.02Å; E92-L95 VanDerWaalsContact O-N 3.07Å; L95-A97 VanDerWaalsContact C-N 3.31Å; L95-A97 PolarHBondContact O-N 3.19Å; L95-R98 CarbonylContact O-C 3.58Å; L95-R98 WeakPolarHBondContact O-CA 3.21Å; L95-R98 WeakPolarHBondContact O-CB 3.46Å; L95-R98 PolarHBondContact O-N 3.47Å; L95-E99 WeakPolarHBondContact O-CB 3.27Å; L95-E99 PolarHBondContact O-N 3.44Å |
| 96 | Q | 98.4 | Very high | 98.4 | Very high | 139 Ų | 139 | 99.1 Ų | 99.1 | 65% | 0.65 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.5 | -39.2 | 176.3 | -168.2 | -176.2 | 46 | 0 | 0 | 111.9 | E92 E99 G100 | E92-Q96 WeakPolarHBondContact O-CB 3.49Å; E92-Q96 PolarHBondContact O-N 2.93Å; Q96-E99 PolarHBondContact O-N 2.88Å; Q96-G100 PolarHBondContact O-N 3.3Å |
| 97 | A | 98.4 | Very high | 98.4 | Very high | 67 Ų | 67 | 100.9 Ų | 100.9 | 55% | 0.554 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66 | -35.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | G93 K94 L95 A101 | G93-A97 VanDerWaalsContact O-CB 3.28Å; G93-A97 WeakPolarHBondContact O-CB 3.4Å; G93-A97 PolarHBondContact O-N 3.41Å; K94-A97 PolarHBondContact O-N 3.03Å; L95-A97 VanDerWaalsContact C-N 3.31Å; L95-A97 PolarHBondContact O-N 3.19Å; A97-A101 PolarHBondContact O-N 2.88Å |
| 98 | R | 98.4 | Very high | 98.4 | Very high | 185 Ų | 185 | 103.8 Ų | 103.8 | 70% | 0.698 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -70.1 | -45.1 | 173 | -76.2 | -65.5 | -168.5 | -167.7 | 2.7 | 111.8 | K94 L95 G100 A101 I102 | K94-R98 WeakPolarHBondContact O-CG 3.5Å; K94-R98 PolarHBondContact O-N 2.74Å; L95-R98 CarbonylContact O-C 3.58Å; L95-R98 WeakPolarHBondContact O-CA 3.21Å; L95-R98 WeakPolarHBondContact O-CB 3.46Å; L95-R98 PolarHBondContact O-N 3.47Å; R98-G100 PolarHBondContact O-N 3.37Å; R98-A101 WeakPolarHBondContact O-CB 3.35Å; R98-A101 PolarHBondContact O-N 3.48Å; R98-A101 VanDerWaalsContact O-N 3.11Å; R98-I102 VanDerWaalsContact O-CG1 3.29Å; R98-I102 WeakPolarHBondContact O-CG1 3.38Å; R98-I102 PolarHBondContact O-N 3.03Å |
| 99 | E | 98.4 | Very high | 98.4 | Very high | 129 Ų | 129 | 103.1 Ų | 103.1 | 60% | 0.603 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.7 | -46 | 176.5 | -173 | -177.5 | -174.4 | 0 | 0 | 111.4 | L95 Q96 A101 I102 K103 | L95-E99 WeakPolarHBondContact O-CB 3.27Å; L95-E99 PolarHBondContact O-N 3.44Å; Q96-E99 PolarHBondContact O-N 2.88Å; E99-A101 VanDerWaalsContact C-N 3.25Å; E99-A101 PolarHBondContact O-N 2.86Å; E99-I102 PolarHBondContact O-N 3.02Å; E99-K103 WeakPolarHBondContact O-CB 3.32Å; E99-K103 PolarHBondContact O-N 2.76Å |
| 100 | G | 98.4 | Very high | 98.4 | Very high | 35 Ų | 35 | 103.4 Ų | 103.4 | 36% | 0.361 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.8 | -27.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q96 R98 K104 | Q96-G100 PolarHBondContact O-N 3.3Å; R98-G100 PolarHBondContact O-N 3.37Å; G100-K104 WeakPolarHBondContact O-CG 3.43Å; G100-K104 PolarHBondContact O-N 3.37Å |
| 101 | A | 98.4 | Very high | 98.4 | Very high | 51 Ų | 51 | 104.9 Ų | 104.9 | 42% | 0.421 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -79.2 | -40.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A97 R98 E99 K103 K104 C105 | A97-A101 PolarHBondContact O-N 2.88Å; R98-A101 WeakPolarHBondContact O-CB 3.35Å; R98-A101 PolarHBondContact O-N 3.48Å; R98-A101 VanDerWaalsContact O-N 3.11Å; E99-A101 VanDerWaalsContact C-N 3.25Å; E99-A101 PolarHBondContact O-N 2.86Å; A101-K103 VanDerWaalsContact C-N 3.34Å; A101-K103 PolarHBondContact O-N 2.9Å; A101-K104 PolarHBondContact O-N 3.5Å; A101-C105 WeakPolarHBondContact O-CB 3.38Å; A101-C105 PolarHBondContact O-N 3.11Å |
| 102 | I | 98.4 | Very high | 98.4 | Very high | 117 Ų | 117 | 105.1 Ų | 105.1 | 60% | 0.6 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.7 | -43.9 | 174.9 | -70.6 | 162.7 | 0 | 0 | 0 | 110.2 | R98 E99 C105 S106 | R98-I102 VanDerWaalsContact O-CG1 3.29Å; R98-I102 WeakPolarHBondContact O-CG1 3.38Å; R98-I102 PolarHBondContact O-N 3.03Å; E99-I102 PolarHBondContact O-N 3.02Å; I102-C105 PolarHBondContact O-N 3.29Å; I102-S106 WeakPolarHBondContact O-CB 3.38Å; I102-S106 PolarHBondContact O-N 2.71Å |
| 103 | K | 98.5 | Very high | 98.4 | Very high | 140 Ų | 140 | 104.2 Ų | 104.2 | 61% | 0.609 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.4 | -49.4 | 176.8 | -175.5 | 166.2 | -176.8 | 169.3 | 0 | 112 | E99 A101 C105 S106 D107 | E99-K103 WeakPolarHBondContact O-CB 3.32Å; E99-K103 PolarHBondContact O-N 2.76Å; A101-K103 VanDerWaalsContact C-N 3.34Å; A101-K103 PolarHBondContact O-N 2.9Å; K103-C105 VanDerWaalsContact C-N 3.34Å; K103-C105 PolarHBondContact O-N 3.31Å; K103-S106 WeakPolarHBondContact O-CB 3.29Å; K103-S106 PolarHBondContact O-N 3.48Å; K103-S106 VanDerWaalsContact O-N 3.11Å; K103-D107 VanDerWaalsContact O-CG 3.22Å; K103-D107 PolarHBondContact O-N 3.45Å |
| 104 | K | 98.2 | Very high | 98.4 | Very high | 135 Ų | 135 | 106.3 Ų | 106.3 | 59% | 0.587 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -58.1 | -44.6 | 175.6 | -71.6 | 171.2 | -177.8 | -179.9 | 0 | 112.4 | G100 A101 S106 D107 E108 | G100-K104 WeakPolarHBondContact O-CG 3.43Å; G100-K104 PolarHBondContact O-N 3.37Å; A101-K104 PolarHBondContact O-N 3.5Å; K104-S106 VanDerWaalsContact C-N 3.29Å; K104-S106 PolarHBondContact O-N 3.26Å; K104-D107 PolarHBondContact O-N 2.97Å; K104-E108 WeakPolarHBondContact O-CB 3.29Å; K104-E108 VanDerWaalsContact O-CG 3.29Å; K104-E108 WeakPolarHBondContact O-CG 3.42Å; K104-E108 PolarHBondContact O-N 3.39Å |
| 105 | C | 98 | Very high | 98.4 | Very high | 80 Ų | 80 | 104.9 Ų | 104.9 | 54% | 0.541 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.2 | -35.8 | 176.8 | -174.9 | 0 | 0 | 0 | 0 | 112.1 | A101 I102 K103 K109 | A101-C105 WeakPolarHBondContact O-CB 3.38Å; A101-C105 PolarHBondContact O-N 3.11Å; I102-C105 PolarHBondContact O-N 3.29Å; K103-C105 VanDerWaalsContact C-N 3.34Å; K103-C105 PolarHBondContact O-N 3.31Å; C105-K109 VanDerWaalsContact O-CB 3.29Å; C105-K109 WeakPolarHBondContact O-CB 3.25Å; C105-K109 PolarHBondContact O-N 3.22Å |
| 106 | S | 98.4 | Very high | 98.5 | Very high | 64 Ų | 64 | 103.1 Ų | 103.1 | 45% | 0.448 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.5 | -47 | 172.5 | -161 | 0 | 0 | 0 | 0 | 111.8 | I102 K103 K104 E108 K109 V110 | I102-S106 WeakPolarHBondContact O-CB 3.38Å; I102-S106 PolarHBondContact O-N 2.71Å; K103-S106 WeakPolarHBondContact O-CB 3.29Å; K103-S106 PolarHBondContact O-N 3.48Å; K103-S106 VanDerWaalsContact O-N 3.11Å; K104-S106 VanDerWaalsContact C-N 3.29Å; K104-S106 PolarHBondContact O-N 3.26Å; S106-E108 VanDerWaalsContact C-N 3.29Å; S106-E108 PolarHBondContact O-N 2.88Å; S106-K109 WeakPolarHBondContact O-CB 3.41Å; S106-K109 PolarHBondContact O-N 2.87Å; S106-V110 WeakPolarHBondContact O-CG2 3.29Å; S106-V110 PolarHBondContact O-N 3.14Å |
| 107 | D | 98.5 | Very high | 98.5 | Very high | 75 Ų | 75 | 100.5 Ų | 100.5 | 40% | 0.401 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.1 | -37.7 | 176.9 | -61 | -26.6 | 0 | 0 | 0 | 111.6 | K103 K104 K111 | K103-D107 VanDerWaalsContact O-CG 3.22Å; K103-D107 PolarHBondContact O-N 3.45Å; K104-D107 PolarHBondContact O-N 2.97Å; D107-K111 WeakPolarHBondContact O-CD 3.41Å; D107-K111 VanDerWaalsContact O-CG 3.27Å; D107-K111 WeakPolarHBondContact O-CG 3.27Å; D107-K111 PolarHBondContact O-N 2.88Å |
| 108 | E | 98.5 | Very high | 98.5 | Very high | 120 Ų | 120 | 101 Ų | 101 | 56% | 0.561 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -70.2 | -41.6 | 174.5 | -74.3 | 164.3 | -167.6 | 0 | 0 | 112.1 | K104 S106 V110 K111 L112 | K104-E108 WeakPolarHBondContact O-CB 3.29Å; K104-E108 VanDerWaalsContact O-CG 3.29Å; K104-E108 WeakPolarHBondContact O-CG 3.42Å; K104-E108 PolarHBondContact O-N 3.39Å; S106-E108 VanDerWaalsContact C-N 3.29Å; S106-E108 PolarHBondContact O-N 2.88Å; E108-V110 PolarHBondContact O-N 3.23Å; E108-K111 PolarHBondContact O-N 2.99Å; E108-L112 WeakPolarHBondContact O-CB 3.25Å; E108-L112 PolarHBondContact O-N 3.5Å |
| 109 | K | 98.5 | Very high | 98.5 | Very high | 141 Ų | 141 | 98.6 Ų | 98.6 | 61% | 0.613 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -59.6 | -44.6 | 173.7 | 178.1 | -174.6 | 172.9 | -173.4 | 0 | 111.6 | C105 S106 L112 Q113 | C105-K109 VanDerWaalsContact O-CB 3.29Å; C105-K109 WeakPolarHBondContact O-CB 3.25Å; C105-K109 PolarHBondContact O-N 3.22Å; S106-K109 WeakPolarHBondContact O-CB 3.41Å; S106-K109 PolarHBondContact O-N 2.87Å; K109-L112 PolarHBondContact O-N 2.76Å; K109-Q113 VanDerWaalsContact O-CB 3.25Å; K109-Q113 WeakPolarHBondContact O-CB 3.49Å; K109-Q113 PolarHBondContact O-N 2.93Å |
| 110 | V | 98.6 | Very high | 98.5 | Very high | 80 Ų | 80 | 98 Ų | 98 | 49% | 0.485 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.1 | -39.4 | 179.6 | 172 | 0 | 0 | 0 | 0 | 111.4 | S106 E108 Q113 T114 | S106-V110 WeakPolarHBondContact O-CG2 3.29Å; S106-V110 PolarHBondContact O-N 3.14Å; E108-V110 PolarHBondContact O-N 3.23Å; V110-Q113 PolarHBondContact O-N 3.49Å; V110-T114 PolarHBondContact O-N 3.49Å; V110-T114 PolarHBondContact O-OG1 3.42Å |
| 111 | K | 98.6 | Very high | 98.5 | Very high | 130 Ų | 130 | 98.8 Ų | 98.8 | 57% | 0.565 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61 | -53.2 | 172.6 | -70.8 | 163.8 | -168.7 | 167.3 | 0 | 111.3 | D107 E108 Q113 T114 D115 | D107-K111 WeakPolarHBondContact O-CD 3.41Å; D107-K111 VanDerWaalsContact O-CG 3.27Å; D107-K111 WeakPolarHBondContact O-CG 3.27Å; D107-K111 PolarHBondContact O-N 2.88Å; E108-K111 PolarHBondContact O-N 2.99Å; K111-Q113 VanDerWaalsContact C-N 3.29Å; K111-Q113 PolarHBondContact O-N 2.99Å; K111-T114 CarbonylContact O-C 3.57Å; K111-T114 WeakPolarHBondContact O-CA 3.42Å; K111-T114 VanDerWaalsContact O-CB 3.29Å; K111-T114 WeakPolarHBondContact O-CB 3.48Å; K111-T114 PolarHBondContact O-N 2.85Å; K111-D115 PolarHBondContact O-N 2.96Å |
| 112 | L | 98.6 | Very high | 98.5 | Very high | 112 Ų | 112 | 100.1 Ų | 100.1 | 59% | 0.586 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.8 | -36.6 | -179.8 | -175.8 | 62.2 | 0 | 0 | 0 | 112.3 | E108 K109 T114 D115 V116 | E108-L112 WeakPolarHBondContact O-CB 3.25Å; E108-L112 PolarHBondContact O-N 3.5Å; K109-L112 PolarHBondContact O-N 2.76Å; L112-T114 VanDerWaalsContact C-N 3.35Å; L112-D115 PolarHBondContact O-N 3.39Å; L112-V116 HydrophobicContact CD1-CG2 4.49Å; L112-V116 WeakPolarHBondContact O-CB 3.47Å; L112-V116 VanDerWaalsContact O-CG2 3.25Å; L112-V116 WeakPolarHBondContact O-CG2 3.34Å; L112-V116 PolarHBondContact O-N 3.16Å |
| 113 | Q | 98.5 | Very high | 98.5 | Very high | 116 Ų | 116 | 97.7 Ų | 97.7 | 54% | 0.542 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.4 | -42.2 | 172.4 | -177.9 | 174.2 | -4.2 | 0 | 0 | 111.5 | K109 V110 K111 V116 T117 | K109-Q113 VanDerWaalsContact O-CB 3.25Å; K109-Q113 WeakPolarHBondContact O-CB 3.49Å; K109-Q113 PolarHBondContact O-N 2.93Å; V110-Q113 PolarHBondContact O-N 3.49Å; K111-Q113 VanDerWaalsContact C-N 3.29Å; K111-Q113 PolarHBondContact O-N 2.99Å; Q113-V116 PolarHBondContact O-N 2.97Å; Q113-T117 WeakPolarHBondContact O-CG2 3.43Å; Q113-T117 PolarHBondContact O-N 3.31Å; Q113-T117 PolarHBondContact O-OG1 2.88Å |
| 114 | T | 98.6 | Very high | 98.5 | Very high | 79 Ų | 79 | 95.5 Ų | 95.5 | 49% | 0.485 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.3 | -49.1 | 175.1 | -52.6 | 0 | 0 | 0 | 0 | 110.7 | V110 K111 L112 V116 T117 S118 | V110-T114 PolarHBondContact O-N 3.49Å; V110-T114 PolarHBondContact O-OG1 3.42Å; K111-T114 CarbonylContact O-C 3.57Å; K111-T114 WeakPolarHBondContact O-CA 3.42Å; K111-T114 VanDerWaalsContact O-CB 3.29Å; K111-T114 WeakPolarHBondContact O-CB 3.48Å; K111-T114 PolarHBondContact O-N 2.85Å; L112-T114 VanDerWaalsContact C-N 3.35Å; T114-V116 VanDerWaalsContact C-N 3.34Å; T114-V116 PolarHBondContact O-N 2.89Å; T114-T117 PolarHBondContact O-N 3.43Å; T114-T117 VanDerWaalsContact O-N 3.16Å; T114-T117 PolarHBondContact O-OG1 3.37Å; T114-S118 PolarHBondContact O-N 2.87Å |
| 115 | D | 98.6 | Very high | 98.5 | Very high | 89 Ų | 89 | 93.7 Ų | 93.7 | 48% | 0.476 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.1 | -42.7 | 177.8 | -65.5 | -31 | 0 | 0 | 0 | 111.9 | K111 L112 S118 Q119 | K111-D115 PolarHBondContact O-N 2.96Å; L112-D115 PolarHBondContact O-N 3.39Å; D115-S118 PolarHBondContact O-N 3.2Å; D115-Q119 WeakPolarHBondContact O-CG 3.48Å; D115-Q119 PolarHBondContact O-N 3.36Å |
| 116 | V | 98.6 | Very high | 98.6 | Very high | 82 Ų | 82 | 93.8 Ų | 93.8 | 50% | 0.497 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.8 | -42.9 | 175.4 | 166.9 | 0 | 0 | 0 | 0 | 111.5 | L112 Q113 T114 S118 Q119 M120 | L112-V116 HydrophobicContact CD1-CG2 4.49Å; L112-V116 WeakPolarHBondContact O-CB 3.47Å; L112-V116 VanDerWaalsContact O-CG2 3.25Å; L112-V116 WeakPolarHBondContact O-CG2 3.34Å; L112-V116 PolarHBondContact O-N 3.16Å; Q113-V116 PolarHBondContact O-N 2.97Å; T114-V116 VanDerWaalsContact C-N 3.34Å; T114-V116 PolarHBondContact O-N 2.89Å; V116-S118 VanDerWaalsContact C-N 3.34Å; V116-S118 PolarHBondContact O-N 3.25Å; V116-Q119 PolarHBondContact O-N 2.95Å; V116-M120 WeakPolarHBondContact O-CB 3.38Å; V116-M120 PolarHBondContact O-N 2.87Å |
| 117 | T | 98.6 | Very high | 98.6 | Very high | 83 Ų | 83 | 99 Ų | 99 | 51% | 0.509 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.3 | -36.8 | 175.3 | 55.5 | 0 | 0 | 0 | 0 | 112.5 | Q113 T114 M120 A121 | Q113-T117 WeakPolarHBondContact O-CG2 3.43Å; Q113-T117 PolarHBondContact O-N 3.31Å; Q113-T117 PolarHBondContact O-OG1 2.88Å; T114-T117 PolarHBondContact O-N 3.43Å; T114-T117 VanDerWaalsContact O-N 3.16Å; T114-T117 PolarHBondContact O-OG1 3.37Å; T117-M120 PolarHBondContact O-N 3.2Å; T117-A121 PolarHBondContact O-N 2.88Å |
| 118 | S | 98.7 | Very high | 98.6 | Very high | 78 Ų | 78 | 101.1 Ų | 101.1 | 55% | 0.545 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.8 | -45.3 | 174.5 | -171.2 | 0 | 0 | 0 | 0 | 111.8 | T114 D115 V116 M120 A121 E122 | T114-S118 PolarHBondContact O-N 2.87Å; D115-S118 PolarHBondContact O-N 3.2Å; V116-S118 VanDerWaalsContact C-N 3.34Å; V116-S118 PolarHBondContact O-N 3.25Å; S118-M120 VanDerWaalsContact C-N 3.33Å; S118-M120 PolarHBondContact O-N 2.87Å; S118-A121 PolarHBondContact O-N 3.29Å; S118-E122 PolarHBondContact O-N 3.41Å |
| 119 | Q | 98.6 | Very high | 98.6 | Very high | 134 Ų | 134 | 100 Ų | 100 | 63% | 0.626 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65 | -36.4 | 175.5 | -72.5 | -178.8 | 15.7 | 0 | 0 | 111.9 | D115 V116 E122 V123 | D115-Q119 WeakPolarHBondContact O-CG 3.48Å; D115-Q119 PolarHBondContact O-N 3.36Å; V116-Q119 PolarHBondContact O-N 2.95Å; Q119-E122 PolarHBondContact O-N 3.49Å; Q119-V123 WeakPolarHBondContact O-CB 3.46Å; Q119-V123 VanDerWaalsContact O-CG2 3.29Å; Q119-V123 WeakPolarHBondContact O-CG2 3.33Å; Q119-V123 PolarHBondContact O-N 3.2Å |
| 120 | M | 98.5 | Very high | 98.6 | Very high | 117 Ų | 117 | 97.6 Ų | 97.6 | 58% | 0.576 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65 | -41.3 | 176.8 | -175.9 | 168.3 | 176 | 0 | 0 | 112 | V116 T117 S118 V123 Q124 | V116-M120 WeakPolarHBondContact O-CB 3.38Å; V116-M120 PolarHBondContact O-N 2.87Å; T117-M120 PolarHBondContact O-N 3.2Å; S118-M120 VanDerWaalsContact C-N 3.33Å; S118-M120 PolarHBondContact O-N 2.87Å; M120-V123 PolarHBondContact O-N 3.46Å; M120-Q124 WeakPolarHBondContact O-CG 3.48Å; M120-Q124 PolarHBondContact O-N 2.8Å |
