| 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 | 39.9 | Very low | 43.1 | Very low | 238 Ų | 238 | 131.4 Ų | 131.4 | 100% | 1.172 | 86% | 0.862 | S | S | * | * | 0 | 119 | 0 | -50.7 | -153.9 | -158.3 | 0 | 0 | 105.2 | |||||
| 2 | S | 42.9 | Very low | 43.5 | Very low | 120 Ų | 120 | 129.8 Ų | 129.8 | 84% | 0.839 | 85% | 0.852 | S | S | * | * | -157.2 | 150.3 | 51.3 | -61.6 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 3 | T | 47.6 | Very low | 43.5 | Very low | 132 Ų | 132 | 129.5 Ų | 129.5 | 81% | 0.81 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 159.2 | -179.8 | 42.9 | 0 | 0 | 0 | 0 | 114.3 | ||
| 4 | P | 46.1 | Very low | 43.1 | Very low | 114 Ų | 114 | 125.1 Ų | 125.1 | 74% | 0.74 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -84.6 | 162.4 | 177.7 | 36.1 | -34.3 | 0 | 0 | 0 | 112 | ||
| 5 | P | 51.9 | Low | 42.7 | Very low | 129 Ų | 129 | 122.9 Ų | 122.9 | 84% | 0.838 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -98.2 | 138.4 | 165 | 31.8 | -21.7 | 0 | 0 | 0 | 112.4 | ||
| 6 | L | 41.3 | Very low | 42.4 | Very low | 169 Ų | 169 | 128.4 Ų | 128.4 | 89% | 0.885 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 134.2 | 177.1 | -110.3 | 66.9 | 0 | 0 | 0 | 113 | ||
| 7 | A | 40.6 | Very low | 42.1 | Very low | 98 Ų | 98 | 126.9 Ų | 126.9 | 81% | 0.81 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 125.2 | 157.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | A9 | A7-A9 PolarHBondContact O-N 3.11Š|
| 8 | G | 38.8 | Very low | 41.6 | Very low | 79 Ų | 79 | 123.2 Ų | 123.2 | 81% | 0.814 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 121 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | G10 | G8-G10 PolarHBondContact O-N 3.07Š|
| 9 | A | 41.2 | Very low | 41.4 | Very low | 105 Ų | 105 | 124.3 Ų | 124.3 | 87% | 0.868 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 128.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | A7 | A7-A9 PolarHBondContact O-N 3.11Š|
| 10 | G | 34 | Very low | 41.3 | Very low | 79 Ų | 79 | 127.7 Ų | 127.7 | 81% | 0.814 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 137 | -178 | 0 | 0 | 0 | 0 | 0 | 113.4 | G8 | G8-G10 PolarHBondContact O-N 3.07Š|
| 11 | M | 49.9 | Very low | 41.3 | Very low | 182 Ų | 182 | 125.6 Ų | 125.6 | 90% | 0.897 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -86.9 | 142.3 | 155.4 | -101.9 | 145.7 | 77 | 0 | 0 | 108.8 | ||
| 12 | P | 48.1 | Very low | 41.1 | Very low | 113 Ų | 113 | 123.3 Ų | 123.3 | 73% | 0.734 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 147.1 | -171.9 | 30.5 | -33.5 | 0 | 0 | 0 | 111.4 | G14 | P12-G14 PolarHBondContact O-N 3.27Š|
| 13 | P | 43.3 | Very low | 40.9 | Very low | 126 Ų | 126 | 122.2 Ų | 122.2 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | -73.7 | 97.9 | 167.9 | 28.9 | -28.7 | 0 | 0 | 0 | 108.5 | A15 | P13-A15 VanDerWaalsContact C-N 3.26Å; P13-A15 PolarHBondContact O-N 3.01Å | ||
| 14 | G | 38 | Very low | 40.7 | Very low | 68 Ų | 68 | 120 Ų | 120 | 70% | 0.701 | 80% | 0.8 | S | S | * | * | trans | -65.5 | 91.7 | 161.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | P12 F16 | P12-G14 PolarHBondContact O-N 3.27Å; G14-F16 PolarHBondContact O-N 2.91Å | ||
| 15 | A | 37.3 | Very low | 41 | Very low | 91 Ų | 91 | 126 Ų | 126 | 75% | 0.752 | 81% | 0.808 | S | S | * | * | trans | -57.9 | 98.6 | 167.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | P13 S17 | P13-A15 VanDerWaalsContact C-N 3.26Å; P13-A15 PolarHBondContact O-N 3.01Å; A15-S17 PolarHBondContact O-N 2.8Å | ||
| 16 | F | 37.8 | Very low | 41.2 | Very low | 211 Ų | 211 | 128.2 Ų | 128.2 | 93% | 0.925 | 81% | 0.807 | S | S | * | * | trans | -67.1 | 90.7 | 153.6 | -96.3 | -96.2 | 0 | 0 | 0 | 106.1 | G14 G18 | G14-F16 PolarHBondContact O-N 2.91Å; F16-G18 PolarHBondContact O-N 3.08Å | ||
| 17 | S | 36.6 | Very low | 42.2 | Very low | 103 Ų | 103 | 124.1 Ų | 124.1 | 72% | 0.72 | 79% | 0.789 | S | S | * | * | trans | -58.2 | 92.7 | 158.8 | 51.4 | 0 | 0 | 0 | 0 | 106.9 | A15 T19 | A15-S17 PolarHBondContact O-N 2.8Å; S17-T19 PolarHBondContact O-N 3.1Å | ||
| 18 | G | 33.9 | Very low | 44 | Very low | 60 Ų | 60 | 123.5 Ų | 123.5 | 62% | 0.619 | 77% | 0.772 | S | S | * | * | trans | -59.4 | 110.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | F16 Q20 | F16-G18 PolarHBondContact O-N 3.08Å; G18-Q20 PolarHBondContact O-N 3.33Å | ||
| 19 | T | 37.8 | Very low | 46.1 | Very low | 145 Ų | 145 | 121.7 Ų | 121.7 | 89% | 0.89 | 75% | 0.745 | S | S | * | * | trans | -69.3 | 52.3 | 158.7 | 45.7 | 0 | 0 | 0 | 0 | 109.9 | S17 A21 | S17-T19 PolarHBondContact O-N 3.1Å; T19-A21 VanDerWaalsContact C-N 3.34Å; T19-A21 PolarHBondContact O-N 3.37Å | ||
| 20 | Q | 39.3 | Very low | 48 | Very low | 192 Ų | 192 | 119.3 Ų | 119.3 | 90% | 0.897 | 73% | 0.726 | S | S | * | * | trans | -94.1 | 65.7 | 170.6 | -91.9 | -173.8 | -9.1 | 0 | 0 | 108.9 | G18 | G18-Q20 PolarHBondContact O-N 3.33Š| ||
| 21 | A | 41.1 | Very low | 50.4 | Low | 83 Ų | 83 | 118.1 Ų | 118.1 | 69% | 0.686 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -167.4 | 73 | 165.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | T19 | T19-A21 VanDerWaalsContact C-N 3.34Å; T19-A21 PolarHBondContact O-N 3.37Å |
| 22 | Q | 36.3 | Very low | 52.3 | Low | 191 Ų | 191 | 110 Ų | 110 | 89% | 0.893 | 67% | 0.665 | S | S | * | * | trans | 170 | 71.3 | 148.6 | -95.9 | 157.1 | -31.8 | 0 | 0 | 109.3 | ||||
| 23 | A | 38.8 | Very low | 54.3 | Low | 96 Ų | 96 | 107.9 Ų | 107.9 | 79% | 0.793 | 65% | 0.652 | S | S | * | * | trans | -130.2 | 39.2 | 158.6 | 0 | 0 | 0 | 0 | 0 | 108.7 | R25 | A23-R25 PolarHBondContact O-N 3.42Å; A23-R25 VanDerWaalsContact O-N 3.1Å | ||
| 24 | A | 43.3 | Very low | 56.5 | Low | 85 Ų | 85 | 108.2 Ų | 108.2 | 70% | 0.702 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -56.7 | 114.9 | 147.7 | 0 | 0 | 0 | 0 | 0 | 103.8 | E26 | A24-E26 VanDerWaalsContact C-N 3.25Å; A24-E26 PolarHBondContact O-N 2.87Å |
| 25 | R | 51.2 | Low | 59.1 | Low | 240 Ų | 240 | 107.9 Ų | 107.9 | 91% | 0.906 | 62% | 0.618 | S | S | * | * | trans | -52.4 | 95.9 | 178.9 | -69.4 | 176 | 178.6 | 173.5 | -1.3 | 107.4 | A23 V27 | A23-R25 PolarHBondContact O-N 3.42Å; A23-R25 VanDerWaalsContact O-N 3.1Å; R25-V27 PolarHBondContact O-N 3.04Å | ||
| 26 | E | 55.8 | Low | 61.8 | Low | 177 Ų | 177 | 104 Ų | 104 | 83% | 0.827 | 59% | 0.587 | S | S | * | * | trans | -58 | 113.9 | 173.8 | -76.2 | -177.9 | 168.1 | 0 | 0 | 105.1 | A24 N28 | A24-E26 VanDerWaalsContact C-N 3.25Å; A24-E26 PolarHBondContact O-N 2.87Å; E26-N28 PolarHBondContact O-N 2.99Å | ||
| 27 | V | 63 | Low | 64.5 | Low | 82 Ų | 82 | 100.7 Ų | 100.7 | 50% | 0.497 | 57% | 0.574 | S | S | . | * | trans | -65.8 | 104.9 | -177.5 | -177 | 0 | 0 | 0 | 0 | 105.6 | R25 T29 L32 N101 | R25-V27 PolarHBondContact O-N 3.04Å; V27-T29 PolarHBondContact O-N 2.92Å; V27-L32 HydrophobicContact CG1-CD1 4.31Å; V27-L32 HydrophobicContact CG1-CD2 3.75Å; V27-L32 HydrophobicContact CG1-CG 3.8Å; V27-N101 PolarHBondContact O-ND2 3.25Å | ||
| 28 | N | 78.1 | Confident | 67.4 | Low | 86 Ų | 86 | 100.8 Ų | 100.8 | 46% | 0.46 | 56% | 0.564 | S | S | . | * | trans | -53.4 | 127.8 | -176.5 | -177.9 | -23.7 | 0 | 0 | 0 | 109.4 | E26 A30 S31 L32 | E26-N28 PolarHBondContact O-N 2.99Å; N28-A30 PolarHBondContact O-N 2.87Å; N28-A30 WeakPolarHBondContact OD1-CB 3.24Å; N28-A30 PolarHBondContact OD1-N 3.38Å; N28-S31 WeakPolarHBondContact O-CA 3.45Å; N28-S31 VanDerWaalsContact O-CB 3.26Å; N28-S31 WeakPolarHBondContact O-CB 3.14Å; N28-S31 PolarHBondContact O-N 2.95Å; N28-L32 PolarHBondContact O-N 3.02Å; N28-L32 VanDerWaalsContact O-N 3.09Å | ||
| 29 | T | 82.4 | Confident | 70.4 | Confident | 41 Ų | 41 | 97.9 Ų | 97.9 | 25% | 0.252 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -54.7 | -37.4 | 179.2 | -53.6 | 0 | 0 | 0 | 0 | 111.8 | V27 S31 L32 C33 N101 C102 | V27-T29 PolarHBondContact O-N 2.92Å; T29-S31 VanDerWaalsContact C-N 3.29Å; T29-S31 PolarHBondContact O-N 3.43Å; T29-L32 WeakPolarHBondContact O-CB 3.41Å; T29-L32 PolarHBondContact O-N 3.46Å; T29-L32 VanDerWaalsContact O-N 3.15Å; T29-C33 PolarHBondContact O-N 3.38Å; T29-C33 PolarHBondContact O-SG 3Å; T29-C33 VanDerWaalsContact O-SG 3.35Å; T29-N101 HydrophobicContact CG2-CB 4.36Å; T29-N101 WeakPolarHBondContact OG1-CB 3.35Å; T29-N101 PolarHBondContact OG1-ND2 2.84Å; T29-C102 VanDerWaalsContact CG2-SG 3.57Å |
| 30 | A | 81.4 | Confident | 73.3 | Confident | 55 Ų | 55 | 94.3 Ų | 94.3 | 46% | 0.455 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.8 | -37.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | N28 C33 R34 | N28-A30 PolarHBondContact O-N 2.87Å; N28-A30 WeakPolarHBondContact OD1-CB 3.24Å; N28-A30 PolarHBondContact OD1-N 3.38Å; A30-C33 PolarHBondContact O-N 2.81Å; A30-R34 PolarHBondContact O-N 3.46Å |
| 31 | S | 85.6 | Confident | 76 | Confident | 53 Ų | 53 | 91.4 Ų | 91.4 | 37% | 0.371 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.2 | -39.1 | 174.6 | -57 | 0 | 0 | 0 | 0 | 111.8 | N28 T29 R34 I35 | N28-S31 WeakPolarHBondContact O-CA 3.45Å; N28-S31 VanDerWaalsContact O-CB 3.26Å; N28-S31 WeakPolarHBondContact O-CB 3.14Å; N28-S31 PolarHBondContact O-N 2.95Å; T29-S31 VanDerWaalsContact C-N 3.29Å; T29-S31 PolarHBondContact O-N 3.43Å; S31-R34 PolarHBondContact O-N 3.23Å; S31-I35 WeakPolarHBondContact O-CD1 3.14Å; S31-I35 VanDerWaalsContact O-CG1 3.23Å; S31-I35 WeakPolarHBondContact O-CG1 3.29Å; S31-I35 PolarHBondContact O-N 3.43Å |
| 32 | L | 89.8 | Confident | 78.7 | Confident | 13 Ų | 13 | 90.5 Ų | 90.5 | 7% | 0.068 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -62.6 | -45.1 | 173.4 | -70.3 | 172 | 0 | 0 | 0 | 111.4 | V27 N28 T29 R34 I35 G36 V94 K97 C98 | V27-L32 HydrophobicContact CG1-CD1 4.31Å; V27-L32 HydrophobicContact CG1-CD2 3.75Å; V27-L32 HydrophobicContact CG1-CG 3.8Å; N28-L32 PolarHBondContact O-N 3.02Å; N28-L32 VanDerWaalsContact O-N 3.09Å; T29-L32 WeakPolarHBondContact O-CB 3.41Å; T29-L32 PolarHBondContact O-N 3.46Å; T29-L32 VanDerWaalsContact O-N 3.15Å; L32-R34 VanDerWaalsContact C-N 3.32Å; L32-R34 PolarHBondContact O-N 3.44Å; L32-I35 PolarHBondContact O-N 2.93Å; L32-G36 PolarHBondContact O-N 3.29Å; L32-V94 HydrophobicContact CB-CG1 4.43Å; L32-V94 VanDerWaalsContact O-CG1 3.22Å; L32-V94 WeakPolarHBondContact O-CG1 3.49Å; L32-K97 HydrophobicContact CD1-CB 4.08Å; L32-K97 HydrophobicContact CD1-CG 3.62Å; L32-K97 HydrophobicContact CD2-CB 4.48Å; L32-K97 HydrophobicContact CD2-CG 4.28Å; L32-C98 HydrophobicContact CB-CB 4.38Å |
| 33 | C | 89.1 | Confident | 81.6 | Confident | 67 Ų | 67 | 82.1 Ų | 82.1 | 45% | 0.453 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -59.6 | -42.5 | 176.3 | -68 | 0 | 0 | 0 | 0 | 111.8 | T29 A30 G36 Q37 | T29-C33 PolarHBondContact O-N 3.38Å; T29-C33 PolarHBondContact O-SG 3Å; T29-C33 VanDerWaalsContact O-SG 3.35Å; A30-C33 PolarHBondContact O-N 2.81Å; C33-G36 PolarHBondContact O-N 3.21Å; C33-Q37 PolarHBondContact O-N 2.86Å |
| 34 | R | 90.1 | Very high | 84.5 | Confident | 133 Ų | 133 | 81.4 Ų | 81.4 | 50% | 0.502 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -62.5 | -45.4 | 176.2 | -174 | 178.8 | -73.5 | 164.1 | -1.5 | 111.8 | A30 S31 L32 G36 Q37 E38 E139 | A30-R34 PolarHBondContact O-N 3.46Å; S31-R34 PolarHBondContact O-N 3.23Å; L32-R34 VanDerWaalsContact C-N 3.32Å; L32-R34 PolarHBondContact O-N 3.44Å; R34-G36 VanDerWaalsContact C-N 3.28Å; R34-G36 PolarHBondContact O-N 2.93Å; R34-Q37 PolarHBondContact O-N 2.93Å; R34-E38 PolarHBondContact O-N 3.01Å; R34-E139 IonicContact CZ-OE1 2.71Å; R34-E139 IonicContact CZ-OE2 2.76Å; R34-E139 IonicContact NH1-OE1 3.49Å; R34-E139 PolarHBondContact NH1-OE1 3.11Å; R34-E139 IonicContact NH1-OE2 3.6Å; R34-E139 PolarHBondContact NH1-OE2 3.32Å; R34-E139 IonicContact NH2-OE1 3.68Å; R34-E139 IonicContact NH2-OE2 3.49Å; R34-E139 PolarHBondContact NH2-OE2 3.49Å |
