| 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 | 46.8 | Very low | 55.4 | Low | 246 Ų | 246 | 147.6 Ų | 147.6 | 100% | 1.212 | 82% | 0.823 | S | S | * | * | 0 | 125 | 0 | -71.1 | 173.3 | 172.2 | 0 | 0 | 107.2 | |||||
| 2 | G | 43.6 | Very low | 54.8 | Low | 73 Ų | 73 | 147.8 Ų | 147.8 | 75% | 0.753 | 82% | 0.82 | S | S | * | * | trans | -73.1 | 148.2 | -168.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 3 | N | 50.2 | Low | 53.9 | Low | 165 Ų | 165 | 140.5 Ų | 140.5 | 88% | 0.882 | 80% | 0.8 | S | S | * | * | trans | -126.4 | 100.1 | 157.2 | -84 | -36.4 | 0 | 0 | 0 | 105.9 | ||||
| 4 | V | 60.2 | Low | 53.6 | Low | 130 Ų | 130 | 140.4 Ų | 140.4 | 79% | 0.788 | 80% | 0.796 | S | S | * | * | trans | -96.4 | 119.3 | 166.2 | -174.2 | 0 | 0 | 0 | 0 | 106 | V6 | V4-V6 PolarHBondContact O-N 2.89Š| ||
| 5 | P | 59 | Low | 53.2 | Low | 112 Ų | 112 | 143.3 Ų | 143.3 | 73% | 0.727 | 80% | 0.8 | S | S | * | * | trans | -67.9 | 119.3 | -177.3 | 25.1 | -31.4 | 0 | 0 | 0 | 110.3 | T7 | P5-T7 PolarHBondContact O-N 3.41Å; P5-T7 VanDerWaalsContact O-N 3.16Å | ||
| 6 | V | 63.8 | Low | 52.5 | Low | 135 Ų | 135 | 144 Ų | 144 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | -72 | 102 | 170 | 177.2 | 0 | 0 | 0 | 0 | 107.6 | V4 R8 | V4-V6 PolarHBondContact O-N 2.89Å; V6-R8 PolarHBondContact O-N 3.27Å | ||
| 7 | T | 62.4 | Low | 51.9 | Low | 123 Ų | 123 | 140.7 Ų | 140.7 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | trans | -70.1 | 108.8 | 168.3 | 32.7 | 0 | 0 | 0 | 0 | 108.9 | P5 I9 | P5-T7 PolarHBondContact O-N 3.41Å; P5-T7 VanDerWaalsContact O-N 3.16Å; T7-I9 PolarHBondContact O-N 3.2Å | ||
| 8 | R | 58.7 | Low | 51.5 | Low | 228 Ų | 228 | 138.2 Ų | 138.2 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | trans | -63.8 | 113.3 | 167.4 | -86.2 | -179.5 | 163.2 | 148 | -4.4 | 108.6 | V6 V10 | V6-R8 PolarHBondContact O-N 3.27Å; R8-V10 PolarHBondContact O-N 3.41Å | ||
| 9 | I | 56.9 | Low | 51.1 | Low | 146 Ų | 146 | 138.9 Ų | 138.9 | 75% | 0.749 | 79% | 0.786 | S | S | * | * | trans | -75.4 | 101.7 | 165.2 | -58.4 | 172 | 0 | 0 | 0 | 106.1 | T7 N11 | T7-I9 PolarHBondContact O-N 3.2Å; I9-N11 PolarHBondContact O-N 2.92Å | ||
| 10 | V | 58.2 | Low | 50.8 | Low | 114 Ų | 114 | 141.6 Ų | 141.6 | 69% | 0.691 | 79% | 0.791 | S | S | * | * | trans | -76.7 | 113.8 | 165.3 | -77.6 | 0 | 0 | 0 | 0 | 107.5 | R8 N12 | R8-V10 PolarHBondContact O-N 3.41Å; V10-N12 PolarHBondContact O-N 2.83Å | ||
| 11 | N | 49.6 | Very low | 50.3 | Low | 152 Ų | 152 | 141.4 Ų | 141.4 | 81% | 0.813 | 79% | 0.788 | S | S | * | * | trans | -71.4 | 96.7 | 167.3 | -72.1 | -27.8 | 0 | 0 | 0 | 107 | I9 G13 | I9-N11 PolarHBondContact O-N 2.92Å; N11-G13 PolarHBondContact O-N 3.18Å; N11-G13 VanDerWaalsContact O-N 3.08Å | ||
| 12 | N | 48.3 | Very low | 50.5 | Low | 149 Ų | 149 | 137.8 Ų | 137.8 | 80% | 0.797 | 77% | 0.769 | S | S | * | * | trans | -65.7 | 109.3 | 164.8 | -83 | 10.2 | 0 | 0 | 0 | 107.2 | V10 N14 | V10-N12 PolarHBondContact O-N 2.83Å; N12-N14 PolarHBondContact O-N 3.48Å | ||
| 13 | G | 43 | Very low | 50.4 | Low | 54 Ų | 54 | 138.7 Ų | 138.7 | 56% | 0.557 | 76% | 0.761 | S | S | * | * | trans | -53 | 132.2 | 167.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | N11 E15 | N11-G13 PolarHBondContact O-N 3.18Å; N11-G13 VanDerWaalsContact O-N 3.08Å; G13-E15 PolarHBondContact O-N 2.86Å | ||
| 14 | N | 49.2 | Very low | 49.8 | Very low | 138 Ų | 138 | 134.2 Ų | 134.2 | 74% | 0.738 | 75% | 0.754 | S | S | * | * | trans | -67.9 | 84.7 | 165.6 | 55.6 | -16.6 | 0 | 0 | 0 | 108.6 | N12 N16 | N12-N14 PolarHBondContact O-N 3.48Å; N14-N16 PolarHBondContact O-N 3.01Å; N14-N16 VanDerWaalsContact O-N 3.11Å | ||
| 15 | E | 47.3 | Very low | 49.1 | Very low | 184 Ų | 184 | 135.3 Ų | 135.3 | 86% | 0.86 | 75% | 0.754 | S | S | * | * | trans | -58.1 | 110.6 | 161.5 | 49.9 | -162.4 | 134.4 | 0 | 0 | 109.2 | G13 A17 | G13-E15 PolarHBondContact O-N 2.86Å; E15-A17 PolarHBondContact O-N 2.96Å | ||
| 16 | N | 42 | Very low | 48.4 | Very low | 155 Ų | 155 | 134.4 Ų | 134.4 | 83% | 0.829 | 75% | 0.75 | S | S | * | * | trans | -69.7 | 109.3 | 172.1 | -59.4 | -67.7 | 0 | 0 | 0 | 108.3 | N14 | N14-N16 PolarHBondContact O-N 3.01Å; N14-N16 VanDerWaalsContact O-N 3.11Å | ||
| 17 | A | 42.4 | Very low | 47.5 | Very low | 88 Ų | 88 | 135.4 Ų | 135.4 | 73% | 0.727 | 75% | 0.751 | S | S | * | * | trans | -116.9 | 113.8 | 156.4 | 0 | 0 | 0 | 0 | 0 | 105.2 | E15 | E15-A17 PolarHBondContact O-N 2.96Š| ||
| 18 | S | 44.7 | Very low | 46.6 | Very low | 95 Ų | 95 | 136.2 Ų | 136.2 | 66% | 0.664 | 75% | 0.75 | S | S | * | * | 47.3 | 117.6 | 79.5 | -146.2 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 19 | E | 44.5 | Very low | 46 | Very low | 152 Ų | 152 | 133.1 Ų | 133.1 | 71% | 0.71 | 75% | 0.745 | S | S | * | * | cis | -141.6 | 144.8 | 14.9 | -77.8 | 99 | -152 | 0 | 0 | 108.2 | ||||
| 20 | H | 45.3 | Very low | 45.6 | Very low | 192 Ų | 192 | 133.8 Ų | 133.8 | 89% | 0.889 | 75% | 0.749 | S | S | * | * | trans | -125.2 | 95 | 156.7 | -117.1 | -68.4 | 0 | 0 | 0 | 107.1 | ||||
| 21 | D | 41.3 | Very low | 45.2 | Very low | 138 Ų | 138 | 134.1 Ų | 134.1 | 74% | 0.738 | 75% | 0.747 | S | S | * | * | trans | -61.5 | 124.6 | 157.2 | -63.8 | -73.9 | 0 | 0 | 0 | 108.6 | ||||
| 22 | E | 49.7 | Very low | 45 | Very low | 170 Ų | 170 | 134.2 Ų | 134.2 | 79% | 0.794 | 75% | 0.748 | S | S | * | * | trans | 173.6 | 152.2 | 151.9 | -99.5 | -67.2 | 96.3 | 0 | 0 | 109.3 | ||||
| 23 | P | 40.9 | Very low | 45.1 | Very low | 93 Ų | 93 | 138.4 Ų | 138.4 | 60% | 0.604 | 75% | 0.752 | S | S | * | * | -109.7 | 168.1 | -104 | 33.2 | -19.8 | 0 | 0 | 0 | 112.9 | I25 | P23-I25 PolarHBondContact O-N 3.14Š| |||
| 24 | G | 37.6 | Very low | 45.5 | Very low | 71 Ų | 71 | 140.2 Ų | 140.2 | 73% | 0.732 | 76% | 0.756 | S | S | * | * | trans | -49.9 | 118.3 | -168.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | S26 | G24-S26 PolarHBondContact O-N 3Å; G24-S26 VanDerWaalsContact O-N 3.1Å | ||
| 25 | I | 45.7 | Very low | 45.6 | Very low | 153 Ų | 153 | 141.3 Ų | 141.3 | 79% | 0.785 | 76% | 0.761 | S | S | * | * | trans | -82.3 | 66.9 | 157 | -38.7 | -176.1 | 0 | 0 | 0 | 107.1 | P23 L28 | P23-I25 PolarHBondContact O-N 3.14Å; I25-L28 HydrophobicContact CG2-CD1 4.47Å | ||
| 26 | S | 44.1 | Very low | 45.9 | Very low | 93 Ų | 93 | 137.2 Ų | 137.2 | 65% | 0.65 | 75% | 0.749 | S | S | * | * | trans | -76.4 | 141.2 | 159.3 | -62.5 | 0 | 0 | 0 | 0 | 107.4 | G24 | G24-S26 PolarHBondContact O-N 3Å; G24-S26 VanDerWaalsContact O-N 3.1Å | ||
| 27 | D | 45.4 | Very low | 46.5 | Very low | 156 Ų | 156 | 135.5 Ų | 135.5 | 83% | 0.834 | 74% | 0.736 | S | S | * | * | trans | 96.4 | 28.5 | 168.7 | -48.6 | -37 | 0 | 0 | 0 | 119.2 | ||||
| 28 | L | 44.2 | Very low | 47.1 | Very low | 139 Ų | 139 | 141.1 Ų | 141.1 | 73% | 0.728 | 74% | 0.738 | S | S | * | * | trans | -97.2 | 83.1 | 149.5 | -84.7 | 155.7 | 0 | 0 | 0 | 109.6 | I25 L30 | I25-L28 HydrophobicContact CG2-CD1 4.47Å; L28-L30 PolarHBondContact O-N 3.42Å | ||
| 29 | H | 44.8 | Very low | 48 | Very low | 163 Ų | 163 | 142 Ų | 142 | 76% | 0.755 | 74% | 0.736 | S | S | * | * | trans | -62.5 | 80.7 | 170.4 | -161.2 | -134.1 | 0 | 0 | 0 | 109.3 | N31 | H29-N31 PolarHBondContact CE1-ND2 3.37Å; H29-N31 PolarHBondContact NE2-ND2 2.93Å; H29-N31 PolarHBondContact O-N 3.45Å | ||
| 30 | L | 49.2 | Very low | 49.3 | Very low | 160 Ų | 160 | 138.4 Ų | 138.4 | 84% | 0.838 | 72% | 0.721 | S | S | * | * | trans | -71.4 | 64.2 | 174.3 | -85.9 | 146.3 | 0 | 0 | 0 | 110.3 | L28 | L28-L30 PolarHBondContact O-N 3.42Š| ||
| 31 | N | 49.7 | Very low | 50.6 | Low | 122 Ų | 122 | 133.9 Ų | 133.9 | 65% | 0.652 | 70% | 0.702 | S | S | * | * | trans | -113.6 | 22.6 | 173.9 | -81.5 | -27.4 | 0 | 0 | 0 | 112.9 | H29 | H29-N31 PolarHBondContact CE1-ND2 3.37Å; H29-N31 PolarHBondContact NE2-ND2 2.93Å; H29-N31 PolarHBondContact O-N 3.45Å | ||
| 32 | D | 45.6 | Very low | 52.1 | Low | 153 Ų | 153 | 130.2 Ų | 130.2 | 82% | 0.818 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -108.1 | 79.4 | 172.1 | -130 | -59.5 | 0 | 0 | 0 | 111.8 | S34 | D32-S34 PolarHBondContact O-N 2.65Å; D32-S34 VanDerWaalsContact O-N 3.12Å |