| 121 | A | 98.4 | Very high | 98.5 | Very high | 51 Ų | 51 | 98 Ų | 98 | 42% | 0.421 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65 | -42.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | T117 S118 V123 Q124 R125 | T117-A121 PolarHBondContact O-N 2.88Å; S118-A121 PolarHBondContact O-N 3.29Å; A121-V123 PolarHBondContact O-N 3.46Å; A121-Q124 WeakPolarHBondContact O-CB 3.28Å; A121-Q124 PolarHBondContact O-N 3.38Å; A121-R125 WeakPolarHBondContact O-CB 3.29Å; A121-R125 PolarHBondContact O-N 3.11Å |
| 122 | E | 98.6 | Very high | 98.5 | Very high | 79 Ų | 79 | 97.7 Ų | 97.7 | 37% | 0.369 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -38.6 | 175.7 | 177.8 | 60 | -170.6 | 0 | 0 | 112 | S118 Q119 Q124 R125 L126 | S118-E122 PolarHBondContact O-N 3.41Å; Q119-E122 PolarHBondContact O-N 3.49Å; E122-Q124 VanDerWaalsContact C-N 3.34Å; E122-Q124 PolarHBondContact O-N 2.84Å; E122-R125 VanDerWaalsContact CD-NH2 3.35Å; E122-R125 PolarHBondContact O-N 2.83Å; E122-R125 IonicContact OE1-CZ 3.17Å; E122-R125 IonicContact OE1-NE 2.71Å; E122-R125 IonicContact OE1-NH2 2.71Å; E122-R125 PolarHBondContact OE1-NH2 3.41Å; E122-R125 IonicContact OE2-CZ 2.74Å; E122-R125 IonicContact OE2-NE 2.71Å; E122-R125 PolarHBondContact OE2-NE 3.35Å; E122-R125 IonicContact OE2-NH2 3.26Å; E122-R125 PolarHBondContact OE2-NH2 3.29Å; E122-L126 HydrophobicContact CG-CD1 4.02Å; E122-L126 HydrophobicContact CG-CG 4.47Å; E122-L126 WeakPolarHBondContact O-CB 3.29Å; E122-L126 VanDerWaalsContact O-CG 3.27Å; E122-L126 WeakPolarHBondContact O-CG 3.47Å; E122-L126 PolarHBondContact O-N 3.15Å |
| 123 | V | 98.6 | Very high | 98.5 | Very high | 67 Ų | 67 | 98.3 Ų | 98.3 | 41% | 0.406 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66 | -33.6 | 173.8 | 166.8 | 0 | 0 | 0 | 0 | 112.2 | Q119 M120 A121 R127 | Q119-V123 WeakPolarHBondContact O-CB 3.46Å; Q119-V123 VanDerWaalsContact O-CG2 3.29Å; Q119-V123 WeakPolarHBondContact O-CG2 3.33Å; Q119-V123 PolarHBondContact O-N 3.2Å; M120-V123 PolarHBondContact O-N 3.46Å; A121-V123 PolarHBondContact O-N 3.46Å; V123-R127 WeakPolarHBondContact O-CB 3.41Å; V123-R127 WeakPolarHBondContact O-CD 3.45Å; V123-R127 WeakPolarHBondContact O-CG 3.4Å; V123-R127 PolarHBondContact O-N 2.83Å; V123-R127 VanDerWaalsContact O-N 3.12Å |
| 124 | Q | 98.6 | Very high | 98.5 | Very high | 94 Ų | 94 | 98.5 Ų | 98.5 | 44% | 0.439 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.2 | -52 | 171.6 | -72.6 | 168.2 | -6.5 | 0 | 0 | 110.6 | M120 A121 E122 L126 R127 E128 | M120-Q124 WeakPolarHBondContact O-CG 3.48Å; M120-Q124 PolarHBondContact O-N 2.8Å; A121-Q124 WeakPolarHBondContact O-CB 3.28Å; A121-Q124 PolarHBondContact O-N 3.38Å; E122-Q124 VanDerWaalsContact C-N 3.34Å; E122-Q124 PolarHBondContact O-N 2.84Å; Q124-L126 VanDerWaalsContact C-N 3.31Å; Q124-L126 PolarHBondContact O-N 3.5Å; Q124-R127 WeakPolarHBondContact O-CA 3.47Å; Q124-R127 WeakPolarHBondContact O-CB 3.44Å; Q124-R127 PolarHBondContact O-N 3.11Å; Q124-E128 WeakPolarHBondContact O-CG 3.38Å; Q124-E128 PolarHBondContact O-N 3.06Å |
| 125 | R | 98.6 | Very high | 98.5 | Very high | 97 Ų | 97 | 101.3 Ų | 101.3 | 37% | 0.366 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -55.7 | -41.5 | 177.7 | -163.2 | -166 | 66.6 | 65.6 | 6.8 | 112.9 | A121 E122 E128 Q129 | A121-R125 WeakPolarHBondContact O-CB 3.29Å; A121-R125 PolarHBondContact O-N 3.11Å; E122-R125 VanDerWaalsContact CD-NH2 3.35Å; E122-R125 PolarHBondContact O-N 2.83Å; E122-R125 IonicContact OE1-CZ 3.17Å; E122-R125 IonicContact OE1-NE 2.71Å; E122-R125 IonicContact OE1-NH2 2.71Å; E122-R125 PolarHBondContact OE1-NH2 3.41Å; E122-R125 IonicContact OE2-CZ 2.74Å; E122-R125 IonicContact OE2-NE 2.71Å; E122-R125 PolarHBondContact OE2-NE 3.35Å; E122-R125 IonicContact OE2-NH2 3.26Å; E122-R125 PolarHBondContact OE2-NH2 3.29Å; R125-E128 PolarHBondContact O-N 3.38Å; R125-Q129 WeakPolarHBondContact O-CG 3.42Å; R125-Q129 PolarHBondContact O-N 2.99Å; R125-Q129 VanDerWaalsContact O-N 3.09Å |
| 126 | L | 98.6 | Very high | 98.5 | Very high | 82 Ų | 82 | 100.4 Ų | 100.4 | 43% | 0.429 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -70.6 | -32.2 | 176.2 | -72.1 | 170.9 | 0 | 0 | 0 | 112.9 | E122 Q124 L130 | E122-L126 HydrophobicContact CG-CD1 4.02Å; E122-L126 HydrophobicContact CG-CG 4.47Å; E122-L126 WeakPolarHBondContact O-CB 3.29Å; E122-L126 VanDerWaalsContact O-CG 3.27Å; E122-L126 WeakPolarHBondContact O-CG 3.47Å; E122-L126 PolarHBondContact O-N 3.15Å; Q124-L126 VanDerWaalsContact C-N 3.31Å; Q124-L126 PolarHBondContact O-N 3.5Å; L126-L130 WeakPolarHBondContact O-CB 3.28Å; L126-L130 PolarHBondContact O-N 3.07Å |
| 127 | R | 98.4 | Very high | 98.4 | Very high | 172 Ų | 172 | 102.8 Ų | 102.8 | 65% | 0.649 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -68.5 | -40.6 | 172.6 | -77.2 | 168.6 | 177 | 179.8 | 0.2 | 111.6 | V123 Q124 L130 T131 | V123-R127 WeakPolarHBondContact O-CB 3.41Å; V123-R127 WeakPolarHBondContact O-CD 3.45Å; V123-R127 WeakPolarHBondContact O-CG 3.4Å; V123-R127 PolarHBondContact O-N 2.83Å; V123-R127 VanDerWaalsContact O-N 3.12Å; Q124-R127 WeakPolarHBondContact O-CA 3.47Å; Q124-R127 WeakPolarHBondContact O-CB 3.44Å; Q124-R127 PolarHBondContact O-N 3.11Å; R127-L130 WeakPolarHBondContact O-CB 3.32Å; R127-L130 PolarHBondContact O-N 2.89Å; R127-T131 PolarHBondContact O-N 3.21Å; R127-T131 PolarHBondContact O-OG1 2.83Å |
| 128 | E | 98.4 | Very high | 98.4 | Very high | 121 Ų | 121 | 104 Ų | 104 | 57% | 0.565 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.3 | -50.9 | 175.4 | -70.9 | 162.8 | -174.3 | 0 | 0 | 111 | Q124 R125 L130 T131 E132 | Q124-E128 WeakPolarHBondContact O-CG 3.38Å; Q124-E128 PolarHBondContact O-N 3.06Å; R125-E128 PolarHBondContact O-N 3.38Å; E128-L130 VanDerWaalsContact C-N 3.28Å; E128-L130 PolarHBondContact O-N 2.99Å; E128-T131 WeakPolarHBondContact CA-OG1 3.28Å; E128-T131 PolarHBondContact O-N 3.33Å; E128-T131 PolarHBondContact O-OG1 3.28Å; E128-E132 PolarHBondContact O-N 2.95Å |
| 129 | Q | 98.5 | Very high | 98.4 | Very high | 95 Ų | 95 | 104.9 Ų | 104.9 | 44% | 0.444 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.1 | -37.1 | 174.2 | -71.9 | -169.3 | -50.6 | 0 | 0 | 112.9 | R125 T131 L133 | R125-Q129 WeakPolarHBondContact O-CG 3.42Å; R125-Q129 PolarHBondContact O-N 2.99Å; R125-Q129 VanDerWaalsContact O-N 3.09Å; Q129-T131 VanDerWaalsContact C-N 3.34Å; Q129-L133 VanDerWaalsContact O-CB 3.28Å; Q129-L133 WeakPolarHBondContact O-CB 3.37Å; Q129-L133 PolarHBondContact O-N 2.81Å |
| 130 | L | 98.5 | Very high | 98.4 | Very high | 92 Ų | 92 | 104 Ų | 104 | 48% | 0.482 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.4 | -32.2 | 175 | -177.6 | 63.1 | 0 | 0 | 0 | 112.4 | L126 R127 E128 K134 | L126-L130 WeakPolarHBondContact O-CB 3.28Å; L126-L130 PolarHBondContact O-N 3.07Å; R127-L130 WeakPolarHBondContact O-CB 3.32Å; R127-L130 PolarHBondContact O-N 2.89Å; E128-L130 VanDerWaalsContact C-N 3.28Å; E128-L130 PolarHBondContact O-N 2.99Å; L130-K134 HydrophobicContact CG-CD 4.49Å; L130-K134 WeakPolarHBondContact O-CB 3.1Å; L130-K134 WeakPolarHBondContact O-CD 3.38Å; L130-K134 WeakPolarHBondContact O-CG 3.44Å; L130-K134 PolarHBondContact O-N 3.24Å |
| 131 | T | 98.3 | Very high | 98.3 | Very high | 87 Ų | 87 | 102 Ų | 102 | 53% | 0.534 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -75.2 | -41 | 173.7 | 45.8 | 0 | 0 | 0 | 0 | 112.8 | R127 E128 Q129 K134 Q135 | R127-T131 PolarHBondContact O-N 3.21Å; R127-T131 PolarHBondContact O-OG1 2.83Å; E128-T131 WeakPolarHBondContact CA-OG1 3.28Å; E128-T131 PolarHBondContact O-N 3.33Å; E128-T131 PolarHBondContact O-OG1 3.28Å; Q129-T131 VanDerWaalsContact C-N 3.34Å; T131-K134 PolarHBondContact O-N 3.5Å; T131-Q135 PolarHBondContact O-N 3.03Å |
| 132 | E | 98.3 | Very high | 98.3 | Very high | 125 Ų | 125 | 105.1 Ų | 105.1 | 58% | 0.584 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.6 | -48.6 | 174.9 | -177.6 | -179.4 | -153.7 | 0 | 0 | 111.2 | E128 K134 Q135 E136 | E128-E132 PolarHBondContact O-N 2.95Å; E132-K134 VanDerWaalsContact C-N 3.3Å; E132-K134 PolarHBondContact O-N 2.79Å; E132-Q135 WeakPolarHBondContact O-CB 3.18Å; E132-Q135 PolarHBondContact O-N 3.06Å; E132-E136 PolarHBondContact O-N 3Å |
| 133 | L | 98.4 | Very high | 98.3 | Very high | 124 Ų | 124 | 107 Ų | 107 | 65% | 0.649 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.2 | -35.1 | 178.9 | -175.2 | 61.4 | 0 | 0 | 0 | 112.5 | Q129 F137 | Q129-L133 VanDerWaalsContact O-CB 3.28Å; Q129-L133 WeakPolarHBondContact O-CB 3.37Å; Q129-L133 PolarHBondContact O-N 2.81Å; L133-F137 WeakPolarHBondContact O-CB 3.47Å; L133-F137 PolarHBondContact O-N 3.47Å |
| 134 | K | 97.9 | Very high | 98.3 | Very high | 120 Ų | 120 | 109.7 Ų | 109.7 | 52% | 0.522 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66 | -40.2 | 172 | -77.2 | 169.3 | -177.2 | 174.8 | 0 | 111.9 | L130 T131 E132 F137 M138 | L130-K134 HydrophobicContact CG-CD 4.49Å; L130-K134 WeakPolarHBondContact O-CB 3.1Å; L130-K134 WeakPolarHBondContact O-CD 3.38Å; L130-K134 WeakPolarHBondContact O-CG 3.44Å; L130-K134 PolarHBondContact O-N 3.24Å; T131-K134 PolarHBondContact O-N 3.5Å; E132-K134 VanDerWaalsContact C-N 3.3Å; E132-K134 PolarHBondContact O-N 2.79Å; K134-F137 PolarHBondContact O-N 3.49Å; K134-M138 WeakPolarHBondContact O-CG 3.45Å; K134-M138 PolarHBondContact O-N 3.15Å |
| 135 | Q | 98.5 | Very high | 98.2 | Very high | 138 Ų | 138 | 109.8 Ų | 109.8 | 65% | 0.645 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.6 | -45.3 | 177.9 | -177.5 | 174.9 | -10.1 | 0 | 0 | 111.5 | T131 E132 F137 M138 K139 | T131-Q135 PolarHBondContact O-N 3.03Å; E132-Q135 WeakPolarHBondContact O-CB 3.18Å; E132-Q135 PolarHBondContact O-N 3.06Å; Q135-F137 VanDerWaalsContact C-N 3.35Å; Q135-F137 PolarHBondContact O-N 2.95Å; Q135-M138 PolarHBondContact O-N 3.37Å; Q135-K139 WeakPolarHBondContact O-CB 3.46Å; Q135-K139 PolarHBondContact O-N 3.44Å; Q135-K139 VanDerWaalsContact O-N 3.11Å |
| 136 | E | 98.2 | Very high | 98.2 | Very high | 71 Ų | 71 | 109 Ų | 109 | 33% | 0.332 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.8 | -35.2 | 174.7 | -73.2 | -61.2 | 126.3 | 0 | 0 | 112.3 | E132 K139 Q140 | E132-E136 PolarHBondContact O-N 3Å; E136-K139 PolarHBondContact O-N 3.18Å; E136-K139 VanDerWaalsContact OE1-CD 3.32Å; E136-K139 WeakPolarHBondContact OE1-CD 3.46Å; E136-K139 IonicContact OE1-NZ 3.37Å; E136-K139 PolarHBondContact OE1-NZ 3.18Å; E136-K139 WeakPolarHBondContact OE2-CD 3.49Å; E136-K139 IonicContact OE2-NZ 2.66Å; E136-K139 PolarHBondContact OE2-NZ 3Å; E136-Q140 WeakPolarHBondContact O-CB 3.4Å; E136-Q140 WeakPolarHBondContact O-CG 3.39Å; E136-Q140 PolarHBondContact O-N 2.81Å |
| 137 | F | 98.1 | Very high | 98.2 | Very high | 131 Ų | 131 | 109.7 Ų | 109.7 | 58% | 0.575 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.8 | -47.9 | 172.5 | -178 | -90.6 | 0 | 0 | 0 | 112.3 | L133 K134 Q135 K139 Q140 E141 | L133-F137 WeakPolarHBondContact O-CB 3.47Å; L133-F137 PolarHBondContact O-N 3.47Å; K134-F137 PolarHBondContact O-N 3.49Å; Q135-F137 VanDerWaalsContact C-N 3.35Å; Q135-F137 PolarHBondContact O-N 2.95Å; F137-K139 VanDerWaalsContact C-N 3.26Å; F137-K139 PolarHBondContact O-N 2.95Å; F137-Q140 PolarHBondContact O-N 2.82Å; F137-E141 PolarHBondContact O-N 2.9Å |
| 138 | M | 98 | Very high | 98.1 | Very high | 109 Ų | 109 | 108.6 Ų | 108.6 | 54% | 0.537 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -58.9 | -38.5 | 177.4 | -71.8 | -63.5 | -62.2 | 0 | 0 | 112.3 | K134 Q135 E141 E142 | K134-M138 WeakPolarHBondContact O-CG 3.45Å; K134-M138 PolarHBondContact O-N 3.15Å; Q135-M138 PolarHBondContact O-N 3.37Å; M138-E141 PolarHBondContact O-N 3.07Å; M138-E142 PolarHBondContact O-N 2.95Å |
| 139 | K | 98.3 | Very high | 98.1 | Very high | 97 Ų | 97 | 108.4 Ų | 108.4 | 42% | 0.422 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -69.2 | -40 | 176.5 | 175.9 | -174.4 | 168.4 | -153.2 | 0 | 112.3 | Q135 E136 F137 E142 Q143 | Q135-K139 WeakPolarHBondContact O-CB 3.46Å; Q135-K139 PolarHBondContact O-N 3.44Å; Q135-K139 VanDerWaalsContact O-N 3.11Å; E136-K139 PolarHBondContact O-N 3.18Å; E136-K139 VanDerWaalsContact OE1-CD 3.32Å; E136-K139 WeakPolarHBondContact OE1-CD 3.46Å; E136-K139 IonicContact OE1-NZ 3.37Å; E136-K139 PolarHBondContact OE1-NZ 3.18Å; E136-K139 WeakPolarHBondContact OE2-CD 3.49Å; E136-K139 IonicContact OE2-NZ 2.66Å; E136-K139 PolarHBondContact OE2-NZ 3Å; F137-K139 VanDerWaalsContact C-N 3.26Å; F137-K139 PolarHBondContact O-N 2.95Å; K139-E142 PolarHBondContact O-N 3.03Å; K139-Q143 WeakPolarHBondContact O-CG 3.3Å; K139-Q143 PolarHBondContact O-N 3.14Å |
| 140 | Q | 98.1 | Very high | 98.1 | Very high | 116 Ų | 116 | 108.3 Ų | 108.3 | 54% | 0.542 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.9 | -40.4 | 171.9 | -74.2 | 178 | 8.9 | 0 | 0 | 112 | E136 F137 E142 Q143 L144 | E136-Q140 WeakPolarHBondContact O-CB 3.4Å; E136-Q140 WeakPolarHBondContact O-CG 3.39Å; E136-Q140 PolarHBondContact O-N 2.81Å; F137-Q140 PolarHBondContact O-N 2.82Å; Q140-E142 VanDerWaalsContact C-N 3.31Å; Q140-E142 PolarHBondContact O-N 2.88Å; Q140-Q143 PolarHBondContact O-N 3.03Å; Q140-L144 WeakPolarHBondContact O-CB 3.48Å; Q140-L144 PolarHBondContact O-N 2.86Å |
| 141 | E | 98 | Very high | 98 | Very high | 73 Ų | 73 | 107.3 Ų | 107.3 | 34% | 0.341 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.2 | -38.3 | 175.7 | -161.2 | -144.3 | 102.4 | 0 | 0 | 111.5 | F137 M138 L144 R145 | F137-E141 PolarHBondContact O-N 2.9Å; M138-E141 PolarHBondContact O-N 3.07Å; E141-L144 PolarHBondContact O-N 3.37Å; E141-R145 WeakPolarHBondContact O-CB 3.5Å; E141-R145 WeakPolarHBondContact O-CG 3.39Å; E141-R145 PolarHBondContact O-N 2.82Å; E141-R145 IonicContact OE1-CZ 3.69Å; E141-R145 IonicContact OE1-NE 3.58Å; E141-R145 PolarHBondContact OE1-NE 2.88Å; E141-R145 IonicContact OE1-NH2 2.73Å; E141-R145 PolarHBondContact OE1-NH2 3.27Å |
| 142 | E | 98.1 | Very high | 98 | Very high | 118 Ų | 118 | 105.8 Ų | 105.8 | 55% | 0.551 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.8 | -45.6 | 172.7 | 178.3 | 151.5 | -99.1 | 0 | 0 | 113.2 | M138 K139 Q140 L144 R145 E146 | M138-E142 PolarHBondContact O-N 2.95Å; K139-E142 PolarHBondContact O-N 3.03Å; Q140-E142 VanDerWaalsContact C-N 3.31Å; Q140-E142 PolarHBondContact O-N 2.88Å; E142-L144 VanDerWaalsContact C-N 3.29Å; E142-L144 PolarHBondContact O-N 3.21Å; E142-R145 WeakPolarHBondContact O-CB 3.28Å; E142-R145 PolarHBondContact O-N 3.27Å; E142-R145 IonicContact OE1-NH1 3.75Å; E142-R145 PolarHBondContact OE1-NH1 2.96Å; E142-E146 WeakPolarHBondContact O-CB 3.36Å; E142-E146 PolarHBondContact O-N 3.5Å |
| 143 | Q | 98.1 | Very high | 98 | Very high | 119 Ų | 119 | 101.8 Ų | 101.8 | 56% | 0.556 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -58.6 | -42.2 | 173.3 | -72.9 | 176.5 | -3 | 0 | 0 | 111.5 | K139 Q140 E146 V147 | K139-Q143 WeakPolarHBondContact O-CG 3.3Å; K139-Q143 PolarHBondContact O-N 3.14Å; Q140-Q143 PolarHBondContact O-N 3.03Å; Q143-E146 PolarHBondContact O-N 3.27Å; Q143-V147 WeakPolarHBondContact O-CG2 3.45Å; Q143-V147 PolarHBondContact O-N 2.88Å |
