| 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 | 35.7 | Very low | 40.2 | Very low | 250 Ų | 250 | 146.5 Ų | 146.5 | 100% | 1.232 | 75% | 0.747 | S | S | * | * | 0 | 91.1 | 0 | -144.5 | 168.1 | -163.7 | 0 | 0 | 105.2 | |||||
| 2 | E | 32.5 | Very low | 40.4 | Very low | 188 Ų | 188 | 141.1 Ų | 141.1 | 88% | 0.879 | 73% | 0.727 | S | S | * | * | trans | -89.4 | 112.4 | -166.8 | -151.9 | 143.9 | 105.6 | 0 | 0 | 107.6 | ||||
| 3 | A | 33.3 | Very low | 40.9 | Very low | 99 Ų | 99 | 140.6 Ų | 140.6 | 82% | 0.818 | 72% | 0.717 | S | S | * | * | trans | -96.8 | 95.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 108.9 | F5 | A3-F5 PolarHBondContact O-N 2.75Š| ||
| 4 | T | 38.7 | Very low | 41.4 | Very low | 111 Ų | 111 | 139.2 Ų | 139.2 | 68% | 0.681 | 71% | 0.708 | S | S | * | * | trans | -63.6 | 108.2 | 172 | -56.1 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 5 | F | 42.6 | Very low | 41.9 | Very low | 188 Ų | 188 | 136.1 Ų | 136.1 | 83% | 0.825 | 69% | 0.693 | S | S | * | * | trans | -151.5 | 82.7 | 156.5 | -91 | -79.5 | 0 | 0 | 0 | 111.5 | A3 | A3-F5 PolarHBondContact O-N 2.75Š| ||
| 6 | P | 39.8 | Very low | 42.3 | Very low | 106 Ų | 106 | 134.9 Ų | 134.9 | 69% | 0.688 | 69% | 0.688 | S | S | * | * | trans | -110.2 | 0.3 | 175.7 | 36.9 | -27.7 | 0 | 0 | 0 | 115 | ||||
| 7 | H | 40.7 | Very low | 42.7 | Very low | 128 Ų | 128 | 132.2 Ų | 132.2 | 59% | 0.593 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -97.5 | -22.5 | -170.5 | -158.4 | -78.5 | 0 | 0 | 0 | 114.9 | ||
| 8 | L | 42.8 | Very low | 43.1 | Very low | 127 Ų | 127 | 130.8 Ų | 130.8 | 67% | 0.665 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -84.4 | -26.8 | -174.4 | -130.8 | 81.8 | 0 | 0 | 0 | 113.8 | T12 | L8-T12 PolarHBondContact O-OG1 2.78Å |
| 9 | D | 44.3 | Very low | 43.4 | Very low | 125 Ų | 125 | 127.7 Ų | 127.7 | 67% | 0.668 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -75.1 | -31.8 | -179 | -116.4 | -54.7 | 0 | 0 | 0 | 112.5 | T12 F13 | D9-T12 WeakPolarHBondContact CA-OG1 3.44Å; D9-T12 PolarHBondContact O-OG1 3.44Å; D9-T12 VanDerWaalsContact O-OG1 3.08Å; D9-F13 WeakPolarHBondContact O-CB 3.48Å; D9-F13 PolarHBondContact O-N 2.57Å |
| 10 | R | 45.3 | Very low | 43.5 | Very low | 196 Ų | 196 | 124.5 Ų | 124.5 | 74% | 0.74 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -76.3 | -33.5 | -175.7 | -154.6 | 174.7 | -161.1 | -163.2 | 3.4 | 113.4 | M14 | R10-M14 HydrophobicContact CG-CE 4.48Å; R10-M14 PolarHBondContact O-N 3.38Å |
| 11 | Q | 46 | Very low | 43.9 | Very low | 93 Ų | 93 | 127.2 Ų | 127.2 | 44% | 0.435 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -76.1 | -35.1 | 177.2 | -74.5 | -171.6 | -49.6 | 0 | 0 | 112.3 | L15 | Q11-L15 WeakPolarHBondContact O-CB 3.49Å; Q11-L15 PolarHBondContact O-N 3.04Å |
| 12 | T | 43.3 | Very low | 44.4 | Very low | 82 Ų | 82 | 117.5 Ų | 117.5 | 50% | 0.503 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -68.8 | -38.2 | 173.4 | 32.8 | 0 | 0 | 0 | 0 | 111.2 | L8 D9 L15 L16 | L8-T12 PolarHBondContact O-OG1 2.78Å; D9-T12 WeakPolarHBondContact CA-OG1 3.44Å; D9-T12 PolarHBondContact O-OG1 3.44Å; D9-T12 VanDerWaalsContact O-OG1 3.08Å; T12-L15 PolarHBondContact O-N 3.21Å; T12-L16 VanDerWaalsContact O-CB 3.31Å; T12-L16 WeakPolarHBondContact O-CB 3.37Å; T12-L16 PolarHBondContact O-N 3.28Å |
| 13 | F | 47.1 | Very low | 45 | Very low | 135 Ų | 135 | 113 Ų | 113 | 59% | 0.592 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.2 | -43.1 | 174.8 | -144.2 | -87.5 | 0 | 0 | 0 | 112.5 | D9 L16 D17 | D9-F13 WeakPolarHBondContact O-CB 3.48Å; D9-F13 PolarHBondContact O-N 2.57Å; F13-L16 PolarHBondContact O-N 2.96Å; F13-D17 WeakPolarHBondContact O-CB 3.22Å; F13-D17 PolarHBondContact O-N 3.33Å |