| 33 | R | 50.8 | Low | 53.1 | Low | 238 Ų | 238 | 124.9 Ų | 124.9 | 90% | 0.898 | 67% | 0.669 | S | S | * | * | S | Bend | trans | 50.6 | 52 | 132.4 | -134.9 | 177 | -168.1 | -178 | 3 | 117.9 | ||
| 34 | S | 50.5 | Low | 54.7 | Low | 91 Ų | 91 | 127.8 Ų | 127.8 | 64% | 0.636 | 67% | 0.668 | S | S | * | * | trans | -156.3 | 50.4 | 150.9 | -177.5 | 0 | 0 | 0 | 0 | 110.7 | D32 V36 | D32-S34 PolarHBondContact O-N 2.65Å; D32-S34 VanDerWaalsContact O-N 3.12Å; S34-V36 PolarHBondContact O-N 2.93Å; S34-V36 VanDerWaalsContact OG-CG2 3.27Å; S34-V36 WeakPolarHBondContact OG-CG2 3.34Å | ||
| 35 | L | 52.1 | Low | 56.3 | Low | 161 Ų | 161 | 129.7 Ų | 129.7 | 84% | 0.843 | 66% | 0.66 | S | S | * | * | trans | -66.2 | 64.9 | 149.3 | -78 | 170.6 | 0 | 0 | 0 | 107.8 | Q37 | L35-Q37 PolarHBondContact O-N 3.26Š| ||
| 36 | V | 53.6 | Low | 57.6 | Low | 99 Ų | 99 | 128.3 Ų | 128.3 | 60% | 0.6 | 65% | 0.65 | S | S | * | * | trans | -66.2 | 75.6 | 152.8 | -177.1 | 0 | 0 | 0 | 0 | 103.9 | S34 R38 | S34-V36 PolarHBondContact O-N 2.93Å; S34-V36 VanDerWaalsContact OG-CG2 3.27Å; S34-V36 WeakPolarHBondContact OG-CG2 3.34Å; V36-R38 PolarHBondContact O-N 3.21Å | ||
| 37 | Q | 54.4 | Low | 58.9 | Low | 119 Ų | 119 | 127.8 Ų | 127.8 | 56% | 0.556 | 64% | 0.64 | S | S | * | * | trans | 34.9 | 87.3 | 144.7 | -139.5 | 141.8 | 9.5 | 0 | 0 | 111.2 | L35 D39 D40 I41 | L35-Q37 PolarHBondContact O-N 3.26Å; Q37-D39 HydrophobicContact CG-CB 4.01Å; Q37-D39 PolarHBondContact O-N 3.42Å; Q37-D39 VanDerWaalsContact O-N 3.11Å; Q37-D40 HydrophobicContact CB-CB 3.73Å; Q37-D40 HydrophobicContact CG-CB 4.26Å; Q37-D40 WeakPolarHBondContact O-CA 3.31Å; Q37-D40 VanDerWaalsContact O-CB 3.29Å; Q37-D40 WeakPolarHBondContact O-CB 3.37Å; Q37-D40 PolarHBondContact O-N 2.88Å; Q37-I41 PolarHBondContact O-N 2.76Å | ||
| 38 | R | 56.1 | Low | 59.8 | Low | 206 Ų | 206 | 126.1 Ų | 126.1 | 78% | 0.777 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -51 | -30.3 | 164.2 | -81.4 | -175.5 | 167.5 | 124.5 | -4.1 | 110.5 | V36 D40 I41 S42 | V36-R38 PolarHBondContact O-N 3.21Å; R38-D40 VanDerWaalsContact C-N 3.31Å; R38-D40 PolarHBondContact O-N 3.2Å; R38-I41 PolarHBondContact O-N 2.8Å; R38-S42 PolarHBondContact O-N 3.45Å |
| 39 | D | 62.5 | Low | 60.8 | Low | 114 Ų | 114 | 122.6 Ų | 122.6 | 61% | 0.61 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -62.9 | -31.3 | 171 | -49.8 | -63.2 | 0 | 0 | 0 | 113.3 | Q37 S43 | Q37-D39 HydrophobicContact CG-CB 4.01Å; Q37-D39 PolarHBondContact O-N 3.42Å; Q37-D39 VanDerWaalsContact O-N 3.11Å; D39-S43 WeakPolarHBondContact O-CB 3.3Å; D39-S43 PolarHBondContact O-N 3.04Å; D39-S43 PolarHBondContact O-OG 2.72Å |
| 40 | D | 72.7 | Confident | 61.7 | Low | 75 Ų | 75 | 119.1 Ų | 119.1 | 40% | 0.401 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -70.5 | -40.6 | 174.3 | -174.9 | -99.7 | 0 | 0 | 0 | 111.1 | Q37 R38 S43 R44 | Q37-D40 HydrophobicContact CB-CB 3.73Å; Q37-D40 HydrophobicContact CG-CB 4.26Å; Q37-D40 WeakPolarHBondContact O-CA 3.31Å; Q37-D40 VanDerWaalsContact O-CB 3.29Å; Q37-D40 WeakPolarHBondContact O-CB 3.37Å; Q37-D40 PolarHBondContact O-N 2.88Å; R38-D40 VanDerWaalsContact C-N 3.31Å; R38-D40 PolarHBondContact O-N 3.2Å; D40-S43 PolarHBondContact O-N 3.29Å; D40-R44 WeakPolarHBondContact O-CB 3.33Å; D40-R44 PolarHBondContact O-N 2.85Å |
| 41 | I | 70.9 | Confident | 62.3 | Low | 98 Ų | 98 | 120.8 Ų | 120.8 | 50% | 0.503 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -64.9 | -46.2 | 176.3 | -58.9 | 175.1 | 0 | 0 | 0 | 110.3 | Q37 R38 R44 I45 | Q37-I41 PolarHBondContact O-N 2.76Å; R38-I41 PolarHBondContact O-N 2.8Å; I41-R44 PolarHBondContact O-N 2.9Å; I41-I45 HydrophobicContact CG2-CD1 3.88Å; I41-I45 HydrophobicContact CG2-CG1 4.42Å; I41-I45 VanDerWaalsContact O-CG1 3.31Å; I41-I45 WeakPolarHBondContact O-CG1 3.42Å; I41-I45 PolarHBondContact O-N 3.34Å |
| 42 | S | 74.2 | Confident | 62.6 | Low | 60 Ų | 60 | 120.2 Ų | 120.2 | 42% | 0.42 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -61.4 | -47.2 | 176.9 | -153.8 | 0 | 0 | 0 | 0 | 111 | R38 R44 I45 E46 | R38-S42 PolarHBondContact O-N 3.45Å; S42-R44 PolarHBondContact O-N 2.73Å; S42-I45 PolarHBondContact O-N 3.11Å; S42-E46 PolarHBondContact O-N 3.35Å |
| 43 | S | 71 | Confident | 63 | Low | 58 Ų | 58 | 115.4 Ų | 115.4 | 41% | 0.406 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -60 | -34.1 | 176.2 | -63.2 | 0 | 0 | 0 | 0 | 112.6 | D39 D40 N47 | D39-S43 WeakPolarHBondContact O-CB 3.3Å; D39-S43 PolarHBondContact O-N 3.04Å; D39-S43 PolarHBondContact O-OG 2.72Å; D40-S43 PolarHBondContact O-N 3.29Å; S43-N47 VanDerWaalsContact O-CB 3.3Å; S43-N47 WeakPolarHBondContact O-CB 3.13Å; S43-N47 PolarHBondContact O-N 3.23Å; S43-N47 PolarHBondContact O-ND2 3.16Å |
| 44 | R | 72.8 | Confident | 63.5 | Low | 155 Ų | 155 | 113.5 Ų | 113.5 | 59% | 0.585 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -74.1 | -41.5 | 178.7 | -170.7 | 166.2 | -179.6 | 170.1 | -1.9 | 111.2 | D40 I41 S42 N47 F48 | D40-R44 WeakPolarHBondContact O-CB 3.33Å; D40-R44 PolarHBondContact O-N 2.85Å; I41-R44 PolarHBondContact O-N 2.9Å; S42-R44 PolarHBondContact O-N 2.73Å; R44-N47 PolarHBondContact O-N 2.78Å; R44-F48 HydrophobicContact CG-CD2 4Å; R44-F48 HydrophobicContact CG-CE2 3.7Å; R44-F48 WeakPolarHBondContact O-CD2 2.92Å; R44-F48 PolarHBondContact O-N 3.08Å |
| 45 | I | 73.1 | Confident | 63.7 | Low | 111 Ų | 111 | 115.9 Ų | 115.9 | 57% | 0.569 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -63.5 | -46.4 | 174.9 | -66.5 | 167.1 | 0 | 0 | 0 | 110.6 | I41 S42 N47 F48 A49 | I41-I45 HydrophobicContact CG2-CD1 3.88Å; I41-I45 HydrophobicContact CG2-CG1 4.42Å; I41-I45 VanDerWaalsContact O-CG1 3.31Å; I41-I45 WeakPolarHBondContact O-CG1 3.42Å; I41-I45 PolarHBondContact O-N 3.34Å; S42-I45 PolarHBondContact O-N 3.11Å; I45-N47 VanDerWaalsContact C-N 3.34Å; I45-N47 PolarHBondContact O-N 3.47Å; I45-F48 WeakPolarHBondContact O-CB 3.47Å; I45-F48 PolarHBondContact O-N 3.41Å; I45-F48 VanDerWaalsContact O-N 3.14Å; I45-A49 PolarHBondContact O-N 3.07Å |
| 46 | E | 72 | Confident | 63.8 | Low | 124 Ų | 124 | 111.7 Ų | 111.7 | 58% | 0.579 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -64.1 | -37.7 | 177.2 | -72.3 | -179.5 | -171.5 | 0 | 0 | 112.4 | S42 A49 S50 | S42-E46 PolarHBondContact O-N 3.35Å; E46-A49 PolarHBondContact O-N 3.2Å; E46-S50 WeakPolarHBondContact O-CB 3.09Å; E46-S50 PolarHBondContact O-N 3.49Å; E46-S50 PolarHBondContact O-OG 3.05Å |
| 47 | N | 70.7 | Confident | 63.8 | Low | 81 Ų | 81 | 110.8 Ų | 110.8 | 43% | 0.433 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.2 | -40.3 | 171.6 | -97.4 | -67.5 | 0 | 0 | 0 | 112.3 | S43 R44 I45 S50 R51 | S43-N47 VanDerWaalsContact O-CB 3.3Å; S43-N47 WeakPolarHBondContact O-CB 3.13Å; S43-N47 PolarHBondContact O-N 3.23Å; S43-N47 PolarHBondContact O-ND2 3.16Å; R44-N47 PolarHBondContact O-N 2.78Å; I45-N47 VanDerWaalsContact C-N 3.34Å; I45-N47 PolarHBondContact O-N 3.47Å; N47-S50 PolarHBondContact O-N 3.19Å; N47-R51 WeakPolarHBondContact O-CB 3.29Å; N47-R51 VanDerWaalsContact O-CG 3.31Å; N47-R51 WeakPolarHBondContact O-CG 3.31Å; N47-R51 PolarHBondContact O-N 3.21Å |
| 48 | F | 65.5 | Low | 64 | Low | 122 Ų | 122 | 111.3 Ų | 111.3 | 54% | 0.535 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64 | -42.9 | 175.6 | -85.6 | -66.7 | 0 | 0 | 0 | 111.7 | R44 I45 N52 | R44-F48 HydrophobicContact CG-CD2 4Å; R44-F48 HydrophobicContact CG-CE2 3.7Å; R44-F48 WeakPolarHBondContact O-CD2 2.92Å; R44-F48 PolarHBondContact O-N 3.08Å; I45-F48 WeakPolarHBondContact O-CB 3.47Å; I45-F48 PolarHBondContact O-N 3.41Å; I45-F48 VanDerWaalsContact O-N 3.14Å; F48-N52 WeakPolarHBondContact O-CB 3.4Å; F48-N52 PolarHBondContact O-N 3.11Å |
| 49 | A | 63.6 | Low | 63.8 | Low | 64 Ų | 64 | 111 Ų | 111 | 53% | 0.529 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.7 | -42.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | I45 E46 N52 G53 | I45-A49 PolarHBondContact O-N 3.07Å; E46-A49 PolarHBondContact O-N 3.2Å; A49-N52 PolarHBondContact O-N 2.93Å; A49-G53 WeakPolarHBondContact O-CA 3.06Å; A49-G53 PolarHBondContact O-N 3.28Å |