| 144 | L | 98.1 | Very high | 97.9 | Very high | 122 Ų | 122 | 101.3 Ų | 101.3 | 64% | 0.639 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -65.2 | -42.2 | 176.6 | -177.3 | 62.6 | 0 | 0 | 0 | 112.1 | Q140 E141 E142 E146 K148 | Q140-L144 WeakPolarHBondContact O-CB 3.48Å; Q140-L144 PolarHBondContact O-N 2.86Å; E141-L144 PolarHBondContact O-N 3.37Å; E142-L144 VanDerWaalsContact C-N 3.29Å; E142-L144 PolarHBondContact O-N 3.21Å; L144-E146 VanDerWaalsContact C-N 3.31Å; L144-E146 PolarHBondContact O-N 2.91Å; L144-K148 WeakPolarHBondContact O-CB 3.25Å; L144-K148 PolarHBondContact O-N 3.45Å |
| 145 | R | 97.8 | Very high | 97.9 | Very high | 97 Ų | 97 | 101 Ų | 101 | 37% | 0.366 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.5 | -44.1 | 171.7 | -82.8 | -174.6 | -97 | 111.7 | -4.6 | 111.1 | E141 E142 K148 K149 | E141-R145 WeakPolarHBondContact O-CB 3.5Å; E141-R145 WeakPolarHBondContact O-CG 3.39Å; E141-R145 PolarHBondContact O-N 2.82Å; E141-R145 IonicContact OE1-CZ 3.69Å; E141-R145 IonicContact OE1-NE 3.58Å; E141-R145 PolarHBondContact OE1-NE 2.88Å; E141-R145 IonicContact OE1-NH2 2.73Å; E141-R145 PolarHBondContact OE1-NH2 3.27Å; E142-R145 WeakPolarHBondContact O-CB 3.28Å; E142-R145 PolarHBondContact O-N 3.27Å; E142-R145 IonicContact OE1-NH1 3.75Å; E142-R145 PolarHBondContact OE1-NH1 2.96Å; R145-K148 PolarHBondContact O-N 3.3Å; R145-K149 WeakPolarHBondContact O-CG 3.35Å; R145-K149 PolarHBondContact O-N 2.84Å |
| 146 | E | 97.9 | Very high | 97.8 | Very high | 79 Ų | 79 | 101.3 Ų | 101.3 | 37% | 0.369 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -71.2 | -43 | -178.2 | -163.6 | 52.7 | -130.3 | 0 | 0 | 112.4 | E142 Q143 L144 K148 K149 N150 | E142-E146 WeakPolarHBondContact O-CB 3.36Å; E142-E146 PolarHBondContact O-N 3.5Å; Q143-E146 PolarHBondContact O-N 3.27Å; L144-E146 VanDerWaalsContact C-N 3.31Å; L144-E146 PolarHBondContact O-N 2.91Å; E146-K148 VanDerWaalsContact C-N 3.26Å; E146-K148 PolarHBondContact O-N 3.48Å; E146-K149 PolarHBondContact O-N 3.28Å; E146-K149 WeakPolarHBondContact OE2-CD 3.39Å; E146-K149 WeakPolarHBondContact OE2-CE 3.35Å; E146-K149 IonicContact OE2-NZ 3.17Å; E146-K149 PolarHBondContact OE2-NZ 3.05Å; E146-N150 PolarHBondContact O-N 2.92Å; E146-N150 PolarHBondContact O-ND2 3.08Å; E146-N150 PolarHBondContact OE1-ND2 3.31Å |
| 147 | V | 97.8 | Very high | 97.8 | Very high | 98 Ų | 98 | 104 Ų | 104 | 59% | 0.594 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -58.2 | -39.8 | 172 | 169.8 | 0 | 0 | 0 | 0 | 110.9 | Q143 N150 S151 | Q143-V147 WeakPolarHBondContact O-CG2 3.45Å; Q143-V147 PolarHBondContact O-N 2.88Å; V147-N150 PolarHBondContact O-N 3.39Å; V147-S151 WeakPolarHBondContact O-CB 3.24Å; V147-S151 PolarHBondContact O-N 2.83Å |
| 148 | K | 97.9 | Very high | 97.8 | Very high | 149 Ų | 149 | 103.4 Ų | 103.4 | 65% | 0.648 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -66.2 | -39.8 | 176.6 | -172.1 | 172.3 | -179.6 | 175.2 | 0 | 113.1 | L144 R145 E146 T152 | L144-K148 WeakPolarHBondContact O-CB 3.25Å; L144-K148 PolarHBondContact O-N 3.45Å; R145-K148 PolarHBondContact O-N 3.3Å; E146-K148 VanDerWaalsContact C-N 3.26Å; E146-K148 PolarHBondContact O-N 3.48Å; K148-T152 WeakPolarHBondContact O-CG2 3.28Å; K148-T152 PolarHBondContact O-N 2.87Å; K148-T152 PolarHBondContact O-OG1 3.21Å |
| 149 | K | 97.8 | Very high | 97.7 | Very high | 117 Ų | 117 | 103.1 Ų | 103.1 | 51% | 0.509 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.5 | -46.8 | 171.8 | -67.4 | 174.8 | -151.1 | 163.1 | 0 | 111.4 | R145 E146 T152 S153 | R145-K149 WeakPolarHBondContact O-CG 3.35Å; R145-K149 PolarHBondContact O-N 2.84Å; E146-K149 PolarHBondContact O-N 3.28Å; E146-K149 WeakPolarHBondContact OE2-CD 3.39Å; E146-K149 WeakPolarHBondContact OE2-CE 3.35Å; E146-K149 IonicContact OE2-NZ 3.17Å; E146-K149 PolarHBondContact OE2-NZ 3.05Å; K149-T152 PolarHBondContact O-OG1 3.44Å; K149-S153 VanDerWaalsContact O-CB 3.31Å; K149-S153 WeakPolarHBondContact O-CB 3.36Å; K149-S153 PolarHBondContact O-N 2.98Å |
| 150 | N | 97.8 | Very high | 97.7 | Very high | 93 Ų | 93 | 105.3 Ų | 105.3 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67 | -42.5 | -177.9 | -75.1 | -65.9 | 0 | 0 | 0 | 111.9 | E146 V147 S153 L154 | E146-N150 PolarHBondContact O-N 2.92Å; E146-N150 PolarHBondContact O-ND2 3.08Å; E146-N150 PolarHBondContact OE1-ND2 3.31Å; V147-N150 PolarHBondContact O-N 3.39Å; N150-S153 PolarHBondContact O-N 3.04Å; N150-L154 WeakPolarHBondContact O-CB 3.49Å; N150-L154 PolarHBondContact O-N 3.2Å |
| 151 | S | 97.7 | Very high | 97.6 | Very high | 71 Ų | 71 | 106 Ų | 106 | 50% | 0.497 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.8 | -55.1 | 173.7 | -173.8 | 0 | 0 | 0 | 0 | 111.8 | V147 S153 L154 E155 | V147-S151 WeakPolarHBondContact O-CB 3.24Å; V147-S151 PolarHBondContact O-N 2.83Å; S151-S153 PolarHBondContact O-N 3.26Å; S151-S153 VanDerWaalsContact O-N 3.13Å; S151-L154 WeakPolarHBondContact O-CB 3.49Å; S151-L154 PolarHBondContact O-N 3.27Å; S151-E155 WeakPolarHBondContact O-CB 3.49Å; S151-E155 PolarHBondContact O-N 2.86Å |
| 152 | T | 97.6 | Very high | 97.5 | Very high | 55 Ų | 55 | 105.7 Ų | 105.7 | 34% | 0.337 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67 | -14.6 | 177.9 | 56 | 0 | 0 | 0 | 0 | 113.9 | K148 K149 R156 | K148-T152 WeakPolarHBondContact O-CG2 3.28Å; K148-T152 PolarHBondContact O-N 2.87Å; K148-T152 PolarHBondContact O-OG1 3.21Å; K149-T152 PolarHBondContact O-OG1 3.44Å; T152-R156 PolarHBondContact O-NE 3.08Å; T152-R156 PolarHBondContact O-NH2 3.46Å |
| 153 | S | 97.4 | Very high | 97.5 | Very high | 41 Ų | 41 | 105.2 Ų | 105.2 | 29% | 0.287 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -86.2 | -28.5 | 168.8 | -172.7 | 0 | 0 | 0 | 0 | 113.4 | K149 N150 S151 K157 | K149-S153 VanDerWaalsContact O-CB 3.31Å; K149-S153 WeakPolarHBondContact O-CB 3.36Å; K149-S153 PolarHBondContact O-N 2.98Å; N150-S153 PolarHBondContact O-N 3.04Å; S151-S153 PolarHBondContact O-N 3.26Å; S151-S153 VanDerWaalsContact O-N 3.13Å; S153-K157 WeakPolarHBondContact O-CD 3.31Å; S153-K157 WeakPolarHBondContact O-CG 3.32Å |
| 154 | L | 97.5 | Very high | 97.4 | Very high | 114 Ų | 114 | 103.4 Ų | 103.4 | 60% | 0.597 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -76.6 | -43 | 174.2 | -178 | 63.1 | 0 | 0 | 0 | 110.5 | N150 S151 R156 K157 L158 | N150-L154 WeakPolarHBondContact O-CB 3.49Å; N150-L154 PolarHBondContact O-N 3.2Å; S151-L154 WeakPolarHBondContact O-CB 3.49Å; S151-L154 PolarHBondContact O-N 3.27Å; L154-R156 PolarHBondContact O-N 3.44Å; L154-K157 WeakPolarHBondContact O-CB 3.49Å; L154-K157 PolarHBondContact O-N 3.45Å; L154-K157 VanDerWaalsContact O-N 3.08Å; L154-L158 PolarHBondContact O-N 2.7Å |
| 155 | E | 97.2 | Very high | 97.3 | Very high | 112 Ų | 112 | 100.6 Ų | 100.6 | 52% | 0.523 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -51.5 | -55.6 | 173.7 | -173.7 | 170.3 | -138 | 0 | 0 | 111.3 | S151 K157 L158 E159 | S151-E155 WeakPolarHBondContact O-CB 3.49Å; S151-E155 PolarHBondContact O-N 2.86Å; E155-K157 VanDerWaalsContact C-N 3.26Å; E155-K157 PolarHBondContact O-N 3.44Å; E155-L158 CarbonylContact O-C 3.6Å; E155-L158 PolarHBondContact O-N 3.1Å; E155-E159 WeakPolarHBondContact O-CG 3.27Å; E155-E159 PolarHBondContact O-N 2.88Å |
| 156 | R | 97.5 | Very high | 97.3 | Very high | 145 Ų | 145 | 97.8 Ų | 97.8 | 55% | 0.547 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.5 | -26 | 176.8 | -74.9 | 178.4 | -67.8 | 126.2 | -1.7 | 114.9 | T152 L154 E159 Y160 | T152-R156 PolarHBondContact O-NE 3.08Å; T152-R156 PolarHBondContact O-NH2 3.46Å; L154-R156 PolarHBondContact O-N 3.44Å; R156-E159 WeakPolarHBondContact CA-OE2 3.35Å; R156-Y160 WeakPolarHBondContact O-CB 3.43Å; R156-Y160 PolarHBondContact O-N 3.01Å; R156-Y160 VanDerWaalsContact O-N 3.15Å |
| 157 | K | 97.6 | Very high | 97.2 | Very high | 129 Ų | 129 | 100.8 Ų | 100.8 | 56% | 0.561 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -73.6 | -43.5 | 172.3 | -72.2 | 169.1 | -178.3 | 176.8 | 0 | 110.6 | S153 L154 E155 Y160 E161 | S153-K157 WeakPolarHBondContact O-CD 3.31Å; S153-K157 WeakPolarHBondContact O-CG 3.32Å; L154-K157 WeakPolarHBondContact O-CB 3.49Å; L154-K157 PolarHBondContact O-N 3.45Å; L154-K157 VanDerWaalsContact O-N 3.08Å; E155-K157 VanDerWaalsContact C-N 3.26Å; E155-K157 PolarHBondContact O-N 3.44Å; K157-Y160 WeakPolarHBondContact O-CB 3.31Å; K157-Y160 PolarHBondContact O-N 3.3Å; K157-E161 PolarHBondContact O-N 2.86Å |
| 158 | L | 96.9 | Very high | 97.1 | Very high | 118 Ų | 118 | 100.7 Ų | 100.7 | 62% | 0.618 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -67.9 | -36.6 | 177.8 | -168.2 | 151.9 | 0 | 0 | 0 | 111.7 | L154 E155 S162 | L154-L158 PolarHBondContact O-N 2.7Å; E155-L158 CarbonylContact O-C 3.6Å; E155-L158 PolarHBondContact O-N 3.1Å; L158-S162 VanDerWaalsContact O-CB 3.23Å; L158-S162 WeakPolarHBondContact O-CB 3.33Å; L158-S162 PolarHBondContact O-N 2.79Å; L158-S162 PolarHBondContact O-OG 3.09Å |
| 159 | E | 96.8 | Very high | 97.1 | Very high | 103 Ų | 103 | 98.5 Ų | 98.5 | 48% | 0.481 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -57.9 | -49.8 | 166.8 | -71.7 | -177.7 | 137.9 | 0 | 0 | 111.2 | E155 R156 E161 S162 L163 | E155-E159 WeakPolarHBondContact O-CG 3.27Å; E155-E159 PolarHBondContact O-N 2.88Å; R156-E159 WeakPolarHBondContact CA-OE2 3.35Å; E159-E161 PolarHBondContact O-N 3.23Å; E159-S162 WeakPolarHBondContact CA-OG 3.28Å; E159-S162 PolarHBondContact O-N 3.32Å; E159-S162 PolarHBondContact O-OG 2.78Å; E159-L163 WeakPolarHBondContact O-CB 3.47Å; E159-L163 VanDerWaalsContact O-CG 3.22Å; E159-L163 WeakPolarHBondContact O-CG 3.36Å; E159-L163 PolarHBondContact O-N 3.45Å |
| 160 | Y | 97.9 | Very high | 97 | Very high | 142 Ų | 142 | 96 Ų | 96 | 56% | 0.557 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.9 | -47.2 | 179.1 | 179.8 | -88.3 | 0 | 0 | 0 | 112.4 | R156 K157 L163 Q164 | R156-Y160 WeakPolarHBondContact O-CB 3.43Å; R156-Y160 PolarHBondContact O-N 3.01Å; R156-Y160 VanDerWaalsContact O-N 3.15Å; K157-Y160 WeakPolarHBondContact O-CB 3.31Å; K157-Y160 PolarHBondContact O-N 3.3Å; Y160-L163 PolarHBondContact O-N 3.13Å; Y160-Q164 WeakPolarHBondContact O-CB 3.43Å; Y160-Q164 PolarHBondContact O-N 3.32Å |
| 161 | E | 96.8 | Very high | 96.9 | Very high | 132 Ų | 132 | 97.3 Ų | 97.3 | 62% | 0.617 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -67.5 | -39 | 179 | -73.3 | -176.8 | 177.5 | 0 | 0 | 112.4 | K157 E159 Q164 C165 | K157-E161 PolarHBondContact O-N 2.86Å; E159-E161 PolarHBondContact O-N 3.23Å; E161-Q164 WeakPolarHBondContact O-CB 3.46Å; E161-Q164 PolarHBondContact O-N 3.06Å; E161-C165 VanDerWaalsContact O-CB 3.31Å; E161-C165 WeakPolarHBondContact O-CB 3.36Å; E161-C165 PolarHBondContact O-N 3.24Å |
| 162 | S | 95.7 | Very high | 96.8 | Very high | 66 Ų | 66 | 98.1 Ų | 98.1 | 46% | 0.462 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67 | -37.6 | 174.5 | 61.7 | 0 | 0 | 0 | 0 | 112.2 | L158 E159 Q164 C165 G166 | L158-S162 VanDerWaalsContact O-CB 3.23Å; L158-S162 WeakPolarHBondContact O-CB 3.33Å; L158-S162 PolarHBondContact O-N 2.79Å; L158-S162 PolarHBondContact O-OG 3.09Å; E159-S162 WeakPolarHBondContact CA-OG 3.28Å; E159-S162 PolarHBondContact O-N 3.32Å; E159-S162 PolarHBondContact O-OG 2.78Å; S162-Q164 VanDerWaalsContact C-N 3.34Å; S162-C165 PolarHBondContact O-N 2.84Å; S162-G166 PolarHBondContact O-N 2.89Å |
| 163 | L | 97.1 | Very high | 96.8 | Very high | 108 Ų | 108 | 101.5 Ų | 101.5 | 57% | 0.565 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -68.1 | -31.2 | 171.1 | -71.1 | 170.5 | 0 | 0 | 0 | 112.5 | E159 Y160 R167 | E159-L163 WeakPolarHBondContact O-CB 3.47Å; E159-L163 VanDerWaalsContact O-CG 3.22Å; E159-L163 WeakPolarHBondContact O-CG 3.36Å; E159-L163 PolarHBondContact O-N 3.45Å; Y160-L163 PolarHBondContact O-N 3.13Å; L163-R167 WeakPolarHBondContact O-CB 3.45Å; L163-R167 WeakPolarHBondContact O-CG 3.44Å; L163-R167 PolarHBondContact O-N 3.48Å; L163-R167 PolarHBondContact O-NE 2.81Å |
| 164 | Q | 96.8 | Very high | 96.7 | Very high | 81 Ų | 81 | 101 Ų | 101 | 38% | 0.379 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -70.1 | -49.4 | 172.6 | -177.6 | 179.3 | -44.9 | 0 | 0 | 111 | Y160 E161 S162 G166 R167 Q168 | Y160-Q164 WeakPolarHBondContact O-CB 3.43Å; Y160-Q164 PolarHBondContact O-N 3.32Å; E161-Q164 WeakPolarHBondContact O-CB 3.46Å; E161-Q164 PolarHBondContact O-N 3.06Å; S162-Q164 VanDerWaalsContact C-N 3.34Å; Q164-G166 PolarHBondContact O-N 3.43Å; Q164-R167 WeakPolarHBondContact O-CB 3.34Å; Q164-R167 PolarHBondContact O-N 3.48Å; Q164-Q168 WeakPolarHBondContact O-CG 3.49Å; Q164-Q168 PolarHBondContact O-N 3.2Å |
| 165 | C | 96.3 | Very high | 96.6 | Very high | 62 Ų | 62 | 101.4 Ų | 101.4 | 42% | 0.419 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 177 | -176.2 | 0 | 0 | 0 | 0 | 111.5 | E161 S162 R167 Q168 I169 | E161-C165 VanDerWaalsContact O-CB 3.31Å; E161-C165 WeakPolarHBondContact O-CB 3.36Å; E161-C165 PolarHBondContact O-N 3.24Å; S162-C165 PolarHBondContact O-N 2.84Å; C165-R167 VanDerWaalsContact C-N 3.29Å; C165-R167 PolarHBondContact O-N 3.04Å; C165-Q168 PolarHBondContact O-N 2.84Å; C165-Q168 VanDerWaalsContact O-N 3.14Å; C165-I169 WeakPolarHBondContact O-CG1 3.22Å; C165-I169 PolarHBondContact O-N 2.76Å |
| 166 | G | 96.9 | Very high | 96.4 | Very high | 39 Ų | 39 | 104.5 Ų | 104.5 | 40% | 0.402 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.9 | -36 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | S162 Q164 A170 | S162-G166 PolarHBondContact O-N 2.89Å; Q164-G166 PolarHBondContact O-N 3.43Å; G166-A170 WeakPolarHBondContact O-CB 3.35Å; G166-A170 PolarHBondContact O-N 2.99Å |
| 167 | R | 96.3 | Very high | 96.3 | Very high | 141 Ų | 141 | 101.3 Ų | 101.3 | 53% | 0.532 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.8 | -44.3 | 172.5 | -81.7 | 174.8 | -76.2 | -160.4 | 0.3 | 112.1 | L163 Q164 C165 A170 Q171 | L163-R167 WeakPolarHBondContact O-CB 3.45Å; L163-R167 WeakPolarHBondContact O-CG 3.44Å; L163-R167 PolarHBondContact O-N 3.48Å; L163-R167 PolarHBondContact O-NE 2.81Å; Q164-R167 WeakPolarHBondContact O-CB 3.34Å; Q164-R167 PolarHBondContact O-N 3.48Å; C165-R167 VanDerWaalsContact C-N 3.29Å; C165-R167 PolarHBondContact O-N 3.04Å; R167-A170 PolarHBondContact O-N 3.3Å; R167-Q171 WeakPolarHBondContact O-CG 3.23Å; R167-Q171 PolarHBondContact O-N 3.24Å; R167-Q171 PolarHBondContact O-OE1 3.04Å |
| 168 | Q | 96.8 | Very high | 96.1 | Very high | 96 Ų | 96 | 102 Ų | 102 | 45% | 0.449 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | 175.8 | -70.3 | 174.5 | -20.4 | 0 | 0 | 112 | Q164 C165 A170 Q171 L172 | Q164-Q168 WeakPolarHBondContact O-CG 3.49Å; Q164-Q168 PolarHBondContact O-N 3.2Å; C165-Q168 PolarHBondContact O-N 2.84Å; C165-Q168 VanDerWaalsContact O-N 3.14Å; Q168-A170 PolarHBondContact O-N 3.15Å; Q168-Q171 PolarHBondContact O-N 3.04Å; Q168-L172 WeakPolarHBondContact O-CB 3.48Å; Q168-L172 WeakPolarHBondContact O-CG 3.47Å; Q168-L172 PolarHBondContact O-N 2.82Å |
| 169 | I | 96.8 | Very high | 95.9 | Very high | 104 Ų | 104 | 99.2 Ų | 99.2 | 53% | 0.533 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 175.2 | -68.3 | 166.7 | 0 | 0 | 0 | 111 | C165 K173 | C165-I169 WeakPolarHBondContact O-CG1 3.22Å; C165-I169 PolarHBondContact O-N 2.76Å; I169-K173 WeakPolarHBondContact O-CB 3.38Å; I169-K173 PolarHBondContact O-N 3.38Å |