| 14 | M | 47.7 | Very low | 45.6 | Very low | 121 Ų | 121 | 110.2 Ų | 110.2 | 60% | 0.596 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -67.3 | -38.1 | 176.4 | -76.4 | -172.8 | -74.8 | 0 | 0 | 113 | R10 D17 Y18 | R10-M14 HydrophobicContact CG-CE 4.48Å; R10-M14 PolarHBondContact O-N 3.38Å; M14-D17 PolarHBondContact O-N 3.03Å; M14-Y18 WeakPolarHBondContact O-CB 3.29Å; M14-Y18 PolarHBondContact O-N 3.03Å |
| 15 | L | 49.1 | Very low | 45.6 | Very low | 92 Ų | 92 | 110.7 Ų | 110.7 | 48% | 0.482 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -67.4 | -36.3 | 174 | -90.1 | 158.7 | 0 | 0 | 0 | 112.1 | Q11 T12 C19 | Q11-L15 WeakPolarHBondContact O-CB 3.49Å; Q11-L15 PolarHBondContact O-N 3.04Å; T12-L15 PolarHBondContact O-N 3.21Å; L15-C19 WeakPolarHBondContact O-CB 3.26Å; L15-C19 PolarHBondContact O-N 3.49Å; L15-C19 PolarHBondContact O-SG 3.37Å |
| 16 | L | 48.4 | Very low | 45.4 | Very low | 118 Ų | 118 | 107.3 Ų | 107.3 | 62% | 0.618 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -71.4 | -38.1 | 176.5 | -151.5 | 88.6 | 0 | 0 | 0 | 111.3 | T12 F13 C20 | T12-L16 VanDerWaalsContact O-CB 3.31Å; T12-L16 WeakPolarHBondContact O-CB 3.37Å; T12-L16 PolarHBondContact O-N 3.28Å; F13-L16 PolarHBondContact O-N 2.96Å; L16-C20 WeakPolarHBondContact O-CA 3.5Å; L16-C20 WeakPolarHBondContact O-CB 3.08Å; L16-C20 PolarHBondContact O-N 2.96Å; L16-C20 PolarHBondContact O-SG 3.34Å; L16-C20 VanDerWaalsContact O-SG 3.33Å |
| 17 | D | 47.8 | Very low | 45.5 | Very low | 89 Ų | 89 | 109.3 Ų | 109.3 | 48% | 0.476 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -68 | -39.5 | 174.5 | -121 | -73.5 | 0 | 0 | 0 | 111.7 | F13 M14 C20 R21 | F13-D17 WeakPolarHBondContact O-CB 3.22Å; F13-D17 PolarHBondContact O-N 3.33Å; M14-D17 PolarHBondContact O-N 3.03Å; D17-C20 PolarHBondContact O-N 3.44Å; D17-R21 WeakPolarHBondContact O-CB 3.38Å; D17-R21 PolarHBondContact O-N 2.94Å |
| 18 | Y | 51.5 | Low | 45.5 | Very low | 106 Ų | 106 | 110.8 Ų | 110.8 | 42% | 0.416 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -68.2 | -45.6 | 175 | -142.7 | -95 | 0 | 0 | 0 | 111.3 | M14 C20 R21 C22 | M14-Y18 WeakPolarHBondContact O-CB 3.29Å; M14-Y18 PolarHBondContact O-N 3.03Å; Y18-C20 PolarHBondContact O-N 2.86Å; Y18-R21 PolarHBondContact O-N 3.39Å; Y18-C22 WeakPolarHBondContact O-CB 3.3Å; Y18-C22 PolarHBondContact O-N 3.4Å; Y18-C22 PolarHBondContact O-SG 3.27Å |
| 19 | C | 47.2 | Very low | 45.2 | Very low | 72 Ų | 72 | 114.2 Ų | 114.2 | 49% | 0.486 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.4 | -35.4 | 173.4 | -80.8 | 0 | 0 | 0 | 0 | 112.8 | L15 C22 C23 | L15-C19 WeakPolarHBondContact O-CB 3.26Å; L15-C19 PolarHBondContact O-N 3.49Å; L15-C19 PolarHBondContact O-SG 3.37Å; C19-C22 CarbonylContact O-C 3.59Å; C19-C22 PolarHBondContact O-N 3.49Å; C19-C23 VanDerWaalsContact O-CB 3.26Å; C19-C23 WeakPolarHBondContact O-CB 3.33Å; C19-C23 PolarHBondContact O-N 3.32Å |
| 20 | C | 46.8 | Very low | 44.9 | Very low | 63 Ų | 63 | 119 Ų | 119 | 43% | 0.426 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -72 | -33.4 | 175.4 | -85.1 | 0 | 0 | 0 | 0 | 112.5 | L16 D17 Y18 | L16-C20 WeakPolarHBondContact O-CA 3.5Å; L16-C20 WeakPolarHBondContact O-CB 3.08Å; L16-C20 PolarHBondContact O-N 2.96Å; L16-C20 PolarHBondContact O-SG 3.34Å; L16-C20 VanDerWaalsContact O-SG 3.33Å; D17-C20 PolarHBondContact O-N 3.44Å; Y18-C20 PolarHBondContact O-N 2.86Å |
| 21 | R | 50.5 | Low | 44.5 | Very low | 182 Ų | 182 | 119 Ų | 119 | 69% | 0.687 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -68.2 | -37 | 167.6 | -91.8 | -176.4 | 161.9 | -166.7 | -4.7 | 112 | D17 Y18 | D17-R21 WeakPolarHBondContact O-CB 3.38Å; D17-R21 PolarHBondContact O-N 2.94Å; Y18-R21 PolarHBondContact O-N 3.39Å |