| 35 | I | 93.4 | Very high | 87 | Confident | 62 Ų | 62 | 83.2 Ų | 83.2 | 32% | 0.318 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.8 | -38.4 | 175.8 | -65.9 | 163.3 | 0 | 0 | 0 | 110.8 | S31 L32 T39 V94 | S31-I35 WeakPolarHBondContact O-CD1 3.14Å; S31-I35 VanDerWaalsContact O-CG1 3.23Å; S31-I35 WeakPolarHBondContact O-CG1 3.29Å; S31-I35 PolarHBondContact O-N 3.43Å; L32-I35 PolarHBondContact O-N 2.93Å; I35-T39 WeakPolarHBondContact O-CB 2.9Å; I35-T39 PolarHBondContact O-N 3.35Å; I35-T39 PolarHBondContact O-OG1 3.05Å; I35-V94 HydrophobicContact CG2-CG2 3.89Å |
| 36 | G | 94.1 | Very high | 89.2 | Confident | 10 Ų | 10 | 73.1 Ų | 73.1 | 10% | 0.103 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -61.8 | -49.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | L32 C33 R34 E38 T39 V40 | L32-G36 PolarHBondContact O-N 3.29Å; C33-G36 PolarHBondContact O-N 3.21Å; R34-G36 VanDerWaalsContact C-N 3.28Å; R34-G36 PolarHBondContact O-N 2.93Å; G36-E38 PolarHBondContact O-N 3.44Å; G36-T39 PolarHBondContact O-N 2.94Å; G36-V40 WeakPolarHBondContact O-CG2 3.43Å; G36-V40 PolarHBondContact O-N 3.32Å |
| 37 | Q | 94.3 | Very high | 91.2 | Very high | 140 Ų | 140 | 66.5 Ų | 66.5 | 65% | 0.654 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -57.9 | -49.2 | 176.6 | -177.4 | -173.7 | -11.9 | 0 | 0 | 112 | C33 R34 T39 V40 Q41 | C33-Q37 PolarHBondContact O-N 2.86Å; R34-Q37 PolarHBondContact O-N 2.93Å; Q37-T39 VanDerWaalsContact C-N 3.3Å; Q37-T39 PolarHBondContact O-N 3.43Å; Q37-V40 PolarHBondContact O-N 3.5Å; Q37-Q41 PolarHBondContact O-N 2.94Å |
| 38 | E | 95.9 | Very high | 92.8 | Very high | 105 Ų | 105 | 67.4 Ų | 67.4 | 49% | 0.491 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -59.2 | -43.1 | 177.1 | -173.1 | 179.9 | -166.9 | 0 | 0 | 111.1 | R34 G36 V40 Q41 D42 | R34-E38 PolarHBondContact O-N 3.01Å; G36-E38 PolarHBondContact O-N 3.44Å; E38-V40 VanDerWaalsContact C-N 3.35Å; E38-V40 PolarHBondContact O-N 2.72Å; E38-Q41 WeakPolarHBondContact O-CB 3.06Å; E38-Q41 PolarHBondContact O-N 3.18Å; E38-D42 PolarHBondContact O-N 3.47Å |
| 39 | T | 97.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -64.3 | -38.1 | 178.2 | -54.9 | 0 | 0 | 0 | 0 | 112.1 | I35 G36 Q37 D42 I43 L87 K90 L91 | I35-T39 WeakPolarHBondContact O-CB 2.9Å; I35-T39 PolarHBondContact O-N 3.35Å; I35-T39 PolarHBondContact O-OG1 3.05Å; G36-T39 PolarHBondContact O-N 2.94Å; Q37-T39 VanDerWaalsContact C-N 3.3Å; Q37-T39 PolarHBondContact O-N 3.43Å; T39-D42 PolarHBondContact O-N 3.46Å; T39-I43 HydrophobicContact CG2-CD1 4.34Å; T39-I43 VanDerWaalsContact O-CG1 3.25Å; T39-I43 WeakPolarHBondContact O-CG1 3.49Å; T39-I43 PolarHBondContact O-N 3.1Å; T39-L87 HydrophobicContact CG2-CB 4.47Å; T39-L87 HydrophobicContact CG2-CD2 4.22Å; T39-L87 WeakPolarHBondContact CG2-O 3.37Å; T39-K90 HydrophobicContact CG2-CB 4.37Å; T39-K90 HydrophobicContact CG2-CD 4.07Å; T39-K90 HydrophobicContact CG2-CG 4.31Å; T39-K90 WeakPolarHBondContact OG1-CE 3.45Å; T39-K90 PolarHBondContact OG1-NZ 3.04Å; T39-L91 HydrophobicContact CG2-CB 3.91Å; T39-L91 HydrophobicContact CG2-CD1 4.41Å |
| 40 | V | 98.1 | Very high | 94.3 | Very high | 69 Ų | 69 | 64.7 Ų | 64.7 | 42% | 0.418 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -65.2 | -42.6 | 174.4 | 172.6 | 0 | 0 | 0 | 0 | 110.8 | G36 Q37 E38 D42 I43 V44 L91 | G36-V40 WeakPolarHBondContact O-CG2 3.43Å; G36-V40 PolarHBondContact O-N 3.32Å; Q37-V40 PolarHBondContact O-N 3.5Å; E38-V40 VanDerWaalsContact C-N 3.35Å; E38-V40 PolarHBondContact O-N 2.72Å; V40-D42 VanDerWaalsContact C-N 3.33Å; V40-D42 PolarHBondContact O-N 3.19Å; V40-I43 WeakPolarHBondContact O-CB 3.47Å; V40-I43 PolarHBondContact O-N 2.87Å; V40-V44 WeakPolarHBondContact O-CG2 3.09Å; V40-V44 PolarHBondContact O-N 3.37Å; V40-L91 HydrophobicContact CG2-CD1 3.71Å; V40-L91 HydrophobicContact CG2-CD2 3.93Å |
| 41 | Q | 97.3 | Very high | 95 | Very high | 132 Ų | 132 | 68.4 Ų | 68.4 | 62% | 0.617 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -60.4 | -44.2 | 176.4 | -173.3 | 177.1 | 8 | 0 | 0 | 111.5 | Q37 E38 I43 V44 F45 | Q37-Q41 PolarHBondContact O-N 2.94Å; E38-Q41 WeakPolarHBondContact O-CB 3.06Å; E38-Q41 PolarHBondContact O-N 3.18Å; Q41-I43 VanDerWaalsContact C-N 3.33Å; Q41-I43 PolarHBondContact O-N 3.01Å; Q41-V44 PolarHBondContact O-N 2.79Å; Q41-F45 PolarHBondContact O-N 3.33Å |
| 42 | D | 97.6 | Very high | 95.4 | Very high | 64 Ų | 64 | 71.2 Ų | 71.2 | 34% | 0.342 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60.7 | -41.2 | 175.9 | -72.5 | -19.1 | 0 | 0 | 0 | 112 | E38 T39 V40 V44 F45 R46 L87 | E38-D42 PolarHBondContact O-N 3.47Å; T39-D42 PolarHBondContact O-N 3.46Å; V40-D42 VanDerWaalsContact C-N 3.33Å; V40-D42 PolarHBondContact O-N 3.19Å; D42-V44 PolarHBondContact O-N 3.2Å; D42-F45 PolarHBondContact O-N 3.04Å; D42-R46 WeakPolarHBondContact O-CB 3.17Å; D42-R46 PolarHBondContact O-N 2.91Å; D42-L87 HydrophobicContact CB-CD1 3.96Å; D42-L87 HydrophobicContact CB-CD2 3.96Å |
| 43 | I | 98.1 | Very high | 95.5 | Very high | 15 Ų | 15 | 71.9 Ų | 71.9 | 8% | 0.077 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.8 | -47.5 | 176.3 | -72.2 | 165.7 | 0 | 0 | 0 | 110.4 | T39 V40 Q41 R46 T47 L84 L87 F88 L91 | T39-I43 HydrophobicContact CG2-CD1 4.34Å; T39-I43 VanDerWaalsContact O-CG1 3.25Å; T39-I43 WeakPolarHBondContact O-CG1 3.49Å; T39-I43 PolarHBondContact O-N 3.1Å; V40-I43 WeakPolarHBondContact O-CB 3.47Å; V40-I43 PolarHBondContact O-N 2.87Å; Q41-I43 VanDerWaalsContact C-N 3.33Å; Q41-I43 PolarHBondContact O-N 3.01Å; I43-R46 PolarHBondContact O-N 3.49Å; I43-T47 VanDerWaalsContact O-CB 3.28Å; I43-T47 WeakPolarHBondContact O-CB 3.36Å; I43-T47 PolarHBondContact O-N 3.12Å; I43-T47 PolarHBondContact O-OG1 2.84Å; I43-L84 HydrophobicContact CB-CD1 4.34Å; I43-L84 HydrophobicContact CG1-CD1 4.43Å; I43-L84 HydrophobicContact CG2-CD1 3.89Å; I43-L87 HydrophobicContact CD1-CB 4.16Å; I43-L87 HydrophobicContact CG1-CB 3.57Å; I43-L87 HydrophobicContact CG1-CD1 4.1Å; I43-L87 HydrophobicContact CG1-CG 4.41Å; I43-F88 HydrophobicContact CD1-CD1 3.92Å; I43-F88 HydrophobicContact CD1-CE1 3.94Å; I43-F88 HydrophobicContact CD1-CG 4.39Å; I43-F88 HydrophobicContact CD1-CZ 4.44Å; I43-F88 HydrophobicContact CG2-CE1 4.06Å; I43-F88 HydrophobicContact CG2-CE2 4.17Å; I43-F88 HydrophobicContact CG2-CZ 3.63Å; I43-L91 HydrophobicContact CD1-CB 4.31Å; I43-L91 HydrophobicContact CD1-CD2 3.77Å |
| 44 | V | 97.8 | Very high | 95.6 | Very high | 80 Ų | 80 | 72.1 Ų | 72.1 | 49% | 0.485 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.9 | -48.4 | 179.2 | 174 | 0 | 0 | 0 | 0 | 110.1 | V40 Q41 D42 R46 T47 M48 | V40-V44 WeakPolarHBondContact O-CG2 3.09Å; V40-V44 PolarHBondContact O-N 3.37Å; Q41-V44 PolarHBondContact O-N 2.79Å; D42-V44 PolarHBondContact O-N 3.2Å; V44-R46 PolarHBondContact O-N 2.85Å; V44-T47 WeakPolarHBondContact O-CB 3.49Å; V44-T47 PolarHBondContact O-N 3.41Å; V44-M48 HydrophobicContact CG1-SD 4.22Å; V44-M48 WeakPolarHBondContact O-CG 3.44Å; V44-M48 PolarHBondContact O-N 2.88Å |
| 45 | F | 97.4 | Very high | 95.6 | Very high | 124 Ų | 124 | 76.2 Ų | 76.2 | 54% | 0.544 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -60.2 | -48.4 | 179.5 | -171.7 | -96.3 | 0 | 0 | 0 | 111.8 | Q41 D42 T47 M48 E49 | Q41-F45 PolarHBondContact O-N 3.33Å; D42-F45 PolarHBondContact O-N 3.04Å; F45-T47 VanDerWaalsContact C-N 3.26Å; F45-T47 PolarHBondContact O-N 3.28Å; F45-M48 WeakPolarHBondContact O-CB 3.21Å; F45-M48 PolarHBondContact O-N 3.25Å; F45-M48 VanDerWaalsContact O-N 3.1Å; F45-E49 HydrophobicContact CD1-CG 4.24Å; F45-E49 WeakPolarHBondContact CD1-OE2 3.34Å; F45-E49 HydrophobicContact CE1-CG 3.94Å; F45-E49 WeakPolarHBondContact CE1-OE1 3.45Å; F45-E49 WeakPolarHBondContact CE1-OE2 3.43Å; F45-E49 HydrophobicContact CZ-CG 4.4Å; F45-E49 PolarHBondContact O-N 3Å |
| 46 | R | 97 | Very high | 95.1 | Very high | 27 Ų | 27 | 77.9 Ų | 77.9 | 10% | 0.102 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -59.7 | -38.7 | 177.7 | -172.6 | 75.4 | -83.2 | 174.8 | 7.2 | 111.6 | D42 I43 V44 E49 I50 H80 L84 L87 | D42-R46 WeakPolarHBondContact O-CB 3.17Å; D42-R46 PolarHBondContact O-N 2.91Å; I43-R46 PolarHBondContact O-N 3.49Å; V44-R46 PolarHBondContact O-N 2.85Å; R46-E49 IonicContact CZ-OE2 3.66Å; R46-E49 IonicContact NE-OE2 3.61Å; R46-E49 PolarHBondContact NE-OE2 2.85Å; R46-E49 IonicContact NH1-OE2 2.93Å; R46-E49 VanDerWaalsContact NH2-CB 3.35Å; R46-E49 IonicContact NH2-OE1 2.84Å; R46-E49 PolarHBondContact NH2-OE1 2.76Å; R46-E49 IonicContact NH2-OE2 3.57Å; R46-E49 PolarHBondContact NH2-OE2 3.34Å; R46-E49 PolarHBondContact O-N 3.49Å; R46-I50 WeakPolarHBondContact O-CG1 3.44Å; R46-I50 PolarHBondContact O-N 3.42Å; R46-H80 PolarHBondContact NH1-CE1 3.37Å; R46-H80 VanDerWaalsContact NH1-CE1 3.29Å; R46-H80 PolarHBondContact NH1-ND1 3.4Å; R46-H80 PolarHBondContact NH2-CD2 2.73Å; R46-H80 PolarHBondContact NH2-CE1 3.44Å; R46-H80 PolarHBondContact NH2-ND1 2.91Å; R46-H80 PolarHBondContact NH2-NE2 3.26Å; R46-L84 HydrophobicContact CB-CD1 4.24Å; R46-L84 HydrophobicContact CG-CB 4.2Å; R46-L84 HydrophobicContact CG-CD1 4.18Å; R46-L87 HydrophobicContact CB-CD1 4.33Å |
| 47 | T | 97.4 | Very high | 94.6 | Very high | 38 Ų | 38 | 79.1 Ų | 79.1 | 23% | 0.233 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -66.8 | -41.3 | 176.6 | -59 | 0 | 0 | 0 | 0 | 111.4 | I43 V44 F45 E49 I50 F51 | I43-T47 VanDerWaalsContact O-CB 3.28Å; I43-T47 WeakPolarHBondContact O-CB 3.36Å; I43-T47 PolarHBondContact O-N 3.12Å; I43-T47 PolarHBondContact O-OG1 2.84Å; V44-T47 WeakPolarHBondContact O-CB 3.49Å; V44-T47 PolarHBondContact O-N 3.41Å; F45-T47 VanDerWaalsContact C-N 3.26Å; F45-T47 PolarHBondContact O-N 3.28Å; T47-E49 VanDerWaalsContact C-N 3.34Å; T47-E49 PolarHBondContact O-N 3.42Å; T47-I50 WeakPolarHBondContact O-CB 3.05Å; T47-I50 PolarHBondContact O-N 3.38Å; T47-F51 HydrophobicContact CG2-CD2 3.8Å; T47-F51 HydrophobicContact CG2-CE2 3.37Å; T47-F51 HydrophobicContact CG2-CZ 4.26Å; T47-F51 WeakPolarHBondContact O-CD2 3.45Å; T47-F51 PolarHBondContact O-N 3.15Å |
| 48 | M | 96.8 | Very high | 93.6 | Very high | 101 Ų | 101 | 78.8 Ų | 78.8 | 50% | 0.498 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 173.7 | -68.3 | 174.3 | 70.2 | 0 | 0 | 111.6 | V44 F45 I50 F51 Q52 | V44-M48 HydrophobicContact CG1-SD 4.22Å; V44-M48 WeakPolarHBondContact O-CG 3.44Å; V44-M48 PolarHBondContact O-N 2.88Å; F45-M48 WeakPolarHBondContact O-CB 3.21Å; F45-M48 PolarHBondContact O-N 3.25Å; F45-M48 VanDerWaalsContact O-N 3.1Å; M48-I50 VanDerWaalsContact C-N 3.34Å; M48-I50 PolarHBondContact O-N 3.35Å; M48-F51 PolarHBondContact O-N 3.09Å; M48-Q52 VanDerWaalsContact O-CG 3.3Å; M48-Q52 WeakPolarHBondContact O-CG 3.42Å; M48-Q52 PolarHBondContact O-N 2.89Å |
| 49 | E | 95.4 | Very high | 92.4 | Very high | 59 Ų | 59 | 79.6 Ų | 79.6 | 28% | 0.276 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -63.8 | -38.2 | 176.9 | -68.3 | 176.8 | 113.6 | 0 | 0 | 112.3 | F45 R46 T47 Q52 L53 | F45-E49 HydrophobicContact CD1-CG 4.24Å; F45-E49 WeakPolarHBondContact CD1-OE2 3.34Å; F45-E49 HydrophobicContact CE1-CG 3.94Å; F45-E49 WeakPolarHBondContact CE1-OE1 3.45Å; F45-E49 WeakPolarHBondContact CE1-OE2 3.43Å; F45-E49 HydrophobicContact CZ-CG 4.4Å; F45-E49 PolarHBondContact O-N 3Å; R46-E49 IonicContact CZ-OE2 3.66Å; R46-E49 IonicContact NE-OE2 3.61Å; R46-E49 PolarHBondContact NE-OE2 2.85Å; R46-E49 IonicContact NH1-OE2 2.93Å; R46-E49 VanDerWaalsContact NH2-CB 3.35Å; R46-E49 IonicContact NH2-OE1 2.84Å; R46-E49 PolarHBondContact NH2-OE1 2.76Å; R46-E49 IonicContact NH2-OE2 3.57Å; R46-E49 PolarHBondContact NH2-OE2 3.34Å; R46-E49 PolarHBondContact O-N 3.49Å; T47-E49 VanDerWaalsContact C-N 3.34Å; T47-E49 PolarHBondContact O-N 3.42Å; E49-Q52 PolarHBondContact O-N 3.23Å; E49-L53 WeakPolarHBondContact O-CB 3.32Å; E49-L53 PolarHBondContact O-N 3.07Å |