| 170 | A | 95.9 | Very high | 95.7 | Very high | 63 Ų | 63 | 100.3 Ų | 100.3 | 52% | 0.521 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.9 | -39.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | G166 R167 Q168 G174 | G166-A170 WeakPolarHBondContact O-CB 3.35Å; G166-A170 PolarHBondContact O-N 2.99Å; R167-A170 PolarHBondContact O-N 3.3Å; Q168-A170 PolarHBondContact O-N 3.15Å; A170-G174 PolarHBondContact O-N 3.46Å |
| 171 | Q | 95.6 | Very high | 95.5 | Very high | 122 Ų | 122 | 98 Ų | 98 | 57% | 0.57 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.1 | -55 | 174.8 | -72.8 | 173.5 | -63.8 | 0 | 0 | 111.2 | R167 Q168 K173 G174 E175 | R167-Q171 WeakPolarHBondContact O-CG 3.23Å; R167-Q171 PolarHBondContact O-N 3.24Å; R167-Q171 PolarHBondContact O-OE1 3.04Å; Q168-Q171 PolarHBondContact O-N 3.04Å; Q171-K173 VanDerWaalsContact C-N 3.29Å; Q171-K173 PolarHBondContact O-N 3.47Å; Q171-G174 WeakPolarHBondContact O-CA 3.35Å; Q171-G174 PolarHBondContact O-N 2.96Å; Q171-E175 PolarHBondContact O-N 3.14Å |
| 172 | L | 96.1 | Very high | 95.2 | Very high | 88 Ų | 88 | 94.2 Ų | 94.2 | 46% | 0.461 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -56.4 | -42.3 | 177 | -74.4 | 165.6 | 0 | 0 | 0 | 111.8 | Q168 G174 E175 Y176 | Q168-L172 WeakPolarHBondContact O-CB 3.48Å; Q168-L172 WeakPolarHBondContact O-CG 3.47Å; Q168-L172 PolarHBondContact O-N 2.82Å; L172-G174 VanDerWaalsContact C-N 3.34Å; L172-G174 PolarHBondContact O-N 2.81Å; L172-E175 PolarHBondContact O-N 2.86Å; L172-Y176 WeakPolarHBondContact O-CD2 3.34Å; L172-Y176 PolarHBondContact O-N 3.26Å |
| 173 | K | 96.3 | Very high | 94.8 | Very high | 126 Ų | 126 | 96.7 Ų | 96.7 | 55% | 0.548 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.2 | -39.7 | 175.6 | -175.3 | -176.1 | 171.9 | -165.8 | 0 | 111.9 | I169 Q171 Y176 E177 | I169-K173 WeakPolarHBondContact O-CB 3.38Å; I169-K173 PolarHBondContact O-N 3.38Å; Q171-K173 VanDerWaalsContact C-N 3.29Å; Q171-K173 PolarHBondContact O-N 3.47Å; K173-Y176 PolarHBondContact O-N 3.3Å; K173-E177 WeakPolarHBondContact CE-OE1 3.3Å; K173-E177 IonicContact NZ-OE1 3.63Å; K173-E177 WeakPolarHBondContact O-CB 3.41Å; K173-E177 PolarHBondContact O-N 3.15Å |
| 174 | G | 95.7 | Very high | 94.5 | Very high | 30 Ų | 30 | 96.2 Ų | 96.2 | 31% | 0.309 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.7 | -51.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | A170 Q171 L172 Y176 E177 E178 | A170-G174 PolarHBondContact O-N 3.46Å; Q171-G174 WeakPolarHBondContact O-CA 3.35Å; Q171-G174 PolarHBondContact O-N 2.96Å; L172-G174 VanDerWaalsContact C-N 3.34Å; L172-G174 PolarHBondContact O-N 2.81Å; G174-Y176 PolarHBondContact O-N 3.39Å; G174-E177 PolarHBondContact O-N 2.8Å; G174-E177 VanDerWaalsContact O-N 3.16Å; G174-E178 WeakPolarHBondContact O-CG 3.21Å; G174-E178 PolarHBondContact O-N 2.88Å |
| 175 | E | 94.9 | Very high | 94.1 | Very high | 122 Ų | 122 | 99.6 Ų | 99.6 | 57% | 0.57 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -57.6 | -44.6 | 176.2 | -67.6 | 169.7 | -171.3 | 0 | 0 | 112.1 | Q171 L172 E178 A179 | Q171-E175 PolarHBondContact O-N 3.14Å; L172-E175 PolarHBondContact O-N 2.86Å; E175-E178 PolarHBondContact O-N 2.92Å; E175-A179 VanDerWaalsContact O-CB 3.25Å; E175-A179 WeakPolarHBondContact O-CB 3.35Å; E175-A179 PolarHBondContact O-N 3.15Å |
| 176 | Y | 93.9 | Very high | 93.5 | Very high | 177 Ų | 177 | 100.4 Ų | 100.4 | 69% | 0.694 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.7 | -40.9 | 174.7 | -82.2 | -61.5 | 0 | 0 | 0 | 113 | L172 K173 G174 K180 | L172-Y176 WeakPolarHBondContact O-CD2 3.34Å; L172-Y176 PolarHBondContact O-N 3.26Å; K173-Y176 PolarHBondContact O-N 3.3Å; G174-Y176 PolarHBondContact O-N 3.39Å; Y176-K180 WeakPolarHBondContact O-CB 3.41Å; Y176-K180 PolarHBondContact O-N 3.17Å |
| 177 | E | 94.9 | Very high | 92.8 | Very high | 79 Ų | 79 | 101.4 Ų | 101.4 | 37% | 0.369 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.5 | -36.5 | 176.2 | -84.9 | -162.6 | -143.5 | 0 | 0 | 112.5 | K173 G174 K181 | K173-E177 WeakPolarHBondContact CE-OE1 3.3Å; K173-E177 IonicContact NZ-OE1 3.63Å; K173-E177 WeakPolarHBondContact O-CB 3.41Å; K173-E177 PolarHBondContact O-N 3.15Å; G174-E177 PolarHBondContact O-N 2.8Å; G174-E177 VanDerWaalsContact O-N 3.16Å; E177-K181 WeakPolarHBondContact O-CB 3.22Å; E177-K181 VanDerWaalsContact O-CD 3.25Å; E177-K181 WeakPolarHBondContact O-CD 3.25Å; E177-K181 WeakPolarHBondContact O-CG 3.45Å; E177-K181 PolarHBondContact O-N 2.96Å; E177-K181 IonicContact OE2-NZ 3.3Å; E177-K181 PolarHBondContact OE2-NZ 3.36Å |
| 178 | E | 93.7 | Very high | 92.1 | Very high | 142 Ų | 142 | 98.2 Ų | 98.2 | 66% | 0.664 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -70.1 | -45.5 | 175 | -73.5 | -170.8 | -178.1 | 0 | 0 | 111.9 | G174 E175 K180 K181 A182 | G174-E178 WeakPolarHBondContact O-CG 3.21Å; G174-E178 PolarHBondContact O-N 2.88Å; E175-E178 PolarHBondContact O-N 2.92Å; E178-K180 VanDerWaalsContact C-N 3.3Å; E178-K180 PolarHBondContact O-N 3.12Å; E178-K181 CarbonylContact O-C 3.5Å; E178-K181 PolarHBondContact O-N 2.94Å; E178-A182 WeakPolarHBondContact O-CB 3.41Å; E178-A182 PolarHBondContact O-N 2.94Å |
| 179 | A | 92.3 | Very high | 91.3 | Very high | 60 Ų | 60 | 101.4 Ų | 101.4 | 50% | 0.496 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58.9 | -41.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | E175 A182 L183 | E175-A179 VanDerWaalsContact O-CB 3.25Å; E175-A179 WeakPolarHBondContact O-CB 3.35Å; E175-A179 PolarHBondContact O-N 3.15Å; A179-A182 PolarHBondContact O-N 3.39Å; A179-L183 WeakPolarHBondContact O-CB 3.32Å; A179-L183 PolarHBondContact O-N 2.9Å |
| 180 | K | 93.6 | Very high | 90.3 | Very high | 126 Ų | 126 | 101.5 Ų | 101.5 | 55% | 0.548 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.7 | -48.7 | 173 | -175.1 | -174 | 175.1 | -158.2 | 0 | 111.7 | Y176 E178 A182 L183 E184 | Y176-K180 WeakPolarHBondContact O-CB 3.41Å; Y176-K180 PolarHBondContact O-N 3.17Å; E178-K180 VanDerWaalsContact C-N 3.3Å; E178-K180 PolarHBondContact O-N 3.12Å; K180-A182 VanDerWaalsContact C-N 3.28Å; K180-A182 PolarHBondContact O-N 3.47Å; K180-L183 PolarHBondContact O-N 3.45Å; K180-E184 WeakPolarHBondContact CE-OE1 3.19Å; K180-E184 IonicContact NZ-OE1 2.74Å; K180-E184 WeakPolarHBondContact O-CB 3.31Å; K180-E184 WeakPolarHBondContact O-CG 3.03Å; K180-E184 PolarHBondContact O-N 3.03Å |
| 181 | K | 93.4 | Very high | 89.3 | Confident | 94 Ų | 94 | 106.8 Ų | 106.8 | 41% | 0.409 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.5 | -31.5 | 178.4 | -71.9 | 159.2 | -165.2 | 159.6 | 0 | 112.1 | E177 E178 K185 | E177-K181 WeakPolarHBondContact O-CB 3.22Å; E177-K181 VanDerWaalsContact O-CD 3.25Å; E177-K181 WeakPolarHBondContact O-CD 3.25Å; E177-K181 WeakPolarHBondContact O-CG 3.45Å; E177-K181 PolarHBondContact O-N 2.96Å; E177-K181 IonicContact OE2-NZ 3.3Å; E177-K181 PolarHBondContact OE2-NZ 3.36Å; E178-K181 CarbonylContact O-C 3.5Å; E178-K181 PolarHBondContact O-N 2.94Å; K181-K185 WeakPolarHBondContact O-CB 3.48Å; K181-K185 WeakPolarHBondContact O-CD 3.42Å; K181-K185 WeakPolarHBondContact O-CG 3.45Å; K181-K185 PolarHBondContact O-N 2.94Å |
| 182 | A | 89.9 | Confident | 87.8 | Confident | 53 Ų | 53 | 107.8 Ų | 107.8 | 44% | 0.438 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -69.5 | -45.4 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | E178 A179 K180 K185 E186 | E178-A182 WeakPolarHBondContact O-CB 3.41Å; E178-A182 PolarHBondContact O-N 2.94Å; A179-A182 PolarHBondContact O-N 3.39Å; K180-A182 VanDerWaalsContact C-N 3.28Å; K180-A182 PolarHBondContact O-N 3.47Å; A182-K185 WeakPolarHBondContact O-CB 3.42Å; A182-K185 PolarHBondContact O-N 3.22Å; A182-E186 PolarHBondContact O-N 3.2Å |
| 183 | L | 88.7 | Confident | 86 | Confident | 117 Ų | 117 | 107.4 Ų | 107.4 | 61% | 0.613 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.8 | -41.6 | 174.9 | -175 | 63.5 | 0 | 0 | 0 | 111.9 | A179 K180 K185 E186 V187 | A179-L183 WeakPolarHBondContact O-CB 3.32Å; A179-L183 PolarHBondContact O-N 2.9Å; K180-L183 PolarHBondContact O-N 3.45Å; L183-K185 PolarHBondContact O-N 3.1Å; L183-E186 PolarHBondContact O-N 3.43Å; L183-V187 WeakPolarHBondContact O-CB 3.32Å; L183-V187 VanDerWaalsContact O-CG2 3.29Å; L183-V187 WeakPolarHBondContact O-CG2 3.18Å; L183-V187 PolarHBondContact O-N 3.3Å |
| 184 | E | 89.9 | Confident | 84.1 | Confident | 98 Ų | 98 | 106 Ų | 106 | 46% | 0.458 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.4 | -39.5 | 174 | -75.2 | 174.8 | 164.7 | 0 | 0 | 112 | K180 S188 | K180-E184 WeakPolarHBondContact CE-OE1 3.19Å; K180-E184 IonicContact NZ-OE1 2.74Å; K180-E184 WeakPolarHBondContact O-CB 3.31Å; K180-E184 WeakPolarHBondContact O-CG 3.03Å; K180-E184 PolarHBondContact O-N 3.03Å; E184-S188 WeakPolarHBondContact O-CB 3.2Å; E184-S188 PolarHBondContact O-N 3.36Å; E184-S188 PolarHBondContact O-OG 3.43Å |
| 185 | K | 87.8 | Confident | 81.9 | Confident | 152 Ų | 152 | 110.8 Ų | 110.8 | 66% | 0.661 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -63.9 | -43.6 | 172.8 | -75.7 | 166.6 | -175.2 | 175.6 | 0 | 112.2 | K181 A182 L183 S188 R189 | K181-K185 WeakPolarHBondContact O-CB 3.48Å; K181-K185 WeakPolarHBondContact O-CD 3.42Å; K181-K185 WeakPolarHBondContact O-CG 3.45Å; K181-K185 PolarHBondContact O-N 2.94Å; A182-K185 WeakPolarHBondContact O-CB 3.42Å; A182-K185 PolarHBondContact O-N 3.22Å; L183-K185 PolarHBondContact O-N 3.1Å; K185-S188 PolarHBondContact O-N 2.88Å; K185-R189 WeakPolarHBondContact O-CB 3.42Å; K185-R189 PolarHBondContact O-N 3.43Å |
| 186 | E | 83.9 | Confident | 79.3 | Confident | 79 Ų | 79 | 108.6 Ų | 108.6 | 37% | 0.369 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -67.8 | -41.2 | 177.1 | -78.3 | -59.6 | 149 | 0 | 0 | 112.4 | A182 L183 S188 R189 L190 | A182-E186 PolarHBondContact O-N 3.2Å; L183-E186 PolarHBondContact O-N 3.43Å; E186-S188 VanDerWaalsContact C-N 3.29Å; E186-S188 PolarHBondContact O-N 2.85Å; E186-R189 PolarHBondContact O-N 3.15Å; E186-R189 IonicContact OE1-CZ 3.18Å; E186-R189 VanDerWaalsContact OE1-CZ 3.3Å; E186-R189 IonicContact OE1-NE 2.83Å; E186-R189 PolarHBondContact OE1-NE 3.47Å; E186-R189 VanDerWaalsContact OE1-NE 3.17Å; E186-R189 IonicContact OE1-NH2 3.04Å; E186-R189 PolarHBondContact OE1-NH2 2.89Å; E186-R189 IonicContact OE2-CZ 2.63Å; E186-R189 IonicContact OE2-NE 3.41Å; E186-R189 PolarHBondContact OE2-NE 3.44Å; E186-R189 IonicContact OE2-NH2 2.71Å; E186-R189 PolarHBondContact OE2-NH2 3.31Å; E186-L190 WeakPolarHBondContact O-CB 3.46Å; E186-L190 WeakPolarHBondContact O-CG 3.45Å; E186-L190 PolarHBondContact O-N 2.82Å |
| 187 | V | 82.3 | Confident | 76.9 | Confident | 60 Ų | 60 | 102 Ų | 102 | 36% | 0.364 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.2 | -38.1 | 171.3 | 169.1 | 0 | 0 | 0 | 0 | 111.2 | L183 R191 | L183-V187 WeakPolarHBondContact O-CB 3.32Å; L183-V187 VanDerWaalsContact O-CG2 3.29Å; L183-V187 WeakPolarHBondContact O-CG2 3.18Å; L183-V187 PolarHBondContact O-N 3.3Å; V187-R191 VanDerWaalsContact O-CB 3.32Å; V187-R191 WeakPolarHBondContact O-CB 3.31Å; V187-R191 VanDerWaalsContact O-CG 3.28Å; V187-R191 WeakPolarHBondContact O-CG 3.33Å; V187-R191 PolarHBondContact O-N 3.29Å |
| 188 | S | 82.4 | Confident | 74.1 | Confident | 75 Ų | 75 | 108.1 Ų | 108.1 | 52% | 0.524 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -68.8 | -37.4 | 173 | -76.5 | 0 | 0 | 0 | 0 | 113 | E184 K185 E186 R191 L192 | E184-S188 WeakPolarHBondContact O-CB 3.2Å; E184-S188 PolarHBondContact O-N 3.36Å; E184-S188 PolarHBondContact O-OG 3.43Å; K185-S188 PolarHBondContact O-N 2.88Å; E186-S188 VanDerWaalsContact C-N 3.29Å; E186-S188 PolarHBondContact O-N 2.85Å; S188-R191 PolarHBondContact O-N 2.81Å; S188-L192 WeakPolarHBondContact O-CB 3.28Å; S188-L192 PolarHBondContact O-N 2.8Å |
| 189 | R | 78.6 | Confident | 71.1 | Confident | 163 Ų | 163 | 104.8 Ų | 104.8 | 62% | 0.615 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -64.5 | -45.6 | 174.7 | -172.2 | 170.4 | 73.4 | 135.1 | -2.8 | 111.1 | K185 E186 L192 S193 | K185-R189 WeakPolarHBondContact O-CB 3.42Å; K185-R189 PolarHBondContact O-N 3.43Å; E186-R189 PolarHBondContact O-N 3.15Å; E186-R189 IonicContact OE1-CZ 3.18Å; E186-R189 VanDerWaalsContact OE1-CZ 3.3Å; E186-R189 IonicContact OE1-NE 2.83Å; E186-R189 PolarHBondContact OE1-NE 3.47Å; E186-R189 VanDerWaalsContact OE1-NE 3.17Å; E186-R189 IonicContact OE1-NH2 3.04Å; E186-R189 PolarHBondContact OE1-NH2 2.89Å; E186-R189 IonicContact OE2-CZ 2.63Å; E186-R189 IonicContact OE2-NE 3.41Å; E186-R189 PolarHBondContact OE2-NE 3.44Å; E186-R189 IonicContact OE2-NH2 2.71Å; E186-R189 PolarHBondContact OE2-NH2 3.31Å; R189-L192 PolarHBondContact O-N 2.83Å; R189-S193 PolarHBondContact O-N 3.34Å |
| 190 | L | 77.6 | Confident | 68.2 | Low | 105 Ų | 105 | 109.3 Ų | 109.3 | 55% | 0.55 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -60.4 | -48.5 | 172.7 | -73.2 | 164.7 | 0 | 0 | 0 | 111 | E186 L192 S193 V194 | E186-L190 WeakPolarHBondContact O-CB 3.46Å; E186-L190 WeakPolarHBondContact O-CG 3.45Å; E186-L190 PolarHBondContact O-N 2.82Å; L190-L192 VanDerWaalsContact C-N 3.33Å; L190-L192 PolarHBondContact O-N 2.9Å; L190-S193 PolarHBondContact O-N 3.4Å; L190-S193 VanDerWaalsContact O-N 3.12Å; L190-S193 PolarHBondContact O-OG 2.76Å; L190-V194 WeakPolarHBondContact O-CG2 3.47Å; L190-V194 PolarHBondContact O-N 3.43Å |
| 191 | R | 74.9 | Confident | 65.4 | Low | 175 Ų | 175 | 109.6 Ų | 109.6 | 66% | 0.66 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -59.9 | -39.6 | 175.7 | -79.6 | 177 | 173.1 | -173.8 | -1.9 | 112.9 | V187 S188 S193 V194 V195 | V187-R191 VanDerWaalsContact O-CB 3.32Å; V187-R191 WeakPolarHBondContact O-CB 3.31Å; V187-R191 VanDerWaalsContact O-CG 3.28Å; V187-R191 WeakPolarHBondContact O-CG 3.33Å; V187-R191 PolarHBondContact O-N 3.29Å; S188-R191 PolarHBondContact O-N 2.81Å; R191-S193 VanDerWaalsContact C-N 3.31Å; R191-S193 PolarHBondContact O-N 2.87Å; R191-V194 PolarHBondContact O-N 2.8Å; R191-V195 WeakPolarHBondContact O-CG2 3.33Å; R191-V195 PolarHBondContact O-N 2.84Å |
| 192 | L | 64 | Low | 62.5 | Low | 142 Ų | 142 | 108.8 Ų | 108.8 | 74% | 0.743 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.1 | -36.5 | 176.2 | -164.9 | 68.8 | 0 | 0 | 0 | 111.6 | S188 R189 L190 | S188-L192 WeakPolarHBondContact O-CB 3.28Å; S188-L192 PolarHBondContact O-N 2.8Å; R189-L192 PolarHBondContact O-N 2.83Å; L190-L192 VanDerWaalsContact C-N 3.33Å; L190-L192 PolarHBondContact O-N 2.9Å |
| 193 | S | 56.9 | Low | 59.8 | Low | 81 Ų | 81 | 111.5 Ų | 111.5 | 57% | 0.566 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -70.7 | -32 | 172.2 | 70.9 | 0 | 0 | 0 | 0 | 113.6 | R189 L190 R191 G196 | R189-S193 PolarHBondContact O-N 3.34Å; L190-S193 PolarHBondContact O-N 3.4Å; L190-S193 VanDerWaalsContact O-N 3.12Å; L190-S193 PolarHBondContact O-OG 2.76Å; R191-S193 VanDerWaalsContact C-N 3.31Å; R191-S193 PolarHBondContact O-N 2.87Å; S193-G196 PolarHBondContact O-N 3.4Å |
| 194 | V | 56.2 | Low | 57.1 | Low | 96 Ų | 96 | 109.8 Ų | 109.8 | 58% | 0.582 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -76.2 | -33.3 | 177.5 | 168.5 | 0 | 0 | 0 | 0 | 112.4 | L190 R191 G196 G197 | L190-V194 WeakPolarHBondContact O-CG2 3.47Å; L190-V194 PolarHBondContact O-N 3.43Å; R191-V194 PolarHBondContact O-N 2.8Å; V194-G196 PolarHBondContact O-N 2.87Å; V194-G197 CarbonylContact O-C 3.59Å; V194-G197 WeakPolarHBondContact O-CA 3.42Å; V194-G197 PolarHBondContact O-N 3.28Å |