| 22 | C | 46.2 | Very low | 44.1 | Very low | 47 Ų | 47 | 117.4 Ų | 117.4 | 32% | 0.318 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -77 | -26.1 | 177.8 | -69.9 | 0 | 0 | 0 | 0 | 114.6 | Y18 C19 | Y18-C22 WeakPolarHBondContact O-CB 3.3Å; Y18-C22 PolarHBondContact O-N 3.4Å; Y18-C22 PolarHBondContact O-SG 3.27Å; C19-C22 CarbonylContact O-C 3.59Å; C19-C22 PolarHBondContact O-N 3.49Å |
| 23 | C | 45.6 | Very low | 43.8 | Very low | 94 Ų | 94 | 119.8 Ų | 119.8 | 64% | 0.635 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.3 | 0 | -177.8 | -79.4 | 0 | 0 | 0 | 0 | 115.3 | C19 V25 | C19-C23 VanDerWaalsContact O-CB 3.26Å; C19-C23 WeakPolarHBondContact O-CB 3.33Å; C19-C23 PolarHBondContact O-N 3.32Å; C23-V25 HydrophobicContact CB-CG2 4.13Å; C23-V25 PolarHBondContact O-N 2.77Å |
| 24 | G | 47 | Very low | 43.4 | Very low | 39 Ų | 39 | 122.7 Ų | 122.7 | 40% | 0.402 | 65% | 0.645 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 59.5 | 17.2 | 174 | 0 | 0 | 0 | 0 | 0 | 115.7 | T26 L27 | G24-T26 PolarHBondContact O-N 3.44Å; G24-L27 VanDerWaalsContact O-CB 3.22Å; G24-L27 WeakPolarHBondContact O-CB 3.45Å; G24-L27 PolarHBondContact O-N 3.33Å |
| 25 | V | 38 | Very low | 42.9 | Very low | 122 Ų | 122 | 121.8 Ų | 121.8 | 74% | 0.739 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -8.8 | -179 | -172.9 | 0 | 0 | 0 | 0 | 112 | C23 | C23-V25 HydrophobicContact CB-CG2 4.13Å; C23-V25 PolarHBondContact O-N 2.77Å |
| 26 | T | 39.3 | Very low | 42.8 | Very low | 116 Ų | 116 | 123.4 Ų | 123.4 | 71% | 0.712 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | 9.4 | 165.9 | 43.7 | 0 | 0 | 0 | 0 | 114.2 | G24 I28 | G24-T26 PolarHBondContact O-N 3.44Å; T26-I28 VanDerWaalsContact C-N 3.29Å; T26-I28 PolarHBondContact O-N 3.49Å |
| 27 | L | 40.3 | Very low | 42.4 | Very low | 148 Ų | 148 | 127 Ų | 127 | 78% | 0.775 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.6 | -10.1 | 178 | -152.1 | 156.6 | 0 | 0 | 0 | 113.7 | G24 | G24-L27 VanDerWaalsContact O-CB 3.22Å; G24-L27 WeakPolarHBondContact O-CB 3.45Å; G24-L27 PolarHBondContact O-N 3.33Å |
| 28 | I | 42.1 | Very low | 42.6 | Very low | 160 Ų | 160 | 126.6 Ų | 126.6 | 82% | 0.821 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.5 | -11.8 | -174.6 | -65.7 | 178.8 | 0 | 0 | 0 | 115.2 | T26 | T26-I28 VanDerWaalsContact C-N 3.29Å; T26-I28 PolarHBondContact O-N 3.49Å |
| 29 | K | 36.4 | Very low | 43 | Very low | 198 Ų | 198 | 125.1 Ų | 125.1 | 86% | 0.861 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.4 | -0.2 | -170.3 | -140.8 | 172.5 | -179.4 | 171.7 | 0 | 119.4 | ||
| 30 | R | 36.9 | Very low | 43.9 | Very low | 226 Ų | 226 | 127 Ų | 127 | 85% | 0.853 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -152.6 | 28.4 | -174.3 | -128.1 | -170.6 | -168.2 | -179.6 | 4.1 | 121.8 | ||
| 31 | H | 38 | Very low | 44.9 | Very low | 195 Ų | 195 | 127.2 Ų | 127.2 | 90% | 0.903 | 69% | 0.686 | S | S | * | * | trans | -130 | 119.8 | 161.8 | -83.5 | -89.8 | 0 | 0 | 0 | 111.5 | ||||
| 32 | G | 37.3 | Very low | 45.9 | Very low | 60 Ų | 60 | 122.9 Ų | 122.9 | 62% | 0.619 | 68% | 0.676 | S | S | * | * | trans | -64.7 | -164.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | F34 | G32-F34 PolarHBondContact O-N 3.47Š| ||
| 33 | P | 35.8 | Very low | 47.3 | Very low | 132 Ų | 132 | 124 Ų | 124 | 86% | 0.857 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -52.7 | 126.8 | -163.6 | 23.3 | -32.9 | 0 | 0 | 0 | 111.2 | S35 | P33-S35 PolarHBondContact O-N 2.82Š|
| 34 | F | 39.5 | Very low | 48.8 | Very low | 196 Ų | 196 | 127.5 Ų | 127.5 | 86% | 0.86 | 68% | 0.682 | S | S | * | * | trans | -61.6 | 80.9 | 176.1 | -142.2 | -92.6 | 0 | 0 | 0 | 108.7 | G32 L36 | G32-F34 PolarHBondContact O-N 3.47Å; F34-L36 VanDerWaalsContact C-N 3.32Å; F34-L36 PolarHBondContact O-N 2.87Å | ||