| 50 | I | 96.3 | Very high | 90.7 | Very high | 12 Ų | 12 | 83 Ų | 83 | 6% | 0.062 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -59.8 | -49.2 | 172.8 | -73 | 163.3 | 0 | 0 | 0 | 110.3 | R46 T47 M48 Q52 L53 L54 L77 H80 L81 L84 | R46-I50 WeakPolarHBondContact O-CG1 3.44Å; R46-I50 PolarHBondContact O-N 3.42Å; T47-I50 WeakPolarHBondContact O-CB 3.05Å; T47-I50 PolarHBondContact O-N 3.38Å; M48-I50 VanDerWaalsContact C-N 3.34Å; M48-I50 PolarHBondContact O-N 3.35Å; I50-Q52 VanDerWaalsContact C-N 3.34Å; I50-Q52 PolarHBondContact O-N 2.89Å; I50-L53 PolarHBondContact O-N 3.41Å; I50-L54 HydrophobicContact CG2-CD1 3.87Å; I50-L54 HydrophobicContact CG2-CG 4.4Å; I50-L54 WeakPolarHBondContact O-CB 3.44Å; I50-L54 WeakPolarHBondContact O-CG 3.35Å; I50-L54 PolarHBondContact O-N 2.92Å; I50-L77 HydrophobicContact CB-CD1 4.49Å; I50-L77 HydrophobicContact CG1-CD1 4.42Å; I50-L77 HydrophobicContact CG2-CD1 3.74Å; I50-H80 HydrophobicContact CD1-CB 4.02Å; I50-H80 HydrophobicContact CG1-CB 3.59Å; I50-L81 HydrophobicContact CD1-CD2 4.02Å; I50-L84 HydrophobicContact CD1-CD2 3.92Å |
| 51 | F | 96.2 | Very high | 89 | Confident | 133 Ų | 133 | 85.4 Ų | 85.4 | 58% | 0.583 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -64.9 | -37.2 | 179 | -72.3 | -53.5 | 0 | 0 | 0 | 112.8 | T47 M48 L54 R55 | T47-F51 HydrophobicContact CG2-CD2 3.8Å; T47-F51 HydrophobicContact CG2-CE2 3.37Å; T47-F51 HydrophobicContact CG2-CZ 4.26Å; T47-F51 WeakPolarHBondContact O-CD2 3.45Å; T47-F51 PolarHBondContact O-N 3.15Å; M48-F51 PolarHBondContact O-N 3.09Å; F51-L54 HydrophobicContact CD1-CD1 4.45Å; F51-L54 PolarHBondContact O-N 3.37Å; F51-R55 VanDerWaalsContact O-CB 3.28Å; F51-R55 WeakPolarHBondContact O-CB 3.48Å; F51-R55 PolarHBondContact O-N 2.9Å |
| 52 | Q | 94.2 | Very high | 87.1 | Confident | 111 Ų | 111 | 82.8 Ų | 82.8 | 52% | 0.519 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 173.7 | -72.7 | 175.5 | 15.5 | 0 | 0 | 111.8 | M48 E49 I50 R55 N56 | M48-Q52 VanDerWaalsContact O-CG 3.3Å; M48-Q52 WeakPolarHBondContact O-CG 3.42Å; M48-Q52 PolarHBondContact O-N 2.89Å; E49-Q52 PolarHBondContact O-N 3.23Å; I50-Q52 VanDerWaalsContact C-N 3.34Å; I50-Q52 PolarHBondContact O-N 2.89Å; Q52-R55 PolarHBondContact O-N 2.84Å; Q52-N56 PolarHBondContact O-N 2.92Å; Q52-N56 PolarHBondContact O-ND2 3.37Å |
| 53 | L | 91.8 | Very high | 85.6 | Confident | 27 Ų | 27 | 86.1 Ų | 86.1 | 14% | 0.141 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -64.1 | -46.8 | 176.8 | -176.3 | 64.5 | 0 | 0 | 0 | 111.4 | E49 I50 N56 M57 R73 K76 L77 | E49-L53 WeakPolarHBondContact O-CB 3.32Å; E49-L53 PolarHBondContact O-N 3.07Å; I50-L53 PolarHBondContact O-N 3.41Å; L53-N56 PolarHBondContact O-N 3.05Å; L53-M57 PolarHBondContact O-N 2.71Å; L53-M57 VanDerWaalsContact O-N 3.09Å; L53-R73 HydrophobicContact CD1-CB 4.27Å; L53-R73 HydrophobicContact CD1-CG 4.2Å; L53-K76 HydrophobicContact CD2-CB 3.96Å; L53-L77 HydrophobicContact CD2-CB 3.71Å; L53-L77 HydrophobicContact CD2-CD1 4.32Å |
| 54 | L | 90.9 | Very high | 83.8 | Confident | 73 Ų | 73 | 89.2 Ų | 89.2 | 38% | 0.382 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -61.5 | -44.7 | 176.8 | -73.4 | 173.3 | 0 | 0 | 0 | 111.8 | I50 F51 N56 M57 L77 | I50-L54 HydrophobicContact CG2-CD1 3.87Å; I50-L54 HydrophobicContact CG2-CG 4.4Å; I50-L54 WeakPolarHBondContact O-CB 3.44Å; I50-L54 WeakPolarHBondContact O-CG 3.35Å; I50-L54 PolarHBondContact O-N 2.92Å; F51-L54 HydrophobicContact CD1-CD1 4.45Å; F51-L54 PolarHBondContact O-N 3.37Å; L54-N56 PolarHBondContact O-N 3.47Å; L54-M57 HydrophobicContact CD2-CE 4.43Å; L54-M57 WeakPolarHBondContact O-CB 3.39Å; L54-M57 PolarHBondContact O-N 3.31Å; L54-L77 HydrophobicContact CD2-CD1 4.17Å; L54-L77 HydrophobicContact CD2-CD2 3.69Å; L54-L77 HydrophobicContact CG-CD1 4.17Å |
| 55 | R | 89.4 | Confident | 82.1 | Confident | 218 Ų | 218 | 91 Ų | 91 | 82% | 0.823 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -55.8 | -40.7 | 176.8 | 178 | -177 | 177.5 | 173.7 | 1.4 | 112.1 | F51 Q52 M57 | F51-R55 VanDerWaalsContact O-CB 3.28Å; F51-R55 WeakPolarHBondContact O-CB 3.48Å; F51-R55 PolarHBondContact O-N 2.9Å; Q52-R55 PolarHBondContact O-N 2.84Å; R55-M57 VanDerWaalsContact C-N 3.33Å |
| 56 | N | 84.6 | Confident | 80.9 | Confident | 97 Ų | 97 | 91.1 Ų | 91.1 | 52% | 0.519 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -82.5 | -14.8 | -177.8 | -68.4 | -35.2 | 0 | 0 | 0 | 112.5 | Q52 L53 L54 Q58 R73 | Q52-N56 PolarHBondContact O-N 2.92Å; Q52-N56 PolarHBondContact O-ND2 3.37Å; L53-N56 PolarHBondContact O-N 3.05Å; L54-N56 PolarHBondContact O-N 3.47Å; N56-Q58 PolarHBondContact O-N 2.94Å; N56-R73 PolarHBondContact O-NH1 3.22Å |
| 57 | M | 82.8 | Confident | 79.9 | Confident | 37 Ų | 37 | 93.2 Ų | 93.2 | 18% | 0.182 | 48% | 0.484 | C | S | . | . | trans | -70.9 | 113.5 | -176.1 | -159.4 | 170.4 | 82.4 | 0 | 0 | 110.3 | L53 L54 R55 Y70 | L53-M57 PolarHBondContact O-N 2.71Å; L53-M57 VanDerWaalsContact O-N 3.09Å; L54-M57 HydrophobicContact CD2-CE 4.43Å; L54-M57 WeakPolarHBondContact O-CB 3.39Å; L54-M57 PolarHBondContact O-N 3.31Å; R55-M57 VanDerWaalsContact C-N 3.33Å; M57-Y70 HydrophobicContact CE-CE2 4.08Å; M57-Y70 HydrophobicContact CG-CD2 4.35Å; M57-Y70 HydrophobicContact CG-CE2 4.32Å; M57-Y70 HydrophobicContact SD-CE2 4.16Å | ||
| 58 | Q | 74.3 | Confident | 79.2 | Confident | 132 Ų | 132 | 94.2 Ų | 94.2 | 62% | 0.617 | 50% | 0.501 | S | S | * | . | trans | -79.2 | 130.1 | 172.1 | -69.2 | -179.2 | 13.1 | 0 | 0 | 109.1 | N56 | N56-Q58 PolarHBondContact O-N 2.94Š| ||
| 59 | L | 69.1 | Low | 78.5 | Confident | 123 Ų | 123 | 92.9 Ų | 92.9 | 64% | 0.644 | 50% | 0.499 | S | S | * | . | trans | -71.6 | 157.7 | 169.2 | -70.4 | 107.7 | 0 | 0 | 0 | 110 | N61 | L59-N61 VanDerWaalsContact C-N 3.29Å; L59-N61 PolarHBondContact O-N 3.23Å; L59-N61 PolarHBondContact O-OD1 3.14Å | ||
| 60 | P | 62 | Low | 78 | Confident | 71 Ų | 71 | 93 Ų | 93 | 46% | 0.461 | 50% | 0.497 | S | S | . | . | trans | -66.1 | 86.1 | 175.5 | -15.6 | 30.1 | 0 | 0 | 0 | 110.6 | G62 Y65 | P60-G62 PolarHBondContact O-N 3.12Å; P60-G62 VanDerWaalsContact O-N 3.15Å; P60-Y65 HydrophobicContact CB-CD2 3.59Å; P60-Y65 HydrophobicContact CB-CE2 3.69Å; P60-Y65 HydrophobicContact CG-CD2 4.05Å; P60-Y65 HydrophobicContact CG-CE2 3.66Å | ||
| 61 | N | 62.9 | Low | 77.6 | Confident | 120 Ų | 120 | 97.4 Ų | 97.4 | 64% | 0.642 | 52% | 0.518 | S | S | * | . | trans | -83.7 | 20.7 | -175.8 | -62.6 | -1.7 | 0 | 0 | 0 | 113.1 | L59 V63 | L59-N61 VanDerWaalsContact C-N 3.29Å; L59-N61 PolarHBondContact O-N 3.23Å; L59-N61 PolarHBondContact O-OD1 3.14Å; N61-V63 PolarHBondContact O-N 3.19Å | ||
| 62 | G | 58.2 | Low | 77.3 | Confident | 77 Ų | 77 | 95 Ų | 95 | 79% | 0.794 | 51% | 0.511 | S | S | * | . | S | Bend | trans | 68.8 | -15.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 117 | P60 | P60-G62 PolarHBondContact O-N 3.12Å; P60-G62 VanDerWaalsContact O-N 3.15Å |
| 63 | V | 64.3 | Low | 77.1 | Confident | 133 Ų | 133 | 93.2 Ų | 93.2 | 81% | 0.806 | 50% | 0.5 | S | S | * | . | S | Bend | trans | -104.2 | -30.4 | -173.2 | -177.7 | 0 | 0 | 0 | 0 | 113.2 | N61 | N61-V63 PolarHBondContact O-N 3.19Š|
| 64 | T | 61.5 | Low | 77 | Confident | 81 Ų | 81 | 94 Ų | 94 | 50% | 0.497 | 50% | 0.504 | S | S | . | . | trans | -145.5 | 89.3 | 175.1 | 47.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 65 | Y | 61.9 | Low | 77.1 | Confident | 116 Ų | 116 | 92.2 Ų | 92.2 | 46% | 0.455 | 50% | 0.503 | S | S | . | . | trans | -101.5 | 102 | 178.1 | -173 | -120.7 | 0 | 0 | 0 | 110.5 | P60 T67 | P60-Y65 HydrophobicContact CB-CD2 3.59Å; P60-Y65 HydrophobicContact CB-CE2 3.69Å; P60-Y65 HydrophobicContact CG-CD2 4.05Å; P60-Y65 HydrophobicContact CG-CE2 3.66Å; Y65-T67 WeakPolarHBondContact CD1-OG1 3.2Å; Y65-T67 HydrophobicContact CE1-CG2 3.79Å; Y65-T67 WeakPolarHBondContact CE1-OG1 3.45Å; Y65-T67 PolarHBondContact O-N 2.91Å | ||
| 66 | H | 72.1 | Confident | 77.4 | Confident | 128 Ų | 128 | 86.6 Ų | 86.6 | 59% | 0.593 | 49% | 0.485 | S | S | * | . | trans | -95 | 81.7 | 171.1 | -61.7 | -66.2 | 0 | 0 | 0 | 109.6 | G68 T69 Y70 | H66-G68 PolarHBondContact O-N 3.34Å; H66-G68 VanDerWaalsContact O-N 3.13Å; H66-T69 PolarHBondContact O-N 3.16Å; H66-Y70 PolarHBondContact O-N 3.48Å; H66-Y70 VanDerWaalsContact O-N 3.17Å | ||
| 67 | T | 76.8 | Confident | 77.9 | Confident | 70 Ų | 70 | 82.9 Ų | 82.9 | 43% | 0.429 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -48.6 | -42.1 | -175.3 | -42.3 | 0 | 0 | 0 | 0 | 113.1 | Y65 Y70 Q71 | Y65-T67 WeakPolarHBondContact CD1-OG1 3.2Å; Y65-T67 HydrophobicContact CE1-CG2 3.79Å; Y65-T67 WeakPolarHBondContact CE1-OG1 3.45Å; Y65-T67 PolarHBondContact O-N 2.91Å; T67-Y70 PolarHBondContact O-N 2.92Å; T67-Q71 HydrophobicContact CG2-CG 4.5Å; T67-Q71 WeakPolarHBondContact O-CB 3.4Å; T67-Q71 VanDerWaalsContact O-CG 3.26Å; T67-Q71 WeakPolarHBondContact O-CG 3.33Å; T67-Q71 PolarHBondContact O-N 3.41Å |
| 68 | G | 80.9 | Confident | 78.5 | Confident | 59 Ų | 59 | 87.1 Ų | 87.1 | 61% | 0.608 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -64.9 | -42.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | H66 Q71 D72 | H66-G68 PolarHBondContact O-N 3.34Å; H66-G68 VanDerWaalsContact O-N 3.13Å; G68-Q71 PolarHBondContact O-N 3.38Å; G68-D72 PolarHBondContact O-N 2.99Å |
| 69 | T | 83.6 | Confident | 79.6 | Confident | 73 Ų | 73 | 83.9 Ų | 83.9 | 45% | 0.448 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -70.6 | -35.2 | -179.7 | -38 | 0 | 0 | 0 | 0 | 112 | H66 R73 | H66-T69 PolarHBondContact O-N 3.16Å; T69-R73 WeakPolarHBondContact O-CD 3.31Å; T69-R73 VanDerWaalsContact O-CG 3.25Å; T69-R73 WeakPolarHBondContact O-CG 3.26Å; T69-R73 PolarHBondContact O-N 3Å |
| 70 | Y | 84.8 | Confident | 80.9 | Confident | 61 Ų | 61 | 79.8 Ų | 79.8 | 24% | 0.239 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -66.3 | -47.4 | 174.1 | 177.3 | -94.4 | 0 | 0 | 0 | 111.4 | M57 H66 T67 D72 R73 L74 | M57-Y70 HydrophobicContact CE-CE2 4.08Å; M57-Y70 HydrophobicContact CG-CD2 4.35Å; M57-Y70 HydrophobicContact CG-CE2 4.32Å; M57-Y70 HydrophobicContact SD-CE2 4.16Å; H66-Y70 PolarHBondContact O-N 3.48Å; H66-Y70 VanDerWaalsContact O-N 3.17Å; T67-Y70 PolarHBondContact O-N 2.92Å; Y70-D72 PolarHBondContact O-N 2.86Å; Y70-R73 PolarHBondContact O-N 3.2Å; Y70-L74 HydrophobicContact CE1-CD2 4.16Å; Y70-L74 WeakPolarHBondContact O-CB 3.43Å; Y70-L74 PolarHBondContact O-N 3.09Å |
| 71 | Q | 87.9 | Confident | 82.6 | Confident | 105 Ų | 105 | 80.3 Ų | 80.3 | 49% | 0.491 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.6 | -40.7 | 178.6 | -72.2 | -67.9 | -12.4 | 0 | 0 | 112.4 | T67 G68 R73 L74 G75 | T67-Q71 HydrophobicContact CG2-CG 4.5Å; T67-Q71 WeakPolarHBondContact O-CB 3.4Å; T67-Q71 VanDerWaalsContact O-CG 3.26Å; T67-Q71 WeakPolarHBondContact O-CG 3.33Å; T67-Q71 PolarHBondContact O-N 3.41Å; G68-Q71 PolarHBondContact O-N 3.38Å; Q71-R73 PolarHBondContact O-N 3.38Å; Q71-L74 PolarHBondContact O-N 3.41Å; Q71-G75 PolarHBondContact O-N 3.22Å |
| 72 | D | 89.8 | Confident | 84.2 | Confident | 84 Ų | 84 | 81.1 Ų | 81.1 | 45% | 0.449 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.6 | -43.4 | 175.2 | -178.1 | 69.2 | 0 | 0 | 0 | 112.3 | G68 Y70 G75 K76 | G68-D72 PolarHBondContact O-N 2.99Å; Y70-D72 PolarHBondContact O-N 2.86Å; D72-G75 PolarHBondContact O-N 2.94Å; D72-K76 WeakPolarHBondContact O-CG 3.39Å; D72-K76 PolarHBondContact O-N 3.22Å; D72-K76 IonicContact OD1-NZ 3.91Å; D72-K76 VanDerWaalsContact OD2-CE 3.32Å; D72-K76 WeakPolarHBondContact OD2-CE 3.44Å; D72-K76 IonicContact OD2-NZ 2.7Å; D72-K76 PolarHBondContact OD2-NZ 3.33Å |
| 73 | R | 89.2 | Confident | 86 | Confident | 72 Ų | 72 | 80.3 Ų | 80.3 | 27% | 0.272 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66.8 | -40.3 | 176.6 | -70.2 | 168.3 | -178 | -132.8 | 12.3 | 112 | L53 N56 T69 Y70 Q71 K76 L77 | L53-R73 HydrophobicContact CD1-CB 4.27Å; L53-R73 HydrophobicContact CD1-CG 4.2Å; N56-R73 PolarHBondContact O-NH1 3.22Å; T69-R73 WeakPolarHBondContact O-CD 3.31Å; T69-R73 VanDerWaalsContact O-CG 3.25Å; T69-R73 WeakPolarHBondContact O-CG 3.26Å; T69-R73 PolarHBondContact O-N 3Å; Y70-R73 PolarHBondContact O-N 3.2Å; Q71-R73 PolarHBondContact O-N 3.38Å; R73-K76 PolarHBondContact O-N 3.49Å; R73-L77 WeakPolarHBondContact O-CB 3.49Å; R73-L77 PolarHBondContact O-N 2.97Å |