| 195 | V | 50.6 | Low | 54.5 | Low | 130 Ų | 130 | 113.9 Ų | 113.9 | 79% | 0.788 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -66.9 | -18.8 | 174.8 | 170.5 | 0 | 0 | 0 | 0 | 112.2 | R191 G197 | R191-V195 WeakPolarHBondContact O-CG2 3.33Å; R191-V195 PolarHBondContact O-N 2.84Å; V195-G197 VanDerWaalsContact C-N 3.31Å |
| 196 | G | 40.2 | Very low | 51.9 | Low | 76 Ų | 76 | 115 Ų | 115 | 78% | 0.784 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | -3.9 | 166.7 | 0 | 0 | 0 | 0 | 0 | 115 | S193 V194 | S193-G196 PolarHBondContact O-N 3.4Å; V194-G196 PolarHBondContact O-N 2.87Å |
| 197 | G | 42.6 | Very low | 49.6 | Very low | 39 Ų | 39 | 115.4 Ų | 115.4 | 40% | 0.402 | 71% | 0.705 | S | S | . | * | S | Bend | trans | -135 | 95.6 | -166.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | V194 V195 | V194-G197 CarbonylContact O-C 3.59Å; V194-G197 WeakPolarHBondContact O-CA 3.42Å; V194-G197 PolarHBondContact O-N 3.28Å; V195-G197 VanDerWaalsContact C-N 3.31Å |
| 198 | Q | 36.4 | Very low | 47.1 | Very low | 208 Ų | 208 | 116 Ų | 116 | 97% | 0.972 | 72% | 0.723 | S | S | * | * | trans | 66.7 | 132.2 | 168.3 | -59.5 | -179.6 | -49.8 | 0 | 0 | 117.4 | ||||
| 199 | G | 31.5 | Very low | 44.7 | Very low | 72 Ų | 72 | 121.6 Ų | 121.6 | 74% | 0.742 | 74% | 0.741 | S | S | * | * | trans | -114.7 | 165.4 | 158.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 200 | N | 30.9 | Very low | 42.5 | Very low | 155 Ų | 155 | 118.5 Ų | 118.5 | 83% | 0.829 | 75% | 0.75 | S | S | * | * | trans | 71.4 | 114 | 159.4 | -161.2 | 29.1 | 0 | 0 | 0 | 118.3 | ||||
| 201 | V | 35.4 | Very low | 40.2 | Very low | 132 Ų | 132 | 117.7 Ų | 117.7 | 80% | 0.8 | 77% | 0.766 | S | S | * | * | 173.2 | 145 | 105.7 | 156.6 | 0 | 0 | 0 | 0 | 109 | |||||
| 202 | G | 31.2 | Very low | 38 | Very low | 76 Ų | 76 | 112.5 Ų | 112.5 | 78% | 0.784 | 77% | 0.768 | S | S | * | * | trans | 135.1 | 88.5 | 159.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 203 | A | 35 | Very low | 36.5 | Very low | 110 Ų | 110 | 113 Ų | 113 | 91% | 0.909 | 78% | 0.777 | S | S | * | * | trans | -107.4 | 144.3 | 171 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 204 | G | 31.6 | Very low | 35.2 | Very low | 81 Ų | 81 | 116 Ų | 116 | 84% | 0.835 | 79% | 0.786 | S | S | * | * | trans | -157 | 144.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 205 | K | 35.3 | Very low | 34 | Very low | 184 Ų | 184 | 114.5 Ų | 114.5 | 80% | 0.8 | 78% | 0.784 | S | S | * | * | trans | -129.3 | 170.6 | -165.6 | -121.2 | -169.9 | -178.7 | -175.2 | 0 | 112 | ||||
| 206 | H | 32.5 | Very low | 32.9 | Very low | 175 Ų | 175 | 115.2 Ų | 115.2 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | trans | 90.2 | 151 | 166.7 | -58.2 | -84.8 | 0 | 0 | 0 | 117.8 | ||||
| 207 | A | 35.8 | Very low | 32.5 | Very low | 89 Ų | 89 | 114.6 Ų | 114.6 | 74% | 0.736 | 78% | 0.783 | S | S | * | * | cis | 171 | 137.2 | -46.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 208 | G | 30.5 | Very low | 32 | Very low | 72 Ų | 72 | 119.8 Ų | 119.8 | 74% | 0.742 | 80% | 0.796 | S | S | * | * | trans | 76 | 166.4 | 173 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 209 | E | 30.9 | Very low | 31.8 | Very low | 193 Ų | 193 | 119 Ų | 119 | 90% | 0.902 | 79% | 0.785 | S | S | * | * | cis | -157 | 167.6 | -19.6 | -159.7 | 163.1 | 138 | 0 | 0 | 110.1 | ||||
| 210 | A | 32 | Very low | 31.9 | Very low | 98 Ų | 98 | 124.2 Ų | 124.2 | 81% | 0.81 | 79% | 0.789 | S | S | * | * | trans | -4.7 | 138.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 211 | G | 30.2 | Very low | 31.9 | Very low | 87 Ų | 87 | 121 Ų | 121 | 90% | 0.897 | 78% | 0.775 | S | S | * | * | trans | -176.2 | 124.5 | 160.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 212 | G | 29.1 | Very low | 31.8 | Very low | 67 Ų | 67 | 121.5 Ų | 121.5 | 69% | 0.691 | 78% | 0.778 | S | S | * | * | trans | -142.3 | -165.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 213 | V | 32.2 | Very low | 31.9 | Very low | 153 Ų | 153 | 121.7 Ų | 121.7 | 93% | 0.927 | 77% | 0.773 | S | S | * | * | trans | 71.4 | 142.2 | -179.2 | -176.2 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 214 | D | 28.9 | Very low | 31.9 | Very low | 142 Ų | 142 | 121.6 Ų | 121.6 | 76% | 0.759 | 76% | 0.76 | S | S | * | * | cis | -169.1 | 173.5 | -26.2 | -179.6 | 30.6 | 0 | 0 | 0 | 107.3 | ||||
| 215 | A | 30.4 | Very low | 32.1 | Very low | 65 Ų | 65 | 124.4 Ų | 124.4 | 54% | 0.537 | 75% | 0.752 | S | S | . | * | trans | 70.6 | 152.6 | 149.7 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 216 | T | 29 | Very low | 32.1 | Very low | 145 Ų | 145 | 122.1 Ų | 122.1 | 89% | 0.89 | 74% | 0.744 | S | S | * | * | trans | 61.3 | 132 | 160.5 | 46.1 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 217 | G | 30.6 | Very low | 32.2 | Very low | 64 Ų | 64 | 121.9 Ų | 121.9 | 66% | 0.66 | 74% | 0.743 | S | S | * | * | cis | 170.1 | 173 | -5.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 218 | E | 32.2 | Very low | 32.1 | Very low | 148 Ų | 148 | 122.8 Ų | 122.8 | 69% | 0.692 | 74% | 0.735 | S | S | * | * | trans | 50.7 | 105.7 | 151.5 | -56.6 | -156.7 | 94.5 | 0 | 0 | 119 | ||||
| 219 | R | 32 | Very low | 32.4 | Very low | 192 Ų | 192 | 129.3 Ų | 129.3 | 73% | 0.725 | 74% | 0.737 | S | S | * | * | 77.9 | 121.6 | 94.8 | -75 | 173.6 | 178 | 166.3 | -7.5 | 114.8 | T221 | R219-T221 HydrophobicContact CB-CG2 3.81Å; R219-T221 HydrophobicContact CG-CG2 3.85Å | |||
| 220 | H | 35.2 | Very low | 32.4 | Very low | 181 Ų | 181 | 127.5 Ų | 127.5 | 84% | 0.838 | 73% | 0.729 | S | S | * | * | -157.1 | 121 | 112.6 | -94.8 | -168.9 | 0 | 0 | 0 | 106.8 | |||||
| 221 | T | 29.4 | Very low | 32.7 | Very low | 87 Ų | 87 | 126.3 Ų | 126.3 | 53% | 0.534 | 71% | 0.714 | S | S | . | * | cis | 95.8 | 125.8 | 24.4 | 68.3 | 0 | 0 | 0 | 0 | 115.8 | R219 | R219-T221 HydrophobicContact CB-CG2 3.81Å; R219-T221 HydrophobicContact CG-CG2 3.85Å | ||
| 222 | V | 33.5 | Very low | 33.1 | Very low | 142 Ų | 142 | 130 Ų | 130 | 86% | 0.861 | 71% | 0.708 | S | S | * | * | trans | 71.9 | 144.8 | 151.5 | 170.2 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 223 | A | 34.8 | Very low | 33.6 | Very low | 81 Ų | 81 | 133.7 Ų | 133.7 | 67% | 0.669 | 71% | 0.711 | S | S | * | * | cis | -139.2 | -172.8 | 14 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 224 | T | 33.6 | Very low | 33.8 | Very low | 107 Ų | 107 | 134.2 Ų | 134.2 | 66% | 0.656 | 70% | 0.701 | S | S | * | * | cis | -168.4 | 177.7 | -37.1 | 35.7 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 225 | H | 36.9 | Very low | 34.3 | Very low | 140 Ų | 140 | 134.9 Ų | 134.9 | 65% | 0.648 | 70% | 0.699 | S | S | * | * | cis | -135.7 | 149.9 | 10.1 | -91.2 | -79.2 | 0 | 0 | 0 | 107.9 | ||||
| 226 | Q | 35.1 | Very low | 34.7 | Very low | 136 Ų | 136 | 139.4 Ų | 139.4 | 64% | 0.636 | 71% | 0.709 | S | S | * | * | 51 | 129.8 | 85.5 | -60.4 | -179.2 | -34 | 0 | 0 | 115.2 | |||||
| 227 | H | 33.4 | Very low | 35.2 | Very low | 171 Ų | 171 | 140.8 Ų | 140.8 | 79% | 0.792 | 71% | 0.707 | S | S | * | * | cis | -115.2 | 156 | 35.2 | -74.4 | -38.7 | 0 | 0 | 0 | 114.5 | ||||
| 228 | D | 34.5 | Very low | 35.5 | Very low | 107 Ų | 107 | 141.3 Ų | 141.3 | 57% | 0.572 | 71% | 0.713 | S | S | * | * | cis | 69.8 | 132.7 | 45.7 | -81.5 | -57.1 | 0 | 0 | 0 | 113.4 | ||||
| 229 | R | 36 | Very low | 36.4 | Very low | 209 Ų | 209 | 144.1 Ų | 144.1 | 79% | 0.789 | 72% | 0.723 | S | S | * | * | cis | -161.9 | 167.4 | 1.1 | -154 | -179.5 | -157.4 | -158.7 | 4.7 | 112.2 | ||||
| 230 | H | 30.6 | Very low | 37.2 | Very low | 156 Ų | 156 | 141.3 Ų | 141.3 | 72% | 0.722 | 73% | 0.73 | S | S | * | * | trans | 102.8 | 100 | 173 | -75.4 | -70.2 | 0 | 0 | 0 | 114.3 | ||||
| 231 | S | 40.2 | Very low | 37.2 | Very low | 73 Ų | 73 | 136.1 Ų | 136.1 | 51% | 0.51 | 73% | 0.725 | S | S | . | * | 93.5 | 102.2 | 80.5 | -79.2 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 232 | E | 37.9 | Very low | 37.5 | Very low | 165 Ų | 165 | 137.6 Ų | 137.6 | 77% | 0.771 | 74% | 0.739 | S | S | * | * | 77.8 | 128.5 | 94.6 | -73.3 | 162.2 | 123.8 | 0 | 0 | 111.1 | |||||
| 233 | I | 40 | Very low | 37.9 | Very low | 144 Ų | 144 | 138.2 Ų | 138.2 | 74% | 0.738 | 74% | 0.737 | S | S | * | * | cis | -147.7 | 134.6 | 22.6 | -124.6 | 150.6 | 0 | 0 | 0 | 111.3 | ||||
| 234 | K | 35.7 | Very low | 38.1 | Very low | 164 Ų | 164 | 138.7 Ų | 138.7 | 71% | 0.713 | 74% | 0.741 | S | S | * | * | trans | 64.5 | 116.1 | 133.1 | -138.5 | 157.6 | -174.7 | 173.7 | 0 | 118.5 | ||||
| 235 | E | 40.3 | Very low | 38.3 | Very low | 156 Ų | 156 | 137 Ų | 137 | 73% | 0.729 | 75% | 0.745 | S | S | * | * | 50.7 | 141.1 | 82.7 | -59.4 | 165.8 | 157.9 | 0 | 0 | 113.9 | |||||
| 236 | E | 38.3 | Very low | 38.6 | Very low | 160 Ų | 160 | 139 Ų | 139 | 75% | 0.748 | 76% | 0.758 | S | S | * | * | cis | -147.1 | -177.6 | 16.8 | -142.4 | -174.8 | 130.3 | 0 | 0 | 113.3 | ||||
| 237 | M | 39.7 | Very low | 39.2 | Very low | 173 Ų | 173 | 138.1 Ų | 138.1 | 85% | 0.852 | 76% | 0.763 | S | S | * | * | trans | -73 | 141 | -172.9 | -63.1 | 164.3 | -79.9 | 0 | 0 | 113.8 | ||||
| 238 | G | 36 | Very low | 39.4 | Very low | 76 Ų | 76 | 133.6 Ų | 133.6 | 78% | 0.784 | 76% | 0.763 | S | S | * | * | trans | -140.8 | 145.5 | 166.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 239 | K | 50.4 | Low | 39.8 | Very low | 206 Ų | 206 | 136.2 Ų | 136.2 | 90% | 0.896 | 78% | 0.775 | S | S | * | * | trans | -100.1 | 157.6 | -174.9 | -97.2 | -179.9 | 177.7 | 175.7 | 0 | 112.8 | ||||
| 240 | P | 50.6 | Low | 40.2 | Very low | 133 Ų | 133 | 134.7 Ų | 134.7 | 86% | 0.864 | 78% | 0.777 | S | S | * | * | trans | -77.3 | 144.5 | -162 | 30.9 | -36.7 | 0 | 0 | 0 | 113.5 | ||||
| 241 | G | 35 | Very low | 40.6 | Very low | 72 Ų | 72 | 133.2 Ų | 133.2 | 74% | 0.742 | 77% | 0.774 | S | S | * | * | trans | -171.8 | 122.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 242 | S | 36 | Very low | 40.8 | Very low | 119 Ų | 119 | 134.9 Ų | 134.9 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | trans | 29.1 | 126.7 | 147.3 | -133.6 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 243 | D | 41.6 | Very low | 41.2 | Very low | 154 Ų | 154 | 135.1 Ų | 135.1 | 82% | 0.824 | 79% | 0.787 | S | S | * | * | trans | 77.3 | 161.3 | 131.6 | -161.3 | 28.8 | 0 | 0 | 0 | 120.1 | ||||
| 244 | A | 39 | Very low | 41.2 | Very low | 91 Ų | 91 | 133.6 Ų | 133.6 | 75% | 0.752 | 78% | 0.784 | S | S | * | * | trans | 66.3 | 130.7 | 169.7 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 245 | G | 36.2 | Very low | 41.1 | Very low | 72 Ų | 72 | 128.8 Ų | 128.8 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | trans | 109.8 | 57.8 | 146.8 | 0 | 0 | 0 | 0 | 0 | 118.4 | P247 | G245-P247 VanDerWaalsContact C-CD 3.44Å; G245-P247 VanDerWaalsContact O-CD 3.28Å; G245-P247 WeakPolarHBondContact O-CD 3.26Å | ||
| 246 | M | 44.5 | Very low | 40.9 | Very low | 183 Ų | 183 | 130.8 Ų | 130.8 | 90% | 0.901 | 79% | 0.787 | S | S | * | * | trans | -88.2 | 105.6 | 149.3 | -175.7 | -172 | 77.2 | 0 | 0 | 109.4 | ||||
| 247 | P | 48 | Very low | 41 | Very low | 117 Ų | 117 | 131.8 Ų | 131.8 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | trans | -134.1 | 140.1 | 144.6 | 36.8 | -25.4 | 0 | 0 | 0 | 111.8 | G245 | G245-P247 VanDerWaalsContact C-CD 3.44Å; G245-P247 VanDerWaalsContact O-CD 3.28Å; G245-P247 WeakPolarHBondContact O-CD 3.26Å | ||
| 248 | G | 36.3 | Very low | 40.8 | Very low | 75 Ų | 75 | 131 Ų | 131 | 77% | 0.773 | 79% | 0.794 | S | S | * | * | trans | 169.7 | 35.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 249 | I | 44.3 | Very low | 40.6 | Very low | 162 Ų | 162 | 135.5 Ų | 135.5 | 83% | 0.831 | 79% | 0.794 | S | S | * | * | trans | -111.9 | 101.6 | 176.4 | 42.7 | 159.2 | 0 | 0 | 0 | 109.8 | ||||
| 250 | E | 44.2 | Very low | 39.7 | Very low | 178 Ų | 178 | 131.1 Ų | 131.1 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | trans | -138.7 | 134.7 | 159.8 | -71.7 | -177 | 162.2 | 0 | 0 | 104.6 | ||||
| 251 | D | 38.8 | Very low | 38.9 | Very low | 124 Ų | 124 | 132.2 Ų | 132.2 | 66% | 0.663 | 78% | 0.778 | S | S | * | * | cis | -157.6 | 177.5 | 7.9 | -116.5 | -10 | 0 | 0 | 0 | 112.9 | ||||
| 252 | S | 45.1 | Very low | 38.7 | Very low | 109 Ų | 109 | 137.3 Ų | 137.3 | 76% | 0.762 | 78% | 0.78 | S | S | * | * | trans | 70.9 | 87.3 | 176.3 | -54.1 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 253 | E | 44.9 | Very low | 38.4 | Very low | 169 Ų | 169 | 135.6 Ų | 135.6 | 79% | 0.79 | 77% | 0.773 | S | S | * | * | 58.3 | 147.6 | 51.6 | -51.4 | -163.7 | 178.4 | 0 | 0 | 114.2 | |||||
| 254 | V | 39.3 | Very low | 38 | Very low | 113 Ų | 113 | 135.2 Ų | 135.2 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | cis | -155.9 | 144.5 | -16 | 127.9 | 0 | 0 | 0 | 0 | 103.1 | ||||
| 255 | G | 33.9 | Very low | 37.7 | Very low | 62 Ų | 62 | 139.3 Ų | 139.3 | 64% | 0.639 | 77% | 0.771 | S | S | * | * | cis | 105.8 | 167.7 | 36.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 256 | K | 37.8 | Very low | 37.7 | Very low | 198 Ų | 198 | 145.3 Ų | 145.3 | 86% | 0.861 | 78% | 0.776 | S | S | * | * | trans | 81.2 | 127.9 | -177.9 | -53.5 | -178.2 | -178 | 177.6 | 0 | 116 | ||||
| 257 | M | 39.8 | Very low | 37.9 | Very low | 182 Ų | 182 | 142.5 Ų | 142.5 | 90% | 0.897 | 77% | 0.772 | S | S | * | * | trans | -117.9 | 151.4 | 176.1 | -49 | 162.1 | -171.4 | 0 | 0 | 106.1 | ||||
| 258 | D | 35.6 | Very low | 37.1 | Very low | 157 Ų | 157 | 141 Ų | 141 | 84% | 0.84 | 77% | 0.769 | S | S | * | * | trans | -136 | 126.8 | 157.7 | -74.3 | -64.5 | 0 | 0 | 0 | 105.5 | ||||
| 259 | E | 30.8 | Very low | 37.1 | Very low | 170 Ų | 170 | 144.4 Ų | 144.4 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | cis | 95.6 | 137.7 | 43.4 | -172.1 | 94.6 | -121.7 | 0 | 0 | 111.6 | ||||
| 260 | V | 33.1 | Very low | 36.6 | Very low | 114 Ų | 114 | 142.2 Ų | 142.2 | 69% | 0.691 | 76% | 0.763 | S | S | * | * | trans | 70.4 | 84.8 | 174.8 | -154.3 | 0 | 0 | 0 | 0 | 121 | ||||
| 261 | Q | 33.3 | Very low | 36.1 | Very low | 155 Ų | 155 | 142.4 Ų | 142.4 | 72% | 0.724 | 76% | 0.764 | S | S | * | * | 38.4 | 152.1 | 115.3 | -53 | 178.8 | -0.6 | 0 | 0 | 125.3 | |||||
| 262 | F | 29.9 | Very low | 35.7 | Very low | 180 Ų | 180 | 146.3 Ų | 146.3 | 79% | 0.789 | 78% | 0.775 | S | S | * | * | trans | 90.6 | 98.5 | 145.3 | -84.3 | -63.3 | 0 | 0 | 0 | 124.1 | ||||
| 263 | A | 30.9 | Very low | 35 | Very low | 82 Ų | 82 | 149.6 Ų | 149.6 | 68% | 0.678 | 78% | 0.778 | S | S | * | * | trans | 61.8 | 152.1 | 133.6 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 264 | L | 32.5 | Very low | 34.1 | Very low | 146 Ų | 146 | 148 Ų | 148 | 76% | 0.764 | 78% | 0.775 | S | S | * | * | cis | -149.6 | 154.3 | 39.5 | -92.3 | 88.1 | 0 | 0 | 0 | 115.1 | ||||
| 265 | K | 32 | Very low | 33.6 | Very low | 178 Ų | 178 | 151 Ų | 151 | 77% | 0.774 | 78% | 0.781 | S | S | * | * | trans | 24 | 111.5 | 146 | -63.3 | 173.8 | -175.9 | 170.8 | 0 | 119.3 | ||||
| 266 | K | 37.6 | Very low | 33.7 | Very low | 197 Ų | 197 | 152.2 Ų | 152.2 | 86% | 0.857 | 79% | 0.786 | S | S | * | * | 76.9 | 152.4 | 87.5 | -78.7 | -170.9 | 177.4 | -168.7 | 0 | 116 | |||||