| 35 | S | 38 | Very low | 50.4 | Low | 102 Ų | 102 | 129.5 Ų | 129.5 | 71% | 0.713 | 69% | 0.686 | S | S | * | * | trans | -78.3 | 88.4 | 174 | 177.5 | 0 | 0 | 0 | 0 | 107.8 | P33 K37 | P33-S35 PolarHBondContact O-N 2.82Å; S35-K37 PolarHBondContact O-N 3.33Å | ||
| 36 | L | 45.4 | Very low | 52.4 | Low | 126 Ų | 126 | 127.3 Ų | 127.3 | 66% | 0.66 | 67% | 0.673 | S | S | * | * | trans | -65.8 | 76.4 | 173.9 | -157.5 | 146.2 | 0 | 0 | 0 | 109.5 | F34 T38 | F34-L36 VanDerWaalsContact C-N 3.32Å; F34-L36 PolarHBondContact O-N 2.87Å; L36-T38 HydrophobicContact CD2-CG2 4.41Å; L36-T38 WeakPolarHBondContact CD2-OG1 3.44Å; L36-T38 HydrophobicContact CG-CG2 4.41Å | ||
| 37 | K | 41.1 | Very low | 54.4 | Low | 194 Ų | 194 | 126.1 Ų | 126.1 | 84% | 0.843 | 66% | 0.661 | S | S | * | * | trans | -102.1 | 61.2 | 164.7 | -114.2 | -169.5 | 178 | -172.1 | 0 | 107.5 | S35 T39 | S35-K37 PolarHBondContact O-N 3.33Å; K37-T39 PolarHBondContact O-N 2.87Å | ||
| 38 | T | 52.4 | Low | 56.3 | Low | 81 Ų | 81 | 124 Ų | 124 | 50% | 0.497 | 65% | 0.648 | S | S | . | * | trans | -76.7 | 116 | 169.4 | 49.1 | 0 | 0 | 0 | 0 | 107.7 | L36 | L36-T38 HydrophobicContact CD2-CG2 4.41Å; L36-T38 WeakPolarHBondContact CD2-OG1 3.44Å; L36-T38 HydrophobicContact CG-CG2 4.41Å | ||
| 39 | T | 59.5 | Low | 58.2 | Low | 75 Ų | 75 | 119.2 Ų | 119.2 | 46% | 0.46 | 62% | 0.624 | S | S | . | * | trans | -60.9 | 133 | 167.8 | 3.5 | 0 | 0 | 0 | 0 | 108.1 | K37 S41 D42 | K37-T39 PolarHBondContact O-N 2.87Å; T39-S41 PolarHBondContact O-N 3.35Å; T39-D42 WeakPolarHBondContact CB-OD2 3.46Å; T39-D42 PolarHBondContact O-N 3.29Å; T39-D42 PolarHBondContact OG1-OD2 2.84Å | ||
| 40 | P | 65.6 | Low | 60.5 | Low | 111 Ų | 111 | 111.4 Ų | 111.4 | 72% | 0.721 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -58.7 | -23.2 | -175.8 | 21.4 | -32.5 | 0 | 0 | 0 | 113 | W44 | P40-W44 PolarHBondContact O-N 3.47Å |
| 41 | S | 68.3 | Low | 62.7 | Low | 67 Ų | 67 | 105.5 Ų | 105.5 | 47% | 0.469 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -61.7 | -41.9 | 172.6 | 53.1 | 0 | 0 | 0 | 0 | 113.3 | T39 W44 V45 | T39-S41 PolarHBondContact O-N 3.35Å; S41-W44 PolarHBondContact O-N 2.75Å; S41-V45 PolarHBondContact O-N 3.38Å |
| 42 | D | 70.9 | Confident | 64.9 | Low | 91 Ų | 91 | 100.8 Ų | 100.8 | 49% | 0.487 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -78.9 | -34.8 | -170.6 | -52 | -25.2 | 0 | 0 | 0 | 110.4 | T39 W44 V45 V46 | T39-D42 WeakPolarHBondContact CB-OD2 3.46Å; T39-D42 PolarHBondContact O-N 3.29Å; T39-D42 PolarHBondContact OG1-OD2 2.84Å; D42-W44 VanDerWaalsContact C-N 3.3Å; D42-W44 PolarHBondContact O-N 3.49Å; D42-V45 PolarHBondContact O-N 3.06Å; D42-V46 WeakPolarHBondContact O-CG2 3.37Å; D42-V46 PolarHBondContact O-N 2.94Å |
| 43 | T | 76.9 | Confident | 67.1 | Low | 71 Ų | 71 | 97.9 Ų | 97.9 | 44% | 0.436 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.4 | -37.5 | 172.5 | -50.8 | 0 | 0 | 0 | 0 | 111.5 | V45 V46 L47 | T43-V45 PolarHBondContact O-N 2.95Å; T43-V46 PolarHBondContact O-N 3.48Å; T43-L47 WeakPolarHBondContact O-CB 3.33Å; T43-L47 PolarHBondContact O-N 2.94Å |
| 44 | W | 76.5 | Confident | 69.4 | Low | 168 Ų | 168 | 92.8 Ų | 92.8 | 64% | 0.636 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64 | -40.3 | 179.1 | -172.8 | -97.9 | 0 | 0 | 0 | 112.5 | P40 S41 D42 L47 Q48 | P40-W44 PolarHBondContact O-N 3.47Å; S41-W44 PolarHBondContact O-N 2.75Å; D42-W44 VanDerWaalsContact C-N 3.3Å; D42-W44 PolarHBondContact O-N 3.49Å; W44-L47 HydrophobicContact CZ3-CD2 4.5Å; W44-L47 PolarHBondContact O-N 2.95Å; W44-Q48 VanDerWaalsContact O-CB 3.29Å; W44-Q48 WeakPolarHBondContact O-CB 3.27Å; W44-Q48 PolarHBondContact O-N 3.2Å |