| 74 | L | 90.1 | Very high | 87.6 | Confident | 44 Ų | 44 | 75.1 Ų | 75.1 | 23% | 0.23 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -63.3 | -43 | 176.1 | -173.1 | 66.8 | 0 | 0 | 0 | 111 | Y70 Q71 L77 Q78 | Y70-L74 HydrophobicContact CE1-CD2 4.16Å; Y70-L74 WeakPolarHBondContact O-CB 3.43Å; Y70-L74 PolarHBondContact O-N 3.09Å; Q71-L74 PolarHBondContact O-N 3.41Å; L74-L77 WeakPolarHBondContact O-CB 3.4Å; L74-L77 PolarHBondContact O-N 2.69Å; L74-Q78 WeakPolarHBondContact O-CG 3.4Å; L74-Q78 PolarHBondContact O-N 2.95Å |
| 75 | G | 93.7 | Very high | 89.4 | Confident | 36 Ų | 36 | 74 Ų | 74 | 37% | 0.371 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.7 | -45.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q71 D72 L77 Q78 E79 | Q71-G75 PolarHBondContact O-N 3.22Å; D72-G75 PolarHBondContact O-N 2.94Å; G75-L77 VanDerWaalsContact C-N 3.34Å; G75-L77 PolarHBondContact O-N 3.47Å; G75-Q78 PolarHBondContact O-N 3Å; G75-E79 PolarHBondContact O-N 3.43Å |
| 76 | K | 94.4 | Very high | 91.1 | Very high | 99 Ų | 99 | 72.1 Ų | 72.1 | 43% | 0.43 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -59.5 | -43.7 | 174.1 | -76.9 | 170 | 177.6 | 161 | 0 | 112.3 | L53 D72 R73 Q78 E79 H80 | L53-K76 HydrophobicContact CD2-CB 3.96Å; D72-K76 WeakPolarHBondContact O-CG 3.39Å; D72-K76 PolarHBondContact O-N 3.22Å; D72-K76 IonicContact OD1-NZ 3.91Å; D72-K76 VanDerWaalsContact OD2-CE 3.32Å; D72-K76 WeakPolarHBondContact OD2-CE 3.44Å; D72-K76 IonicContact OD2-NZ 2.7Å; D72-K76 PolarHBondContact OD2-NZ 3.33Å; R73-K76 PolarHBondContact O-N 3.49Å; K76-Q78 PolarHBondContact O-N 3.32Å; K76-E79 PolarHBondContact O-N 2.82Å; K76-H80 PolarHBondContact O-CD2 2.91Å; K76-H80 PolarHBondContact O-N 3Å; K76-H80 PolarHBondContact O-ND1 2.91Å |
| 77 | L | 94.8 | Very high | 92.3 | Very high | 20 Ų | 20 | 67.2 Ų | 67.2 | 11% | 0.105 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -60.3 | -46.8 | 177.1 | 178.7 | 64.7 | 0 | 0 | 0 | 111.2 | I50 L53 L54 R73 L74 G75 E79 H80 L81 | I50-L77 HydrophobicContact CB-CD1 4.49Å; I50-L77 HydrophobicContact CG1-CD1 4.42Å; I50-L77 HydrophobicContact CG2-CD1 3.74Å; L53-L77 HydrophobicContact CD2-CB 3.71Å; L53-L77 HydrophobicContact CD2-CD1 4.32Å; L54-L77 HydrophobicContact CD2-CD1 4.17Å; L54-L77 HydrophobicContact CD2-CD2 3.69Å; L54-L77 HydrophobicContact CG-CD1 4.17Å; R73-L77 WeakPolarHBondContact O-CB 3.49Å; R73-L77 PolarHBondContact O-N 2.97Å; L74-L77 WeakPolarHBondContact O-CB 3.4Å; L74-L77 PolarHBondContact O-N 2.69Å; G75-L77 VanDerWaalsContact C-N 3.34Å; G75-L77 PolarHBondContact O-N 3.47Å; L77-E79 VanDerWaalsContact C-N 3.32Å; L77-E79 PolarHBondContact O-N 2.99Å; L77-H80 PolarHBondContact O-N 3.19Å; L77-L81 HydrophobicContact CD1-CD1 4.45Å; L77-L81 HydrophobicContact CD1-CG 4.5Å; L77-L81 HydrophobicContact CG-CD1 4.19Å; L77-L81 WeakPolarHBondContact O-CG 3.44Å; L77-L81 PolarHBondContact O-N 3.42Å |
| 78 | Q | 96.1 | Very high | 93.3 | Very high | 125 Ų | 125 | 69 Ų | 69 | 58% | 0.584 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -59.8 | -41.9 | 177.3 | -74.4 | 179 | -5.5 | 0 | 0 | 111.9 | L74 G75 K76 L81 R82 | L74-Q78 WeakPolarHBondContact O-CG 3.4Å; L74-Q78 PolarHBondContact O-N 2.95Å; G75-Q78 PolarHBondContact O-N 3Å; K76-Q78 PolarHBondContact O-N 3.32Å; Q78-L81 PolarHBondContact O-N 3.01Å; Q78-R82 WeakPolarHBondContact O-CB 3.37Å; Q78-R82 PolarHBondContact O-N 3.33Å |
| 79 | E | 96.8 | Very high | 94.1 | Very high | 65 Ų | 65 | 74.8 Ų | 74.8 | 30% | 0.304 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -66 | -41.5 | 176.6 | 179.6 | 55.8 | -161 | 0 | 0 | 111.9 | G75 K76 L77 L81 R82 Q83 | G75-E79 PolarHBondContact O-N 3.43Å; K76-E79 PolarHBondContact O-N 2.82Å; L77-E79 VanDerWaalsContact C-N 3.32Å; L77-E79 PolarHBondContact O-N 2.99Å; E79-L81 VanDerWaalsContact C-N 3.33Å; E79-L81 PolarHBondContact O-N 3.38Å; E79-R82 WeakPolarHBondContact O-CB 3.22Å; E79-R82 PolarHBondContact O-N 2.96Å; E79-R82 IonicContact OE1-CZ 2.73Å; E79-R82 IonicContact OE1-NE 3.6Å; E79-R82 IonicContact OE1-NH2 3.68Å; E79-R82 PolarHBondContact OE1-NH2 3.34Å; E79-R82 IonicContact OE2-CZ 3.36Å; E79-R82 IonicContact OE2-NE 3.18Å; E79-R82 PolarHBondContact OE2-NE 3.04Å; E79-R82 IonicContact OE2-NH2 2.63Å; E79-R82 PolarHBondContact OE2-NH2 3.05Å; E79-Q83 WeakPolarHBondContact O-CG 3.43Å; E79-Q83 PolarHBondContact O-N 3.26Å; E79-Q83 PolarHBondContact OE1-NE2 3.43Å |
| 80 | H | 96.4 | Very high | 94.7 | Very high | 36 Ų | 36 | 75.4 Ų | 75.4 | 17% | 0.167 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -62.5 | -40 | 176.1 | -62.7 | -12.2 | 0 | 0 | 0 | 112 | R46 I50 K76 L77 Q83 L84 | R46-H80 PolarHBondContact NH1-CE1 3.37Å; R46-H80 VanDerWaalsContact NH1-CE1 3.29Å; R46-H80 PolarHBondContact NH1-ND1 3.4Å; R46-H80 PolarHBondContact NH2-CD2 2.73Å; R46-H80 PolarHBondContact NH2-CE1 3.44Å; R46-H80 PolarHBondContact NH2-ND1 2.91Å; R46-H80 PolarHBondContact NH2-NE2 3.26Å; I50-H80 HydrophobicContact CD1-CB 4.02Å; I50-H80 HydrophobicContact CG1-CB 3.59Å; K76-H80 PolarHBondContact O-CD2 2.91Å; K76-H80 PolarHBondContact O-N 3Å; K76-H80 PolarHBondContact O-ND1 2.91Å; L77-H80 PolarHBondContact O-N 3.19Å; H80-Q83 PolarHBondContact O-N 3.1Å; H80-L84 VanDerWaalsContact O-CB 3.29Å; H80-L84 WeakPolarHBondContact O-CB 3.4Å; H80-L84 PolarHBondContact O-N 3.36Å |
| 81 | L | 97.4 | Very high | 95.3 | Very high | 83 Ų | 83 | 74.6 Ų | 74.6 | 44% | 0.435 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -65.7 | -38.3 | 174.2 | -70.9 | 172 | 0 | 0 | 0 | 112.3 | I50 L77 Q78 E79 L84 S85 | I50-L81 HydrophobicContact CD1-CD2 4.02Å; L77-L81 HydrophobicContact CD1-CD1 4.45Å; L77-L81 HydrophobicContact CD1-CG 4.5Å; L77-L81 HydrophobicContact CG-CD1 4.19Å; L77-L81 WeakPolarHBondContact O-CG 3.44Å; L77-L81 PolarHBondContact O-N 3.42Å; Q78-L81 PolarHBondContact O-N 3.01Å; E79-L81 VanDerWaalsContact C-N 3.33Å; E79-L81 PolarHBondContact O-N 3.38Å; L81-L84 PolarHBondContact O-N 3.35Å; L81-S85 PolarHBondContact O-N 3Å; L81-S85 PolarHBondContact O-OG 3.27Å |
| 82 | R | 97.8 | Very high | 95.7 | Very high | 136 Ų | 136 | 77.9 Ų | 77.9 | 51% | 0.513 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -63.4 | -46.1 | 174.7 | -166.4 | -172.7 | 73.7 | 90.3 | 6.4 | 111.1 | Q78 E79 S85 I86 | Q78-R82 WeakPolarHBondContact O-CB 3.37Å; Q78-R82 PolarHBondContact O-N 3.33Å; E79-R82 WeakPolarHBondContact O-CB 3.22Å; E79-R82 PolarHBondContact O-N 2.96Å; E79-R82 IonicContact OE1-CZ 2.73Å; E79-R82 IonicContact OE1-NE 3.6Å; E79-R82 IonicContact OE1-NH2 3.68Å; E79-R82 PolarHBondContact OE1-NH2 3.34Å; E79-R82 IonicContact OE2-CZ 3.36Å; E79-R82 IonicContact OE2-NE 3.18Å; E79-R82 PolarHBondContact OE2-NE 3.04Å; E79-R82 IonicContact OE2-NH2 2.63Å; E79-R82 PolarHBondContact OE2-NH2 3.05Å; R82-S85 WeakPolarHBondContact O-CB 3.27Å; R82-S85 PolarHBondContact O-N 3.43Å; R82-I86 WeakPolarHBondContact O-CG1 3.44Å; R82-I86 PolarHBondContact O-N 2.9Å; R82-I86 VanDerWaalsContact O-N 3.15Å |
| 83 | Q | 96.8 | Very high | 96 | Very high | 61 Ų | 61 | 79.8 Ų | 79.8 | 29% | 0.285 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.4 | -44.4 | 176.2 | -71.2 | 174.5 | 4.7 | 0 | 0 | 111.8 | E79 H80 S85 I86 L87 | E79-Q83 WeakPolarHBondContact O-CG 3.43Å; E79-Q83 PolarHBondContact O-N 3.26Å; E79-Q83 PolarHBondContact OE1-NE2 3.43Å; H80-Q83 PolarHBondContact O-N 3.1Å; Q83-S85 VanDerWaalsContact C-N 3.27Å; Q83-S85 PolarHBondContact O-N 2.82Å; Q83-I86 WeakPolarHBondContact O-CB 3.23Å; Q83-I86 PolarHBondContact O-N 3.47Å; Q83-L87 PolarHBondContact O-N 3.23Å |
| 84 | L | 97.6 | Very high | 96.2 | Very high | 23 Ų | 23 | 76.9 Ų | 76.9 | 12% | 0.12 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -57.8 | -41.8 | 175.9 | -171.2 | 66.8 | 0 | 0 | 0 | 111.5 | I43 R46 I50 H80 L81 I86 L87 F88 | I43-L84 HydrophobicContact CB-CD1 4.34Å; I43-L84 HydrophobicContact CG1-CD1 4.43Å; I43-L84 HydrophobicContact CG2-CD1 3.89Å; R46-L84 HydrophobicContact CB-CD1 4.24Å; R46-L84 HydrophobicContact CG-CB 4.2Å; R46-L84 HydrophobicContact CG-CD1 4.18Å; I50-L84 HydrophobicContact CD1-CD2 3.92Å; H80-L84 VanDerWaalsContact O-CB 3.29Å; H80-L84 WeakPolarHBondContact O-CB 3.4Å; H80-L84 PolarHBondContact O-N 3.36Å; L81-L84 PolarHBondContact O-N 3.35Å; L84-I86 VanDerWaalsContact C-N 3.31Å; L84-I86 PolarHBondContact O-N 3.19Å; L84-L87 PolarHBondContact O-N 3.1Å; L84-F88 HydrophobicContact CD1-CD2 4.45Å; L84-F88 HydrophobicContact CD1-CE2 3.93Å; L84-F88 HydrophobicContact CD2-CE2 4.21Å; L84-F88 HydrophobicContact CG-CD2 4.07Å; L84-F88 HydrophobicContact CG-CE2 3.73Å; L84-F88 VanDerWaalsContact O-CD2 3.25Å; L84-F88 WeakPolarHBondContact O-CD2 3.44Å; L84-F88 PolarHBondContact O-N 2.92Å |
| 85 | S | 97.9 | Very high | 96.3 | Very high | 57 Ų | 57 | 81.7 Ų | 81.7 | 40% | 0.399 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.2 | -37.7 | 175.7 | -58.3 | 0 | 0 | 0 | 0 | 112.6 | L81 R82 Q83 R89 | L81-S85 PolarHBondContact O-N 3Å; L81-S85 PolarHBondContact O-OG 3.27Å; R82-S85 WeakPolarHBondContact O-CB 3.27Å; R82-S85 PolarHBondContact O-N 3.43Å; Q83-S85 VanDerWaalsContact C-N 3.27Å; Q83-S85 PolarHBondContact O-N 2.82Å; S85-R89 WeakPolarHBondContact O-CG 3.42Å; S85-R89 PolarHBondContact O-N 3.49Å |
| 86 | I | 97.6 | Very high | 96.2 | Very high | 77 Ų | 77 | 83.1 Ų | 83.1 | 40% | 0.395 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -67.6 | -43.3 | 175.9 | -65.7 | 165.3 | 0 | 0 | 0 | 110.4 | R82 Q83 L84 F88 R89 K90 | R82-I86 WeakPolarHBondContact O-CG1 3.44Å; R82-I86 PolarHBondContact O-N 2.9Å; R82-I86 VanDerWaalsContact O-N 3.15Å; Q83-I86 WeakPolarHBondContact O-CB 3.23Å; Q83-I86 PolarHBondContact O-N 3.47Å; L84-I86 VanDerWaalsContact C-N 3.31Å; L84-I86 PolarHBondContact O-N 3.19Å; I86-F88 VanDerWaalsContact C-N 3.34Å; I86-F88 PolarHBondContact O-N 2.7Å; I86-R89 PolarHBondContact O-N 3.25Å; I86-K90 PolarHBondContact O-N 3.49Å |
| 87 | L | 97.4 | Very high | 96 | Very high | 26 Ų | 26 | 82.5 Ų | 82.5 | 14% | 0.136 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -60 | -42.3 | 177.8 | -70.5 | 170.5 | 0 | 0 | 0 | 111.9 | T39 D42 I43 R46 Q83 L84 R89 K90 L91 | T39-L87 HydrophobicContact CG2-CB 4.47Å; T39-L87 HydrophobicContact CG2-CD2 4.22Å; T39-L87 WeakPolarHBondContact CG2-O 3.37Å; D42-L87 HydrophobicContact CB-CD1 3.96Å; D42-L87 HydrophobicContact CB-CD2 3.96Å; I43-L87 HydrophobicContact CD1-CB 4.16Å; I43-L87 HydrophobicContact CG1-CB 3.57Å; I43-L87 HydrophobicContact CG1-CD1 4.1Å; I43-L87 HydrophobicContact CG1-CG 4.41Å; R46-L87 HydrophobicContact CB-CD1 4.33Å; Q83-L87 PolarHBondContact O-N 3.23Å; L84-L87 PolarHBondContact O-N 3.1Å; L87-R89 PolarHBondContact O-N 3.06Å; L87-K90 WeakPolarHBondContact O-CB 3.44Å; L87-K90 PolarHBondContact O-N 2.93Å; L87-L91 WeakPolarHBondContact O-CB 3.25Å; L87-L91 PolarHBondContact O-N 3.44Å |
| 88 | F | 98 | Very high | 95.7 | Very high | 106 Ų | 106 | 82.6 Ų | 82.6 | 47% | 0.465 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64.1 | -38.6 | 175.3 | -80.5 | -63.7 | 0 | 0 | 0 | 113.2 | I43 L84 I86 L91 R92 | I43-F88 HydrophobicContact CD1-CD1 3.92Å; I43-F88 HydrophobicContact CD1-CE1 3.94Å; I43-F88 HydrophobicContact CD1-CG 4.39Å; I43-F88 HydrophobicContact CD1-CZ 4.44Å; I43-F88 HydrophobicContact CG2-CE1 4.06Å; I43-F88 HydrophobicContact CG2-CE2 4.17Å; I43-F88 HydrophobicContact CG2-CZ 3.63Å; L84-F88 HydrophobicContact CD1-CD2 4.45Å; L84-F88 HydrophobicContact CD1-CE2 3.93Å; L84-F88 HydrophobicContact CD2-CE2 4.21Å; L84-F88 HydrophobicContact CG-CD2 4.07Å; L84-F88 HydrophobicContact CG-CE2 3.73Å; L84-F88 VanDerWaalsContact O-CD2 3.25Å; L84-F88 WeakPolarHBondContact O-CD2 3.44Å; L84-F88 PolarHBondContact O-N 2.92Å; I86-F88 VanDerWaalsContact C-N 3.34Å; I86-F88 PolarHBondContact O-N 2.7Å; F88-L91 PolarHBondContact O-N 3.24Å; F88-R92 PolarHBondContact O-N 2.7Å |