| 267 | P | 47.1 | Very low | 33.8 | Very low | 125 Ų | 125 | 149 Ų | 149 | 81% | 0.812 | 79% | 0.785 | S | S | * | * | cis | -104.1 | -142.2 | -15.9 | 40.5 | -27.5 | 0 | 0 | 0 | 109.5 | ||||
| 268 | A | 31.6 | Very low | 33.3 | Very low | 84 Ų | 84 | 147.3 Ų | 147.3 | 69% | 0.694 | 78% | 0.779 | S | S | * | * | cis | -156 | 165.1 | -6.6 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 269 | I | 37.3 | Very low | 33.2 | Very low | 147 Ų | 147 | 146 Ų | 146 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | cis | 131.4 | 102.2 | -0.4 | -78.6 | 175.5 | 0 | 0 | 0 | 110.9 | ||||
| 270 | T | 33.7 | Very low | 33.1 | Very low | 117 Ų | 117 | 141.4 Ų | 141.4 | 72% | 0.718 | 78% | 0.775 | S | S | * | * | trans | 46.8 | 134.7 | 150.4 | 62.2 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 271 | Q | 33.1 | Very low | 33.1 | Very low | 182 Ų | 182 | 141 Ų | 141 | 85% | 0.85 | 78% | 0.784 | S | S | * | * | cis | 66.4 | 101.6 | 35 | -164.2 | -166.9 | 12 | 0 | 0 | 116.1 | ||||
| 272 | K | 31.2 | Very low | 32.9 | Very low | 206 Ų | 206 | 138.2 Ų | 138.2 | 90% | 0.896 | 79% | 0.787 | S | S | * | * | trans | -154.7 | 155.5 | 153.2 | -89.3 | -140.4 | 171.8 | -167.4 | 0 | 112.6 | ||||
| 273 | Q | 28.6 | Very low | 32.9 | Very low | 177 Ų | 177 | 135 Ų | 135 | 83% | 0.827 | 79% | 0.794 | S | S | * | * | trans | -103 | 175 | 165.6 | -66.4 | 170.6 | -37.9 | 0 | 0 | 109.8 | ||||
| 274 | N | 26.9 | Very low | 32.8 | Very low | 135 Ų | 135 | 134.4 Ų | 134.4 | 72% | 0.722 | 80% | 0.796 | S | S | * | * | trans | 27.5 | 150.8 | 146.4 | -63.6 | 27.5 | 0 | 0 | 0 | 121 | ||||
| 275 | E | 28.4 | Very low | 32.7 | Very low | 176 Ų | 176 | 132.6 Ų | 132.6 | 82% | 0.822 | 80% | 0.802 | S | S | * | * | cis | -148.9 | -163.7 | 18.1 | -148.5 | 146.7 | 102.7 | 0 | 0 | 112.5 | ||||
| 276 | A | 35.8 | Very low | 32.5 | Very low | 89 Ų | 89 | 127.5 Ų | 127.5 | 74% | 0.736 | 80% | 0.8 | S | S | * | * | trans | -85.5 | 168.5 | -170.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 277 | P | 40.1 | Very low | 32.9 | Very low | 129 Ų | 129 | 124.8 Ų | 124.8 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | trans | -120.2 | 163.8 | 156.3 | 38.9 | -28.6 | 0 | 0 | 0 | 113.6 | ||||
| 278 | D | 29.8 | Very low | 31.9 | Very low | 147 Ų | 147 | 121.7 Ų | 121.7 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | trans | -114.3 | -176.6 | 175.7 | -176.5 | 28.2 | 0 | 0 | 0 | 111.1 | ||||
| 279 | V | 33 | Very low | 31.9 | Very low | 130 Ų | 130 | 125.6 Ų | 125.6 | 79% | 0.788 | 80% | 0.802 | S | S | * | * | trans | 68.2 | 117.6 | 167 | -65.4 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 280 | G | 29.5 | Very low | 31.3 | Very low | 74 Ų | 74 | 126.9 Ų | 126.9 | 76% | 0.763 | 81% | 0.805 | S | S | * | * | 131.5 | 74.2 | 108.4 | 0 | 0 | 0 | 0 | 0 | 121 | |||||
| 281 | A | 31.9 | Very low | 31.2 | Very low | 106 Ų | 106 | 125.5 Ų | 125.5 | 88% | 0.876 | 81% | 0.805 | S | S | * | * | trans | 70.6 | 141.4 | 139.2 | 0 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 282 | A | 29.6 | Very low | 31.2 | Very low | 96 Ų | 96 | 120.8 Ų | 120.8 | 79% | 0.793 | 80% | 0.797 | S | S | * | * | trans | 93.4 | 113.1 | 144.3 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 283 | A | 30.3 | Very low | 31.3 | Very low | 111 Ų | 111 | 118.7 Ų | 118.7 | 92% | 0.917 | 80% | 0.796 | S | S | * | * | trans | 61.7 | 145.1 | 161.5 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 284 | G | 27.9 | Very low | 31.4 | Very low | 70 Ų | 70 | 113.5 Ų | 113.5 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | cis | 169.6 | 161.2 | -6.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 285 | A | 30.4 | Very low | 32.2 | Very low | 109 Ų | 109 | 113.4 Ų | 113.4 | 90% | 0.901 | 80% | 0.796 | S | S | * | * | trans | 70.4 | 143.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 286 | G | 29.1 | Very low | 32.3 | Very low | 70 Ų | 70 | 108.9 Ų | 108.9 | 72% | 0.722 | 80% | 0.797 | S | S | * | * | trans | -100.5 | -155.3 | 153.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 287 | P | 44.8 | Very low | 32.1 | Very low | 140 Ų | 140 | 108.4 Ų | 108.4 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | cis | -133.7 | -168.5 | 9.1 | 43.2 | -25.6 | 0 | 0 | 0 | 114.4 | ||||
| 288 | G | 27.3 | Very low | 31.7 | Very low | 61 Ų | 61 | 112 Ų | 112 | 63% | 0.629 | 81% | 0.807 | S | S | * | * | trans | 145.4 | 138.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 289 | L | 31 | Very low | 31.7 | Very low | 165 Ų | 165 | 108.5 Ų | 108.5 | 86% | 0.864 | 81% | 0.805 | S | S | * | * | cis | 60.3 | 130.3 | 39.2 | -55.5 | 171.9 | 0 | 0 | 0 | 111.7 | ||||
| 290 | E | 25.5 | Very low | 31.6 | Very low | 175 Ų | 175 | 111.4 Ų | 111.4 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | cis | -151.3 | -170.1 | 18.8 | -145.6 | 169.3 | 120 | 0 | 0 | 112.5 | ||||
| 291 | A | 31.6 | Very low | 31.8 | Very low | 88 Ų | 88 | 115.6 Ų | 115.6 | 73% | 0.727 | 82% | 0.817 | S | S | * | * | trans | -16.1 | 157.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 292 | A | 33 | Very low | 31.8 | Very low | 83 Ų | 83 | 119 Ų | 119 | 69% | 0.686 | 82% | 0.819 | S | S | * | * | cis | -165.4 | 170.5 | 38.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 293 | D | 33 | Very low | 32 | Very low | 161 Ų | 161 | 121.6 Ų | 121.6 | 86% | 0.861 | 82% | 0.82 | S | S | * | * | trans | 44 | 129 | 149.8 | -59.3 | -21 | 0 | 0 | 0 | 123.1 | ||||
| 294 | G | 29.6 | Very low | 32.3 | Very low | 69 Ų | 69 | 123.4 Ų | 123.4 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | trans | -93.5 | -148.2 | 152.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 295 | P | 45.7 | Very low | 33 | Very low | 132 Ų | 132 | 125.9 Ų | 125.9 | 86% | 0.857 | 81% | 0.813 | S | S | * | * | cis | -135.5 | -179.1 | 1.8 | 43.3 | -27.6 | 0 | 0 | 0 | 114.9 | ||||
| 296 | G | 30 | Very low | 32.8 | Very low | 81 Ų | 81 | 129.8 Ų | 129.8 | 84% | 0.835 | 80% | 0.804 | S | S | * | * | trans | 88.5 | 115.3 | 142.2 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 297 | G | 30.9 | Very low | 32.9 | Very low | 80 Ų | 80 | 134.9 Ų | 134.9 | 83% | 0.825 | 81% | 0.814 | S | S | * | * | trans | -139.9 | 88.4 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 298 | Q | 31.4 | Very low | 32.2 | Very low | 203 Ų | 203 | 134.6 Ų | 134.6 | 95% | 0.949 | 80% | 0.801 | S | S | * | * | trans | -82.2 | 145.2 | 153.2 | -65.5 | 158.6 | -30.8 | 0 | 0 | 106.6 | ||||
| 299 | G | 30.7 | Very low | 32.5 | Very low | 74 Ų | 74 | 138.9 Ų | 138.9 | 76% | 0.763 | 80% | 0.804 | S | S | * | * | cis | 111.1 | 80.8 | 12.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 300 | M | 31.3 | Very low | 32.4 | Very low | 192 Ų | 192 | 136.5 Ų | 136.5 | 95% | 0.946 | 79% | 0.792 | S | S | * | * | trans | -159.4 | 161 | 162.8 | -124.7 | -178.3 | -177.3 | 0 | 0 | 114.6 | ||||
| 301 | L | 32.4 | Very low | 32.7 | Very low | 162 Ų | 162 | 137.6 Ų | 137.6 | 85% | 0.848 | 79% | 0.789 | S | S | * | * | trans | -71.5 | 166.8 | -179.8 | -81.6 | 91.9 | 0 | 0 | 0 | 113.8 | ||||
| 302 | L | 32.8 | Very low | 32.6 | Very low | 176 Ų | 176 | 140.4 Ų | 140.4 | 92% | 0.921 | 79% | 0.791 | S | S | * | * | trans | -130 | 154 | 153.4 | -105.9 | 163.6 | 0 | 0 | 0 | 110 | ||||
| 303 | D | 32.4 | Very low | 32.6 | Very low | 152 Ų | 152 | 145 Ų | 145 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | trans | -117.5 | 168.1 | -155.6 | -164.7 | 15.2 | 0 | 0 | 0 | 114.1 | ||||
| 304 | Q | 36.8 | Very low | 32.3 | Very low | 148 Ų | 148 | 141.2 Ų | 141.2 | 69% | 0.692 | 80% | 0.798 | S | S | * | * | trans | -83.6 | 155 | 176.8 | -176.2 | -178.8 | 114.5 | 0 | 0 | 112.1 | ||||
| 305 | P | 44.3 | Very low | 32.2 | Very low | 122 Ų | 122 | 149.6 Ų | 149.6 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | trans | -119.2 | 143.6 | 156.8 | 36.2 | -27 | 0 | 0 | 0 | 113.1 | ||||
| 306 | R | 25.8 | Very low | 31.3 | Very low | 191 Ų | 191 | 147.8 Ų | 147.8 | 72% | 0.721 | 80% | 0.804 | S | S | * | * | trans | -151.1 | 132.2 | 174.6 | 179.6 | -175.7 | -177.9 | 168.7 | 2.4 | 110.3 | ||||
| 307 | L | 30.3 | Very low | 31.1 | Very low | 178 Ų | 178 | 148 Ų | 148 | 93% | 0.932 | 81% | 0.806 | S | S | * | * | trans | -145 | 163.6 | 164.2 | -80.7 | -175.9 | 0 | 0 | 0 | 111.6 | ||||
| 308 | Q | 30.6 | Very low | 30.8 | Very low | 134 Ų | 134 | 147.6 Ų | 147.6 | 63% | 0.626 | 80% | 0.802 | S | S | * | * | trans | -123.2 | 141.1 | -172 | -93.2 | 176.4 | -82.3 | 0 | 0 | 109.5 | ||||
| 309 | Q | 33.8 | Very low | 30.7 | Very low | 150 Ų | 150 | 146.7 Ų | 146.7 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | 77.6 | 141.4 | 100.9 | -158.3 | 171.4 | -14.7 | 0 | 0 | 112.8 | |||||
| 310 | D | 28.4 | Very low | 30.6 | Very low | 115 Ų | 115 | 147.3 Ų | 147.3 | 62% | 0.615 | 80% | 0.8 | S | S | * | * | cis | -157.4 | 146.4 | 41.7 | -154.6 | 28.6 | 0 | 0 | 0 | 115.3 | ||||
| 311 | R | 31.1 | Very low | 31.5 | Very low | 198 Ų | 198 | 143.8 Ų | 143.8 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | trans | 34.9 | 129.5 | 134.5 | -170.6 | -178.9 | -168.5 | 165.3 | 4 | 124.1 | ||||
| 312 | L | 30.2 | Very low | 32.5 | Very low | 147 Ų | 147 | 140.6 Ų | 140.6 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | -170.7 | -177.9 | 118.2 | -102.5 | 174.1 | 0 | 0 | 0 | 113.4 | |||||
| 313 | E | 33 | Very low | 32.3 | Very low | 180 Ų | 180 | 138 Ų | 138 | 84% | 0.841 | 77% | 0.772 | S | S | * | * | trans | -94.9 | 161.3 | -155.1 | -59.7 | 167.7 | 143.2 | 0 | 0 | 116.9 | ||||
| 314 | G | 27.1 | Very low | 32.3 | Very low | 82 Ų | 82 | 137 Ų | 137 | 85% | 0.845 | 77% | 0.765 | S | S | * | * | trans | -171.6 | 157.5 | 173 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 315 | R | 26.3 | Very low | 31.9 | Very low | 245 Ų | 245 | 137.2 Ų | 137.2 | 93% | 0.925 | 77% | 0.769 | S | S | * | * | trans | -140.6 | 138.1 | -166 | 170.5 | 174.9 | 172.1 | 179.4 | -1.5 | 115.4 | ||||
| 316 | A | 26.7 | Very low | 31.3 | Very low | 93 Ų | 93 | 139.4 Ų | 139.4 | 77% | 0.769 | 77% | 0.767 | S | S | * | * | trans | 71.6 | 124.9 | 156 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 317 | G | 26.4 | Very low | 31.3 | Very low | 85 Ų | 85 | 139.2 Ų | 139.2 | 88% | 0.876 | 77% | 0.774 | S | S | * | * | 105.3 | 128.9 | 119.4 | 0 | 0 | 0 | 0 | 0 | 119 | |||||
| 318 | G | 24.8 | Very low | 31 | Very low | 72 Ų | 72 | 134.1 Ų | 134.1 | 74% | 0.742 | 76% | 0.764 | S | S | * | * | trans | 136.6 | 96.7 | 150.2 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 319 | L | 29.3 | Very low | 30.8 | Very low | 184 Ų | 184 | 133.8 Ų | 133.8 | 96% | 0.963 | 77% | 0.767 | S | S | * | * | trans | 64.6 | 166.9 | 142.6 | -61.5 | 164.5 | 0 | 0 | 0 | 119.8 | ||||
| 320 | A | 27.9 | Very low | 30.7 | Very low | 87 Ų | 87 | 135.3 Ų | 135.3 | 72% | 0.719 | 77% | 0.771 | S | S | * | * | trans | -156.7 | -156.6 | -172.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 321 | P | 51.7 | Low | 31.3 | Very low | 118 Ų | 118 | 134.8 Ų | 134.8 | 77% | 0.766 | 77% | 0.774 | S | S | * | * | -105.9 | -142.1 | -74.6 | 39 | -23.3 | 0 | 0 | 0 | 108.7 | |||||
| 322 | P | 52.8 | Low | 31 | Very low | 96 Ų | 96 | 132.7 Ų | 132.7 | 62% | 0.623 | 78% | 0.776 | S | S | * | * | cis | -125.1 | -163.7 | -16.8 | 40.5 | -19.8 | 0 | 0 | 0 | 112.6 | I324 | P322-I324 HydrophobicContact CB-CD1 4.34Å; P322-I324 HydrophobicContact CB-CG1 4.2Å; P322-I324 HydrophobicContact CG-CD1 4.34Å | ||
| 323 | V | 28 | Very low | 30.9 | Very low | 121 Ų | 121 | 131.6 Ų | 131.6 | 73% | 0.733 | 78% | 0.775 | S | S | * | * | -157.9 | 113.5 | 73.5 | 163.8 | 0 | 0 | 0 | 0 | 108.3 | |||||
| 324 | I | 32.1 | Very low | 30.5 | Very low | 131 Ų | 131 | 131.7 Ų | 131.7 | 67% | 0.672 | 77% | 0.773 | S | S | * | * | 51.3 | 123.4 | 93.8 | -38.4 | 162 | 0 | 0 | 0 | 112.5 | P322 | P322-I324 HydrophobicContact CB-CD1 4.34Å; P322-I324 HydrophobicContact CB-CG1 4.2Å; P322-I324 HydrophobicContact CG-CD1 4.34Å | |||
| 325 | I | 30.2 | Very low | 30.6 | Very low | 152 Ų | 152 | 137.2 Ų | 137.2 | 78% | 0.779 | 78% | 0.777 | S | S | * | * | -170.9 | 144.1 | 83.8 | -79.3 | 171.9 | 0 | 0 | 0 | 112.8 | |||||
| 326 | K | 29.8 | Very low | 30.9 | Very low | 169 Ų | 169 | 133.7 Ų | 133.7 | 74% | 0.735 | 77% | 0.771 | S | S | * | * | trans | -3.5 | 150.5 | 156 | -62.9 | -177.4 | -179.6 | -178.1 | 0 | 122.7 | ||||
| 327 | Q | 25.7 | Very low | 31.1 | Very low | 187 Ų | 187 | 136 Ų | 136 | 87% | 0.874 | 77% | 0.77 | S | S | * | * | 68.6 | 140 | 60.2 | -115.5 | 175.9 | 8.2 | 0 | 0 | 113 | |||||
| 328 | G | 25.9 | Very low | 31.3 | Very low | 71 Ų | 71 | 137.2 Ų | 137.2 | 73% | 0.732 | 76% | 0.757 | S | S | * | * | cis | -170.5 | -148.4 | 8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 329 | D | 25.8 | Very low | 31.7 | Very low | 127 Ų | 127 | 142.8 Ų | 142.8 | 68% | 0.679 | 76% | 0.76 | S | S | * | * | trans | -76.5 | 139.9 | -162.7 | -74.2 | -105.1 | 0 | 0 | 0 | 121.1 | ||||
| 330 | K | 31.3 | Very low | 31.9 | Very low | 182 Ų | 182 | 138.8 Ų | 138.8 | 79% | 0.791 | 75% | 0.754 | S | S | * | * | trans | 58.8 | -170.4 | 135.5 | -57.6 | 170.7 | -179 | 130.5 | 0 | 117 | ||||
| 331 | P | 40.1 | Very low | 32.1 | Very low | 103 Ų | 103 | 138 Ų | 138 | 67% | 0.669 | 75% | 0.754 | S | S | * | * | cis | -133.1 | -179.7 | -14.4 | 42.8 | -26.7 | 0 | 0 | 0 | 116.2 | ||||
| 332 | I | 26.6 | Very low | 31.1 | Very low | 155 Ų | 155 | 140.2 Ų | 140.2 | 80% | 0.795 | 76% | 0.758 | S | S | * | * | trans | 67.4 | 135.4 | 148.3 | -76.7 | 159 | 0 | 0 | 0 | 116.7 | ||||
| 333 | V | 27.1 | Very low | 30.5 | Very low | 123 Ų | 123 | 145.6 Ų | 145.6 | 75% | 0.745 | 77% | 0.771 | S | S | * | * | -149.8 | 160.8 | 60.2 | 177.6 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 334 | F | 24.8 | Very low | 30.7 | Very low | 183 Ų | 183 | 144.1 Ų | 144.1 | 80% | 0.803 | 77% | 0.772 | S | S | * | * | trans | -43.7 | 157.7 | 167.3 | -64.7 | -112.5 | 0 | 0 | 0 | 118 | ||||
| 335 | E | 30 | Very low | 31.1 | Very low | 197 Ų | 197 | 145.6 Ų | 145.6 | 92% | 0.921 | 78% | 0.781 | S | S | * | * | -148.9 | 153.2 | 120.1 | -144.3 | 164.1 | -149.9 | 0 | 0 | 110.2 | |||||
| 336 | E | 32 | Very low | 31.6 | Very low | 172 Ų | 172 | 146.2 Ų | 146.2 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | -101 | 149.2 | -178.8 | -63.1 | 172.5 | 93.9 | 0 | 0 | 110.8 | ||||
| 337 | D | 31 | Very low | 31.9 | Very low | 141 Ų | 141 | 145.9 Ų | 145.9 | 75% | 0.754 | 79% | 0.786 | S | S | * | * | -172.9 | 153.2 | 116.3 | -134.2 | -13.3 | 0 | 0 | 0 | 118.5 | |||||
| 338 | N | 29.4 | Very low | 32.2 | Very low | 110 Ų | 110 | 140.8 Ų | 140.8 | 59% | 0.588 | 78% | 0.784 | S | S | * | * | trans | 52.4 | 96.9 | 146.2 | -86.3 | -56.5 | 0 | 0 | 0 | 124.7 | ||||
| 339 | K | 33.6 | Very low | 32.8 | Very low | 189 Ų | 189 | 145.9 Ų | 145.9 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | 69.4 | 119.1 | 100.5 | -177 | -174.7 | -176 | 179.4 | 0 | 122.6 | |||||
| 340 | A | 33.5 | Very low | 33.1 | Very low | 101 Ų | 101 | 148 Ų | 148 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | 170.2 | 146.4 | 117.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 341 | G | 31.9 | Very low | 33 | Very low | 69 Ų | 69 | 147.6 Ų | 147.6 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | 77 | 112.3 | 165 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 342 | I | 32 | Very low | 32.5 | Very low | 166 Ų | 166 | 152.8 Ų | 152.8 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | cis | 70.2 | 93.8 | 31.5 | -44 | 176.7 | 0 | 0 | 0 | 114.8 | ||||