| 45 | V | 80.6 | Confident | 71.7 | Confident | 80 Ų | 80 | 87.1 Ų | 87.1 | 49% | 0.485 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.2 | -44.5 | 177.5 | 176.3 | 0 | 0 | 0 | 0 | 111.2 | S41 D42 T43 Q48 N49 | S41-V45 PolarHBondContact O-N 3.38Å; D42-V45 PolarHBondContact O-N 3.06Å; T43-V45 PolarHBondContact O-N 2.95Å; V45-Q48 PolarHBondContact O-N 2.85Å; V45-N49 PolarHBondContact O-N 3.33Å |
| 46 | V | 80.1 | Confident | 74 | Confident | 76 Ų | 76 | 84 Ų | 84 | 46% | 0.461 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62.8 | -45.2 | 176.7 | 175.1 | 0 | 0 | 0 | 0 | 110.9 | D42 T43 Q48 N49 L50 | D42-V46 WeakPolarHBondContact O-CG2 3.37Å; D42-V46 PolarHBondContact O-N 2.94Å; T43-V46 PolarHBondContact O-N 3.48Å; V46-Q48 VanDerWaalsContact C-N 3.32Å; V46-Q48 PolarHBondContact O-N 3.45Å; V46-N49 PolarHBondContact O-N 3.38Å; V46-L50 WeakPolarHBondContact O-CB 3.4Å; V46-L50 PolarHBondContact O-N 2.89Å |
| 47 | L | 81.4 | Confident | 75.9 | Confident | 91 Ų | 91 | 78 Ų | 78 | 48% | 0.476 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63 | -40 | 178.3 | -173.9 | 67.9 | 0 | 0 | 0 | 111.7 | T43 W44 L50 L51 | T43-L47 WeakPolarHBondContact O-CB 3.33Å; T43-L47 PolarHBondContact O-N 2.94Å; W44-L47 HydrophobicContact CZ3-CD2 4.5Å; W44-L47 PolarHBondContact O-N 2.95Å; L47-L50 PolarHBondContact O-N 3.48Å; L47-L51 VanDerWaalsContact O-CB 3.32Å; L47-L51 WeakPolarHBondContact O-CB 3.37Å; L47-L51 PolarHBondContact O-N 2.9Å |
| 48 | Q | 79.9 | Confident | 77.9 | Confident | 105 Ų | 105 | 70.5 Ų | 70.5 | 49% | 0.491 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -64.9 | -43.6 | 177.2 | -175 | 174.1 | -5.2 | 0 | 0 | 111.5 | W44 V45 V46 L50 L51 M52 | W44-Q48 VanDerWaalsContact O-CB 3.29Å; W44-Q48 WeakPolarHBondContact O-CB 3.27Å; W44-Q48 PolarHBondContact O-N 3.2Å; V45-Q48 PolarHBondContact O-N 2.85Å; V46-Q48 VanDerWaalsContact C-N 3.32Å; V46-Q48 PolarHBondContact O-N 3.45Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; Q48-L51 PolarHBondContact O-N 3.4Å; Q48-M52 WeakPolarHBondContact O-CB 3.27Å; Q48-M52 VanDerWaalsContact O-CG 3.28Å; Q48-M52 WeakPolarHBondContact O-CG 3.39Å; Q48-M52 PolarHBondContact O-N 2.84Å |
| 49 | N | 82.2 | Confident | 79.5 | Confident | 59 Ų | 59 | 69.4 Ų | 69.4 | 32% | 0.316 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -62.7 | -42.4 | 174.9 | -75.1 | -2.2 | 0 | 0 | 0 | 111.5 | V45 V46 L51 M52 C53 Y126 | V45-N49 PolarHBondContact O-N 3.33Å; V46-N49 PolarHBondContact O-N 3.38Å; N49-L51 PolarHBondContact O-N 3.17Å; N49-M52 PolarHBondContact O-N 3.49Å; N49-C53 PolarHBondContact O-N 2.89Å; N49-C53 PolarHBondContact O-SG 2.91Å; N49-Y126 HydrophobicContact CB-CE1 4.25Å |
| 50 | L | 83.8 | Confident | 80.8 | Confident | 34 Ų | 34 | 67.6 Ų | 67.6 | 18% | 0.178 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.1 | -43 | 175.5 | -175.9 | 146.6 | 0 | 0 | 0 | 111.6 | V46 L47 Q48 C53 M54 Y126 L133 | V46-L50 WeakPolarHBondContact O-CB 3.4Å; V46-L50 PolarHBondContact O-N 2.89Å; L47-L50 PolarHBondContact O-N 3.48Å; Q48-L50 VanDerWaalsContact C-N 3.34Å; L50-C53 WeakPolarHBondContact O-CB 3.4Å; L50-C53 PolarHBondContact O-N 3.34Å; L50-M54 PolarHBondContact O-N 3.48Å; L50-Y126 HydrophobicContact CB-CD1 4.24Å; L50-Y126 HydrophobicContact CB-CE1 4.05Å; L50-L133 HydrophobicContact CD2-CD1 3.83Å |
| 51 | L | 84.3 | Confident | 81.7 | Confident | 101 Ų | 101 | 62.9 Ų | 62.9 | 53% | 0.529 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64.9 | -41.8 | 177.9 | -170.8 | 146.9 | 0 | 0 | 0 | 111.2 | L47 Q48 N49 M54 V55 | L47-L51 VanDerWaalsContact O-CB 3.32Å; L47-L51 WeakPolarHBondContact O-CB 3.37Å; L47-L51 PolarHBondContact O-N 2.9Å; Q48-L51 PolarHBondContact O-N 3.4Å; N49-L51 PolarHBondContact O-N 3.17Å; L51-M54 WeakPolarHBondContact O-CB 3.49Å; L51-M54 PolarHBondContact O-N 3.32Å; L51-V55 HydrophobicContact CD2-CG2 4.06Å; L51-V55 WeakPolarHBondContact O-CG2 3.2Å; L51-V55 PolarHBondContact O-N 2.87Å |