| 89 | R | 98 | Very high | 95.2 | Very high | 182 Ų | 182 | 80.7 Ų | 80.7 | 69% | 0.687 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -64.8 | -42.5 | 173.8 | -69.8 | 177.8 | -166.5 | 142.9 | 3.1 | 111.7 | S85 I86 L87 R92 L93 | S85-R89 WeakPolarHBondContact O-CG 3.42Å; S85-R89 PolarHBondContact O-N 3.49Å; I86-R89 PolarHBondContact O-N 3.25Å; L87-R89 PolarHBondContact O-N 3.06Å; R89-R92 PolarHBondContact O-N 3.48Å; R89-L93 PolarHBondContact O-N 2.91Å; R89-L93 VanDerWaalsContact O-N 3.09Å |
| 90 | K | 96.8 | Very high | 94.7 | Very high | 85 Ų | 85 | 83.2 Ų | 83.2 | 37% | 0.37 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.1 | -48.1 | 174.8 | -178.2 | -173 | 174.6 | -160.1 | 0 | 110.5 | T39 I86 L87 R92 L93 V94 | T39-K90 HydrophobicContact CG2-CB 4.37Å; T39-K90 HydrophobicContact CG2-CD 4.07Å; T39-K90 HydrophobicContact CG2-CG 4.31Å; T39-K90 WeakPolarHBondContact OG1-CE 3.45Å; T39-K90 PolarHBondContact OG1-NZ 3.04Å; I86-K90 PolarHBondContact O-N 3.49Å; L87-K90 WeakPolarHBondContact O-CB 3.44Å; L87-K90 PolarHBondContact O-N 2.93Å; K90-R92 VanDerWaalsContact C-N 3.29Å; K90-R92 PolarHBondContact O-N 3.39Å; K90-L93 PolarHBondContact O-N 2.95Å; K90-V94 WeakPolarHBondContact O-CG2 3.43Å; K90-V94 PolarHBondContact O-N 3.3Å |
| 91 | L | 97.1 | Very high | 93.9 | Very high | 44 Ų | 44 | 84.7 Ų | 84.7 | 23% | 0.23 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -58.7 | -43.3 | 179.5 | -176.4 | 61.7 | 0 | 0 | 0 | 111.2 | T39 V40 I43 L87 F88 V94 Y95 | T39-L91 HydrophobicContact CG2-CB 3.91Å; T39-L91 HydrophobicContact CG2-CD1 4.41Å; V40-L91 HydrophobicContact CG2-CD1 3.71Å; V40-L91 HydrophobicContact CG2-CD2 3.93Å; I43-L91 HydrophobicContact CD1-CB 4.31Å; I43-L91 HydrophobicContact CD1-CD2 3.77Å; L87-L91 WeakPolarHBondContact O-CB 3.25Å; L87-L91 PolarHBondContact O-N 3.44Å; F88-L91 PolarHBondContact O-N 3.24Å; L91-V94 PolarHBondContact O-N 3.45Å; L91-Y95 WeakPolarHBondContact O-CB 3.48Å; L91-Y95 PolarHBondContact O-N 3.21Å |
| 92 | R | 96.3 | Very high | 92.6 | Very high | 175 Ų | 175 | 82.6 Ų | 82.6 | 66% | 0.66 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -62 | -45.4 | 177.4 | -174.6 | 154.5 | -170.2 | 124.2 | 3.6 | 112.3 | F88 R89 K90 V94 Y95 D96 | F88-R92 PolarHBondContact O-N 2.7Å; R89-R92 PolarHBondContact O-N 3.48Å; K90-R92 VanDerWaalsContact C-N 3.29Å; K90-R92 PolarHBondContact O-N 3.39Å; R92-V94 VanDerWaalsContact C-N 3.32Å; R92-V94 PolarHBondContact O-N 2.93Å; R92-Y95 WeakPolarHBondContact O-CB 3.2Å; R92-Y95 PolarHBondContact O-N 2.84Å; R92-D96 PolarHBondContact O-N 3.46Å |
| 93 | L | 95.1 | Very high | 91 | Very high | 123 Ų | 123 | 80.1 Ų | 80.1 | 64% | 0.644 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -60.8 | -42.4 | 177.2 | -170.7 | 151.8 | 0 | 0 | 0 | 111.8 | R89 K90 K97 | R89-L93 PolarHBondContact O-N 2.91Å; R89-L93 VanDerWaalsContact O-N 3.09Å; K90-L93 PolarHBondContact O-N 2.95Å; L93-K97 WeakPolarHBondContact O-CB 3.34Å; L93-K97 PolarHBondContact O-N 2.96Å |
| 94 | V | 94.1 | Very high | 89.3 | Confident | 12 Ų | 12 | 81 Ų | 81 | 7% | 0.073 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -63.8 | -43 | 176.2 | 174.5 | 0 | 0 | 0 | 0 | 111 | L32 I35 K90 L91 R92 K97 C98 | L32-V94 HydrophobicContact CB-CG1 4.43Å; L32-V94 VanDerWaalsContact O-CG1 3.22Å; L32-V94 WeakPolarHBondContact O-CG1 3.49Å; I35-V94 HydrophobicContact CG2-CG2 3.89Å; K90-V94 WeakPolarHBondContact O-CG2 3.43Å; K90-V94 PolarHBondContact O-N 3.3Å; L91-V94 PolarHBondContact O-N 3.45Å; R92-V94 VanDerWaalsContact C-N 3.32Å; R92-V94 PolarHBondContact O-N 2.93Å; V94-K97 PolarHBondContact O-N 3.29Å; V94-C98 WeakPolarHBondContact O-CB 3.47Å; V94-C98 PolarHBondContact O-N 2.97Å |
| 95 | Y | 91.6 | Very high | 87.5 | Confident | 145 Ų | 145 | 86 Ų | 86 | 57% | 0.569 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -61.6 | -51.4 | 176.7 | 175.1 | -93.1 | 0 | 0 | 0 | 111.5 | L91 R92 K97 C98 N99 | L91-Y95 WeakPolarHBondContact O-CB 3.48Å; L91-Y95 PolarHBondContact O-N 3.21Å; R92-Y95 WeakPolarHBondContact O-CB 3.2Å; R92-Y95 PolarHBondContact O-N 2.84Å; Y95-K97 VanDerWaalsContact C-N 3.28Å; Y95-K97 PolarHBondContact O-N 3.43Å; Y95-C98 PolarHBondContact O-N 3.26Å; Y95-N99 HydrophobicContact CE1-CB 4.47Å; Y95-N99 WeakPolarHBondContact O-CB 3.28Å; Y95-N99 PolarHBondContact O-N 3.5Å |
| 96 | D | 92.3 | Very high | 85.3 | Confident | 65 Ų | 65 | 90.6 Ų | 90.6 | 35% | 0.348 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -57.8 | -44.8 | -179.5 | -65.5 | -23.4 | 0 | 0 | 0 | 110 | R92 N99 E100 | R92-D96 PolarHBondContact O-N 3.46Å; D96-N99 PolarHBondContact O-N 3Å; D96-E100 WeakPolarHBondContact O-CG 3.25Å; D96-E100 PolarHBondContact O-N 2.87Å |
| 97 | K | 90.4 | Very high | 83.5 | Confident | 86 Ų | 86 | 92.1 Ų | 92.1 | 37% | 0.374 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.9 | -42 | 177.9 | -164.9 | 72.6 | -145 | 152.7 | 0 | 113.2 | L32 L93 V94 Y95 N99 E100 N101 | L32-K97 HydrophobicContact CD1-CB 4.08Å; L32-K97 HydrophobicContact CD1-CG 3.62Å; L32-K97 HydrophobicContact CD2-CB 4.48Å; L32-K97 HydrophobicContact CD2-CG 4.28Å; L93-K97 WeakPolarHBondContact O-CB 3.34Å; L93-K97 PolarHBondContact O-N 2.96Å; V94-K97 PolarHBondContact O-N 3.29Å; Y95-K97 VanDerWaalsContact C-N 3.28Å; Y95-K97 PolarHBondContact O-N 3.43Å; K97-N99 VanDerWaalsContact C-N 3.32Å; K97-E100 IonicContact NZ-OE2 3.97Å; K97-E100 PolarHBondContact NZ-OE2 3.45Å; K97-N101 PolarHBondContact O-N 3.41Å; K97-N101 VanDerWaalsContact O-N 3.11Å; K97-N101 PolarHBondContact O-OD1 3.26Å |
| 98 | C | 87.4 | Confident | 81.8 | Confident | 22 Ų | 22 | 95.1 Ų | 95.1 | 15% | 0.149 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -65.7 | -39.7 | 177 | -169 | 0 | 0 | 0 | 0 | 110.8 | L32 V94 Y95 N101 C102 | L32-C98 HydrophobicContact CB-CB 4.38Å; V94-C98 WeakPolarHBondContact O-CB 3.47Å; V94-C98 PolarHBondContact O-N 2.97Å; Y95-C98 PolarHBondContact O-N 3.26Å; C98-N101 PolarHBondContact O-N 2.87Å; C98-C102 WeakPolarHBondContact O-CB 3.35Å; C98-C102 PolarHBondContact O-N 3.35Å; C98-C102 PolarHBondContact O-SG 3.06Å |
| 99 | N | 85.5 | Confident | 80.2 | Confident | 86 Ų | 86 | 92.7 Ų | 92.7 | 46% | 0.46 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.7 | -43.3 | 178.8 | -172.4 | 71 | 0 | 0 | 0 | 111.6 | Y95 D96 K97 N101 C102 A103 | Y95-N99 HydrophobicContact CE1-CB 4.47Å; Y95-N99 WeakPolarHBondContact O-CB 3.28Å; Y95-N99 PolarHBondContact O-N 3.5Å; D96-N99 PolarHBondContact O-N 3Å; K97-N99 VanDerWaalsContact C-N 3.32Å; N99-N101 VanDerWaalsContact C-N 3.33Å; N99-N101 PolarHBondContact O-N 3.32Å; N99-C102 CarbonylContact O-C 3.59Å; N99-C102 PolarHBondContact O-N 3.05Å; N99-A103 WeakPolarHBondContact O-CB 3.47Å; N99-A103 PolarHBondContact O-N 3.15Å |
| 100 | E | 86.6 | Confident | 78.4 | Confident | 118 Ų | 118 | 89.8 Ų | 89.8 | 55% | 0.551 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -56.3 | -45.8 | 171.1 | -75.7 | 173.5 | -177.3 | 0 | 0 | 111.9 | D96 K97 C102 A103 | D96-E100 WeakPolarHBondContact O-CG 3.25Å; D96-E100 PolarHBondContact O-N 2.87Å; K97-E100 IonicContact NZ-OE2 3.97Å; K97-E100 PolarHBondContact NZ-OE2 3.45Å; E100-C102 VanDerWaalsContact C-N 3.29Å; E100-C102 PolarHBondContact O-N 2.99Å; E100-A103 WeakPolarHBondContact O-CB 3.35Å; E100-A103 PolarHBondContact O-N 3.34Å |
| 101 | N | 81.3 | Confident | 76.7 | Confident | 67 Ų | 67 | 92.1 Ų | 92.1 | 36% | 0.358 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.3 | -25.7 | -179.7 | -72.6 | 10.1 | 0 | 0 | 0 | 113 | V27 T29 K97 C98 N99 | V27-N101 PolarHBondContact O-ND2 3.25Å; T29-N101 HydrophobicContact CG2-CB 4.36Å; T29-N101 WeakPolarHBondContact OG1-CB 3.35Å; T29-N101 PolarHBondContact OG1-ND2 2.84Å; K97-N101 PolarHBondContact O-N 3.41Å; K97-N101 VanDerWaalsContact O-N 3.11Å; K97-N101 PolarHBondContact O-OD1 3.26Å; C98-N101 PolarHBondContact O-N 2.87Å; N99-N101 VanDerWaalsContact C-N 3.33Å; N99-N101 PolarHBondContact O-N 3.32Å |
| 102 | C | 69.7 | Low | 75.1 | Confident | 39 Ų | 39 | 96.9 Ų | 96.9 | 26% | 0.264 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -95.5 | -1.4 | 178.1 | -68.8 | 0 | 0 | 0 | 0 | 113.5 | T29 C98 N99 E100 G104 L105 | T29-C102 VanDerWaalsContact CG2-SG 3.57Å; C98-C102 WeakPolarHBondContact O-CB 3.35Å; C98-C102 PolarHBondContact O-N 3.35Å; C98-C102 PolarHBondContact O-SG 3.06Å; N99-C102 CarbonylContact O-C 3.59Å; N99-C102 PolarHBondContact O-N 3.05Å; E100-C102 VanDerWaalsContact C-N 3.29Å; E100-C102 PolarHBondContact O-N 2.99Å; C102-G104 PolarHBondContact O-N 2.96Å; C102-L105 PolarHBondContact O-N 3.41Å |
| 103 | A | 64.4 | Low | 73.4 | Confident | 83 Ų | 83 | 94.2 Ų | 94.2 | 69% | 0.686 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -1.9 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | N99 E100 | N99-A103 WeakPolarHBondContact O-CB 3.47Å; N99-A103 PolarHBondContact O-N 3.15Å; E100-A103 WeakPolarHBondContact O-CB 3.35Å; E100-A103 PolarHBondContact O-N 3.34Å |
| 104 | G | 59.7 | Low | 71.8 | Confident | 80 Ų | 80 | 93.7 Ų | 93.7 | 83% | 0.825 | 52% | 0.517 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.5 | 1.6 | 170.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | C102 | C102-G104 PolarHBondContact O-N 2.96Š|
| 105 | L | 60.5 | Low | 69.8 | Low | 127 Ų | 127 | 98.3 Ų | 98.3 | 67% | 0.665 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -99.6 | 119.3 | 172.7 | -64.9 | 171.8 | 0 | 0 | 0 | 107.5 | C102 | C102-L105 PolarHBondContact O-N 3.41Š|
| 106 | D | 52.3 | Low | 67.9 | Low | 154 Ų | 154 | 101.1 Ų | 101.1 | 82% | 0.824 | 56% | 0.559 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 122.5 | 178.4 | -128.9 | -10.1 | 0 | 0 | 0 | 108.7 | V108 | D106-V108 PolarHBondContact O-N 3.29Š|
| 107 | P | 57.9 | Low | 66 | Low | 109 Ų | 109 | 104.4 Ų | 104.4 | 71% | 0.708 | 58% | 0.581 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 117 | -178.1 | 22.3 | -30.1 | 0 | 0 | 0 | 108.5 | P109 | P107-P109 VanDerWaalsContact O-CD 3.24Å; P107-P109 WeakPolarHBondContact O-CD 3.41Å; P107-P109 VanDerWaalsContact O-N 3.13Å |
| 108 | V | 62.5 | Low | 64 | Low | 90 Ų | 90 | 107.7 Ų | 107.7 | 55% | 0.545 | 60% | 0.598 | S | S | . | * | P | Polyproline II helix | trans | -59.2 | 118.3 | 171.6 | 177.2 | 0 | 0 | 0 | 0 | 106.8 | D106 I110 Q112 L113 | D106-V108 PolarHBondContact O-N 3.29Å; V108-I110 PolarHBondContact O-N 3.45Å; V108-Q112 HydrophobicContact CG1-CB 3.99Å; V108-L113 HydrophobicContact CG1-CG 4.37Å |
| 109 | P | 64 | Low | 62 | Low | 55 Ų | 55 | 115.3 Ų | 115.3 | 36% | 0.357 | 63% | 0.631 | S | S | . | * | P | Polyproline II helix | trans | -54.7 | 137.8 | -178.2 | -23.5 | 31.4 | 0 | 0 | 0 | 110.5 | P107 E111 Q112 | P107-P109 VanDerWaalsContact O-CD 3.24Å; P107-P109 WeakPolarHBondContact O-CD 3.41Å; P107-P109 VanDerWaalsContact O-N 3.13Å; P109-E111 WeakPolarHBondContact CB-OE2 3.13Å; P109-E111 PolarHBondContact O-N 2.88Å; P109-E111 VanDerWaalsContact O-N 3.08Å; P109-Q112 HydrophobicContact CB-CG 4.33Å; P109-Q112 HydrophobicContact CG-CG 4.42Å; P109-Q112 WeakPolarHBondContact O-CB 3.47Å; P109-Q112 PolarHBondContact O-N 3.25Å |
| 110 | I | 60.5 | Low | 59.8 | Low | 120 Ų | 120 | 118.5 Ų | 118.5 | 62% | 0.615 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -59.7 | -26 | -177.4 | -158.4 | 164.2 | 0 | 0 | 0 | 111.5 | V108 Q112 L113 I114 | V108-I110 PolarHBondContact O-N 3.45Å; I110-Q112 VanDerWaalsContact C-N 3.25Å; I110-Q112 PolarHBondContact O-N 2.88Å; I110-L113 WeakPolarHBondContact O-CB 3.43Å; I110-L113 PolarHBondContact O-N 3.38Å; I110-L113 VanDerWaalsContact O-N 3.1Å; I110-I114 PolarHBondContact O-N 3.49Å |
| 111 | E | 62.4 | Low | 58.1 | Low | 134 Ų | 134 | 116.5 Ų | 116.5 | 63% | 0.626 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -64.6 | -26.9 | 174.7 | -57 | 81.6 | -173.4 | 0 | 0 | 112.8 | P109 | P109-E111 WeakPolarHBondContact CB-OE2 3.13Å; P109-E111 PolarHBondContact O-N 2.88Å; P109-E111 VanDerWaalsContact O-N 3.08Å |