| 343 | K | 39 | Very low | 32.8 | Very low | 208 Ų | 208 | 152.6 Ų | 152.6 | 90% | 0.904 | 80% | 0.797 | S | S | * | * | -170.6 | 159.3 | 118.1 | -103.1 | -172.7 | 179.2 | -163.3 | 0 | 111.7 | |||||
| 344 | A | 33.6 | Very low | 32.8 | Very low | 91 Ų | 91 | 154.5 Ų | 154.5 | 75% | 0.752 | 80% | 0.803 | S | S | * | * | trans | -153.3 | 153.6 | 176 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 345 | D | 39.5 | Very low | 33.3 | Very low | 162 Ų | 162 | 152 Ų | 152 | 87% | 0.866 | 81% | 0.805 | S | S | * | * | trans | -157.4 | 132.5 | 160.8 | -79.3 | -48.2 | 0 | 0 | 0 | 103.2 | ||||
| 346 | E | 40.3 | Very low | 33.2 | Very low | 164 Ų | 164 | 146.9 Ų | 146.9 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | cis | 92.4 | 90.8 | 20.5 | -160 | 160.2 | -160.6 | 0 | 0 | 116.3 | ||||
| 347 | L | 36.5 | Very low | 33.1 | Very low | 162 Ų | 162 | 147 Ų | 147 | 85% | 0.848 | 80% | 0.804 | S | S | * | * | trans | 49.7 | 140.6 | 143.5 | -64.5 | 171.3 | 0 | 0 | 0 | 122.2 | ||||
| 348 | G | 31.9 | Very low | 33 | Very low | 80 Ų | 80 | 143.8 Ų | 143.8 | 83% | 0.825 | 80% | 0.804 | S | S | * | * | trans | -157.4 | 113.2 | 163.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 349 | E | 38.9 | Very low | 33.3 | Very low | 178 Ų | 178 | 148.2 Ų | 148.2 | 83% | 0.832 | 82% | 0.817 | S | S | * | * | trans | -99.6 | 151.7 | 169.7 | -60.9 | -175.7 | 123.1 | 0 | 0 | 110.9 | ||||
| 350 | Q | 31.4 | Very low | 33.2 | Very low | 172 Ų | 172 | 148.4 Ų | 148.4 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | 162.7 | 108.8 | 120.8 | -87.7 | 173.8 | 31.5 | 0 | 0 | 114.7 | |||||
| 351 | Q | 29.3 | Very low | 33.2 | Very low | 174 Ų | 174 | 151.5 Ų | 151.5 | 81% | 0.813 | 82% | 0.822 | S | S | * | * | 29.1 | 117.9 | 119.6 | -172.9 | -178.4 | 44.7 | 0 | 0 | 120.3 | |||||
| 352 | R | 30.4 | Very low | 33.3 | Very low | 212 Ų | 212 | 157.6 Ų | 157.6 | 80% | 0.8 | 83% | 0.83 | S | S | * | * | trans | -172.3 | 119.9 | 133.7 | -103.2 | -168.5 | -177.6 | -165.7 | -2 | 110.6 | ||||
| 353 | Q | 31.6 | Very low | 33 | Very low | 150 Ų | 150 | 158.2 Ų | 158.2 | 70% | 0.701 | 83% | 0.831 | S | S | * | * | 89.4 | 117.4 | 85.8 | -83.7 | -177.1 | -17.2 | 0 | 0 | 115.4 | |||||
| 354 | N | 28.5 | Very low | 32.8 | Very low | 163 Ų | 163 | 155.9 Ų | 155.9 | 87% | 0.872 | 83% | 0.827 | S | S | * | * | trans | -79.8 | 159.3 | 166.8 | -64.8 | -14.9 | 0 | 0 | 0 | 111.7 | ||||
| 355 | P | 34.9 | Very low | 32.7 | Very low | 130 Ų | 130 | 156.9 Ų | 156.9 | 84% | 0.844 | 83% | 0.825 | S | S | * | * | trans | -125 | 166.5 | 131.7 | 37.1 | -29.7 | 0 | 0 | 0 | 111.9 | ||||
| 356 | A | 28.6 | Very low | 32.3 | Very low | 91 Ų | 91 | 157 Ų | 157 | 75% | 0.752 | 83% | 0.825 | S | S | * | * | trans | -115 | 150 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 357 | D | 28.8 | Very low | 32.1 | Very low | 175 Ų | 175 | 154.8 Ų | 154.8 | 94% | 0.936 | 83% | 0.825 | S | S | * | * | trans | 172 | 164.1 | 131.1 | -103.4 | -36.8 | 0 | 0 | 0 | 111.9 | ||||
| 358 | G | 28.5 | Very low | 32 | Very low | 73 Ų | 73 | 155.7 Ų | 155.7 | 75% | 0.753 | 83% | 0.825 | S | S | * | * | trans | 125.6 | 80.7 | 162.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 359 | K | 35.9 | Very low | 31.9 | Very low | 202 Ų | 202 | 158.3 Ų | 158.3 | 88% | 0.878 | 82% | 0.819 | S | S | * | * | trans | -74.7 | 136.8 | 171.2 | -60.7 | 168.3 | -177 | 171.4 | 0 | 111.1 | ||||
| 360 | H | 32.8 | Very low | 31.6 | Very low | 193 Ų | 193 | 156.6 Ų | 156.6 | 89% | 0.894 | 82% | 0.816 | S | S | * | * | trans | -153 | 121.5 | 147.1 | -122 | -75.4 | 0 | 0 | 0 | 113.4 | ||||
| 361 | L | 33 | Very low | 31.7 | Very low | 166 Ų | 166 | 151.9 Ų | 151.9 | 87% | 0.869 | 81% | 0.806 | S | S | * | * | trans | -80 | 140.6 | 175.7 | -74.2 | 148 | 0 | 0 | 0 | 111.1 | ||||
| 362 | K | 33.3 | Very low | 31.8 | Very low | 198 Ų | 198 | 152.4 Ų | 152.4 | 86% | 0.861 | 81% | 0.809 | S | S | * | * | trans | -153.9 | 80.8 | 163.4 | -135.9 | 172 | -172.4 | 178.6 | 0 | 115.1 | ||||
| 363 | M | 26.9 | Very low | 31.9 | Very low | 178 Ų | 178 | 148.7 Ų | 148.7 | 88% | 0.877 | 81% | 0.81 | S | S | * | * | trans | 31.6 | 106.7 | 136.9 | -172.3 | 179.4 | -71.7 | 0 | 0 | 118.2 | ||||
| 364 | I | 33.6 | Very low | 32.4 | Very low | 159 Ų | 159 | 146.2 Ų | 146.2 | 82% | 0.815 | 81% | 0.807 | S | S | * | * | trans | -107.7 | 130 | 165.3 | -61.9 | 169.5 | 0 | 0 | 0 | 108.6 | ||||
| 365 | P | 32.2 | Very low | 32.4 | Very low | 112 Ų | 112 | 147.6 Ų | 147.6 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -81 | 139.3 | 172.1 | -12.9 | 29.9 | 0 | 0 | 0 | 113.2 | ||
| 366 | L | 31.4 | Very low | 32.8 | Very low | 166 Ų | 166 | 146.5 Ų | 146.5 | 87% | 0.869 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -82.2 | 141.1 | 171.3 | -74.1 | 158.9 | 0 | 0 | 0 | 112.1 | ||
| 367 | P | 36.4 | Very low | 32.9 | Very low | 116 Ų | 116 | 149.9 Ų | 149.9 | 75% | 0.753 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -83.7 | 164.9 | 152.9 | 34.4 | -30.4 | 0 | 0 | 0 | 111.5 | ||
| 368 | H | 34.5 | Very low | 33 | Very low | 182 Ų | 182 | 149.5 Ų | 149.5 | 84% | 0.843 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -78 | 145.3 | -171.5 | -77.8 | 8.3 | 0 | 0 | 0 | 115.3 | ||
| 369 | D | 29 | Very low | 33.2 | Very low | 134 Ų | 134 | 153.5 Ų | 153.5 | 72% | 0.717 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 151.9 | 148.3 | 172.8 | 34 | 0 | 0 | 0 | 110.3 | A371 | D369-A371 PolarHBondContact OD1-N 2.93Š|
| 370 | N | 33.6 | Very low | 33 | Very low | 143 Ų | 143 | 152 Ų | 152 | 77% | 0.765 | 79% | 0.793 | S | S | * | * | trans | -164.2 | 90.3 | 155.3 | -111.5 | -85.6 | 0 | 0 | 0 | 109.9 | ||||
| 371 | A | 32.4 | Very low | 32.8 | Very low | 72 Ų | 72 | 154.4 Ų | 154.4 | 60% | 0.595 | 79% | 0.794 | S | S | * | * | trans | -68.6 | 144.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | D369 | D369-A371 PolarHBondContact OD1-N 2.93Š| ||
| 372 | Q | 31.5 | Very low | 32.6 | Very low | 185 Ų | 185 | 151.1 Ų | 151.1 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -166.4 | 128.2 | 144.1 | -111.4 | 150.1 | 104.6 | 0 | 0 | 114.8 | ||||
| 373 | V | 33.4 | Very low | 32.6 | Very low | 135 Ų | 135 | 149.9 Ų | 149.9 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -152 | 145.8 | 174.4 | -156.6 | 0 | 0 | 0 | 0 | 102.8 | ||||
| 374 | P | 41.6 | Very low | 32.8 | Very low | 98 Ų | 98 | 146.2 Ų | 146.2 | 64% | 0.636 | 77% | 0.77 | S | S | * | * | cis | -158 | 166.6 | 43.1 | 44.1 | -22.3 | 0 | 0 | 0 | 121.3 | ||||
| 375 | K | 29 | Very low | 32.7 | Very low | 192 Ų | 192 | 148 Ų | 148 | 84% | 0.835 | 78% | 0.775 | S | S | * | * | trans | 65.6 | 169.5 | 142.6 | -76.8 | 166.2 | -172 | 176.4 | 0 | 119 | ||||
| 376 | P | 41.8 | Very low | 32.9 | Very low | 107 Ų | 107 | 148.7 Ų | 148.7 | 70% | 0.695 | 78% | 0.777 | S | S | * | * | cis | -133.5 | 160.6 | -24.7 | 30.8 | -11.4 | 0 | 0 | 0 | 116.3 | ||||
| 377 | I | 32 | Very low | 33.2 | Very low | 161 Ų | 161 | 146.9 Ų | 146.9 | 83% | 0.826 | 78% | 0.775 | S | S | * | * | trans | 28.6 | 123 | 138.8 | -52.5 | 164.7 | 0 | 0 | 0 | 119.7 | ||||
| 378 | Q | 30.6 | Very low | 32.9 | Very low | 168 Ų | 168 | 145.7 Ų | 145.7 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | trans | -151.6 | 146.8 | 130.4 | -138.6 | 171 | 101.5 | 0 | 0 | 114.7 | ||||
| 379 | L | 31.8 | Very low | 32.6 | Very low | 157 Ų | 157 | 145 Ų | 145 | 82% | 0.822 | 77% | 0.772 | S | S | * | * | trans | -109.1 | 125.5 | 178.6 | 168.8 | 73.1 | 0 | 0 | 0 | 109.1 | ||||
| 380 | Q | 32.1 | Very low | 32.8 | Very low | 169 Ų | 169 | 145.3 Ų | 145.3 | 79% | 0.79 | 77% | 0.769 | S | S | * | * | trans | -139.4 | 156.6 | 168 | -70.3 | -160.8 | 10.5 | 0 | 0 | 113 | ||||
| 381 | R | 28.7 | Very low | 32.7 | Very low | 244 Ų | 244 | 146.5 Ų | 146.5 | 92% | 0.921 | 77% | 0.774 | S | S | * | * | trans | -152.1 | 118.1 | -167 | 175.2 | -168.8 | -167.1 | 170.8 | 6.4 | 109.5 | ||||
| 382 | A | 29.9 | Very low | 32.8 | Very low | 97 Ų | 97 | 151.1 Ų | 151.1 | 80% | 0.802 | 78% | 0.784 | S | S | * | * | trans | 145.5 | 154.4 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 383 | K | 32 | Very low | 33 | Very low | 172 Ų | 172 | 150.9 Ų | 150.9 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | cis | -166.9 | 163 | -32.8 | -141.2 | -171.8 | 158.9 | -136.3 | 0 | 108.8 | ||||
| 384 | D | 30.5 | Very low | 33 | Very low | 101 Ų | 101 | 155.5 Ų | 155.5 | 54% | 0.54 | 79% | 0.785 | S | S | . | * | trans | 41.6 | 102.2 | 155.3 | -53.7 | -23.6 | 0 | 0 | 0 | 120.3 | ||||
| 385 | Q | 32.4 | Very low | 32.8 | Very low | 196 Ų | 196 | 158.6 Ų | 158.6 | 92% | 0.916 | 79% | 0.791 | S | S | * | * | 175.4 | 160.7 | 110.9 | -94.2 | 155.7 | 109.8 | 0 | 0 | 114.6 | |||||
| 386 | V | 35.5 | Very low | 33.5 | Very low | 128 Ų | 128 | 154 Ų | 154 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | trans | -134.9 | 137.5 | 178.8 | 175.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 387 | P | 38.5 | Very low | 33.5 | Very low | 128 Ų | 128 | 159.4 Ų | 159.4 | 83% | 0.831 | 79% | 0.789 | S | S | * | * | -113.9 | 166 | 129.4 | -10.1 | 29.3 | 0 | 0 | 0 | 112.5 | |||||
| 388 | A | 31.1 | Very low | 33.9 | Very low | 90 Ų | 90 | 160.9 Ų | 160.9 | 74% | 0.744 | 79% | 0.79 | S | S | * | * | trans | -107.2 | -161 | -168.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 389 | E | 28.1 | Very low | 34.3 | Very low | 167 Ų | 167 | 162.5 Ų | 162.5 | 78% | 0.78 | 80% | 0.795 | S | S | * | * | trans | 83.5 | 136.5 | -177.2 | -54 | -155.4 | 96.2 | 0 | 0 | 115.1 | ||||
| 390 | Q | 31.7 | Very low | 34.5 | Very low | 141 Ų | 141 | 161.6 Ų | 161.6 | 66% | 0.659 | 79% | 0.791 | S | S | * | * | cis | -147.6 | 145.9 | 1.2 | -123.9 | 166.3 | 38.8 | 0 | 0 | 110.4 | ||||
| 391 | L | 31.6 | Very low | 35.1 | Very low | 168 Ų | 168 | 160.7 Ų | 160.7 | 88% | 0.88 | 79% | 0.787 | S | S | * | * | trans | -106.9 | 107.9 | -178 | -126.6 | 176.8 | 0 | 0 | 0 | 110.5 | ||||
| 392 | H | 35.6 | Very low | 35.3 | Very low | 170 Ų | 170 | 155.3 Ų | 155.3 | 79% | 0.787 | 78% | 0.776 | S | S | * | * | trans | -101.3 | 106.9 | 174.9 | -93.3 | -68.3 | 0 | 0 | 0 | 112.3 | ||||
| 393 | H | 34.4 | Very low | 35.8 | Very low | 179 Ų | 179 | 159.1 Ų | 159.1 | 83% | 0.829 | 78% | 0.777 | S | S | * | * | trans | -88.8 | 122.8 | 178.2 | -167.3 | 75.5 | 0 | 0 | 0 | 110.4 | ||||
| 394 | R | 34.8 | Very low | 36.1 | Very low | 233 Ų | 233 | 155.9 Ų | 155.9 | 88% | 0.879 | 78% | 0.776 | S | S | * | * | trans | -131.6 | 77.2 | 177.2 | -164.2 | 176.2 | -174.2 | 165.2 | 5 | 113.8 | ||||
| 395 | Q | 37.2 | Very low | 37.2 | Very low | 163 Ų | 163 | 156 Ų | 156 | 76% | 0.762 | 78% | 0.782 | S | S | * | * | trans | 24.4 | 110.7 | 136.6 | -168.7 | 171.6 | 22.9 | 0 | 0 | 118.5 | ||||
| 396 | S | 42.8 | Very low | 37.5 | Very low | 95 Ų | 95 | 152.8 Ų | 152.8 | 66% | 0.664 | 78% | 0.776 | S | S | * | * | trans | 17.5 | 129.9 | 149.5 | 63.4 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 397 | R | 41.8 | Very low | 37.6 | Very low | 220 Ų | 220 | 152.1 Ų | 152.1 | 83% | 0.83 | 77% | 0.768 | S | S | * | * | trans | -127.8 | 124.7 | 141 | -69 | -169.5 | -178.9 | -145.9 | 1.1 | 109.8 | ||||
| 398 | F | 40.9 | Very low | 38.1 | Very low | 193 Ų | 193 | 152 Ų | 152 | 85% | 0.846 | 77% | 0.768 | S | S | * | * | trans | -70 | 141 | 149.2 | -77.7 | -107.2 | 0 | 0 | 0 | 107.6 | ||||
| 399 | F | 38.3 | Very low | 38.8 | Very low | 201 Ų | 201 | 155.3 Ų | 155.3 | 88% | 0.882 | 77% | 0.768 | S | S | * | * | trans | -150.2 | 152.8 | 140.7 | -101.8 | -70.1 | 0 | 0 | 0 | 108.1 | ||||
| 400 | D | 36.7 | Very low | 39.3 | Very low | 139 Ų | 139 | 156.6 Ų | 156.6 | 74% | 0.743 | 77% | 0.773 | S | S | * | * | trans | -115.4 | 171.9 | -164.2 | -135.5 | -22.3 | 0 | 0 | 0 | 111.9 | ||||
| 401 | E | 44.1 | Very low | 39.7 | Very low | 150 Ų | 150 | 153.2 Ų | 153.2 | 70% | 0.701 | 78% | 0.776 | S | S | * | * | trans | 7.2 | 120 | 161.4 | -63 | 177.7 | 156.4 | 0 | 0 | 119.5 | ||||
| 402 | N | 33.1 | Very low | 40.3 | Very low | 130 Ų | 130 | 150 Ų | 150 | 70% | 0.695 | 77% | 0.768 | S | S | * | * | 170.3 | 143.1 | 96.7 | -92 | -56.5 | 0 | 0 | 0 | 116 | |||||
| 403 | E | 40.3 | Very low | 40.9 | Very low | 178 Ų | 178 | 152 Ų | 152 | 83% | 0.832 | 77% | 0.774 | S | S | * | * | trans | 59.3 | 149 | 153.8 | -61.3 | -178.3 | 158.2 | 0 | 0 | 119.1 | ||||
| 404 | S | 39.6 | Very low | 41.7 | Very low | 103 Ų | 103 | 150 Ų | 150 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | cis | -153.9 | -169.9 | 18.7 | -146 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 405 | P | 52.7 | Low | 42.3 | Very low | 104 Ų | 104 | 143.3 Ų | 143.3 | 68% | 0.675 | 76% | 0.764 | S | S | * | * | -129 | -171.9 | -100.8 | 38.4 | -18.6 | 0 | 0 | 0 | 117.2 | |||||
| 406 | V | 39.3 | Very low | 42.9 | Very low | 128 Ų | 128 | 142.1 Ų | 142.1 | 78% | 0.776 | 76% | 0.763 | S | S | * | * | trans | 80 | 141.1 | 169.1 | -166.6 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 407 | D | 37.2 | Very low | 43.3 | Very low | 114 Ų | 114 | 146.8 Ų | 146.8 | 61% | 0.61 | 77% | 0.767 | S | S | * | * | cis | -132.7 | 138.6 | 13 | -158.4 | -44.5 | 0 | 0 | 0 | 113 | Q409 | D407-Q409 PolarHBondContact O-N 3.44Å; D407-Q409 PolarHBondContact OD1-N 3.24Å | ||
| 408 | P | 49.7 | Very low | 43.9 | Very low | 127 Ų | 127 | 142.4 Ų | 142.4 | 83% | 0.825 | 76% | 0.76 | S | S | * | * | trans | -75.1 | -4.5 | 172.1 | -18.6 | 33.8 | 0 | 0 | 0 | 117.5 | H410 | P408-H410 PolarHBondContact O-N 2.87Å; P408-H410 VanDerWaalsContact O-N 3.14Å | ||
| 409 | Q | 45.3 | Very low | 44.4 | Very low | 159 Ų | 159 | 136.5 Ų | 136.5 | 74% | 0.743 | 75% | 0.754 | S | S | * | * | trans | -86.6 | 69.5 | -170.2 | -67.4 | -160.4 | 6.2 | 0 | 0 | 116.8 | D407 | D407-Q409 PolarHBondContact O-N 3.44Å; D407-Q409 PolarHBondContact OD1-N 3.24Å | ||
| 410 | H | 39.2 | Very low | 44.6 | Very low | 193 Ų | 193 | 132.8 Ų | 132.8 | 89% | 0.894 | 74% | 0.743 | S | S | * | * | trans | -147.8 | 77.9 | 149 | -88.7 | -40.7 | 0 | 0 | 0 | 112.1 | P408 | P408-H410 PolarHBondContact O-N 2.87Å; P408-H410 VanDerWaalsContact O-N 3.14Å | ||
| 411 | G | 39.1 | Very low | 45.6 | Very low | 70 Ų | 70 | 134.2 Ų | 134.2 | 72% | 0.722 | 75% | 0.751 | S | S | * | * | trans | -64.5 | 160.4 | 166 | 0 | 0 | 0 | 0 | 0 | 112.5 | K413 | G411-K413 PolarHBondContact O-N 3.47Š| ||
| 412 | S | 45.1 | Very low | 46 | Very low | 102 Ų | 102 | 129.6 Ų | 129.6 | 71% | 0.713 | 74% | 0.743 | S | S | * | * | trans | -48.8 | 117.2 | -177.8 | 50.8 | 0 | 0 | 0 | 0 | 114 | L414 | S412-L414 PolarHBondContact O-N 2.93Š| ||
| 413 | K | 47.7 | Very low | 46.6 | Very low | 212 Ų | 212 | 129.6 Ų | 129.6 | 92% | 0.922 | 74% | 0.743 | S | S | * | * | trans | -72.8 | 82.7 | 153.3 | -80.8 | -169.1 | 173.1 | -174.8 | 0 | 109.4 | G411 | G411-K413 PolarHBondContact O-N 3.47Š| ||
| 414 | L | 49.8 | Very low | 47.3 | Very low | 135 Ų | 135 | 127 Ų | 127 | 71% | 0.707 | 74% | 0.739 | S | S | * | * | trans | -59.2 | 140.9 | 152 | -78.4 | 152.4 | 0 | 0 | 0 | 107.8 | S412 D416 | S412-L414 PolarHBondContact O-N 2.93Å; L414-D416 PolarHBondContact O-N 3.38Å | ||