| 52 | M | 83.7 | Confident | 82.3 | Confident | 96 Ų | 96 | 65.3 Ų | 65.3 | 47% | 0.473 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.1 | -46.1 | 173.3 | -72.7 | -68.1 | -71.6 | 0 | 0 | 111.3 | Q48 N49 M54 V55 C56 | Q48-M52 WeakPolarHBondContact O-CB 3.27Å; Q48-M52 VanDerWaalsContact O-CG 3.28Å; Q48-M52 WeakPolarHBondContact O-CG 3.39Å; Q48-M52 PolarHBondContact O-N 2.84Å; N49-M52 PolarHBondContact O-N 3.49Å; M52-M54 VanDerWaalsContact C-N 3.3Å; M52-M54 PolarHBondContact O-N 2.98Å; M52-V55 PolarHBondContact O-N 2.85Å; M52-C56 WeakPolarHBondContact O-CB 3.32Å; M52-C56 PolarHBondContact O-N 3.3Å; M52-C56 PolarHBondContact O-SG 2.84Å |
| 53 | C | 83.8 | Confident | 83.1 | Confident | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -56.2 | -44.4 | 173.3 | -78.8 | 0 | 0 | 0 | 0 | 111.9 | N49 L50 C56 F57 F115 V130 | N49-C53 PolarHBondContact O-N 2.89Å; N49-C53 PolarHBondContact O-SG 2.91Å; L50-C53 WeakPolarHBondContact O-CB 3.4Å; L50-C53 PolarHBondContact O-N 3.34Å; C53-C56 PolarHBondContact O-N 3.29Å; C53-F57 VanDerWaalsContact O-CB 3.32Å; C53-F57 WeakPolarHBondContact O-CB 3.28Å; C53-F57 PolarHBondContact O-N 3.37Å; C53-F115 HydrophobicContact CB-CD1 4.23Å; C53-F115 HydrophobicContact CB-CE1 3.61Å; C53-F115 HydrophobicContact CB-CE2 4.25Å; C53-F115 HydrophobicContact CB-CZ 3.62Å; C53-F115 VanDerWaalsContact O-CE1 3.3Å; C53-F115 WeakPolarHBondContact O-CE1 3.35Å; C53-F115 WeakPolarHBondContact O-CZ 3.36Å; C53-V130 HydrophobicContact CB-CG2 4.25Å |
| 54 | M | 84.3 | Confident | 83.4 | Confident | 24 Ų | 24 | 62.5 Ų | 62.5 | 12% | 0.118 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.8 | -48 | 179 | -160.1 | 67.5 | 172 | 0 | 0 | 111.9 | L50 L51 M52 C56 F57 Y58 V130 L133 M137 | L50-M54 PolarHBondContact O-N 3.48Å; L51-M54 WeakPolarHBondContact O-CB 3.49Å; L51-M54 PolarHBondContact O-N 3.32Å; M52-M54 VanDerWaalsContact C-N 3.3Å; M52-M54 PolarHBondContact O-N 2.98Å; M54-C56 PolarHBondContact O-N 3.49Å; M54-F57 PolarHBondContact O-N 2.88Å; M54-Y58 HydrophobicContact CE-CD2 4.36Å; M54-Y58 HydrophobicContact CE-CE2 3.28Å; M54-Y58 WeakPolarHBondContact CE-OH 3.38Å; M54-Y58 HydrophobicContact CG-CD2 4.01Å; M54-Y58 HydrophobicContact CG-CE2 3.77Å; M54-Y58 VanDerWaalsContact O-CD2 3.24Å; M54-Y58 WeakPolarHBondContact O-CD2 3.44Å; M54-Y58 PolarHBondContact O-N 3.34Å; M54-Y58 HydrophobicContact SD-CD2 4.47Å; M54-Y58 HydrophobicContact SD-CE2 3.89Å; M54-V130 HydrophobicContact SD-CG1 3.91Å; M54-V130 HydrophobicContact SD-CG2 4.42Å; M54-L133 HydrophobicContact CE-CB 3.83Å; M54-M137 HydrophobicContact CE-CE 4.2Å |
| 55 | V | 86.6 | Confident | 83.5 | Confident | 78 Ų | 78 | 54.9 Ų | 54.9 | 47% | 0.473 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.7 | -43.1 | 178.8 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | L51 M52 S59 | L51-V55 HydrophobicContact CD2-CG2 4.06Å; L51-V55 WeakPolarHBondContact O-CG2 3.2Å; L51-V55 PolarHBondContact O-N 2.87Å; M52-V55 PolarHBondContact O-N 2.85Å; V55-S59 VanDerWaalsContact O-CB 3.29Å; V55-S59 WeakPolarHBondContact O-CB 3.31Å; V55-S59 PolarHBondContact O-N 2.91Å; V55-S59 PolarHBondContact O-OG 3.03Å |
| 56 | C | 86.1 | Confident | 83.5 | Confident | 35 Ų | 35 | 54.8 Ų | 54.8 | 24% | 0.236 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 176.3 | -72.6 | 0 | 0 | 0 | 0 | 111.6 | M52 C53 M54 S59 L60 V114 | M52-C56 WeakPolarHBondContact O-CB 3.32Å; M52-C56 PolarHBondContact O-N 3.3Å; M52-C56 PolarHBondContact O-SG 2.84Å; C53-C56 PolarHBondContact O-N 3.29Å; M54-C56 PolarHBondContact O-N 3.49Å; C56-S59 PolarHBondContact O-N 3.45Å; C56-L60 WeakPolarHBondContact O-CB 3.31Å; C56-L60 WeakPolarHBondContact O-CG 3.45Å; C56-L60 PolarHBondContact O-N 3.24Å; C56-V114 HydrophobicContact CB-CG1 4.44Å |