| 50 | S | 64.6 | Low | 63.4 | Low | 90 Ų | 90 | 109.2 Ų | 109.2 | 63% | 0.629 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -69.2 | -39.9 | -179.5 | -62.2 | 0 | 0 | 0 | 0 | 113.1 | E46 N47 N52 | E46-S50 WeakPolarHBondContact O-CB 3.09Å; E46-S50 PolarHBondContact O-N 3.49Å; E46-S50 PolarHBondContact O-OG 3.05Å; N47-S50 PolarHBondContact O-N 3.19Å; S50-N52 VanDerWaalsContact C-N 3.34Å |
| 51 | R | 62 | Low | 62.6 | Low | 195 Ų | 195 | 112.4 Ų | 112.4 | 74% | 0.736 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -70.9 | -29.4 | 178.6 | -72.6 | 178.1 | -177.1 | -177 | 0.8 | 112.7 | N47 | N47-R51 WeakPolarHBondContact O-CB 3.29Å; N47-R51 VanDerWaalsContact O-CG 3.31Å; N47-R51 WeakPolarHBondContact O-CG 3.31Å; N47-R51 PolarHBondContact O-N 3.21Å |
| 52 | N | 56.1 | Low | 61.5 | Low | 110 Ų | 110 | 110 Ų | 110 | 59% | 0.588 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -100.9 | -11.8 | -178.6 | -69.4 | -24.2 | 0 | 0 | 0 | 114.2 | F48 A49 S50 K54 N55 | F48-N52 WeakPolarHBondContact O-CB 3.4Å; F48-N52 PolarHBondContact O-N 3.11Å; A49-N52 PolarHBondContact O-N 2.93Å; S50-N52 VanDerWaalsContact C-N 3.34Å; N52-K54 VanDerWaalsContact C-N 3.34Å; N52-K54 PolarHBondContact O-N 3.01Å; N52-N55 PolarHBondContact O-N 2.91Å |
| 53 | G | 53.9 | Low | 60.3 | Low | 53 Ų | 53 | 113.1 Ų | 113.1 | 55% | 0.546 | 62% | 0.621 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69 | -19.2 | -170.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | A49 | A49-G53 WeakPolarHBondContact O-CA 3.06Å; A49-G53 PolarHBondContact O-N 3.28Å |
| 54 | K | 60.9 | Low | 59.5 | Low | 197 Ų | 197 | 116.2 Ų | 116.2 | 86% | 0.857 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | -11.6 | -179.7 | -62.4 | -171.7 | -176.7 | -178.4 | 0 | 114.6 | N52 | N52-K54 VanDerWaalsContact C-N 3.34Å; N52-K54 PolarHBondContact O-N 3.01Å |
| 55 | N | 54.6 | Low | 58.5 | Low | 141 Ų | 141 | 115.9 Ų | 115.9 | 75% | 0.754 | 64% | 0.637 | S | S | * | * | trans | -121.3 | 32 | 175.8 | -61.3 | -56.9 | 0 | 0 | 0 | 110.6 | N52 P57 | N52-N55 PolarHBondContact O-N 2.91Å; N55-P57 WeakPolarHBondContact O-CD 3.39Å | ||
| 56 | A | 54.2 | Low | 57.5 | Low | 74 Ų | 74 | 118.2 Ų | 118.2 | 61% | 0.612 | 65% | 0.648 | S | S | * | * | trans | -71.5 | 104.4 | 160.9 | 0 | 0 | 0 | 0 | 0 | 105.8 | D58 | A56-D58 PolarHBondContact O-N 2.77Š| ||
| 57 | P | 53.6 | Low | 56.7 | Low | 79 Ų | 79 | 120.4 Ų | 120.4 | 51% | 0.513 | 66% | 0.658 | S | S | . | * | trans | -58 | 129.4 | 170.8 | 25.8 | -34.4 | 0 | 0 | 0 | 107.5 | N55 Y59 | N55-P57 WeakPolarHBondContact O-CD 3.39Å; P57-Y59 HydrophobicContact CB-CD2 3.5Å; P57-Y59 HydrophobicContact CB-CE1 4.45Å; P57-Y59 HydrophobicContact CB-CE2 3.23Å; P57-Y59 HydrophobicContact CB-CG 4.23Å; P57-Y59 HydrophobicContact CG-CD2 3.34Å; P57-Y59 HydrophobicContact CG-CE2 3.14Å; P57-Y59 HydrophobicContact CG-CG 4.44Å; P57-Y59 PolarHBondContact O-N 2.83Å | ||
| 58 | D | 58.2 | Low | 56.2 | Low | 130 Ų | 130 | 122.9 Ų | 122.9 | 70% | 0.695 | 67% | 0.667 | S | S | * | * | trans | -68.9 | 65.7 | 176.3 | -170.2 | 2.2 | 0 | 0 | 0 | 110 | A56 | A56-D58 PolarHBondContact O-N 2.77Š| ||
| 59 | Y | 52.6 | Low | 56.2 | Low | 200 Ų | 200 | 118.2 Ų | 118.2 | 78% | 0.784 | 65% | 0.651 | S | S | * | * | trans | -85.4 | 6.2 | 169.4 | -64.4 | -54.6 | 0 | 0 | 0 | 111.1 | P57 | P57-Y59 HydrophobicContact CB-CD2 3.5Å; P57-Y59 HydrophobicContact CB-CE1 4.45Å; P57-Y59 HydrophobicContact CB-CE2 3.23Å; P57-Y59 HydrophobicContact CB-CG 4.23Å; P57-Y59 HydrophobicContact CG-CD2 3.34Å; P57-Y59 HydrophobicContact CG-CE2 3.14Å; P57-Y59 HydrophobicContact CG-CG 4.44Å; P57-Y59 PolarHBondContact O-N 2.83Å | ||
| 60 | A | 54.4 | Low | 56.6 | Low | 77 Ų | 77 | 117.8 Ų | 117.8 | 64% | 0.636 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -78.9 | -23.8 | -172.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||
| 61 | N | 55.9 | Low | 57 | Low | 141 Ų | 141 | 117.4 Ų | 117.4 | 75% | 0.754 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -140.2 | 18.8 | -173.6 | -62.2 | -69.6 | 0 | 0 | 0 | 115.5 | ||
| 62 | G | 48.2 | Very low | 57.7 | Low | 48 Ų | 48 | 108.3 Ų | 108.3 | 50% | 0.495 | 59% | 0.591 | S | S | . | * | S | Bend | trans | -75 | 131.5 | 165.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | I64 | G62-I64 VanDerWaalsContact C-N 3.35Å; G62-I64 PolarHBondContact O-N 3.12Å |
| 63 | P | 49.4 | Very low | 58.3 | Low | 125 Ų | 125 | 108.3 Ų | 108.3 | 81% | 0.812 | 60% | 0.598 | S | S | * | * | trans | -57.7 | 106.4 | 162.9 | 23.5 | -28.9 | 0 | 0 | 0 | 106.4 | E65 | P63-E65 PolarHBondContact O-N 2.84Š| ||
| 64 | I | 53.3 | Low | 58.9 | Low | 124 Ų | 124 | 110.5 Ų | 110.5 | 64% | 0.636 | 59% | 0.594 | S | S | * | * | trans | -53.2 | 108.2 | 171.3 | -57.8 | 171.4 | 0 | 0 | 0 | 104.1 | G62 M66 | G62-I64 VanDerWaalsContact C-N 3.35Å; G62-I64 PolarHBondContact O-N 3.12Å; I64-M66 WeakPolarHBondContact O-CA 3.27Å; I64-M66 PolarHBondContact O-N 3.28Å | ||
| 65 | E | 51 | Low | 59.7 | Low | 147 Ų | 147 | 104 Ų | 104 | 69% | 0.687 | 57% | 0.572 | S | S | * | * | trans | -45.9 | 106.7 | -178.6 | -80.2 | -171.6 | 130.3 | 0 | 0 | 108.2 | P63 Q67 Q68 | P63-E65 PolarHBondContact O-N 2.84Å; E65-Q67 PolarHBondContact O-N 2.8Å; E65-Q68 PolarHBondContact O-N 3.1Å | ||
| 66 | M | 53.1 | Low | 60.4 | Low | 161 Ų | 161 | 103 Ų | 103 | 79% | 0.793 | 57% | 0.567 | S | S | * | * | G | 310 helix | trans | -64.3 | -12.7 | -163.2 | -160.2 | 174.7 | 168.5 | 0 | 0 | 111.6 | I64 Q68 A69 | I64-M66 WeakPolarHBondContact O-CA 3.27Å; I64-M66 PolarHBondContact O-N 3.28Å; M66-Q68 VanDerWaalsContact C-N 3.31Å; M66-Q68 PolarHBondContact O-N 3.44Å; M66-A69 PolarHBondContact O-N 2.7Å |
| 67 | Q | 55.6 | Low | 61.2 | Low | 169 Ų | 169 | 100.6 Ų | 100.6 | 79% | 0.79 | 55% | 0.547 | S | S | * | . | G | 310 helix | trans | -68.3 | -21.8 | 174 | -86.1 | 153 | -46.7 | 0 | 0 | 114.4 | E65 K81 | E65-Q67 PolarHBondContact O-N 2.8Å; Q67-K81 PolarHBondContact O-NZ 2.94Å |
| 68 | Q | 58.7 | Low | 62 | Low | 133 Ų | 133 | 100.3 Ų | 100.3 | 62% | 0.621 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -108.6 | 20 | 175.2 | -71.5 | -171.4 | 3.1 | 0 | 0 | 113.7 | E65 M66 K81 | E65-Q68 PolarHBondContact O-N 3.1Å; M66-Q68 VanDerWaalsContact C-N 3.31Å; M66-Q68 PolarHBondContact O-N 3.44Å; Q68-K81 HydrophobicContact CB-CD 4.38Å; Q68-K81 WeakPolarHBondContact O-CB 3.17Å; Q68-K81 WeakPolarHBondContact O-CG 3.34Å; Q68-K81 PolarHBondContact O-N 3.18Å |
| 69 | A | 66.2 | Low | 62.8 | Low | 24 Ų | 24 | 97.1 Ų | 97.1 | 20% | 0.198 | 53% | 0.526 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.3 | 137.3 | 168.1 | 0 | 0 | 0 | 0 | 0 | 111 | M66 F79 | M66-A69 PolarHBondContact O-N 2.7Å; A69-F79 CarbonylContact C-O 3.46Å; A69-F79 VanDerWaalsContact CA-O 3.26Å; A69-F79 WeakPolarHBondContact CA-O 3.35Å |
| 70 | F | 71.7 | Confident | 63.7 | Low | 55 Ų | 55 | 89.6 Ų | 89.6 | 24% | 0.241 | 51% | 0.505 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.1 | 120.9 | 160 | 179.3 | -96.6 | 0 | 0 | 0 | 107.9 | C72 F79 K81 Q86 | F70-C72 HydrophobicContact CE1-CB 4.37Å; F70-F79 PolarHBondContact N-O 2.79Å; F70-F79 PolarHBondContact O-N 3.43Å; F70-K81 HydrophobicContact CB-CG 4.34Å; F70-Q86 HydrophobicContact CD1-CG 4.11Å; F70-Q86 HydrophobicContact CD2-CG 4.31Å; F70-Q86 HydrophobicContact CE1-CG 4.03Å; F70-Q86 HydrophobicContact CE2-CG 4.24Å; F70-Q86 HydrophobicContact CG-CG 4.25Å; F70-Q86 HydrophobicContact CZ-CG 4.09Å |
| 71 | H | 73.5 | Confident | 64.4 | Low | 82 Ų | 82 | 92.1 Ų | 92.1 | 38% | 0.38 | 50% | 0.502 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.1 | 120.2 | 175.1 | -171.9 | -93.4 | 0 | 0 | 0 | 109.3 | P73 N76 C78 | H71-P73 WeakPolarHBondContact O-CD 3.26Å; H71-N76 PolarHBondContact CE1-OD1 2.74Å; H71-N76 VanDerWaalsContact NE2-CG 3.31Å; H71-N76 PolarHBondContact NE2-OD1 3.4Å; H71-N76 VanDerWaalsContact NE2-OD1 3.07Å; H71-C78 VanDerWaalsContact CD2-SG 3.53Å |