| 415 | A | 49.1 | Very low | 48.1 | Very low | 94 Ų | 94 | 124.3 Ų | 124.3 | 78% | 0.777 | 73% | 0.728 | S | S | * | * | trans | -84 | 93.2 | 177 | 0 | 0 | 0 | 0 | 0 | 109 | Y417 | A415-Y417 PolarHBondContact O-N 3.21Š| ||
| 416 | D | 48.9 | Very low | 48.2 | Very low | 138 Ų | 138 | 128.5 Ų | 128.5 | 74% | 0.738 | 74% | 0.738 | S | S | * | * | trans | -67.3 | 86.4 | 167.9 | -69.7 | -38.4 | 0 | 0 | 0 | 108.9 | L414 N418 | L414-D416 PolarHBondContact O-N 3.38Å; D416-N418 PolarHBondContact O-N 3.24Å; D416-N418 PolarHBondContact O-OD1 2.93Å | ||
| 417 | Y | 52.2 | Low | 48.8 | Very low | 193 Ų | 193 | 132.2 Ų | 132.2 | 76% | 0.757 | 74% | 0.74 | S | S | * | * | trans | -82.8 | 63.4 | 174.4 | -156.4 | -87.5 | 0 | 0 | 0 | 109.8 | A415 G419 | A415-Y417 PolarHBondContact O-N 3.21Å; Y417-G419 PolarHBondContact O-N 2.96Å; Y417-G419 VanDerWaalsContact O-N 3.11Å | ||
| 418 | N | 53.9 | Low | 49.6 | Very low | 128 Ų | 128 | 135.6 Ų | 135.6 | 68% | 0.684 | 75% | 0.752 | S | S | * | * | trans | -65.4 | 107.5 | 167.9 | 42.2 | -105.6 | 0 | 0 | 0 | 108.7 | D416 D420 | D416-N418 PolarHBondContact O-N 3.24Å; D416-N418 PolarHBondContact O-OD1 2.93Å; N418-D420 PolarHBondContact O-N 3.39Å | ||
| 419 | G | 50.9 | Low | 49.6 | Very low | 69 Ų | 69 | 132.4 Ų | 132.4 | 71% | 0.711 | 74% | 0.736 | S | S | * | * | trans | -60.6 | 93.6 | -170.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y417 | Y417-G419 PolarHBondContact O-N 2.96Å; Y417-G419 VanDerWaalsContact O-N 3.11Å | ||
| 420 | D | 43.3 | Very low | 49.9 | Very low | 123 Ų | 123 | 131.8 Ų | 131.8 | 66% | 0.658 | 74% | 0.738 | S | S | * | * | trans | -101.9 | 120.7 | 167.7 | -177 | 1.1 | 0 | 0 | 0 | 107.7 | N418 G422 | N418-D420 PolarHBondContact O-N 3.39Å; D420-G422 PolarHBondContact O-N 2.91Å; D420-G422 PolarHBondContact OD1-N 2.86Å | ||
| 421 | D | 56.6 | Low | 50.5 | Low | 169 Ų | 169 | 131.2 Ų | 131.2 | 90% | 0.904 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | 3.8 | -178.4 | -70.4 | -46.2 | 0 | 0 | 0 | 113 | N423 | D421-N423 VanDerWaalsContact C-N 3.31Å; D421-N423 PolarHBondContact O-N 3.44Å |
| 422 | G | 52.9 | Low | 51.2 | Low | 53 Ų | 53 | 135.5 Ų | 135.5 | 55% | 0.546 | 73% | 0.734 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.7 | -7.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | D420 V424 | D420-G422 PolarHBondContact O-N 2.91Å; D420-G422 PolarHBondContact OD1-N 2.86Å; G422-V424 VanDerWaalsContact C-N 3.27Å; G422-V424 PolarHBondContact O-N 3.49Å |
| 423 | N | 45.2 | Very low | 51.4 | Low | 129 Ų | 129 | 134 Ų | 134 | 69% | 0.69 | 73% | 0.729 | S | S | * | * | trans | -78.2 | 72.2 | 179.6 | -168.4 | 94.4 | 0 | 0 | 0 | 112.1 | D421 G425 | D421-N423 VanDerWaalsContact C-N 3.31Å; D421-N423 PolarHBondContact O-N 3.44Å; N423-G425 PolarHBondContact O-N 2.98Å | ||
| 424 | V | 55.3 | Low | 51.5 | Low | 123 Ų | 123 | 131.7 Ų | 131.7 | 75% | 0.745 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 119.6 | 170.2 | -175.2 | 0 | 0 | 0 | 0 | 109 | G422 E426 | G422-V424 VanDerWaalsContact C-N 3.27Å; G422-V424 PolarHBondContact O-N 3.49Å; V424-E426 PolarHBondContact O-N 3.16Å |
| 425 | G | 57.1 | Low | 51.6 | Low | 47 Ų | 47 | 132.1 Ų | 132.1 | 49% | 0.485 | 72% | 0.723 | S | S | . | * | P | Polyproline II helix | trans | -66.6 | 126.9 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | N423 Y427 | N423-G425 PolarHBondContact O-N 2.98Å; G425-Y427 WeakPolarHBondContact O-CD2 3.21Å; G425-Y427 PolarHBondContact O-N 3.03Å |
| 426 | E | 54.4 | Low | 51.8 | Low | 193 Ų | 193 | 131.8 Ų | 131.8 | 90% | 0.902 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 125.9 | 170.5 | -65.2 | -177.6 | -163.4 | 0 | 0 | 109.2 | V424 E428 | V424-E426 PolarHBondContact O-N 3.16Å; E426-E428 PolarHBondContact O-N 3.33Å |
| 427 | Y | 52 | Low | 51.8 | Low | 206 Ų | 206 | 135.4 Ų | 135.4 | 81% | 0.808 | 73% | 0.725 | S | S | * | * | trans | -78.3 | 115 | -173.3 | -82.9 | -107.7 | 0 | 0 | 0 | 111.2 | G425 A429 | G425-Y427 WeakPolarHBondContact O-CD2 3.21Å; G425-Y427 PolarHBondContact O-N 3.03Å; Y427-A429 PolarHBondContact O-N 2.88Å | ||
| 428 | E | 53.3 | Low | 51.7 | Low | 184 Ų | 184 | 133.1 Ų | 133.1 | 86% | 0.86 | 73% | 0.726 | S | S | * | * | G | 310 helix | trans | -70 | 21.7 | 174.3 | -58.8 | -170.8 | 123.1 | 0 | 0 | 114.4 | E426 | E426-E428 PolarHBondContact O-N 3.33Š|
| 429 | A | 50.6 | Low | 51.6 | Low | 60 Ų | 60 | 136 Ų | 136 | 50% | 0.496 | 74% | 0.735 | S | S | . | * | G | 310 helix | trans | -72.4 | -42.4 | -170.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y427 K431 Q432 | Y427-A429 PolarHBondContact O-N 2.88Å; A429-K431 PolarHBondContact O-N 2.81Å; A429-Q432 PolarHBondContact O-N 3.26Å |
| 430 | D | 52 | Low | 51.7 | Low | 146 Ų | 146 | 142.2 Ų | 142.2 | 78% | 0.781 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -72 | -4.1 | -167.3 | -69.6 | -2.5 | 0 | 0 | 0 | 114.1 | ||
| 431 | K | 51.8 | Low | 52.1 | Low | 181 Ų | 181 | 145 Ų | 145 | 79% | 0.787 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -89.4 | -2.2 | 179.7 | -147.8 | -176.5 | -179.2 | -179 | 0 | 114.8 | A429 | A429-K431 PolarHBondContact O-N 2.81Š|
| 432 | Q | 52.7 | Low | 51.6 | Low | 160 Ų | 160 | 145.1 Ų | 145.1 | 75% | 0.748 | 76% | 0.756 | S | S | * | * | S | Bend | trans | -102.1 | -13.2 | 176.6 | -63 | -170.8 | 10.7 | 0 | 0 | 113.5 | A429 | A429-Q432 PolarHBondContact O-N 3.26Š|
| 433 | A | 50.5 | Low | 51 | Low | 72 Ų | 72 | 146.8 Ų | 146.8 | 60% | 0.595 | 77% | 0.773 | S | S | * | * | G | 310 helix | trans | -72.3 | -31.3 | -179 | 0 | 0 | 0 | 0 | 0 | 113.8 | L435 A436 | A433-L435 PolarHBondContact O-N 2.77Å; A433-A436 PolarHBondContact O-N 3.24Å |
| 434 | E | 49.8 | Very low | 51 | Low | 162 Ų | 162 | 148.6 Ų | 148.6 | 76% | 0.757 | 78% | 0.783 | S | S | * | * | G | 310 helix | trans | -67.9 | -12.9 | -178.3 | -66.1 | -169.2 | 141.8 | 0 | 0 | 114.3 | ||
| 435 | L | 51.5 | Low | 50.5 | Low | 145 Ų | 145 | 146.1 Ų | 146.1 | 76% | 0.759 | 78% | 0.781 | S | S | * | * | G | 310 helix | trans | -87.6 | -11.6 | 177 | -66 | 176.8 | 0 | 0 | 0 | 113.6 | A433 | A433-L435 PolarHBondContact O-N 2.77Š|
| 436 | A | 52.5 | Low | 49.6 | Very low | 87 Ų | 87 | 147.8 Ų | 147.8 | 72% | 0.719 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -96.3 | 11 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | A433 | A433-A436 PolarHBondContact O-N 3.24Š|
| 437 | Y | 48.8 | Very low | 49.2 | Very low | 213 Ų | 213 | 147.7 Ų | 147.7 | 84% | 0.835 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -130 | 18.8 | -172.6 | -138.6 | -98.7 | 0 | 0 | 0 | 114.5 | ||
| 438 | N | 50.4 | Low | 48.9 | Very low | 146 Ų | 146 | 146.8 Ų | 146.8 | 78% | 0.781 | 80% | 0.802 | S | S | * | * | S | Bend | trans | -125.3 | 13.5 | -177.4 | -83.5 | -9.7 | 0 | 0 | 0 | 114 | ||
| 439 | E | 51.1 | Low | 48.6 | Very low | 187 Ų | 187 | 145.6 Ų | 145.6 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -112.6 | 12.7 | 179.3 | -67.8 | -167.6 | 146.7 | 0 | 0 | 114 | ||
| 440 | E | 52.9 | Low | 48.5 | Very low | 200 Ų | 200 | 148.2 Ų | 148.2 | 94% | 0.935 | 81% | 0.811 | S | S | * | * | S | Bend | trans | -111.1 | 39.4 | 177.1 | -70.6 | -163.7 | 175.1 | 0 | 0 | 114.4 | ||
| 441 | E | 52.7 | Low | 48.1 | Very low | 183 Ų | 183 | 150.3 Ų | 150.3 | 86% | 0.855 | 82% | 0.816 | S | S | * | * | S | Bend | trans | -150.8 | 81.1 | 162.5 | -158.1 | 164.7 | -148.2 | 0 | 0 | 113.2 | ||
| 442 | D | 46.2 | Very low | 47.9 | Very low | 170 Ų | 170 | 148.7 Ų | 148.7 | 91% | 0.909 | 82% | 0.816 | S | S | * | * | trans | -174.7 | 84.4 | 143.1 | -104.1 | -18.5 | 0 | 0 | 0 | 109.6 | ||||
| 443 | G | 39.9 | Very low | 47.7 | Very low | 88 Ų | 88 | 148.2 Ų | 148.2 | 91% | 0.907 | 82% | 0.818 | S | S | * | * | trans | -102.2 | 109.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 444 | D | 44.9 | Very low | 47.5 | Very low | 168 Ų | 168 | 152 Ų | 152 | 90% | 0.898 | 83% | 0.829 | S | S | * | * | trans | -121 | 136.8 | 164.3 | -165.8 | 11.5 | 0 | 0 | 0 | 110 | ||||
| 445 | G | 45 | Very low | 47.6 | Very low | 70 Ų | 70 | 151.1 Ų | 151.1 | 72% | 0.722 | 83% | 0.829 | S | S | * | * | trans | -116.2 | 106.5 | -167.4 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 446 | G | 38.5 | Very low | 47.5 | Very low | 83 Ų | 83 | 154 Ų | 154 | 86% | 0.856 | 83% | 0.83 | S | S | * | * | trans | -110.9 | 90.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 447 | E | 45.1 | Very low | 47.1 | Very low | 191 Ų | 191 | 157.4 Ų | 157.4 | 89% | 0.893 | 84% | 0.836 | S | S | * | * | trans | -84 | 121 | 161.8 | -64.3 | 175.8 | -145.4 | 0 | 0 | 108.8 | ||||
| 448 | E | 46.9 | Very low | 47 | Very low | 187 Ų | 187 | 155 Ų | 155 | 87% | 0.874 | 84% | 0.836 | S | S | * | * | trans | -159.8 | 110.8 | 155.8 | -121.1 | 167.8 | -141.9 | 0 | 0 | 113.3 | ||||
| 449 | D | 46.4 | Very low | 46.9 | Very low | 158 Ų | 158 | 156.4 Ų | 156.4 | 85% | 0.845 | 84% | 0.838 | S | S | * | * | trans | 46.4 | 140.1 | 148 | -69.9 | -6.6 | 0 | 0 | 0 | 125.4 | ||||
| 450 | V | 49.3 | Very low | 46.6 | Very low | 116 Ų | 116 | 155.5 Ų | 155.5 | 70% | 0.703 | 84% | 0.839 | S | S | * | * | trans | -75.8 | 141.8 | 171.7 | 175.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 451 | Q | 42.8 | Very low | 46.1 | Very low | 190 Ų | 190 | 157.7 Ų | 157.7 | 89% | 0.888 | 84% | 0.839 | S | S | * | * | trans | -149.1 | 131.3 | 150.3 | -134.5 | 143.3 | 103.9 | 0 | 0 | 111.4 | ||||
| 452 | D | 47.4 | Very low | 45.7 | Very low | 146 Ų | 146 | 158 Ų | 158 | 78% | 0.781 | 84% | 0.841 | S | S | * | * | trans | -77.1 | 141.5 | 175.7 | -47.4 | -80.1 | 0 | 0 | 0 | 110.7 | ||||
| 453 | D | 48.3 | Very low | 45.4 | Very low | 150 Ų | 150 | 161.6 Ų | 161.6 | 80% | 0.802 | 84% | 0.841 | S | S | * | * | trans | -154.5 | 59.2 | 166.1 | -130.5 | -4.7 | 0 | 0 | 0 | 110 | ||||
| 454 | D | 46 | Very low | 45.4 | Very low | 151 Ų | 151 | 161.1 Ų | 161.1 | 81% | 0.807 | 83% | 0.829 | S | S | * | * | trans | -64.9 | 169.5 | 158.7 | -96.6 | -44.2 | 0 | 0 | 0 | 110.3 | ||||
| 455 | D | 52.3 | Low | 45.2 | Very low | 145 Ų | 145 | 159.5 Ų | 159.5 | 78% | 0.775 | 82% | 0.824 | S | S | * | * | trans | 66.5 | 76.9 | 176.6 | -68.8 | -25.8 | 0 | 0 | 0 | 117.7 | ||||
| 456 | R | 50.1 | Low | 44.9 | Very low | 205 Ų | 205 | 162.3 Ų | 162.3 | 77% | 0.774 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -143.6 | -30.7 | 153 | -147.1 | 158.8 | -68.7 | -163.5 | 8.9 | 120.4 | ||
| 457 | D | 44.9 | Very low | 44.9 | Very low | 159 Ų | 159 | 169.9 Ų | 169.9 | 85% | 0.85 | 83% | 0.828 | S | S | * | * | S | Bend | trans | -100.4 | 4.9 | -169 | -75.4 | -40.7 | 0 | 0 | 0 | 117.1 | Q459 | D457-Q459 VanDerWaalsContact C-N 3.3Å; D457-Q459 PolarHBondContact O-N 2.87Å; D457-Q459 VanDerWaalsContact O-N 3.15Å |
| 458 | I | 46.8 | Very low | 44.5 | Very low | 163 Ų | 163 | 163.4 Ų | 163.4 | 84% | 0.836 | 81% | 0.812 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | 46.6 | -178.8 | -37.6 | -177.4 | 0 | 0 | 0 | 112.7 | ||
| 459 | Q | 47 | Very low | 44.2 | Very low | 175 Ų | 175 | 163.7 Ų | 163.7 | 82% | 0.818 | 81% | 0.81 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.1 | -24.5 | 176.1 | -66.6 | -165.6 | 5 | 0 | 0 | 115.8 | D457 R461 | D457-Q459 VanDerWaalsContact C-N 3.3Å; D457-Q459 PolarHBondContact O-N 2.87Å; D457-Q459 VanDerWaalsContact O-N 3.15Å; Q459-R461 PolarHBondContact O-N 3.15Å |
| 460 | D | 44.3 | Very low | 44 | Very low | 167 Ų | 167 | 167.9 Ų | 167.9 | 89% | 0.893 | 81% | 0.814 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.1 | 19.8 | -165.8 | -97.9 | 8.3 | 0 | 0 | 0 | 116.3 | ||
| 461 | R | 43.5 | Very low | 43.6 | Very low | 246 Ų | 246 | 168.8 Ų | 168.8 | 93% | 0.928 | 81% | 0.81 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.9 | -4.2 | -176.3 | -129 | -178 | -166.5 | -148.6 | 2.6 | 119.4 | Q459 | Q459-R461 PolarHBondContact O-N 3.15Š|
| 462 | E | 45 | Very low | 43.6 | Very low | 191 Ų | 191 | 166.6 Ų | 166.6 | 89% | 0.893 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -134.7 | 37 | -176.6 | -151 | 165 | -136.8 | 0 | 0 | 115.5 | ||
| 463 | R | 38.6 | Very low | 43.1 | Very low | 244 Ų | 244 | 165.8 Ų | 165.8 | 92% | 0.921 | 80% | 0.796 | S | S | * | * | trans | -159.8 | 140.5 | 162.3 | -107.9 | 167.3 | -179.1 | 175.1 | 2.4 | 110.5 | ||||
| 464 | A | 39.5 | Very low | 42.6 | Very low | 78 Ų | 78 | 165 Ų | 165 | 65% | 0.645 | 79% | 0.792 | S | S | * | * | cis | -163.3 | 141.5 | -19.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 465 | V | 40.8 | Very low | 42.4 | Very low | 134 Ų | 134 | 163.4 Ų | 163.4 | 81% | 0.812 | 78% | 0.783 | S | S | * | * | trans | 62.5 | 116.5 | 136.5 | -179.6 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 466 | D | 38.5 | Very low | 42.2 | Very low | 130 Ų | 130 | 163.3 Ų | 163.3 | 70% | 0.695 | 78% | 0.781 | S | S | * | * | trans | 36.5 | 117.9 | 141.9 | -172.6 | 20.8 | 0 | 0 | 0 | 120.3 | G468 | D466-G468 PolarHBondContact OD1-N 3.16Å; D466-G468 VanDerWaalsContact OD1-N 3.08Å | ||
| 467 | Y | 38.6 | Very low | 42.2 | Very low | 242 Ų | 242 | 164.9 Ų | 164.9 | 95% | 0.949 | 80% | 0.804 | S | S | * | * | trans | -140.1 | 110.2 | 138.1 | -109.6 | -81.5 | 0 | 0 | 0 | 113.1 | ||||
| 468 | G | 37.6 | Very low | 42.1 | Very low | 54 Ų | 54 | 165.2 Ų | 165.2 | 56% | 0.557 | 80% | 0.801 | S | S | * | * | 95.7 | 47.8 | 120.3 | 0 | 0 | 0 | 0 | 0 | 118.9 | D466 R470 | D466-G468 PolarHBondContact OD1-N 3.16Å; D466-G468 VanDerWaalsContact OD1-N 3.08Å; G468-R470 PolarHBondContact O-N 3.35Å | |||
| 469 | K | 40.3 | Very low | 41.9 | Very low | 193 Ų | 193 | 165.3 Ų | 165.3 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | trans | -67.2 | 110.2 | 163.5 | -170.7 | 174.9 | -175.4 | 175 | 0 | 110.6 | ||||
| 470 | R | 43.1 | Very low | 41.6 | Very low | 246 Ų | 246 | 164.8 Ų | 164.8 | 93% | 0.928 | 80% | 0.799 | S | S | * | * | trans | -119.1 | 157.3 | 168.3 | -81.6 | -165.1 | 176.7 | -164 | 1 | 112.5 | G468 | G468-R470 PolarHBondContact O-N 3.35Š| ||
| 471 | H | 40.8 | Very low | 41.4 | Very low | 136 Ų | 136 | 164.6 Ų | 164.6 | 63% | 0.63 | 79% | 0.793 | S | S | * | * | trans | -108.4 | 146.7 | -160.3 | -97.5 | -129.5 | 0 | 0 | 0 | 113.8 | ||||
| 472 | Q | 42.5 | Very low | 41.3 | Very low | 143 Ų | 143 | 159.6 Ų | 159.6 | 67% | 0.668 | 79% | 0.785 | S | S | * | * | trans | 71.9 | 113.3 | 135.4 | -70.8 | 170.2 | -37.5 | 0 | 0 | 122.3 | ||||
| 473 | N | 37.1 | Very low | 41 | Very low | 129 Ų | 129 | 157.5 Ų | 157.5 | 69% | 0.69 | 78% | 0.777 | S | S | * | * | 76.6 | 161 | 116 | -58.2 | 6.7 | 0 | 0 | 0 | 121.8 | |||||
| 474 | N | 37.8 | Very low | 41.2 | Very low | 134 Ų | 134 | 151.3 Ų | 151.3 | 72% | 0.717 | 77% | 0.767 | S | S | * | * | trans | 74.4 | 140.2 | 167.4 | -60 | 20.4 | 0 | 0 | 0 | 116.2 | ||||
| 475 | D | 40.5 | Very low | 41.3 | Very low | 118 Ų | 118 | 156.9 Ų | 156.9 | 63% | 0.631 | 78% | 0.777 | S | S | * | * | cis | -158.5 | 151.2 | -13.3 | -108.1 | -30.7 | 0 | 0 | 0 | 112.5 | ||||
| 476 | I | 49.3 | Very low | 41.4 | Very low | 143 Ų | 143 | 158.8 Ų | 158.8 | 73% | 0.733 | 77% | 0.774 | S | S | * | * | trans | 39.4 | 116.9 | 142.7 | -56.3 | 159.9 | 0 | 0 | 0 | 119.7 | ||||
| 477 | L | 50.4 | Low | 41.6 | Very low | 238 Ų | 238 | 161.5 Ų | 161.5 | 100% | 1.246 | 78% | 0.781 | S | S | * | * | -148.1 | 0 | 115.1 | -165.8 | 64.8 | 0 | 0 | 0 | 111.3 |
Retrieved 477 of 477 residues in 249.8 ms
(Link to these results)