| 57 | F | 85.2 | Confident | 83.6 | Confident | 1 Ų | 1 | 56.8 Ų | 56.8 | 0% | 0.004 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60 | -48.7 | 179.4 | -176.8 | -95.8 | 0 | 0 | 0 | 112 | C53 M54 S59 L60 Y61 T107 Y108 F115 V130 | C53-F57 VanDerWaalsContact O-CB 3.32Å; C53-F57 WeakPolarHBondContact O-CB 3.28Å; C53-F57 PolarHBondContact O-N 3.37Å; M54-F57 PolarHBondContact O-N 2.88Å; F57-S59 PolarHBondContact O-N 3.07Å; F57-L60 PolarHBondContact O-N 3.39Å; F57-Y61 WeakPolarHBondContact O-CB 3.43Å; F57-Y61 PolarHBondContact O-N 3.22Å; F57-T107 HydrophobicContact CD2-CG2 4.36Å; F57-T107 HydrophobicContact CE2-CG2 4Å; F57-T107 HydrophobicContact CZ-CG2 4.14Å; F57-Y108 HydrophobicContact CE2-CD1 4.25Å; F57-Y108 HydrophobicContact CE2-CE1 4.19Å; F57-Y108 HydrophobicContact CE2-CE2 4.46Å; F57-Y108 HydrophobicContact CE2-CG 4.4Å; F57-Y108 HydrophobicContact CZ-CD2 4.28Å; F57-Y108 HydrophobicContact CZ-CE1 4.13Å; F57-Y108 AromaticContact CZ-CE2 3.87Å; F57-Y108 HydrophobicContact CZ-CE2 3.87Å; F57-Y108 AromaticContact CZ-CZ 3.78Å; F57-F115 HydrophobicContact CB-CE1 4.42Å; F57-F115 HydrophobicContact CB-CZ 4.04Å; F57-F115 HydrophobicContact CD2-CZ 4.42Å; F57-V130 HydrophobicContact CB-CG1 4.46Å; F57-V130 HydrophobicContact CD1-CG1 4.44Å; F57-V130 HydrophobicContact CG-CG1 4.23Å |
| 58 | Y | 84.1 | Confident | 83.4 | Confident | 37 Ų | 37 | 53.1 Ų | 53.1 | 15% | 0.145 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -66.5 | -37.1 | 177 | -78.4 | -67.8 | 0 | 0 | 0 | 112.8 | M54 Y61 Y62 M137 | M54-Y58 HydrophobicContact CE-CD2 4.36Å; M54-Y58 HydrophobicContact CE-CE2 3.28Å; M54-Y58 WeakPolarHBondContact CE-OH 3.38Å; M54-Y58 HydrophobicContact CG-CD2 4.01Å; M54-Y58 HydrophobicContact CG-CE2 3.77Å; M54-Y58 VanDerWaalsContact O-CD2 3.24Å; M54-Y58 WeakPolarHBondContact O-CD2 3.44Å; M54-Y58 PolarHBondContact O-N 3.34Å; M54-Y58 HydrophobicContact SD-CD2 4.47Å; M54-Y58 HydrophobicContact SD-CE2 3.89Å; Y58-Y61 WeakPolarHBondContact O-CB 3.36Å; Y58-Y61 PolarHBondContact O-N 2.93Å; Y58-Y62 WeakPolarHBondContact O-CD2 3.32Å; Y58-Y62 PolarHBondContact O-N 2.87Å; Y58-M137 HydrophobicContact CE2-CE 4.18Å; Y58-M137 HydrophobicContact CE2-SD 4.35Å; Y58-M137 PolarHBondContact OH-SD 2.94Å |
| 59 | S | 86.7 | Confident | 83.1 | Confident | 58 Ų | 58 | 49.5 Ų | 49.5 | 41% | 0.406 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -63 | -45.9 | 176.9 | -61.6 | 0 | 0 | 0 | 0 | 111.1 | V55 C56 F57 Y61 Y62 I63 | V55-S59 VanDerWaalsContact O-CB 3.29Å; V55-S59 WeakPolarHBondContact O-CB 3.31Å; V55-S59 PolarHBondContact O-N 2.91Å; V55-S59 PolarHBondContact O-OG 3.03Å; C56-S59 PolarHBondContact O-N 3.45Å; F57-S59 PolarHBondContact O-N 3.07Å; S59-Y61 VanDerWaalsContact C-N 3.33Å; S59-Y61 PolarHBondContact O-N 3.04Å; S59-Y62 PolarHBondContact O-N 3Å; S59-I63 WeakPolarHBondContact O-CD1 3.4Å; S59-I63 VanDerWaalsContact O-CG1 3.23Å; S59-I63 WeakPolarHBondContact O-CG1 3.43Å; S59-I63 PolarHBondContact O-N 3.49Å |
| 60 | L | 85.9 | Confident | 82.8 | Confident | 36 Ų | 36 | 49.1 Ų | 49.1 | 19% | 0.188 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -61.8 | -41.2 | 173.4 | -71.9 | 172 | 0 | 0 | 0 | 111.6 | C56 F57 Y62 I63 V64 T107 L110 V114 | C56-L60 WeakPolarHBondContact O-CB 3.31Å; C56-L60 WeakPolarHBondContact O-CG 3.45Å; C56-L60 PolarHBondContact O-N 3.24Å; F57-L60 PolarHBondContact O-N 3.39Å; L60-Y62 PolarHBondContact O-N 3.26Å; L60-I63 PolarHBondContact O-N 3.31Å; L60-V64 WeakPolarHBondContact O-CB 3.18Å; L60-V64 WeakPolarHBondContact O-CG2 3.38Å; L60-V64 PolarHBondContact O-N 2.9Å; L60-T107 HydrophobicContact CB-CG2 4.39Å; L60-L110 HydrophobicContact CD1-CB 4.41Å; L60-V114 HydrophobicContact CD1-CB 4.34Å; L60-V114 HydrophobicContact CD1-CG2 4.02Å |