| 72 | C | 75.8 | Confident | 65.1 | Low | 4 Ų | 4 | 90 Ų | 90 | 3% | 0.027 | 49% | 0.491 | C | S | . | . | P | Polyproline II helix | trans | -78.5 | 118.9 | 172.2 | 178.9 | 0 | 0 | 0 | 0 | 110.1 | F70 Q74 C75 N76 A77 H89 H93 | F70-C72 HydrophobicContact CE1-CB 4.37Å; C72-Q74 PolarHBondContact O-N 3.04Å; C72-Q74 PolarHBondContact SG-N 3.07Å; C72-Q74 VanDerWaalsContact SG-N 3.41Å; C72-C75 VanDerWaalsContact SG-SG 3.67Å; C72-N76 VanDerWaalsContact O-CA 3.23Å; C72-N76 WeakPolarHBondContact O-CA 3.11Å; C72-N76 PolarHBondContact O-N 3.05Å; C72-A77 PolarHBondContact N-O 2.98Å; C72-H89 WeakPolarHBondContact CB-NE2 3.43Å; C72-H89 PolarHBondContact SG-NE2 3.31Å; C72-H93 PolarHBondContact SG-NE2 3.48Å |
| 73 | P | 70.1 | Confident | 66 | Low | 111 Ų | 111 | 93 Ų | 93 | 72% | 0.721 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.4 | -17.2 | 179 | 28 | -34.8 | 0 | 0 | 0 | 113.9 | H71 | H71-P73 WeakPolarHBondContact O-CD 3.26Š|
| 74 | Q | 66 | Low | 67 | Low | 98 Ų | 98 | 89 Ų | 89 | 46% | 0.458 | 48% | 0.483 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.2 | -32.3 | -175.8 | -70.7 | 174.8 | -60.4 | 0 | 0 | 114 | C72 H93 | C72-Q74 PolarHBondContact O-N 3.04Å; C72-Q74 PolarHBondContact SG-N 3.07Å; C72-Q74 VanDerWaalsContact SG-N 3.41Å; Q74-H93 VanDerWaalsContact CB-CE1 3.47Å; Q74-H93 WeakPolarHBondContact CB-CE1 3.11Å; Q74-H93 VanDerWaalsContact OE1-CB 3.3Å; Q74-H93 PolarHBondContact OE1-CD2 3.24Å |
| 75 | C | 78.2 | Confident | 67.9 | Low | 61 Ų | 61 | 86.5 Ų | 86.5 | 41% | 0.412 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -124.1 | 7 | 177.8 | 62.7 | 0 | 0 | 0 | 0 | 113.6 | C72 A77 H89 | C72-C75 VanDerWaalsContact SG-SG 3.67Å; C75-A77 PolarHBondContact O-N 3.06Å; C75-A77 WeakPolarHBondContact SG-CB 3.15Å; C75-H89 PolarHBondContact SG-CE1 2.94Å |
| 76 | N | 68.1 | Low | 69 | Low | 120 Ų | 120 | 83 Ų | 83 | 64% | 0.642 | 45% | 0.454 | S | S | * | . | trans | 54.9 | 28.6 | -179.9 | -146.8 | 72.8 | 0 | 0 | 0 | 113.4 | H71 C72 | H71-N76 PolarHBondContact CE1-OD1 2.74Å; H71-N76 VanDerWaalsContact NE2-CG 3.31Å; H71-N76 PolarHBondContact NE2-OD1 3.4Å; H71-N76 VanDerWaalsContact NE2-OD1 3.07Å; C72-N76 VanDerWaalsContact O-CA 3.23Å; C72-N76 WeakPolarHBondContact O-CA 3.11Å; C72-N76 PolarHBondContact O-N 3.05Å | ||
| 77 | A | 72.5 | Confident | 70 | Confident | 24 Ų | 24 | 79.6 Ų | 79.6 | 20% | 0.198 | 44% | 0.442 | C | S | . | . | trans | -92.4 | 128.9 | -177.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | C72 C75 F79 | C72-A77 PolarHBondContact N-O 2.98Å; C75-A77 PolarHBondContact O-N 3.06Å; C75-A77 WeakPolarHBondContact SG-CB 3.15Å; A77-F79 HydrophobicContact CB-CD2 4.35Å; A77-F79 HydrophobicContact CB-CE2 3.33Å; A77-F79 HydrophobicContact CB-CZ 3.48Å; A77-F79 VanDerWaalsContact CB-CZ 3.48Å | ||
| 78 | C | 69.7 | Low | 70.9 | Confident | 73 Ų | 73 | 80.6 Ų | 80.6 | 49% | 0.493 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.2 | 123.7 | 177.8 | -59 | 0 | 0 | 0 | 0 | 109.8 | H71 | H71-C78 VanDerWaalsContact CD2-SG 3.53Å |
| 79 | F | 74.9 | Confident | 71.9 | Confident | 62 Ų | 62 | 74.9 Ų | 74.9 | 27% | 0.272 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.4 | 149.7 | 171.1 | -50.7 | -84.5 | 0 | 0 | 0 | 109.6 | A69 F70 A77 L85 H89 | A69-F79 CarbonylContact C-O 3.46Å; A69-F79 VanDerWaalsContact CA-O 3.26Å; A69-F79 WeakPolarHBondContact CA-O 3.35Å; F70-F79 PolarHBondContact N-O 2.79Å; F70-F79 PolarHBondContact O-N 3.43Å; A77-F79 HydrophobicContact CB-CD2 4.35Å; A77-F79 HydrophobicContact CB-CE2 3.33Å; A77-F79 HydrophobicContact CB-CZ 3.48Å; A77-F79 VanDerWaalsContact CB-CZ 3.48Å; F79-L85 HydrophobicContact CB-CD2 4.29Å; F79-L85 HydrophobicContact CD1-CD2 4.02Å; F79-L85 HydrophobicContact CG-CD2 4.39Å; F79-H89 HydrophobicContact CE2-CB 4.5Å; F79-H89 AromaticContact CE2-CE1 3.41Å; F79-H89 VanDerWaalsContact CE2-CE1 3.41Å; F79-H89 WeakPolarHBondContact CE2-CE1 3.44Å; F79-H89 AromaticContact CE2-CG 3.72Å; F79-H89 AromaticContact CE2-ND1 3.11Å; F79-H89 WeakPolarHBondContact CE2-ND1 3.43Å; F79-H89 AromaticContact CZ-CE1 3.86Å; F79-H89 AromaticContact CZ-ND1 3.44Å; F79-H89 WeakPolarHBondContact CZ-ND1 3.49Å |
| 80 | A | 71.9 | Confident | 72.1 | Confident | 42 Ų | 42 | 78.9 Ų | 78.9 | 35% | 0.347 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -55.1 | 144.4 | 168.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | L82 | A80-L82 HydrophobicContact CB-CG 4.4Å; A80-L82 PolarHBondContact O-N 3.42Å |
| 81 | K | 68.4 | Low | 72.3 | Confident | 131 Ų | 131 | 85.7 Ų | 85.7 | 57% | 0.57 | 45% | 0.449 | S | S | * | . | trans | -65.8 | 65.1 | 173.1 | -77.5 | 169.7 | -174.4 | 167.6 | 0 | 111.1 | Q67 Q68 F70 | Q67-K81 PolarHBondContact O-NZ 2.94Å; Q68-K81 HydrophobicContact CB-CD 4.38Å; Q68-K81 WeakPolarHBondContact O-CB 3.17Å; Q68-K81 WeakPolarHBondContact O-CG 3.34Å; Q68-K81 PolarHBondContact O-N 3.18Å; F70-K81 HydrophobicContact CB-CG 4.34Å | ||
| 82 | L | 71.6 | Confident | 72.1 | Confident | 97 Ų | 97 | 89.4 Ų | 89.4 | 51% | 0.508 | 46% | 0.464 | S | S | . | . | trans | -95.6 | 127.6 | 167.7 | -70.2 | 177.1 | 0 | 0 | 0 | 108 | A80 G84 L85 Q86 | A80-L82 HydrophobicContact CB-CG 4.4Å; A80-L82 PolarHBondContact O-N 3.42Å; L82-G84 PolarHBondContact O-N 2.94Å; L82-L85 HydrophobicContact CB-CB 4.27Å; L82-L85 HydrophobicContact CB-CD1 3.52Å; L82-L85 HydrophobicContact CD1-CD1 3.35Å; L82-L85 HydrophobicContact CG-CD1 3.98Å; L82-L85 PolarHBondContact O-N 3.37Å; L82-Q86 PolarHBondContact O-N 2.97Å | ||
| 83 | P | 66.5 | Low | 72 | Confident | 110 Ų | 110 | 90.6 Ų | 90.6 | 71% | 0.714 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -58.2 | -28.7 | -173.8 | 20.6 | -31.9 | 0 | 0 | 0 | 112.9 | V87 | P83-V87 WeakPolarHBondContact O-CG2 3.11Å |
| 84 | G | 69.7 | Low | 71.6 | Confident | 42 Ų | 42 | 89.6 Ų | 89.6 | 43% | 0.433 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -78.1 | -30.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | L82 R88 | L82-G84 PolarHBondContact O-N 2.94Å; G84-R88 WeakPolarHBondContact O-CB 3.41Å; G84-R88 WeakPolarHBondContact O-CG 3.43Å; G84-R88 PolarHBondContact O-N 3.5Å; G84-R88 VanDerWaalsContact O-N 3.13Å |
| 85 | L | 73.4 | Confident | 71.1 | Confident | 71 Ų | 71 | 91.2 Ų | 91.2 | 37% | 0.372 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -73.5 | -42 | -176.9 | -92.3 | 120.2 | 0 | 0 | 0 | 111.5 | F79 L82 V87 R88 H89 | F79-L85 HydrophobicContact CB-CD2 4.29Å; F79-L85 HydrophobicContact CD1-CD2 4.02Å; F79-L85 HydrophobicContact CG-CD2 4.39Å; L82-L85 HydrophobicContact CB-CB 4.27Å; L82-L85 HydrophobicContact CB-CD1 3.52Å; L82-L85 HydrophobicContact CD1-CD1 3.35Å; L82-L85 HydrophobicContact CG-CD1 3.98Å; L82-L85 PolarHBondContact O-N 3.37Å; L85-V87 VanDerWaalsContact C-N 3.33Å; L85-V87 PolarHBondContact O-N 3.08Å; L85-R88 PolarHBondContact O-N 3.16Å; L85-H89 WeakPolarHBondContact O-CB 3.37Å; L85-H89 PolarHBondContact O-N 3.34Å |
| 86 | Q | 73.8 | Confident | 69.8 | Low | 74 Ų | 74 | 92.3 Ų | 92.3 | 35% | 0.346 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.4 | -43.8 | 177.8 | -167.9 | -175.4 | 10.9 | 0 | 0 | 111.6 | F70 L82 H89 K90 | F70-Q86 HydrophobicContact CD1-CG 4.11Å; F70-Q86 HydrophobicContact CD2-CG 4.31Å; F70-Q86 HydrophobicContact CE1-CG 4.03Å; F70-Q86 HydrophobicContact CE2-CG 4.24Å; F70-Q86 HydrophobicContact CG-CG 4.25Å; F70-Q86 HydrophobicContact CZ-CG 4.09Å; L82-Q86 PolarHBondContact O-N 2.97Å; Q86-H89 PolarHBondContact O-N 3.43Å; Q86-K90 WeakPolarHBondContact O-CG 3.29Å; Q86-K90 PolarHBondContact O-N 3.14Å |
| 87 | V | 74.2 | Confident | 69 | Low | 88 Ų | 88 | 91.6 Ų | 91.6 | 53% | 0.533 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65.8 | -45.8 | 179 | 177.5 | 0 | 0 | 0 | 0 | 111.3 | P83 L85 H89 K90 R91 | P83-V87 WeakPolarHBondContact O-CG2 3.11Å; L85-V87 VanDerWaalsContact C-N 3.33Å; L85-V87 PolarHBondContact O-N 3.08Å; V87-H89 VanDerWaalsContact C-N 3.27Å; V87-H89 PolarHBondContact O-N 2.9Å; V87-K90 PolarHBondContact O-N 3.25Å; V87-R91 PolarHBondContact O-N 3.13Å |
| 88 | R | 75.1 | Confident | 67.7 | Low | 191 Ų | 191 | 95.5 Ų | 95.5 | 72% | 0.721 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -64.3 | -34.7 | 175.6 | -73.8 | -177 | 179.6 | -164.9 | 1.8 | 112.1 | G84 L85 R91 | G84-R88 WeakPolarHBondContact O-CB 3.41Å; G84-R88 WeakPolarHBondContact O-CG 3.43Å; G84-R88 PolarHBondContact O-N 3.5Å; G84-R88 VanDerWaalsContact O-N 3.13Å; L85-R88 PolarHBondContact O-N 3.16Å; R88-R91 WeakPolarHBondContact O-CB 3.23Å; R88-R91 PolarHBondContact O-N 3.49Å |