| 112 | Q | 62.2 | Low | 56.5 | Low | 144 Ų | 144 | 118.3 Ų | 118.3 | 67% | 0.673 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -83.3 | -14 | 174.8 | -63.1 | -179.2 | 5.4 | 0 | 0 | 112.9 | V108 P109 I110 | V108-Q112 HydrophobicContact CG1-CB 3.99Å; P109-Q112 HydrophobicContact CB-CG 4.33Å; P109-Q112 HydrophobicContact CG-CG 4.42Å; P109-Q112 WeakPolarHBondContact O-CB 3.47Å; P109-Q112 PolarHBondContact O-N 3.25Å; I110-Q112 VanDerWaalsContact C-N 3.25Å; I110-Q112 PolarHBondContact O-N 2.88Å |
| 113 | L | 61.6 | Low | 55.5 | Low | 119 Ų | 119 | 126 Ų | 126 | 62% | 0.623 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -91 | -15.6 | 177.1 | -75.5 | 155.7 | 0 | 0 | 0 | 112.5 | V108 I110 P115 | V108-L113 HydrophobicContact CG1-CG 4.37Å; I110-L113 WeakPolarHBondContact O-CB 3.43Å; I110-L113 PolarHBondContact O-N 3.38Å; I110-L113 VanDerWaalsContact O-N 3.1Å; L113-P115 VanDerWaalsContact O-CD 3.29Å; L113-P115 WeakPolarHBondContact O-CD 3.41Å |
| 114 | I | 59.9 | Low | 54.7 | Low | 112 Ų | 112 | 128.5 Ų | 128.5 | 57% | 0.574 | 70% | 0.703 | S | S | * | * | S | Bend | trans | -80.9 | 113.2 | 169.5 | -58.7 | 170.3 | 0 | 0 | 0 | 106.6 | I110 Y116 | I110-I114 PolarHBondContact O-N 3.49Å; I114-Y116 PolarHBondContact O-N 3.01Å |
| 115 | P | 53.5 | Low | 54 | Low | 110 Ų | 110 | 132.2 Ų | 132.2 | 71% | 0.714 | 70% | 0.704 | S | S | * | * | trans | -58.8 | 115.5 | 173 | -20.3 | 33.5 | 0 | 0 | 0 | 108.5 | L113 V117 | L113-P115 VanDerWaalsContact O-CD 3.29Å; L113-P115 WeakPolarHBondContact O-CD 3.41Å; P115-V117 PolarHBondContact O-N 2.9Å | ||
| 116 | Y | 50.5 | Low | 53.4 | Low | 204 Ų | 204 | 131.7 Ų | 131.7 | 80% | 0.8 | 70% | 0.702 | S | S | * | * | trans | -66.5 | 108.7 | 170.1 | -140.4 | -98.6 | 0 | 0 | 0 | 106.3 | I114 E118 | I114-Y116 PolarHBondContact O-N 3.01Å; Y116-E118 HydrophobicContact CD1-CG 4.01Å; Y116-E118 PolarHBondContact O-N 3.23Å | ||
| 117 | V | 54.1 | Low | 53.4 | Low | 133 Ų | 133 | 133.6 Ų | 133.6 | 81% | 0.806 | 70% | 0.698 | S | S | * | * | trans | -74.8 | 82.4 | 172 | -174.4 | 0 | 0 | 0 | 0 | 105.9 | P115 E119 | P115-V117 PolarHBondContact O-N 2.9Å; V117-E119 PolarHBondContact O-N 3.03Å | ||
| 118 | E | 46.9 | Very low | 53.1 | Low | 155 Ų | 155 | 131 Ų | 131 | 72% | 0.724 | 69% | 0.691 | S | S | * | * | trans | -67.7 | 116.1 | 153.4 | -68.7 | -139.3 | 145.9 | 0 | 0 | 106.2 | Y116 D120 | Y116-E118 HydrophobicContact CD1-CG 4.01Å; Y116-E118 PolarHBondContact O-N 3.23Å; E118-D120 PolarHBondContact O-N 3.28Å | ||
| 119 | E | 46.9 | Very low | 52.5 | Low | 183 Ų | 183 | 129.6 Ų | 129.6 | 86% | 0.855 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -63.4 | 73 | 167.6 | -172.6 | -175.2 | 161 | 0 | 0 | 108.2 | V117 | V117-E119 PolarHBondContact O-N 3.03Š|
| 120 | D | 39.4 | Very low | 52 | Low | 152 Ų | 152 | 128.4 Ų | 128.4 | 81% | 0.813 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -166.5 | 118.8 | 152.6 | -101.1 | -37.4 | 0 | 0 | 0 | 110.2 | E118 S122 | E118-D120 PolarHBondContact O-N 3.28Å; D120-S122 PolarHBondContact O-N 3.47Å; D120-S122 VanDerWaalsContact O-N 3.11Å |
| 121 | G | 49.2 | Very low | 51.7 | Low | 76 Ų | 76 | 125.3 Ų | 125.3 | 78% | 0.784 | 67% | 0.672 | S | S | * | * | trans | -63.6 | 112.8 | -174 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 122 | S | 49.2 | Very low | 51.4 | Low | 105 Ų | 105 | 126.1 Ų | 126.1 | 73% | 0.734 | 68% | 0.676 | S | S | * | * | trans | -165 | 107.1 | 152.4 | -88.3 | 0 | 0 | 0 | 0 | 113.2 | D120 | D120-S122 PolarHBondContact O-N 3.47Å; D120-S122 VanDerWaalsContact O-N 3.11Å | ||
| 123 | K | 48.3 | Very low | 51.2 | Low | 200 Ų | 200 | 124.7 Ų | 124.7 | 87% | 0.87 | 67% | 0.673 | S | S | * | * | trans | 58.4 | 74.8 | 145 | -53.7 | 179.9 | -177.7 | 178.1 | 0 | 117.6 | ||||
| 124 | H | 46.8 | Very low | 51.2 | Low | 137 Ų | 137 | 127.7 Ų | 127.7 | 63% | 0.634 | 68% | 0.676 | S | S | * | * | trans | -159.1 | 72.7 | 150.5 | -154.1 | -72.7 | 0 | 0 | 0 | 114.5 | ||||
| 125 | D | 45.3 | Very low | 51.2 | Low | 157 Ų | 157 | 128.5 Ų | 128.5 | 84% | 0.84 | 68% | 0.675 | S | S | * | * | trans | -127.8 | 62 | 168.4 | -164.2 | 26.7 | 0 | 0 | 0 | 111.8 | ||||
| 126 | D | 48.8 | Very low | 51.7 | Low | 117 Ų | 117 | 125.7 Ų | 125.7 | 63% | 0.626 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -141.9 | -11.2 | 172.8 | -153.5 | 20.1 | 0 | 0 | 0 | 115 | A130 | D126-A130 WeakPolarHBondContact O-CB 3.29Å; D126-A130 PolarHBondContact O-N 3.48Å |
| 127 | R | 51.5 | Low | 52.6 | Low | 193 Ų | 193 | 119.7 Ų | 119.7 | 73% | 0.728 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -74.6 | -37.6 | -180 | -95.4 | 176.9 | 146.5 | 147.9 | -10.6 | 114.5 | S131 | R127-S131 WeakPolarHBondContact O-CB 3.44Å; R127-S131 PolarHBondContact O-N 3.3Å |
| 128 | G | 51.7 | Low | 53.4 | Low | 56 Ų | 56 | 119.5 Ų | 119.5 | 58% | 0.577 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -71 | -49.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | S131 Q132 | G128-S131 PolarHBondContact O-N 3.4Å; G128-Q132 WeakPolarHBondContact O-CB 3.44Å; G128-Q132 PolarHBondContact O-N 3.36Å |
| 129 | A | 50.1 | Low | 54.6 | Low | 59 Ų | 59 | 115.4 Ų | 115.4 | 49% | 0.488 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -63.8 | -43.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S131 Q132 L133 | A129-S131 PolarHBondContact O-N 3.18Å; A129-Q132 PolarHBondContact O-N 2.9Å; A129-L133 WeakPolarHBondContact O-CB 3.28Å; A129-L133 PolarHBondContact O-N 3.22Å |
| 130 | A | 53.8 | Low | 56 | Low | 30 Ų | 30 | 115.6 Ų | 115.6 | 25% | 0.248 | 61% | 0.61 | C | S | . | * | H | α-helix | trans | -67.2 | -33.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | D126 R134 | D126-A130 WeakPolarHBondContact O-CB 3.29Å; D126-A130 PolarHBondContact O-N 3.48Å; A130-R134 WeakPolarHBondContact O-CB 3.18Å; A130-R134 WeakPolarHBondContact O-CD 3.43Å; A130-R134 WeakPolarHBondContact O-CG 3.5Å; A130-R134 PolarHBondContact O-N 3.41Å |
| 131 | S | 54 | Low | 58 | Low | 55 Ų | 55 | 116.4 Ų | 116.4 | 39% | 0.385 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -65.8 | -50.2 | 174.4 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | R127 G128 A129 L133 R134 F135 | R127-S131 WeakPolarHBondContact O-CB 3.44Å; R127-S131 PolarHBondContact O-N 3.3Å; G128-S131 PolarHBondContact O-N 3.4Å; A129-S131 PolarHBondContact O-N 3.18Å; S131-L133 VanDerWaalsContact C-N 3.35Å; S131-L133 PolarHBondContact O-N 2.99Å; S131-R134 WeakPolarHBondContact O-CB 3.3Å; S131-R134 PolarHBondContact O-N 3.41Å; S131-F135 WeakPolarHBondContact O-CD2 3.29Å; S131-F135 PolarHBondContact O-N 2.99Å; S131-F135 WeakPolarHBondContact OG-CE2 3.34Å |
| 132 | Q | 56.4 | Low | 59.5 | Low | 151 Ų | 151 | 118.4 Ų | 118.4 | 71% | 0.706 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -65.7 | -38 | 179.5 | -160.9 | 171 | 73.1 | 0 | 0 | 112.1 | G128 A129 F135 A136 | G128-Q132 WeakPolarHBondContact O-CB 3.44Å; G128-Q132 PolarHBondContact O-N 3.36Å; A129-Q132 PolarHBondContact O-N 2.9Å; Q132-F135 PolarHBondContact O-N 2.94Å; Q132-A136 WeakPolarHBondContact O-CB 3.39Å; Q132-A136 PolarHBondContact O-N 2.95Å |
| 133 | L | 56.4 | Low | 61.1 | Low | 114 Ų | 114 | 118.2 Ų | 118.2 | 60% | 0.597 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.8 | -40.5 | 173.2 | -175.7 | 63.2 | 0 | 0 | 0 | 111.6 | A129 S131 A136 T137 | A129-L133 WeakPolarHBondContact O-CB 3.28Å; A129-L133 PolarHBondContact O-N 3.22Å; S131-L133 VanDerWaalsContact C-N 3.35Å; S131-L133 PolarHBondContact O-N 2.99Å; L133-A136 PolarHBondContact O-N 3.25Å; L133-T137 VanDerWaalsContact O-CG2 3.32Å; L133-T137 WeakPolarHBondContact O-CG2 3.46Å; L133-T137 PolarHBondContact O-N 3.44Å; L133-T137 PolarHBondContact O-OG1 2.89Å; L133-T137 VanDerWaalsContact O-OG1 3.1Å |
| 134 | R | 62.5 | Low | 62.9 | Low | 183 Ų | 183 | 114.6 Ų | 114.6 | 69% | 0.691 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -60.3 | -49 | 174.9 | -83.7 | 173.2 | 170.2 | -129.4 | -1.9 | 111.4 | A130 S131 A136 T137 E138 | A130-R134 WeakPolarHBondContact O-CB 3.18Å; A130-R134 WeakPolarHBondContact O-CD 3.43Å; A130-R134 WeakPolarHBondContact O-CG 3.5Å; A130-R134 PolarHBondContact O-N 3.41Å; S131-R134 WeakPolarHBondContact O-CB 3.3Å; S131-R134 PolarHBondContact O-N 3.41Å; R134-A136 PolarHBondContact O-N 3.2Å; R134-T137 WeakPolarHBondContact CA-OG1 3.48Å; R134-T137 PolarHBondContact O-N 2.98Å; R134-T137 PolarHBondContact O-OG1 3.48Å; R134-E138 WeakPolarHBondContact O-CB 3.5Å; R134-E138 PolarHBondContact O-N 3.2Å |
| 135 | F | 60.1 | Low | 65 | Low | 129 Ų | 129 | 112.2 Ų | 112.2 | 57% | 0.566 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60.5 | -43.1 | 176.4 | -74.6 | -65.5 | 0 | 0 | 0 | 112.4 | S131 Q132 T137 E138 E139 | S131-F135 WeakPolarHBondContact O-CD2 3.29Å; S131-F135 PolarHBondContact O-N 2.99Å; S131-F135 WeakPolarHBondContact OG-CE2 3.34Å; Q132-F135 PolarHBondContact O-N 2.94Å; F135-T137 VanDerWaalsContact C-N 3.35Å; F135-T137 PolarHBondContact O-N 2.91Å; F135-E138 PolarHBondContact O-N 3.29Å; F135-E139 PolarHBondContact O-N 3.43Å |
| 136 | A | 63.8 | Low | 67.1 | Low | 50 Ų | 50 | 109 Ų | 109 | 41% | 0.413 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.4 | -36.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q132 L133 R134 R140 | Q132-A136 WeakPolarHBondContact O-CB 3.39Å; Q132-A136 PolarHBondContact O-N 2.95Å; L133-A136 PolarHBondContact O-N 3.25Å; R134-A136 PolarHBondContact O-N 3.2Å; A136-R140 WeakPolarHBondContact O-CB 3.35Å; A136-R140 PolarHBondContact O-N 2.93Å; A136-R140 VanDerWaalsContact O-N 3.14Å |
| 137 | T | 69.6 | Low | 69.1 | Low | 79 Ų | 79 | 106.9 Ų | 106.9 | 49% | 0.485 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -70.5 | -34.9 | 175.8 | 53.2 | 0 | 0 | 0 | 0 | 112.9 | L133 R134 F135 R140 R141 | L133-T137 VanDerWaalsContact O-CG2 3.32Å; L133-T137 WeakPolarHBondContact O-CG2 3.46Å; L133-T137 PolarHBondContact O-N 3.44Å; L133-T137 PolarHBondContact O-OG1 2.89Å; L133-T137 VanDerWaalsContact O-OG1 3.1Å; R134-T137 WeakPolarHBondContact CA-OG1 3.48Å; R134-T137 PolarHBondContact O-N 2.98Å; R134-T137 PolarHBondContact O-OG1 3.48Å; F135-T137 VanDerWaalsContact C-N 3.35Å; F135-T137 PolarHBondContact O-N 2.91Å; T137-R140 PolarHBondContact O-N 3.38Å; T137-R141 WeakPolarHBondContact O-CB 3.33Å; T137-R141 PolarHBondContact O-N 2.94Å |
| 138 | E | 71.1 | Confident | 71 | Confident | 128 Ų | 128 | 105.1 Ų | 105.1 | 60% | 0.598 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -70.3 | -42.8 | 179.1 | -165.6 | 159 | -155.7 | 0 | 0 | 111.3 | R134 F135 R140 R141 E142 | R134-E138 WeakPolarHBondContact O-CB 3.5Å; R134-E138 PolarHBondContact O-N 3.2Å; F135-E138 PolarHBondContact O-N 3.29Å; E138-R140 PolarHBondContact O-N 2.84Å; E138-R141 WeakPolarHBondContact O-CB 3.35Å; E138-R141 PolarHBondContact O-N 3.07Å; E138-E142 PolarHBondContact O-N 3.09Å |
| 139 | E | 71.2 | Confident | 72.9 | Confident | 69 Ų | 69 | 108.9 Ų | 108.9 | 32% | 0.322 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60 | -45.9 | 172.2 | -177.5 | -178.1 | -162.9 | 0 | 0 | 111.7 | R34 F135 R141 E142 I143 | R34-E139 IonicContact CZ-OE1 2.71Å; R34-E139 IonicContact CZ-OE2 2.76Å; R34-E139 IonicContact NH1-OE1 3.49Å; R34-E139 PolarHBondContact NH1-OE1 3.11Å; R34-E139 IonicContact NH1-OE2 3.6Å; R34-E139 PolarHBondContact NH1-OE2 3.32Å; R34-E139 IonicContact NH2-OE1 3.68Å; R34-E139 IonicContact NH2-OE2 3.49Å; R34-E139 PolarHBondContact NH2-OE2 3.49Å; F135-E139 PolarHBondContact O-N 3.43Å; E139-R141 PolarHBondContact O-N 3.28Å; E139-E142 PolarHBondContact O-N 3.19Å; E139-I143 HydrophobicContact CG-CD1 3.96Å; E139-I143 VanDerWaalsContact O-CG1 3.31Å; E139-I143 WeakPolarHBondContact O-CG1 3.48Å; E139-I143 PolarHBondContact O-N 3.29Å |