| 89 | H | 78.9 | Confident | 66.8 | Low | 12 Ų | 12 | 95.9 Ų | 95.9 | 6% | 0.056 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -69.1 | -44.7 | 179 | -178.9 | 75.9 | 0 | 0 | 0 | 112 | C72 C75 F79 L85 Q86 V87 R91 K92 H93 | C72-H89 WeakPolarHBondContact CB-NE2 3.43Å; C72-H89 PolarHBondContact SG-NE2 3.31Å; C75-H89 PolarHBondContact SG-CE1 2.94Å; F79-H89 HydrophobicContact CE2-CB 4.5Å; F79-H89 AromaticContact CE2-CE1 3.41Å; F79-H89 VanDerWaalsContact CE2-CE1 3.41Å; F79-H89 WeakPolarHBondContact CE2-CE1 3.44Å; F79-H89 AromaticContact CE2-CG 3.72Å; F79-H89 AromaticContact CE2-ND1 3.11Å; F79-H89 WeakPolarHBondContact CE2-ND1 3.43Å; F79-H89 AromaticContact CZ-CE1 3.86Å; F79-H89 AromaticContact CZ-ND1 3.44Å; F79-H89 WeakPolarHBondContact CZ-ND1 3.49Å; L85-H89 WeakPolarHBondContact O-CB 3.37Å; L85-H89 PolarHBondContact O-N 3.34Å; Q86-H89 PolarHBondContact O-N 3.43Å; V87-H89 VanDerWaalsContact C-N 3.27Å; V87-H89 PolarHBondContact O-N 2.9Å; H89-R91 PolarHBondContact O-N 2.87Å; H89-R91 VanDerWaalsContact O-N 3.15Å; H89-K92 VanDerWaalsContact O-CB 3.29Å; H89-K92 WeakPolarHBondContact O-CB 3.49Å; H89-K92 PolarHBondContact O-N 3.22Å; H89-H93 AromaticContact CD2-NE2 3.99Å; H89-H93 AromaticContact CE1-NE2 3.67Å; H89-H93 AromaticContact NE2-CD2 3.57Å; H89-H93 AromaticContact NE2-NE2 3.08Å; H89-H93 PolarHBondContact NE2-NE2 3.49Å |
| 90 | K | 70.1 | Confident | 65.5 | Low | 109 Ų | 109 | 94.1 Ų | 94.1 | 47% | 0.474 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -57.7 | -29.6 | 176.8 | -75.4 | -170.5 | 175.7 | -161.9 | 0 | 113.1 | Q86 V87 K92 H93 | Q86-K90 WeakPolarHBondContact O-CG 3.29Å; Q86-K90 PolarHBondContact O-N 3.14Å; V87-K90 PolarHBondContact O-N 3.25Å; K90-K92 PolarHBondContact O-N 3.15Å; K90-H93 PolarHBondContact O-N 3.12Å; K90-H93 VanDerWaalsContact O-N 3.14Å |
| 91 | R | 75.3 | Confident | 64.3 | Low | 198 Ų | 198 | 96.9 Ų | 96.9 | 75% | 0.747 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -19.1 | 173.3 | -66.6 | -179.2 | 175.4 | -178.9 | -2.1 | 114 | V87 R88 H89 H93 | V87-R91 PolarHBondContact O-N 3.13Å; R88-R91 WeakPolarHBondContact O-CB 3.23Å; R88-R91 PolarHBondContact O-N 3.49Å; H89-R91 PolarHBondContact O-N 2.87Å; H89-R91 VanDerWaalsContact O-N 3.15Å; R91-H93 VanDerWaalsContact C-N 3.33Å |
| 92 | K | 70.6 | Confident | 63.5 | Low | 160 Ų | 160 | 93.6 Ų | 93.6 | 70% | 0.696 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.6 | -13.5 | 176.4 | -62 | -169.6 | 173.5 | -169.7 | 0 | 113.1 | H89 K90 P94 | H89-K92 VanDerWaalsContact O-CB 3.29Å; H89-K92 WeakPolarHBondContact O-CB 3.49Å; H89-K92 PolarHBondContact O-N 3.22Å; K90-K92 PolarHBondContact O-N 3.15Å; K92-P94 WeakPolarHBondContact O-CD 3.47Å |
| 93 | H | 72.6 | Confident | 62.9 | Low | 28 Ų | 28 | 93.2 Ų | 93.2 | 13% | 0.13 | 48% | 0.483 | C | S | . | . | trans | -104.3 | 89.6 | 177.9 | -66.3 | -63.1 | 0 | 0 | 0 | 110.1 | C72 Q74 H89 K90 R91 N95 D96 Y97 | C72-H93 PolarHBondContact SG-NE2 3.48Å; Q74-H93 VanDerWaalsContact CB-CE1 3.47Å; Q74-H93 WeakPolarHBondContact CB-CE1 3.11Å; Q74-H93 VanDerWaalsContact OE1-CB 3.3Å; Q74-H93 PolarHBondContact OE1-CD2 3.24Å; H89-H93 AromaticContact CD2-NE2 3.99Å; H89-H93 AromaticContact CE1-NE2 3.67Å; H89-H93 AromaticContact NE2-CD2 3.57Å; H89-H93 AromaticContact NE2-NE2 3.08Å; H89-H93 PolarHBondContact NE2-NE2 3.49Å; K90-H93 PolarHBondContact O-N 3.12Å; K90-H93 VanDerWaalsContact O-N 3.14Å; R91-H93 VanDerWaalsContact C-N 3.33Å; H93-N95 PolarHBondContact O-N 3.48Å; H93-N95 VanDerWaalsContact O-N 3.16Å; H93-D96 PolarHBondContact O-N 3.46Å; H93-Y97 PolarHBondContact O-N 3.41Å | ||
| 94 | P | 61.4 | Low | 62.5 | Low | 90 Ų | 90 | 89.9 Ų | 89.9 | 58% | 0.584 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | -23.4 | -179.3 | 24.4 | -34.1 | 0 | 0 | 0 | 113.1 | K92 D96 Y97 | K92-P94 WeakPolarHBondContact O-CD 3.47Å; P94-D96 PolarHBondContact O-N 3.16Å; P94-Y97 WeakPolarHBondContact O-CB 3.39Å; P94-Y97 PolarHBondContact O-N 3.42Å |
| 95 | N | 56 | Low | 62.6 | Low | 132 Ų | 132 | 91.1 Ų | 91.1 | 71% | 0.706 | 46% | 0.46 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.2 | -24.4 | 180 | -80.2 | 1 | 0 | 0 | 0 | 114 | H93 | H93-N95 PolarHBondContact O-N 3.48Å; H93-N95 VanDerWaalsContact O-N 3.16Å |
| 96 | D | 52.2 | Low | 62.6 | Low | 85 Ų | 85 | 93.5 Ų | 93.5 | 46% | 0.455 | 47% | 0.468 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.9 | -11.6 | 176.2 | -139.3 | 12.7 | 0 | 0 | 0 | 111.9 | H93 P94 L98 A99 | H93-D96 PolarHBondContact O-N 3.46Å; P94-D96 PolarHBondContact O-N 3.16Å; D96-L98 PolarHBondContact O-N 2.85Å; D96-A99 PolarHBondContact O-N 2.7Å |
| 97 | Y | 49.4 | Very low | 62.7 | Low | 104 Ų | 104 | 94.6 Ų | 94.6 | 41% | 0.408 | 48% | 0.475 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -17.7 | 169.4 | -176.8 | -111.9 | 0 | 0 | 0 | 112.4 | H93 P94 S100 Q101 Q104 | H93-Y97 PolarHBondContact O-N 3.41Å; P94-Y97 WeakPolarHBondContact O-CB 3.39Å; P94-Y97 PolarHBondContact O-N 3.42Å; Y97-S100 WeakPolarHBondContact CD2-OG 3.21Å; Y97-S100 WeakPolarHBondContact CE2-OG 3.36Å; Y97-S100 CarbonylContact O-C 3.34Å; Y97-S100 VanDerWaalsContact O-CA 3.3Å; Y97-S100 WeakPolarHBondContact O-CA 3.33Å; Y97-S100 WeakPolarHBondContact O-CB 3.3Å; Y97-S100 PolarHBondContact O-N 3.24Å; Y97-S100 PolarHBondContact O-OG 3.21Å; Y97-Q101 PolarHBondContact O-N 3.38Å; Y97-Q104 HydrophobicContact CE1-CG 3.82Å; Y97-Q104 VanDerWaalsContact CE1-OE1 3.29Å; Y97-Q104 HydrophobicContact CE2-CG 3.92Å; Y97-Q104 WeakPolarHBondContact OH-CG 3.48Å; Y97-Q104 PolarHBondContact OH-NE2 3Å |
| 98 | L | 45.7 | Very low | 63 | Low | 107 Ų | 107 | 94.3 Ų | 94.3 | 56% | 0.56 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.2 | -29.4 | 174.7 | -63.9 | -178.9 | 0 | 0 | 0 | 113.3 | D96 S100 Q101 | D96-L98 PolarHBondContact O-N 2.85Å; L98-S100 PolarHBondContact O-N 3.22Å; L98-Q101 HydrophobicContact CD2-CG 4.32Å; L98-Q101 VanDerWaalsContact O-CB 3.29Å; L98-Q101 WeakPolarHBondContact O-CB 2.99Å; L98-Q101 WeakPolarHBondContact O-CG 3.29Å; L98-Q101 PolarHBondContact O-N 3.04Å; L98-Q101 VanDerWaalsContact O-N 3.15Å |
| 99 | A | 50.5 | Low | 63.2 | Low | 80 Ų | 80 | 88 Ų | 88 | 66% | 0.661 | 46% | 0.455 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -23.7 | 167.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | D96 Q101 | D96-A99 PolarHBondContact O-N 2.7Å; A99-Q101 VanDerWaalsContact C-N 3.29Å; A99-Q101 PolarHBondContact O-N 3.34Å |
| 100 | S | 48.2 | Very low | 63.3 | Low | 25 Ų | 25 | 91.4 Ų | 91.4 | 18% | 0.175 | 47% | 0.474 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.4 | 9.9 | 172.3 | 94.1 | 0 | 0 | 0 | 0 | 113.7 | Y97 L98 S102 D103 Q104 | Y97-S100 WeakPolarHBondContact CD2-OG 3.21Å; Y97-S100 WeakPolarHBondContact CE2-OG 3.36Å; Y97-S100 CarbonylContact O-C 3.34Å; Y97-S100 VanDerWaalsContact O-CA 3.3Å; Y97-S100 WeakPolarHBondContact O-CA 3.33Å; Y97-S100 WeakPolarHBondContact O-CB 3.3Å; Y97-S100 PolarHBondContact O-N 3.24Å; Y97-S100 PolarHBondContact O-OG 3.21Å; L98-S100 PolarHBondContact O-N 3.22Å; S100-S102 PolarHBondContact O-N 3.09Å; S100-S102 VanDerWaalsContact O-N 3.12Å; S100-D103 CarbonylContact O-C 3.57Å; S100-D103 WeakPolarHBondContact O-CA 3.3Å; S100-D103 WeakPolarHBondContact O-CB 3.21Å; S100-D103 PolarHBondContact O-N 2.85Å; S100-Q104 PolarHBondContact O-N 3.4Å |
| 101 | Q | 47.1 | Very low | 63.8 | Low | 101 Ų | 101 | 90.5 Ų | 90.5 | 47% | 0.472 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -53.7 | -30.6 | 168.5 | -76.9 | -79.2 | -13.2 | 0 | 0 | 111.5 | Y97 L98 A99 Q104 S105 | Y97-Q101 PolarHBondContact O-N 3.38Å; L98-Q101 HydrophobicContact CD2-CG 4.32Å; L98-Q101 VanDerWaalsContact O-CB 3.29Å; L98-Q101 WeakPolarHBondContact O-CB 2.99Å; L98-Q101 WeakPolarHBondContact O-CG 3.29Å; L98-Q101 PolarHBondContact O-N 3.04Å; L98-Q101 VanDerWaalsContact O-N 3.15Å; A99-Q101 VanDerWaalsContact C-N 3.29Å; A99-Q101 PolarHBondContact O-N 3.34Å; Q101-Q104 VanDerWaalsContact CD-OE1 3.29Å; Q101-S105 WeakPolarHBondContact O-CB 3.33Å; Q101-S105 PolarHBondContact O-N 3.49Å |
| 102 | S | 51 | Low | 64.3 | Low | 62 Ų | 62 | 88.1 Ų | 88.1 | 43% | 0.434 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.1 | -39.4 | 171.7 | 75 | 0 | 0 | 0 | 0 | 112.5 | S100 K106 | S100-S102 PolarHBondContact O-N 3.09Å; S100-S102 VanDerWaalsContact O-N 3.12Å; S102-K106 WeakPolarHBondContact O-CB 3.37Å; S102-K106 WeakPolarHBondContact O-CG 3.44Å; S102-K106 PolarHBondContact O-N 3.12Å |
| 103 | D | 59.6 | Low | 64.8 | Low | 89 Ų | 89 | 88.1 Ų | 88.1 | 48% | 0.476 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -76.9 | -32.8 | 177 | -66.1 | -31 | 0 | 0 | 0 | 112 | S100 K106 L107 | S100-D103 CarbonylContact O-C 3.57Å; S100-D103 WeakPolarHBondContact O-CA 3.3Å; S100-D103 WeakPolarHBondContact O-CB 3.21Å; S100-D103 PolarHBondContact O-N 2.85Å; D103-K106 PolarHBondContact O-N 3.44Å; D103-K106 IonicContact OD1-NZ 3.44Å; D103-K106 PolarHBondContact OD1-NZ 2.76Å; D103-L107 WeakPolarHBondContact O-CB 3.47Å; D103-L107 PolarHBondContact O-N 3.14Å |
| 104 | Q | 58 | Low | 65.2 | Low | 39 Ų | 39 | 92.2 Ų | 92.2 | 18% | 0.182 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -64 | -46.2 | 168.1 | -68.8 | -167.3 | -83.1 | 0 | 0 | 111.2 | Y97 S100 Q101 K106 L107 I108 | Y97-Q104 HydrophobicContact CE1-CG 3.82Å; Y97-Q104 VanDerWaalsContact CE1-OE1 3.29Å; Y97-Q104 HydrophobicContact CE2-CG 3.92Å; Y97-Q104 WeakPolarHBondContact OH-CG 3.48Å; Y97-Q104 PolarHBondContact OH-NE2 3Å; S100-Q104 PolarHBondContact O-N 3.4Å; Q101-Q104 VanDerWaalsContact CD-OE1 3.29Å; Q104-K106 VanDerWaalsContact C-N 3.32Å; Q104-K106 PolarHBondContact O-N 3.31Å; Q104-L107 CarbonylContact O-C 3.6Å; Q104-L107 PolarHBondContact O-N 3.5Å; Q104-L107 VanDerWaalsContact O-N 3.14Å; Q104-I108 WeakPolarHBondContact O-CB 3.17Å; Q104-I108 WeakPolarHBondContact O-CG1 3.28Å; Q104-I108 PolarHBondContact O-N 3.46Å |
| 105 | S | 71.5 | Confident | 66.4 | Low | 69 Ų | 69 | 93.2 Ų | 93.2 | 48% | 0.483 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.3 | -42.6 | 177.2 | -178.7 | 0 | 0 | 0 | 0 | 110.9 | Q101 S109 | Q101-S105 WeakPolarHBondContact O-CB 3.33Å; Q101-S105 PolarHBondContact O-N 3.49Å; S105-S109 WeakPolarHBondContact O-CB 3.19Å; S105-S109 PolarHBondContact O-N 3Å; S105-S109 PolarHBondContact O-OG 2.83Å |
| 106 | K | 74 | Confident | 67.7 | Low | 120 Ų | 120 | 93.5 Ų | 93.5 | 52% | 0.522 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 171 | -71.8 | 167.5 | -167.7 | 164.3 | 0 | 112.1 | S102 D103 Q104 S109 N110 | S102-K106 WeakPolarHBondContact O-CB 3.37Å; S102-K106 WeakPolarHBondContact O-CG 3.44Å; S102-K106 PolarHBondContact O-N 3.12Å; D103-K106 PolarHBondContact O-N 3.44Å; D103-K106 IonicContact OD1-NZ 3.44Å; D103-K106 PolarHBondContact OD1-NZ 2.76Å; Q104-K106 VanDerWaalsContact C-N 3.32Å; Q104-K106 PolarHBondContact O-N 3.31Å; K106-S109 PolarHBondContact O-N 2.79Å; K106-N110 VanDerWaalsContact O-CB 3.3Å; K106-N110 WeakPolarHBondContact O-CB 3.35Å; K106-N110 PolarHBondContact O-N 3.34Å; K106-N110 PolarHBondContact O-ND2 2.78Å |
| 107 | L | 76.4 | Confident | 68.8 | Low | 97 Ų | 97 | 96.8 Ų | 96.8 | 51% | 0.508 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64 | -45.8 | 178.6 | -178.2 | 66.2 | 0 | 0 | 0 | 111.3 | D103 Q104 S109 N110 L111 | D103-L107 WeakPolarHBondContact O-CB 3.47Å; D103-L107 PolarHBondContact O-N 3.14Å; Q104-L107 CarbonylContact O-C 3.6Å; Q104-L107 PolarHBondContact O-N 3.5Å; Q104-L107 VanDerWaalsContact O-N 3.14Å; L107-S109 VanDerWaalsContact C-N 3.34Å; L107-N110 CarbonylContact O-C 3.45Å; L107-N110 PolarHBondContact O-N 3.12Å; L107-L111 HydrophobicContact CG-CD1 4.25Å; L107-L111 WeakPolarHBondContact O-CB 3.29Å; L107-L111 VanDerWaalsContact O-CG 3.28Å; L107-L111 WeakPolarHBondContact O-CG 3.22Å; L107-L111 PolarHBondContact O-N 3.27Å |
| 108 | I | 80.4 | Confident | 70.2 | Confident | 83 Ų | 83 | 100.1 Ų | 100.1 | 43% | 0.426 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.3 | -43.7 | 175.1 | -68.6 | 164.8 | 0 | 0 | 0 | 109.8 | Q104 N110 L111 K112 | Q104-I108 WeakPolarHBondContact O-CB 3.17Å; Q104-I108 WeakPolarHBondContact O-CG1 3.28Å; Q104-I108 PolarHBondContact O-N 3.46Å; I108-N110 VanDerWaalsContact C-N 3.32Å; I108-N110 PolarHBondContact O-N 2.76Å; I108-L111 PolarHBondContact O-N 2.74Å; I108-K112 HydrophobicContact CG2-CD 4.34Å; I108-K112 WeakPolarHBondContact O-CB 3.45Å; I108-K112 WeakPolarHBondContact O-CG 3.46Å; I108-K112 PolarHBondContact O-N 2.8Å |
| 109 | S | 78.7 | Confident | 71.7 | Confident | 59 Ų | 59 | 101.6 Ų | 101.6 | 41% | 0.413 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.3 | -40.7 | 176.1 | -62.4 | 0 | 0 | 0 | 0 | 111.7 | S105 K106 L107 R113 | S105-S109 WeakPolarHBondContact O-CB 3.19Å; S105-S109 PolarHBondContact O-N 3Å; S105-S109 PolarHBondContact O-OG 2.83Å; K106-S109 PolarHBondContact O-N 2.79Å; L107-S109 VanDerWaalsContact C-N 3.34Å; S109-R113 WeakPolarHBondContact O-CB 3.36Å; S109-R113 PolarHBondContact O-N 2.95Å |
| 110 | N | 80.7 | Confident | 72.7 | Confident | 83 Ų | 83 | 102.1 Ų | 102.1 | 44% | 0.444 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.8 | -41.9 | 174.6 | -75.4 | -23.4 | 0 | 0 | 0 | 111.5 | K106 L107 I108 R113 L114 | K106-N110 VanDerWaalsContact O-CB 3.3Å; K106-N110 WeakPolarHBondContact O-CB 3.35Å; K106-N110 PolarHBondContact O-N 3.34Å; K106-N110 PolarHBondContact O-ND2 2.78Å; L107-N110 CarbonylContact O-C 3.45Å; L107-N110 PolarHBondContact O-N 3.12Å; I108-N110 VanDerWaalsContact C-N 3.32Å; I108-N110 PolarHBondContact O-N 2.76Å; N110-R113 WeakPolarHBondContact O-CB 3.48Å; N110-R113 PolarHBondContact O-N 3.48Å; N110-L114 WeakPolarHBondContact O-CB 3.21Å; N110-L114 VanDerWaalsContact O-CG 3.29Å; N110-L114 WeakPolarHBondContact O-CG 3.2Å; N110-L114 PolarHBondContact O-N 2.78Å |
| 111 | L | 80.3 | Confident | 73.5 | Confident | 89 Ų | 89 | 106.4 Ų | 106.4 | 47% | 0.466 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63 | -45.3 | 175.7 | -74.5 | 170.4 | 0 | 0 | 0 | 111.4 | L107 I108 R113 L114 L115 | L107-L111 HydrophobicContact CG-CD1 4.25Å; L107-L111 WeakPolarHBondContact O-CB 3.29Å; L107-L111 VanDerWaalsContact O-CG 3.28Å; L107-L111 WeakPolarHBondContact O-CG 3.22Å; L107-L111 PolarHBondContact O-N 3.27Å; I108-L111 PolarHBondContact O-N 2.74Å; L111-R113 VanDerWaalsContact C-N 3.3Å; L111-R113 PolarHBondContact O-N 3.15Å; L111-L114 PolarHBondContact O-N 3.11Å; L111-L115 WeakPolarHBondContact O-CB 3.25Å; L111-L115 WeakPolarHBondContact O-CG 3.08Å; L111-L115 PolarHBondContact O-N 3.45Å |
| 112 | K | 85.8 | Confident | 74.2 | Confident | 148 Ų | 148 | 108.2 Ų | 108.2 | 64% | 0.643 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -58.7 | -42.5 | 173.4 | -74.6 | -179.6 | 179.7 | -178.2 | 0 | 111.5 | I108 L115 K116 | I108-K112 HydrophobicContact CG2-CD 4.34Å; I108-K112 WeakPolarHBondContact O-CB 3.45Å; I108-K112 WeakPolarHBondContact O-CG 3.46Å; I108-K112 PolarHBondContact O-N 2.8Å; K112-L115 PolarHBondContact O-N 3.17Å; K112-K116 WeakPolarHBondContact O-CB 3.48Å; K112-K116 PolarHBondContact O-N 3.16Å |
| 113 | R | 82.1 | Confident | 74.3 | Confident | 160 Ų | 160 | 109.9 Ų | 109.9 | 60% | 0.604 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.7 | -45.6 | 175.9 | -173.5 | 178.8 | -65.5 | 178.4 | 0.4 | 111.3 | S109 N110 L111 K116 W117 | S109-R113 WeakPolarHBondContact O-CB 3.36Å; S109-R113 PolarHBondContact O-N 2.95Å; N110-R113 WeakPolarHBondContact O-CB 3.48Å; N110-R113 PolarHBondContact O-N 3.48Å; L111-R113 VanDerWaalsContact C-N 3.3Å; L111-R113 PolarHBondContact O-N 3.15Å; R113-K116 PolarHBondContact O-N 3.41Å; R113-W117 WeakPolarHBondContact O-CB 3.45Å; R113-W117 VanDerWaalsContact O-CD1 3.24Å; R113-W117 PolarHBondContact O-N 2.82Å |
| 114 | L | 81 | Confident | 73.7 | Confident | 114 Ų | 114 | 107.2 Ų | 107.2 | 60% | 0.597 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.9 | -40.8 | 178.1 | -72.5 | 172.6 | 0 | 0 | 0 | 112.5 | N110 L111 W117 R118 | N110-L114 WeakPolarHBondContact O-CB 3.21Å; N110-L114 VanDerWaalsContact O-CG 3.29Å; N110-L114 WeakPolarHBondContact O-CG 3.2Å; N110-L114 PolarHBondContact O-N 2.78Å; L111-L114 PolarHBondContact O-N 3.11Å; L114-W117 PolarHBondContact O-N 3.28Å; L114-R118 WeakPolarHBondContact O-CB 3.49Å; L114-R118 PolarHBondContact O-N 3.33Å |