| 140 | R | 76.6 | Confident | 74.9 | Confident | 187 Ų | 187 | 111 Ų | 111 | 71% | 0.706 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.6 | -35.6 | 177.6 | -172.9 | 176.2 | 179 | -170.8 | -0.2 | 111.8 | A136 T137 E138 M144 | A136-R140 WeakPolarHBondContact O-CB 3.35Å; A136-R140 PolarHBondContact O-N 2.93Å; A136-R140 VanDerWaalsContact O-N 3.14Å; T137-R140 PolarHBondContact O-N 3.38Å; E138-R140 PolarHBondContact O-N 2.84Å; R140-M144 WeakPolarHBondContact O-CB 3.4Å; R140-M144 PolarHBondContact O-N 2.88Å; R140-M144 VanDerWaalsContact O-N 3.12Å |
| 141 | R | 81.8 | Confident | 76.7 | Confident | 169 Ų | 169 | 116.1 Ų | 116.1 | 64% | 0.638 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -68.6 | -46.2 | 175.8 | -176.5 | -175.9 | 172.7 | 176.8 | 3 | 111.2 | T137 E138 E139 I143 M144 E145 | T137-R141 WeakPolarHBondContact O-CB 3.33Å; T137-R141 PolarHBondContact O-N 2.94Å; E138-R141 WeakPolarHBondContact O-CB 3.35Å; E138-R141 PolarHBondContact O-N 3.07Å; E139-R141 PolarHBondContact O-N 3.28Å; R141-I143 PolarHBondContact O-N 3.08Å; R141-M144 WeakPolarHBondContact O-CB 3.32Å; R141-M144 PolarHBondContact O-N 3.29Å; R141-M144 VanDerWaalsContact O-N 3.16Å; R141-E145 IonicContact CZ-OE1 3.82Å; R141-E145 IonicContact NE-OE1 3.12Å; R141-E145 PolarHBondContact NE-OE1 2.96Å; R141-E145 VanDerWaalsContact NE-OE1 3.12Å; R141-E145 IonicContact NH2-OE1 2.81Å; R141-E145 WeakPolarHBondContact O-CG 3.46Å; R141-E145 PolarHBondContact O-N 3.48Å |
| 142 | E | 80.1 | Confident | 78.7 | Confident | 118 Ų | 118 | 119 Ų | 119 | 55% | 0.551 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -60.8 | -45.8 | 178.5 | -169.8 | 179.3 | -170.3 | 0 | 0 | 111.5 | E138 E139 M144 E145 V146 | E138-E142 PolarHBondContact O-N 3.09Å; E139-E142 PolarHBondContact O-N 3.19Å; E142-M144 VanDerWaalsContact C-N 3.28Å; E142-M144 PolarHBondContact O-N 3.08Å; E142-E145 PolarHBondContact O-N 2.63Å; E142-V146 WeakPolarHBondContact O-CG2 3.45Å; E142-V146 PolarHBondContact O-N 3.46Å |
| 143 | I | 82.4 | Confident | 80.5 | Confident | 102 Ų | 102 | 118.1 Ų | 118.1 | 52% | 0.523 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -58 | -42.6 | 174.8 | -68.4 | 169.4 | 0 | 0 | 0 | 110.9 | E139 R141 N147 | E139-I143 HydrophobicContact CG-CD1 3.96Å; E139-I143 VanDerWaalsContact O-CG1 3.31Å; E139-I143 WeakPolarHBondContact O-CG1 3.48Å; E139-I143 PolarHBondContact O-N 3.29Å; R141-I143 PolarHBondContact O-N 3.08Å; I143-N147 VanDerWaalsContact O-CB 3.27Å; I143-N147 WeakPolarHBondContact O-CB 3.33Å; I143-N147 PolarHBondContact O-N 2.96Å |
| 144 | M | 86.8 | Confident | 82.3 | Confident | 124 Ų | 124 | 117.2 Ų | 117.2 | 61% | 0.611 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.3 | -41.6 | 178.3 | -170.3 | -177 | -60.6 | 0 | 0 | 112 | R140 R141 E142 N147 K148 | R140-M144 WeakPolarHBondContact O-CB 3.4Å; R140-M144 PolarHBondContact O-N 2.88Å; R140-M144 VanDerWaalsContact O-N 3.12Å; R141-M144 WeakPolarHBondContact O-CB 3.32Å; R141-M144 PolarHBondContact O-N 3.29Å; R141-M144 VanDerWaalsContact O-N 3.16Å; E142-M144 VanDerWaalsContact C-N 3.28Å; E142-M144 PolarHBondContact O-N 3.08Å; M144-N147 PolarHBondContact O-N 3Å; M144-K148 WeakPolarHBondContact O-CB 3.48Å; M144-K148 PolarHBondContact O-N 3.36Å |
| 145 | E | 90.5 | Very high | 83.9 | Confident | 87 Ų | 87 | 114.4 Ų | 114.4 | 41% | 0.407 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -65.1 | -43.5 | 177.3 | -74.6 | -175.3 | -166.8 | 0 | 0 | 111.9 | R141 E142 K148 K149 | R141-E145 IonicContact CZ-OE1 3.82Å; R141-E145 IonicContact NE-OE1 3.12Å; R141-E145 PolarHBondContact NE-OE1 2.96Å; R141-E145 VanDerWaalsContact NE-OE1 3.12Å; R141-E145 IonicContact NH2-OE1 2.81Å; R141-E145 WeakPolarHBondContact O-CG 3.46Å; R141-E145 PolarHBondContact O-N 3.48Å; E142-E145 PolarHBondContact O-N 2.63Å; E145-K148 PolarHBondContact O-N 2.92Å; E145-K149 WeakPolarHBondContact O-CG 3.33Å; E145-K149 PolarHBondContact O-N 3.46Å |
| 146 | V | 89.4 | Confident | 85.6 | Confident | 88 Ų | 88 | 112.2 Ų | 112.2 | 53% | 0.533 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.6 | -45.3 | 174.4 | 172.7 | 0 | 0 | 0 | 0 | 110.7 | E142 K148 K149 L150 | E142-V146 WeakPolarHBondContact O-CG2 3.45Å; E142-V146 PolarHBondContact O-N 3.46Å; V146-K148 VanDerWaalsContact C-N 3.3Å; V146-K148 PolarHBondContact O-N 3.07Å; V146-K149 PolarHBondContact O-N 3.48Å; V146-L150 WeakPolarHBondContact O-CB 3.33Å; V146-L150 PolarHBondContact O-N 3.4Å |
| 147 | N | 90.4 | Very high | 87.1 | Confident | 74 Ų | 74 | 114.8 Ų | 114.8 | 40% | 0.396 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -61.8 | -39.7 | 178.4 | -162.6 | -85.4 | 0 | 0 | 0 | 111.8 | I143 M144 L150 K151 | I143-N147 VanDerWaalsContact O-CB 3.27Å; I143-N147 WeakPolarHBondContact O-CB 3.33Å; I143-N147 PolarHBondContact O-N 2.96Å; M144-N147 PolarHBondContact O-N 3Å; N147-L150 PolarHBondContact O-N 2.87Å; N147-K151 WeakPolarHBondContact O-CG 3.49Å; N147-K151 PolarHBondContact O-N 3.05Å; N147-K151 WeakPolarHBondContact OD1-CE 3.43Å; N147-K151 PolarHBondContact OD1-NZ 2.98Å |
| 148 | K | 93 | Very high | 88.4 | Confident | 155 Ų | 155 | 117.6 Ų | 117.6 | 67% | 0.674 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -62.6 | -47.5 | 175.5 | -174.4 | 179.3 | 179.5 | -178.7 | 0 | 111.7 | M144 E145 V146 L150 K151 Q152 | M144-K148 WeakPolarHBondContact O-CB 3.48Å; M144-K148 PolarHBondContact O-N 3.36Å; E145-K148 PolarHBondContact O-N 2.92Å; V146-K148 VanDerWaalsContact C-N 3.3Å; V146-K148 PolarHBondContact O-N 3.07Å; K148-L150 VanDerWaalsContact C-N 3.31Å; K148-L150 PolarHBondContact O-N 2.97Å; K148-K151 PolarHBondContact O-N 3.27Å; K148-Q152 PolarHBondContact O-N 2.96Å |
| 149 | K | 90.1 | Very high | 89.6 | Confident | 136 Ų | 136 | 116.9 Ų | 116.9 | 59% | 0.591 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.7 | -42.5 | 175.8 | -73 | 174.7 | -178.2 | 171.7 | 0 | 111.4 | E145 V146 Q152 K153 | E145-K149 WeakPolarHBondContact O-CG 3.33Å; E145-K149 PolarHBondContact O-N 3.46Å; V146-K149 PolarHBondContact O-N 3.48Å; K149-Q152 PolarHBondContact O-N 3.24Å; K149-K153 WeakPolarHBondContact O-CG 3.21Å; K149-K153 PolarHBondContact O-N 3.28Å |
| 150 | L | 92.4 | Very high | 90.8 | Very high | 102 Ų | 102 | 117.7 Ų | 117.7 | 53% | 0.534 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.6 | -45.6 | 178.4 | -170.5 | 68.9 | 0 | 0 | 0 | 111.9 | V146 N147 K148 Q152 K153 N154 | V146-L150 WeakPolarHBondContact O-CB 3.33Å; V146-L150 PolarHBondContact O-N 3.4Å; N147-L150 PolarHBondContact O-N 2.87Å; K148-L150 VanDerWaalsContact C-N 3.31Å; K148-L150 PolarHBondContact O-N 2.97Å; L150-Q152 VanDerWaalsContact C-N 3.35Å; L150-Q152 PolarHBondContact O-N 3.41Å; L150-K153 PolarHBondContact O-N 2.81Å; L150-N154 PolarHBondContact O-N 3.46Å |
| 151 | K | 93.2 | Very high | 91.7 | Very high | 139 Ų | 139 | 113.2 Ų | 113.2 | 60% | 0.604 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -59.9 | -43.8 | 175.6 | -77.4 | 175.6 | 175.7 | 168.3 | 0 | 111.9 | N147 K148 K153 N154 Q155 | N147-K151 WeakPolarHBondContact O-CG 3.49Å; N147-K151 PolarHBondContact O-N 3.05Å; N147-K151 WeakPolarHBondContact OD1-CE 3.43Å; N147-K151 PolarHBondContact OD1-NZ 2.98Å; K148-K151 PolarHBondContact O-N 3.27Å; K151-K153 PolarHBondContact O-N 3.31Å; K151-N154 PolarHBondContact O-N 2.98Å; K151-Q155 PolarHBondContact O-N 2.8Å |
| 152 | Q | 94.1 | Very high | 92.4 | Very high | 115 Ų | 115 | 108.1 Ų | 108.1 | 54% | 0.537 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.3 | -43.6 | 177.6 | -169.9 | 179.5 | 14.4 | 0 | 0 | 111.8 | K148 K149 L150 Q155 Q156 | K148-Q152 PolarHBondContact O-N 2.96Å; K149-Q152 PolarHBondContact O-N 3.24Å; L150-Q152 VanDerWaalsContact C-N 3.35Å; L150-Q152 PolarHBondContact O-N 3.41Å; Q152-Q155 PolarHBondContact O-N 2.87Å; Q152-Q156 WeakPolarHBondContact O-CG 3.5Å; Q152-Q156 PolarHBondContact O-N 3.5Å |
| 153 | K | 94.5 | Very high | 93.2 | Very high | 133 Ų | 133 | 108.4 Ų | 108.4 | 58% | 0.578 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.3 | -42.5 | 176.3 | -72.6 | -70.8 | -178.7 | 179.6 | 0 | 112.4 | K149 L150 K151 Q155 Q156 L157 | K149-K153 WeakPolarHBondContact O-CG 3.21Å; K149-K153 PolarHBondContact O-N 3.28Å; L150-K153 PolarHBondContact O-N 2.81Å; K151-K153 PolarHBondContact O-N 3.31Å; K153-Q155 VanDerWaalsContact C-N 3.3Å; K153-Q155 PolarHBondContact O-N 2.96Å; K153-Q156 PolarHBondContact O-N 3.28Å; K153-L157 WeakPolarHBondContact O-CG 3.42Å; K153-L157 PolarHBondContact O-N 3.48Å |
| 154 | N | 95.6 | Very high | 93.8 | Very high | 94 Ų | 94 | 108.1 Ų | 108.1 | 50% | 0.503 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.5 | -38.9 | 174.3 | -86.5 | -27.6 | 0 | 0 | 0 | 112.4 | L150 K151 L157 K158 | L150-N154 PolarHBondContact O-N 3.46Å; K151-N154 PolarHBondContact O-N 2.98Å; N154-L157 PolarHBondContact O-N 3.32Å; N154-K158 PolarHBondContact O-N 3.37Å |
| 155 | Q | 95.4 | Very high | 94.3 | Very high | 125 Ų | 125 | 108.5 Ų | 108.5 | 58% | 0.584 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -66.8 | -40.4 | 177.1 | -168.1 | 169.8 | 9.9 | 0 | 0 | 112.1 | K151 Q152 K153 K158 Q159 | K151-Q155 PolarHBondContact O-N 2.8Å; Q152-Q155 PolarHBondContact O-N 2.87Å; K153-Q155 VanDerWaalsContact C-N 3.3Å; K153-Q155 PolarHBondContact O-N 2.96Å; Q155-K158 PolarHBondContact O-N 3.34Å; Q155-Q159 PolarHBondContact O-N 2.96Å |
| 156 | Q | 96 | Very high | 94.5 | Very high | 83 Ų | 83 | 109.3 Ų | 109.3 | 39% | 0.388 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.6 | -45.9 | 173.1 | -73 | 179.9 | -26.6 | 0 | 0 | 111.8 | Q152 K153 K158 Q159 I160 | Q152-Q156 WeakPolarHBondContact O-CG 3.5Å; Q152-Q156 PolarHBondContact O-N 3.5Å; K153-Q156 PolarHBondContact O-N 3.28Å; Q156-K158 VanDerWaalsContact C-N 3.27Å; Q156-K158 PolarHBondContact O-N 2.95Å; Q156-Q159 PolarHBondContact O-N 3.3Å; Q156-I160 WeakPolarHBondContact O-CG1 3.25Å; Q156-I160 PolarHBondContact O-N 3.28Å |
| 157 | L | 95.6 | Very high | 94.9 | Very high | 104 Ų | 104 | 109.8 Ų | 109.8 | 55% | 0.545 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.4 | -40 | 176.5 | -73.8 | 173.8 | 0 | 0 | 0 | 111.8 | K153 N154 I160 M161 | K153-L157 WeakPolarHBondContact O-CG 3.42Å; K153-L157 PolarHBondContact O-N 3.48Å; N154-L157 PolarHBondContact O-N 3.32Å; L157-I160 PolarHBondContact O-N 2.9Å; L157-M161 VanDerWaalsContact O-CB 3.29Å; L157-M161 WeakPolarHBondContact O-CB 3.38Å; L157-M161 PolarHBondContact O-N 3.45Å |
| 158 | K | 95.9 | Very high | 95.1 | Very high | 137 Ų | 137 | 111 Ų | 111 | 60% | 0.596 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -62.4 | -45.4 | 176.1 | -168 | 174.5 | -179.1 | 175.7 | 0 | 111.7 | N154 Q155 Q156 I160 M161 D162 | N154-K158 PolarHBondContact O-N 3.37Å; Q155-K158 PolarHBondContact O-N 3.34Å; Q156-K158 VanDerWaalsContact C-N 3.27Å; Q156-K158 PolarHBondContact O-N 2.95Å; K158-I160 PolarHBondContact O-N 3.49Å; K158-M161 WeakPolarHBondContact O-CB 3.32Å; K158-M161 PolarHBondContact O-N 3.07Å; K158-D162 VanDerWaalsContact O-CG 3.26Å; K158-D162 PolarHBondContact O-N 2.89Å |
| 159 | Q | 96.4 | Very high | 95.2 | Very high | 113 Ų | 113 | 112.5 Ų | 112.5 | 53% | 0.528 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.5 | -45 | 176.3 | -73.8 | 174.8 | -13.7 | 0 | 0 | 112.3 | Q155 Q156 M161 D162 Q163 | Q155-Q159 PolarHBondContact O-N 2.96Å; Q156-Q159 PolarHBondContact O-N 3.3Å; Q159-M161 VanDerWaalsContact C-N 3.32Å; Q159-M161 PolarHBondContact O-N 2.95Å; Q159-D162 PolarHBondContact O-N 3.4Å; Q159-Q163 WeakPolarHBondContact O-CG 3.36Å; Q159-Q163 PolarHBondContact O-N 3.01Å |
| 160 | I | 96.8 | Very high | 95.4 | Very high | 86 Ų | 86 | 109.9 Ų | 109.9 | 44% | 0.441 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.1 | -43.7 | 176.8 | -66.5 | 167.2 | 0 | 0 | 0 | 110.2 | Q156 L157 K158 D162 Q163 L164 | Q156-I160 WeakPolarHBondContact O-CG1 3.25Å; Q156-I160 PolarHBondContact O-N 3.28Å; L157-I160 PolarHBondContact O-N 2.9Å; K158-I160 PolarHBondContact O-N 3.49Å; I160-D162 VanDerWaalsContact C-N 3.29Å; I160-D162 PolarHBondContact O-N 2.86Å; I160-Q163 PolarHBondContact O-N 2.63Å; I160-L164 HydrophobicContact CG2-CD1 4.03Å; I160-L164 HydrophobicContact CG2-CG 4.36Å; I160-L164 WeakPolarHBondContact O-CB 3.42Å; I160-L164 WeakPolarHBondContact O-CG 3.42Å; I160-L164 PolarHBondContact O-N 3.25Å |