| 115 | L | 85.7 | Confident | 73.3 | Confident | 112 Ų | 112 | 111.5 Ų | 111.5 | 59% | 0.586 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -64.2 | -44.1 | 174.8 | -71.5 | 172.2 | 0 | 0 | 0 | 111.4 | L111 K112 W117 R118 Q119 | L111-L115 WeakPolarHBondContact O-CB 3.25Å; L111-L115 WeakPolarHBondContact O-CG 3.08Å; L111-L115 PolarHBondContact O-N 3.45Å; K112-L115 PolarHBondContact O-N 3.17Å; L115-W117 PolarHBondContact O-N 3.44Å; L115-R118 PolarHBondContact O-N 2.83Å; L115-Q119 WeakPolarHBondContact O-CB 3.43Å; L115-Q119 PolarHBondContact O-N 3.24Å |
| 116 | K | 83.8 | Confident | 72.3 | Confident | 137 Ų | 137 | 112.1 Ų | 112.1 | 60% | 0.596 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -61.1 | -43.7 | 173.8 | -174.5 | 175.5 | -178.6 | 176.9 | 0 | 111.5 | K112 R113 Q119 L120 | K112-K116 WeakPolarHBondContact O-CB 3.48Å; K112-K116 PolarHBondContact O-N 3.16Å; R113-K116 PolarHBondContact O-N 3.41Å; K116-Q119 PolarHBondContact O-N 3.46Å; K116-L120 HydrophobicContact CG-CD1 4.09Å; K116-L120 HydrophobicContact CG-CG 4.43Å; K116-L120 WeakPolarHBondContact O-CB 3.49Å; K116-L120 VanDerWaalsContact O-CG 3.29Å; K116-L120 WeakPolarHBondContact O-CG 3.34Å; K116-L120 PolarHBondContact O-N 3.26Å |
| 117 | W | 75.6 | Confident | 70.9 | Confident | 154 Ų | 154 | 111.9 Ų | 111.9 | 58% | 0.583 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -59.4 | -46 | 173.9 | -92.8 | 96 | 0 | 0 | 0 | 111.7 | R113 L114 L115 Q119 L120 Q121 | R113-W117 WeakPolarHBondContact O-CB 3.45Å; R113-W117 VanDerWaalsContact O-CD1 3.24Å; R113-W117 PolarHBondContact O-N 2.82Å; L114-W117 PolarHBondContact O-N 3.28Å; L115-W117 PolarHBondContact O-N 3.44Å; W117-Q119 VanDerWaalsContact C-N 3.33Å; W117-Q119 PolarHBondContact O-N 2.84Å; W117-L120 PolarHBondContact O-N 3.49Å; W117-Q121 WeakPolarHBondContact O-CB 3.38Å; W117-Q121 WeakPolarHBondContact O-CG 3.48Å; W117-Q121 PolarHBondContact O-N 3.36Å |
| 118 | R | 78.3 | Confident | 69.4 | Low | 175 Ų | 175 | 111 Ų | 111 | 66% | 0.66 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61 | -41.7 | 176.4 | -178 | -172.6 | -82.9 | -159 | -3.7 | 111.7 | L114 L115 Q121 Q122 | L114-R118 WeakPolarHBondContact O-CB 3.49Å; L114-R118 PolarHBondContact O-N 3.33Å; L115-R118 PolarHBondContact O-N 2.83Å; R118-Q121 PolarHBondContact O-N 3.23Å; R118-Q122 WeakPolarHBondContact O-CG 3.49Å; R118-Q122 PolarHBondContact O-N 3.22Å; R118-Q122 VanDerWaalsContact O-N 3.11Å |
| 119 | Q | 77 | Confident | 67.5 | Low | 138 Ų | 138 | 116 Ų | 116 | 65% | 0.645 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -65.6 | -42.2 | 177.1 | -169.2 | 176.1 | 17.6 | 0 | 0 | 111.4 | L115 K116 W117 Q121 Q122 V123 | L115-Q119 WeakPolarHBondContact O-CB 3.43Å; L115-Q119 PolarHBondContact O-N 3.24Å; K116-Q119 PolarHBondContact O-N 3.46Å; W117-Q119 VanDerWaalsContact C-N 3.33Å; W117-Q119 PolarHBondContact O-N 2.84Å; Q119-Q121 PolarHBondContact O-N 3.46Å; Q119-Q122 PolarHBondContact O-N 3.28Å; Q119-V123 PolarHBondContact O-N 2.88Å |
| 120 | L | 71.4 | Confident | 65.8 | Low | 90 Ų | 90 | 118.1 Ų | 118.1 | 47% | 0.471 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -64.8 | -36.5 | 174.6 | -71.9 | 174 | 0 | 0 | 0 | 112.7 | K116 W117 Q122 V123 G124 | K116-L120 HydrophobicContact CG-CD1 4.09Å; K116-L120 HydrophobicContact CG-CG 4.43Å; K116-L120 WeakPolarHBondContact O-CB 3.49Å; K116-L120 VanDerWaalsContact O-CG 3.29Å; K116-L120 WeakPolarHBondContact O-CG 3.34Å; K116-L120 PolarHBondContact O-N 3.26Å; W117-L120 PolarHBondContact O-N 3.49Å; L120-Q122 VanDerWaalsContact C-N 3.29Å; L120-Q122 PolarHBondContact O-N 2.95Å; L120-V123 HydrophobicContact CD2-CG2 4.22Å; L120-V123 WeakPolarHBondContact O-CG2 3.43Å; L120-V123 PolarHBondContact O-N 2.71Å; L120-G124 PolarHBondContact O-N 2.84Å |
| 121 | Q | 64.5 | Low | 64.3 | Low | 116 Ų | 116 | 123.6 Ų | 123.6 | 54% | 0.542 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -67 | -31.9 | 174.7 | -71.5 | -67.2 | -56 | 0 | 0 | 111.9 | W117 R118 Q119 G124 V125 | W117-Q121 WeakPolarHBondContact O-CB 3.38Å; W117-Q121 WeakPolarHBondContact O-CG 3.48Å; W117-Q121 PolarHBondContact O-N 3.36Å; R118-Q121 PolarHBondContact O-N 3.23Å; Q119-Q121 PolarHBondContact O-N 3.46Å; Q121-G124 PolarHBondContact O-N 3.11Å; Q121-V125 VanDerWaalsContact O-CG2 3.25Å; Q121-V125 WeakPolarHBondContact O-CG2 3.29Å; Q121-V125 PolarHBondContact O-N 2.95Å |
| 122 | Q | 62.6 | Low | 62.6 | Low | 139 Ų | 139 | 125.2 Ų | 125.2 | 65% | 0.65 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -70.3 | -36 | 174.9 | -72.6 | 176.8 | 64.9 | 0 | 0 | 112.4 | R118 Q119 L120 G124 | R118-Q122 WeakPolarHBondContact O-CG 3.49Å; R118-Q122 PolarHBondContact O-N 3.22Å; R118-Q122 VanDerWaalsContact O-N 3.11Å; Q119-Q122 PolarHBondContact O-N 3.28Å; L120-Q122 VanDerWaalsContact C-N 3.29Å; L120-Q122 PolarHBondContact O-N 2.95Å; Q122-G124 VanDerWaalsContact C-N 3.35Å |
| 123 | V | 53.9 | Low | 60.6 | Low | 96 Ų | 96 | 127.1 Ų | 127.1 | 58% | 0.582 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -77.7 | -18.9 | 172.1 | -67.8 | 0 | 0 | 0 | 0 | 113.3 | Q119 L120 | Q119-V123 PolarHBondContact O-N 2.88Å; L120-V123 HydrophobicContact CD2-CG2 4.22Å; L120-V123 WeakPolarHBondContact O-CG2 3.43Å; L120-V123 PolarHBondContact O-N 2.71Å |
| 124 | G | 46.4 | Very low | 58.4 | Low | 33 Ų | 33 | 128.9 Ų | 128.9 | 34% | 0.34 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -82.5 | -15.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.6 | L120 Q121 Q122 A126 N127 | L120-G124 PolarHBondContact O-N 2.84Å; Q121-G124 PolarHBondContact O-N 3.11Å; Q122-G124 VanDerWaalsContact C-N 3.35Å; G124-A126 PolarHBondContact O-N 3.23Å; G124-N127 CarbonylContact O-C 3.48Å; G124-N127 PolarHBondContact O-N 2.85Å; G124-N127 VanDerWaalsContact O-N 3.14Å |
| 125 | V | 49.3 | Very low | 56.7 | Low | 130 Ų | 130 | 130.5 Ų | 130.5 | 79% | 0.788 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -19.5 | 173.9 | -163.1 | 0 | 0 | 0 | 0 | 111.5 | Q121 | Q121-V125 VanDerWaalsContact O-CG2 3.25Å; Q121-V125 WeakPolarHBondContact O-CG2 3.29Å; Q121-V125 PolarHBondContact O-N 2.95Å |
| 126 | A | 51.1 | Low | 54.9 | Low | 82 Ų | 82 | 129.7 Ų | 129.7 | 68% | 0.678 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | -21.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | G124 | G124-A126 PolarHBondContact O-N 3.23Š|
| 127 | N | 44.9 | Very low | 53 | Low | 114 Ų | 114 | 132.6 Ų | 132.6 | 61% | 0.61 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.5 | 74 | -172.8 | -68.6 | -45.3 | 0 | 0 | 0 | 110.9 | G124 F129 | G124-N127 CarbonylContact O-C 3.48Å; G124-N127 PolarHBondContact O-N 2.85Å; G124-N127 VanDerWaalsContact O-N 3.14Å; N127-F129 VanDerWaalsContact O-CD2 3.26Å; N127-F129 WeakPolarHBondContact O-CD2 3.15Å; N127-F129 PolarHBondContact O-N 3.47Å |
| 128 | G | 43.1 | Very low | 51.5 | Low | 80 Ų | 80 | 128 Ų | 128 | 83% | 0.825 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 44.6 | 12.6 | 138.5 | 0 | 0 | 0 | 0 | 0 | 122.4 | P130 | G128-P130 WeakPolarHBondContact O-CD 3.4Š|
| 129 | F | 41 | Very low | 49.9 | Very low | 187 Ų | 187 | 129.7 Ų | 129.7 | 82% | 0.82 | 69% | 0.694 | S | S | * | * | trans | -82.4 | 120.9 | 178.8 | -84.7 | -82.2 | 0 | 0 | 0 | 110.4 | N127 K131 | N127-F129 VanDerWaalsContact O-CD2 3.26Å; N127-F129 WeakPolarHBondContact O-CD2 3.15Å; N127-F129 PolarHBondContact O-N 3.47Å; F129-K131 PolarHBondContact O-N 2.88Å | ||
| 130 | P | 43.8 | Very low | 48.6 | Very low | 104 Ų | 104 | 129.6 Ų | 129.6 | 68% | 0.675 | 70% | 0.702 | S | S | * | * | trans | -66.6 | 134.6 | -175.3 | 25.7 | -32 | 0 | 0 | 0 | 110.2 | G128 T132 | G128-P130 WeakPolarHBondContact O-CD 3.4Å; P130-T132 VanDerWaalsContact C-N 3.28Å; P130-T132 PolarHBondContact O-N 3.4Å | ||
| 131 | K | 48.9 | Very low | 47.4 | Very low | 198 Ų | 198 | 136 Ų | 136 | 86% | 0.861 | 72% | 0.72 | S | S | * | * | trans | -59.3 | 85.9 | 172.9 | -68.7 | 176.2 | 179.7 | 176.4 | 0 | 110 | F129 Y133 | F129-K131 PolarHBondContact O-N 2.88Å; K131-Y133 PolarHBondContact O-N 2.84Å | ||
| 132 | T | 44.4 | Very low | 46.8 | Very low | 123 Ų | 123 | 137 Ų | 137 | 76% | 0.755 | 74% | 0.735 | S | S | * | * | trans | -77.9 | 82.8 | 160.8 | 57.3 | 0 | 0 | 0 | 0 | 107 | P130 F134 | P130-T132 VanDerWaalsContact C-N 3.28Å; P130-T132 PolarHBondContact O-N 3.4Å; T132-F134 PolarHBondContact O-N 3.46Å; T132-F134 VanDerWaalsContact O-N 3.12Å | ||
| 133 | Y | 44.5 | Very low | 46.1 | Very low | 187 Ų | 187 | 136.9 Ų | 136.9 | 73% | 0.733 | 74% | 0.743 | S | S | * | * | trans | -60.7 | 112.1 | 161.9 | -130 | -97.5 | 0 | 0 | 0 | 105.9 | K131 Q135 | K131-Y133 PolarHBondContact O-N 2.84Å; Y133-Q135 PolarHBondContact O-N 2.68Å | ||
| 134 | F | 36.4 | Very low | 45.5 | Very low | 197 Ų | 197 | 135.3 Ų | 135.3 | 86% | 0.864 | 75% | 0.746 | S | S | * | * | trans | -70.5 | 86.9 | 175 | -142.2 | -96.7 | 0 | 0 | 0 | 106.8 | T132 P136 | T132-F134 PolarHBondContact O-N 3.46Å; T132-F134 VanDerWaalsContact O-N 3.12Å; F134-P136 WeakPolarHBondContact O-CD 3.26Å | ||
| 135 | Q | 44.2 | Very low | 45.8 | Very low | 148 Ų | 148 | 140.3 Ų | 140.3 | 69% | 0.692 | 77% | 0.77 | S | S | * | * | trans | -97 | 103.2 | 175.3 | -138.7 | 139.6 | 53.1 | 0 | 0 | 106.3 | Y133 H137 | Y133-Q135 PolarHBondContact O-N 2.68Å; Q135-H137 PolarHBondContact O-N 3.37Å | ||
| 136 | P | 47.2 | Very low | 45.9 | Very low | 95 Ų | 95 | 142 Ų | 142 | 62% | 0.617 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -70.5 | 130.9 | 179.4 | 30.2 | -30.2 | 0 | 0 | 0 | 107.1 | F134 | F134-P136 WeakPolarHBondContact O-CD 3.26Š|
| 137 | H | 45.7 | Very low | 46 | Very low | 198 Ų | 198 | 144.4 Ų | 144.4 | 92% | 0.917 | 78% | 0.78 | S | S | * | * | S | Bend | trans | 83.5 | 84.1 | -177.8 | -52.7 | -88.3 | 0 | 0 | 0 | 115.9 | Q135 | Q135-H137 PolarHBondContact O-N 3.37Š|
| 138 | G | 42.1 | Very low | 46.4 | Very low | 58 Ų | 58 | 143.3 Ų | 143.3 | 60% | 0.598 | 79% | 0.786 | S | S | * | * | trans | 164.3 | 121.5 | 158.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V140 | G138-V140 PolarHBondContact O-N 3.14Š| ||
| 139 | K | 45.5 | Very low | 46.8 | Very low | 211 Ų | 211 | 150.9 Ų | 150.9 | 92% | 0.917 | 79% | 0.79 | S | S | * | * | trans | -56.8 | 110.6 | 175.3 | -67.6 | 175 | 179.2 | 176 | 0 | 109.1 | R141 | K139-R141 PolarHBondContact O-N 3.28Š| ||
| 140 | V | 49.4 | Very low | 47.7 | Very low | 135 Ų | 135 | 151.9 Ų | 151.9 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | trans | -69.8 | 111.6 | -179.1 | 177.8 | 0 | 0 | 0 | 0 | 108.9 | G138 | G138-V140 PolarHBondContact O-N 3.14Š| ||
| 141 | R | 46.1 | Very low | 48.2 | Very low | 224 Ų | 224 | 156.4 Ų | 156.4 | 85% | 0.845 | 80% | 0.803 | S | S | * | * | trans | -88.5 | 118.7 | 163.1 | -59.9 | -179.8 | 99 | 174.7 | 4.8 | 106.6 | K139 V143 | K139-R141 PolarHBondContact O-N 3.28Å; R141-V143 PolarHBondContact O-N 3.5Å; R141-V143 VanDerWaalsContact O-N 3.09Å | ||
| 142 | T | 53.3 | Low | 48 | Very low | 138 Ų | 138 | 155.5 Ų | 155.5 | 85% | 0.847 | 80% | 0.802 | S | S | * | * | trans | -60.2 | 109 | 176.7 | -48.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 143 | V | 47.7 | Very low | 48.3 | Very low | 136 Ų | 136 | 154.5 Ų | 154.5 | 82% | 0.824 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 130.1 | 170.2 | -176.6 | 0 | 0 | 0 | 0 | 107.8 | R141 | R141-V143 PolarHBondContact O-N 3.5Å; R141-V143 VanDerWaalsContact O-N 3.09Å |
| 144 | G | 41.7 | Very low | 48.7 | Very low | 63 Ų | 63 | 150.9 Ų | 150.9 | 65% | 0.649 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 161.2 | -163.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | I146 | G144-I146 PolarHBondContact O-N 3.39Š|
| 145 | T | 51.6 | Low | 49.2 | Very low | 138 Ų | 138 | 151.2 Ų | 151.2 | 85% | 0.847 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 122.4 | -178.2 | 48 | 0 | 0 | 0 | 0 | 111.9 | T147 | T145-T147 PolarHBondContact O-N 2.93Š|
| 146 | I | 51.2 | Low | 49.6 | Very low | 166 Ų | 166 | 153.2 Ų | 153.2 | 85% | 0.851 | 80% | 0.796 | S | S | * | * | trans | -83.6 | 106.2 | 167.5 | -58.2 | 177 | 0 | 0 | 0 | 107.7 | G144 A148 | G144-I146 PolarHBondContact O-N 3.39Å; I146-A148 PolarHBondContact O-N 3.36Å; I146-A148 VanDerWaalsContact O-N 3.11Å | ||
| 147 | T | 53.1 | Low | 49.6 | Very low | 133 Ų | 133 | 158 Ų | 158 | 82% | 0.816 | 81% | 0.81 | S | S | * | * | trans | -68.9 | 102.7 | 172.4 | -16 | 0 | 0 | 0 | 0 | 108.7 | T145 R149 | T145-T147 PolarHBondContact O-N 2.93Å; T147-R149 PolarHBondContact O-N 3.35Å | ||
| 148 | A | 53.8 | Low | 49.5 | Very low | 90 Ų | 90 | 156.6 Ų | 156.6 | 74% | 0.744 | 81% | 0.809 | S | S | * | * | trans | -67.4 | 112.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.2 | I146 K150 | I146-A148 PolarHBondContact O-N 3.36Å; I146-A148 VanDerWaalsContact O-N 3.11Å; A148-K150 PolarHBondContact O-N 3.47Å; A148-K150 VanDerWaalsContact O-N 3.16Å | ||
| 149 | R | 51.7 | Low | 50.3 | Low | 239 Ų | 239 | 163.7 Ų | 163.7 | 90% | 0.902 | 84% | 0.841 | S | S | * | * | trans | -56.1 | 118.6 | 171.7 | -88.1 | -178.3 | 176.4 | 179.2 | -1.3 | 109.4 | T147 K151 | T147-R149 PolarHBondContact O-N 3.35Å; R149-K151 PolarHBondContact O-N 3.21Å | ||
| 150 | K | 59.2 | Low | 50.5 | Low | 208 Ų | 208 | 161.3 Ų | 161.3 | 90% | 0.904 | 84% | 0.837 | S | S | * | * | trans | -50.3 | 114.4 | 172.4 | -148 | 172.4 | -176 | -178 | 0 | 108.9 | A148 E152 | A148-K150 PolarHBondContact O-N 3.47Å; A148-K150 VanDerWaalsContact O-N 3.16Å; K150-E152 PolarHBondContact O-N 3.21Å | ||
| 151 | K | 54.3 | Low | 50.6 | Low | 199 Ų | 199 | 162.7 Ų | 162.7 | 87% | 0.865 | 84% | 0.838 | S | S | * | * | trans | -82.8 | 107.8 | 167.9 | -78.1 | -176.4 | 177.5 | -179.2 | 0 | 107.3 | R149 V153 | R149-K151 PolarHBondContact O-N 3.21Å; K151-V153 PolarHBondContact O-N 2.85Å | ||
| 152 | E | 45.4 | Very low | 50.8 | Low | 179 Ų | 179 | 159.3 Ų | 159.3 | 84% | 0.836 | 84% | 0.837 | S | S | * | * | trans | -75.2 | 114.7 | 173.4 | -150.1 | 171 | 173.5 | 0 | 0 | 108.1 | K150 | K150-E152 PolarHBondContact O-N 3.21Š| ||
| 153 | V | 51 | Low | 50.7 | Low | 103 Ų | 103 | 160.5 Ų | 160.5 | 62% | 0.624 | 84% | 0.837 | S | S | * | * | trans | -92.7 | 102.6 | 173.7 | 179 | 0 | 0 | 0 | 0 | 106.7 | K151 Y155 | K151-V153 PolarHBondContact O-N 2.85Å; V153-Y155 HydrophobicContact CB-CE2 4.32Å; V153-Y155 HydrophobicContact CG1-CD2 4.15Å; V153-Y155 HydrophobicContact CG1-CE1 4.4Å; V153-Y155 HydrophobicContact CG1-CE2 3.66Å | ||
| 154 | V | 51.3 | Low | 50.9 | Low | 111 Ų | 111 | 162.1 Ų | 162.1 | 67% | 0.673 | 84% | 0.837 | S | S | * | * | trans | -84.1 | 110 | 173.8 | 179.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 155 | Y | 48.8 | Very low | 51.5 | Low | 204 Ų | 204 | 168.7 Ų | 168.7 | 80% | 0.8 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 119.8 | 168.4 | -67.2 | -89.3 | 0 | 0 | 0 | 108.2 | V153 | V153-Y155 HydrophobicContact CB-CE2 4.32Å; V153-Y155 HydrophobicContact CG1-CD2 4.15Å; V153-Y155 HydrophobicContact CG1-CE1 4.4Å; V153-Y155 HydrophobicContact CG1-CE2 3.66Å |
| 156 | K | 50.7 | Low | 51.5 | Low | 189 Ų | 189 | 170.9 Ų | 170.9 | 82% | 0.822 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -91.3 | 119.1 | 166.2 | -74.5 | -175.7 | 175.8 | -176.5 | 0 | 107.7 | L158 | K156-L158 PolarHBondContact O-N 3.37Š|
| 157 | E | 48.6 | Very low | 51.5 | Low | 195 Ų | 195 | 171.2 Ų | 171.2 | 91% | 0.911 | 85% | 0.85 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 122.1 | 168 | -68 | -178.5 | 131.4 | 0 | 0 | 108.4 | T159 | E157-T159 PolarHBondContact O-N 3.49Š|
| 158 | L | 43.9 | Very low | 51.3 | Low | 170 Ų | 170 | 174.4 Ų | 174.4 | 89% | 0.89 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -78.8 | 116.3 | 167 | -78.7 | 155.8 | 0 | 0 | 0 | 106.4 | K156 | K156-L158 PolarHBondContact O-N 3.37Š|
| 159 | T | 57.4 | Low | 51.1 | Low | 206 Ų | 206 | 182.1 Ų | 182.1 | 100% | 1.264 | 86% | 0.863 | S | S | * | * | trans | -31.5 | 0 | 171.3 | 46.5 | 0 | 0 | 0 | 0 | 115.5 | E157 | E157-T159 PolarHBondContact O-N 3.49Š|
Retrieved 159 of 159 residues in 380.4 ms
(Link to these results)