| 161 | M | 96.3 | Very high | 95.5 | Very high | 93 Ų | 93 | 109.2 Ų | 109.2 | 46% | 0.458 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.8 | -40.3 | 178.4 | -165 | -171.9 | -67 | 0 | 0 | 111.6 | L157 K158 Q159 L164 R165 | L157-M161 VanDerWaalsContact O-CB 3.29Å; L157-M161 WeakPolarHBondContact O-CB 3.38Å; L157-M161 PolarHBondContact O-N 3.45Å; K158-M161 WeakPolarHBondContact O-CB 3.32Å; K158-M161 PolarHBondContact O-N 3.07Å; Q159-M161 VanDerWaalsContact C-N 3.32Å; Q159-M161 PolarHBondContact O-N 2.95Å; M161-L164 PolarHBondContact O-N 3.44Å; M161-R165 VanDerWaalsContact CG-NH1 3.29Å; M161-R165 WeakPolarHBondContact O-CG 3.41Å; M161-R165 PolarHBondContact O-N 3.41Å; M161-R165 VanDerWaalsContact SD-CZ 3.52Å; M161-R165 PolarHBondContact SD-NH1 3.38Å; M161-R165 PolarHBondContact SD-NH2 2.82Å |
| 162 | D | 96.5 | Very high | 95.5 | Very high | 62 Ų | 62 | 107 Ų | 107 | 33% | 0.332 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -71.7 | -37.6 | 177.9 | -65.5 | -23.1 | 0 | 0 | 0 | 111.9 | K158 Q159 I160 R165 N166 | K158-D162 VanDerWaalsContact O-CG 3.26Å; K158-D162 PolarHBondContact O-N 2.89Å; Q159-D162 PolarHBondContact O-N 3.4Å; I160-D162 VanDerWaalsContact C-N 3.29Å; I160-D162 PolarHBondContact O-N 2.86Å; D162-R165 WeakPolarHBondContact O-CB 3.44Å; D162-R165 PolarHBondContact O-N 3.48Å; D162-R165 IonicContact OD1-CZ 2.86Å; D162-R165 IonicContact OD1-NH1 3.48Å; D162-R165 PolarHBondContact OD1-NH1 2.86Å; D162-N166 VanDerWaalsContact O-CG 3.31Å; D162-N166 PolarHBondContact O-N 3.48Å; D162-N166 PolarHBondContact O-ND2 2.93Å |
| 163 | Q | 95.6 | Very high | 95.5 | Very high | 125 Ų | 125 | 103.4 Ų | 103.4 | 58% | 0.584 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.3 | -44.8 | 171.2 | -74.2 | 175.6 | -15.4 | 0 | 0 | 111.9 | Q159 I160 R165 N166 L167 | Q159-Q163 WeakPolarHBondContact O-CG 3.36Å; Q159-Q163 PolarHBondContact O-N 3.01Å; I160-Q163 PolarHBondContact O-N 2.63Å; Q163-R165 VanDerWaalsContact C-N 3.33Å; Q163-R165 PolarHBondContact O-N 3.4Å; Q163-N166 PolarHBondContact O-N 3.27Å; Q163-L167 WeakPolarHBondContact O-CG 3.38Å; Q163-L167 PolarHBondContact O-N 3.34Å |
| 164 | L | 96.2 | Very high | 95.4 | Very high | 96 Ų | 96 | 102.7 Ų | 102.7 | 50% | 0.503 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.8 | -40.7 | 176.2 | -72 | 173.1 | 0 | 0 | 0 | 111.4 | I160 M161 L167 I168 | I160-L164 HydrophobicContact CG2-CD1 4.03Å; I160-L164 HydrophobicContact CG2-CG 4.36Å; I160-L164 WeakPolarHBondContact O-CB 3.42Å; I160-L164 WeakPolarHBondContact O-CG 3.42Å; I160-L164 PolarHBondContact O-N 3.25Å; M161-L164 PolarHBondContact O-N 3.44Å; L164-L167 PolarHBondContact O-N 3.4Å; L164-I168 WeakPolarHBondContact O-CD1 3.42Å; L164-I168 WeakPolarHBondContact O-CG1 3.19Å; L164-I168 PolarHBondContact O-N 2.89Å |
| 165 | R | 96.1 | Very high | 95 | Very high | 132 Ų | 132 | 102.9 Ų | 102.9 | 50% | 0.498 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.4 | -45.9 | 174.1 | -77.2 | 178.1 | -178 | 110.1 | 7.9 | 112 | M161 D162 Q163 I168 W169 | M161-R165 VanDerWaalsContact CG-NH1 3.29Å; M161-R165 WeakPolarHBondContact O-CG 3.41Å; M161-R165 PolarHBondContact O-N 3.41Å; M161-R165 VanDerWaalsContact SD-CZ 3.52Å; M161-R165 PolarHBondContact SD-NH1 3.38Å; M161-R165 PolarHBondContact SD-NH2 2.82Å; D162-R165 WeakPolarHBondContact O-CB 3.44Å; D162-R165 PolarHBondContact O-N 3.48Å; D162-R165 IonicContact OD1-CZ 2.86Å; D162-R165 IonicContact OD1-NH1 3.48Å; D162-R165 PolarHBondContact OD1-NH1 2.86Å; Q163-R165 VanDerWaalsContact C-N 3.33Å; Q163-R165 PolarHBondContact O-N 3.4Å; R165-I168 PolarHBondContact O-N 3.15Å; R165-W169 WeakPolarHBondContact O-CB 3.34Å; R165-W169 PolarHBondContact O-N 3.04Å |
| 166 | N | 96.1 | Very high | 94.5 | Very high | 103 Ų | 103 | 100.1 Ų | 100.1 | 55% | 0.551 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.6 | -45.2 | 179 | -68.9 | -18 | 0 | 0 | 0 | 111.4 | D162 Q163 I168 W169 D170 | D162-N166 VanDerWaalsContact O-CG 3.31Å; D162-N166 PolarHBondContact O-N 3.48Å; D162-N166 PolarHBondContact O-ND2 2.93Å; Q163-N166 PolarHBondContact O-N 3.27Å; N166-I168 VanDerWaalsContact C-N 3.34Å; N166-I168 PolarHBondContact O-N 2.89Å; N166-W169 CarbonylContact O-C 3.52Å; N166-W169 WeakPolarHBondContact O-CA 3.47Å; N166-W169 WeakPolarHBondContact O-CB 3.42Å; N166-W169 PolarHBondContact O-N 3.46Å; N166-W169 VanDerWaalsContact O-N 3.07Å; N166-D170 VanDerWaalsContact O-CG 3.28Å; N166-D170 PolarHBondContact O-N 2.92Å |
| 167 | L | 96.1 | Very high | 93.8 | Very high | 99 Ų | 99 | 103.4 Ų | 103.4 | 52% | 0.518 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.3 | -43.1 | 176.7 | -73.2 | 173.6 | 0 | 0 | 0 | 112.3 | Q163 L164 W169 D170 I171 | Q163-L167 WeakPolarHBondContact O-CG 3.38Å; Q163-L167 PolarHBondContact O-N 3.34Å; L164-L167 PolarHBondContact O-N 3.4Å; L167-W169 VanDerWaalsContact C-N 3.27Å; L167-W169 PolarHBondContact O-N 3.24Å; L167-D170 PolarHBondContact O-N 3.49Å; L167-I171 WeakPolarHBondContact O-CB 3.47Å; L167-I171 WeakPolarHBondContact O-CD1 3.37Å; L167-I171 WeakPolarHBondContact O-CG1 3.3Å; L167-I171 PolarHBondContact O-N 3.42Å |
| 168 | I | 94.9 | Very high | 92.5 | Very high | 98 Ų | 98 | 108.9 Ų | 108.9 | 50% | 0.503 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.9 | -42.1 | 175 | -68.8 | 163.6 | 0 | 0 | 0 | 110.1 | L164 R165 N166 I171 N172 | L164-I168 WeakPolarHBondContact O-CD1 3.42Å; L164-I168 WeakPolarHBondContact O-CG1 3.19Å; L164-I168 PolarHBondContact O-N 2.89Å; R165-I168 PolarHBondContact O-N 3.15Å; N166-I168 VanDerWaalsContact C-N 3.34Å; N166-I168 PolarHBondContact O-N 2.89Å; I168-I171 PolarHBondContact O-N 3.01Å; I168-N172 WeakPolarHBondContact O-CB 3.43Å; I168-N172 PolarHBondContact O-N 3.44Å; I168-N172 PolarHBondContact O-ND2 3.04Å |
| 169 | W | 95.4 | Very high | 90.4 | Very high | 188 Ų | 188 | 111.9 Ų | 111.9 | 71% | 0.712 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.2 | -45.8 | 178.6 | -156.4 | 75.4 | 0 | 0 | 0 | 112 | R165 N166 L167 I171 N172 A173 | R165-W169 WeakPolarHBondContact O-CB 3.34Å; R165-W169 PolarHBondContact O-N 3.04Å; N166-W169 CarbonylContact O-C 3.52Å; N166-W169 WeakPolarHBondContact O-CA 3.47Å; N166-W169 WeakPolarHBondContact O-CB 3.42Å; N166-W169 PolarHBondContact O-N 3.46Å; N166-W169 VanDerWaalsContact O-N 3.07Å; L167-W169 VanDerWaalsContact C-N 3.27Å; L167-W169 PolarHBondContact O-N 3.24Å; W169-I171 PolarHBondContact O-N 3.31Å; W169-N172 PolarHBondContact O-N 3.49Å; W169-A173 WeakPolarHBondContact O-CB 3.38Å; W169-A173 PolarHBondContact O-N 3.17Å |
| 170 | D | 95.2 | Very high | 90.1 | Very high | 81 Ų | 81 | 111.8 Ų | 111.8 | 43% | 0.433 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.5 | -43.6 | 176.8 | -67.1 | -21.9 | 0 | 0 | 0 | 111.5 | N166 L167 A173 M174 | N166-D170 VanDerWaalsContact O-CG 3.28Å; N166-D170 PolarHBondContact O-N 2.92Å; L167-D170 PolarHBondContact O-N 3.49Å; D170-A173 PolarHBondContact O-N 3.22Å; D170-M174 WeakPolarHBondContact O-CB 3.35Å; D170-M174 WeakPolarHBondContact O-CG 3.26Å; D170-M174 PolarHBondContact O-N 2.7Å |
| 171 | I | 94.6 | Very high | 89.7 | Confident | 87 Ų | 87 | 113.2 Ų | 113.2 | 45% | 0.446 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61.6 | -48.4 | 175.6 | -69.7 | 165.3 | 0 | 0 | 0 | 110.4 | L167 I168 W169 A173 M174 L175 | L167-I171 WeakPolarHBondContact O-CB 3.47Å; L167-I171 WeakPolarHBondContact O-CD1 3.37Å; L167-I171 WeakPolarHBondContact O-CG1 3.3Å; L167-I171 PolarHBondContact O-N 3.42Å; I168-I171 PolarHBondContact O-N 3.01Å; W169-I171 PolarHBondContact O-N 3.31Å; I171-A173 VanDerWaalsContact C-N 3.32Å; I171-A173 PolarHBondContact O-N 3.3Å; I171-M174 HydrophobicContact CG1-CE 4.46Å; I171-M174 PolarHBondContact O-N 2.89Å; I171-L175 HydrophobicContact CG2-CD1 3.83Å; I171-L175 HydrophobicContact CG2-CG 4.32Å; I171-L175 WeakPolarHBondContact O-CB 3.46Å; I171-L175 VanDerWaalsContact O-CG 3.3Å; I171-L175 WeakPolarHBondContact O-CG 2.99Å; I171-L175 PolarHBondContact O-N 3.15Å |
| 172 | N | 92.7 | Very high | 89.4 | Confident | 93 Ų | 93 | 114.3 Ų | 114.3 | 50% | 0.497 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.5 | -39.7 | 179.6 | -72.5 | -16.8 | 0 | 0 | 0 | 111.7 | I168 W169 A176 | I168-N172 WeakPolarHBondContact O-CB 3.43Å; I168-N172 PolarHBondContact O-N 3.44Å; I168-N172 PolarHBondContact O-ND2 3.04Å; W169-N172 PolarHBondContact O-N 3.49Å; N172-A176 WeakPolarHBondContact O-CB 3.43Å; N172-A176 PolarHBondContact O-N 3.49Å |
| 173 | A | 93.4 | Very high | 89 | Confident | 40 Ų | 40 | 117.4 Ų | 117.4 | 33% | 0.331 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.1 | -45.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | W169 D170 I171 L175 A176 M177 | W169-A173 WeakPolarHBondContact O-CB 3.38Å; W169-A173 PolarHBondContact O-N 3.17Å; D170-A173 PolarHBondContact O-N 3.22Å; I171-A173 VanDerWaalsContact C-N 3.32Å; I171-A173 PolarHBondContact O-N 3.3Å; A173-L175 PolarHBondContact O-N 3.45Å; A173-A176 PolarHBondContact O-N 3.49Å; A173-M177 WeakPolarHBondContact O-CG 3.21Å; A173-M177 PolarHBondContact O-N 3.49Å; A173-M177 VanDerWaalsContact O-N 3.15Å |
| 174 | M | 91.7 | Very high | 88.5 | Confident | 117 Ų | 117 | 116.9 Ų | 116.9 | 58% | 0.576 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.5 | -39.3 | 176.4 | -75.9 | -171.6 | -71.3 | 0 | 0 | 112.7 | D170 I171 | D170-M174 WeakPolarHBondContact O-CB 3.35Å; D170-M174 WeakPolarHBondContact O-CG 3.26Å; D170-M174 PolarHBondContact O-N 2.7Å; I171-M174 HydrophobicContact CG1-CE 4.46Å; I171-M174 PolarHBondContact O-N 2.89Å |
| 175 | L | 89 | Confident | 88 | Confident | 99 Ų | 99 | 118.3 Ų | 118.3 | 52% | 0.518 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.5 | -39 | 175.7 | -72.8 | 173.5 | 0 | 0 | 0 | 111.9 | I171 A173 M177 R178 | I171-L175 HydrophobicContact CG2-CD1 3.83Å; I171-L175 HydrophobicContact CG2-CG 4.32Å; I171-L175 WeakPolarHBondContact O-CB 3.46Å; I171-L175 VanDerWaalsContact O-CG 3.3Å; I171-L175 WeakPolarHBondContact O-CG 2.99Å; I171-L175 PolarHBondContact O-N 3.15Å; A173-L175 PolarHBondContact O-N 3.45Å; L175-M177 VanDerWaalsContact C-N 3.35Å; L175-M177 PolarHBondContact O-N 3.05Å; L175-R178 PolarHBondContact O-N 3.13Å |
| 176 | A | 84.1 | Confident | 87.5 | Confident | 66 Ų | 66 | 117.3 Ų | 117.3 | 55% | 0.545 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.3 | -31.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | N172 A173 R178 | N172-A176 WeakPolarHBondContact O-CB 3.43Å; N172-A176 PolarHBondContact O-N 3.49Å; A173-A176 PolarHBondContact O-N 3.49Å; A176-R178 VanDerWaalsContact C-N 3.29Å; A176-R178 PolarHBondContact O-N 3.29Å |
| 177 | M | 80.4 | Confident | 86.8 | Confident | 153 Ų | 153 | 118.4 Ų | 118.4 | 75% | 0.754 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.2 | -11.2 | 176.2 | -68.7 | -170.8 | -64.5 | 0 | 0 | 114.2 | A173 L175 | A173-M177 WeakPolarHBondContact O-CG 3.21Å; A173-M177 PolarHBondContact O-N 3.49Å; A173-M177 VanDerWaalsContact O-N 3.15Å; L175-M177 VanDerWaalsContact C-N 3.35Å; L175-M177 PolarHBondContact O-N 3.05Å |
| 178 | R | 69.9 | Low | 86 | Confident | 218 Ų | 218 | 120 Ų | 120 | 82% | 0.823 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -8.7 | -179.7 | -173.1 | 171 | 166.3 | -174.4 | -4.3 | 113 | L175 A176 | L175-R178 PolarHBondContact O-N 3.13Å; A176-R178 VanDerWaalsContact C-N 3.29Å; A176-R178 PolarHBondContact O-N 3.29Å |
| 179 | N | 50.9 | Low | 85.2 | Confident | 200 Ų | 200 | 122 Ų | 122 | 100% | 1.07 | 61% | 0.61 | S | S | * | * | trans | -99.8 | 0 | 169.5 | -67.5 | -23.2 | 0 | 0 | 0 | 110.3 |
Retrieved 179 of 179 residues in 349.6 ms
(Link to these results)