| 61 | Y | 84 | Confident | 82.6 | Confident | 13 Ų | 13 | 54 Ų | 54 | 5% | 0.051 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -54.3 | -55 | 174.9 | -180 | -100.8 | 0 | 0 | 0 | 111.3 | F57 Y58 S59 I63 V64 V65 P83 F84 T107 | F57-Y61 WeakPolarHBondContact O-CB 3.43Å; F57-Y61 PolarHBondContact O-N 3.22Å; Y58-Y61 WeakPolarHBondContact O-CB 3.36Å; Y58-Y61 PolarHBondContact O-N 2.93Å; S59-Y61 VanDerWaalsContact C-N 3.33Å; S59-Y61 PolarHBondContact O-N 3.04Å; Y61-I63 VanDerWaalsContact C-N 3.34Å; Y61-I63 PolarHBondContact O-N 3Å; Y61-V64 PolarHBondContact O-N 3.4Å; Y61-V65 HydrophobicContact CD1-CG2 4.16Å; Y61-V65 HydrophobicContact CD2-CG2 4.24Å; Y61-V65 HydrophobicContact CE1-CG2 3.79Å; Y61-V65 HydrophobicContact CE2-CG2 3.89Å; Y61-V65 HydrophobicContact CG-CG2 4.37Å; Y61-V65 WeakPolarHBondContact O-CB 3.13Å; Y61-V65 VanDerWaalsContact O-CG2 3.24Å; Y61-V65 WeakPolarHBondContact O-CG2 3.37Å; Y61-V65 PolarHBondContact O-N 2.86Å; Y61-P83 HydrophobicContact CE1-CB 4.43Å; Y61-F84 AromaticContact CE2-CE2 3.82Å; Y61-F84 HydrophobicContact CE2-CE2 3.82Å; Y61-F84 HydrophobicContact CE2-CZ 4.18Å; Y61-T107 WeakPolarHBondContact CA-OG1 3.5Å; Y61-T107 HydrophobicContact CD2-CG2 4.23Å |
| 62 | Y | 82 | Confident | 82 | Confident | 118 Ų | 118 | 52.8 Ų | 52.8 | 46% | 0.463 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -65.8 | -34.8 | -178.5 | -74.6 | -67 | 0 | 0 | 0 | 113.3 | Y58 S59 L60 S66 | Y58-Y62 WeakPolarHBondContact O-CD2 3.32Å; Y58-Y62 PolarHBondContact O-N 2.87Å; S59-Y62 PolarHBondContact O-N 3Å; L60-Y62 PolarHBondContact O-N 3.26Å; Y62-S66 VanDerWaalsContact O-CB 3.25Å; Y62-S66 WeakPolarHBondContact O-CB 3.5Å; Y62-S66 PolarHBondContact O-N 2.83Å |
| 63 | I | 86.4 | Confident | 81.2 | Confident | 97 Ų | 97 | 58.6 Ų | 58.6 | 50% | 0.497 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -65 | -49.2 | 175.2 | -69.1 | 164.6 | 0 | 0 | 0 | 110.5 | S59 L60 Y61 S66 L67 | S59-I63 WeakPolarHBondContact O-CD1 3.4Å; S59-I63 VanDerWaalsContact O-CG1 3.23Å; S59-I63 WeakPolarHBondContact O-CG1 3.43Å; S59-I63 PolarHBondContact O-N 3.49Å; L60-I63 PolarHBondContact O-N 3.31Å; Y61-I63 VanDerWaalsContact C-N 3.34Å; Y61-I63 PolarHBondContact O-N 3Å; I63-S66 PolarHBondContact O-N 2.9Å; I63-L67 HydrophobicContact CG2-CD1 4Å; I63-L67 HydrophobicContact CG2-CG 4.47Å; I63-L67 WeakPolarHBondContact O-CG 3.46Å; I63-L67 PolarHBondContact O-N 2.96Å |
| 64 | V | 84.1 | Confident | 80.3 | Confident | 6 Ų | 6 | 59.5 Ų | 59.5 | 4% | 0.036 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64.5 | -44.8 | -179.9 | 176.4 | 0 | 0 | 0 | 0 | 110.4 | L60 Y61 S66 L67 C68 S103 V106 L110 | L60-V64 WeakPolarHBondContact O-CB 3.18Å; L60-V64 WeakPolarHBondContact O-CG2 3.38Å; L60-V64 PolarHBondContact O-N 2.9Å; Y61-V64 PolarHBondContact O-N 3.4Å; V64-S66 VanDerWaalsContact C-N 3.31Å; V64-S66 PolarHBondContact O-N 2.79Å; V64-L67 PolarHBondContact O-N 3.45Å; V64-L67 VanDerWaalsContact O-N 3.15Å; V64-C68 WeakPolarHBondContact O-CB 3.38Å; V64-C68 PolarHBondContact O-N 2.97Å; V64-C68 PolarHBondContact O-SG 3.48Å; V64-S103 WeakPolarHBondContact CG1-OG 3.42Å; V64-V106 HydrophobicContact CG1-CB 3.84Å; V64-V106 HydrophobicContact CG1-CG1 3.69Å; V64-V106 HydrophobicContact CG2-CG1 3.97Å; V64-L110 HydrophobicContact CG2-CD1 3.79Å |
| 65 | V | 78.4 | Confident | 78.9 | Confident | 8 Ų | 8 | 67.3 Ų | 67.3 | 5% | 0.048 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -55.7 | -48.5 | 174.4 | 166.2 | 0 | 0 | 0 | 0 | 110.3 | Y61 L67 C68 I69 L80 S103 | Y61-V65 HydrophobicContact CD1-CG2 4.16Å; Y61-V65 HydrophobicContact CD2-CG2 4.24Å; Y61-V65 HydrophobicContact CE1-CG2 3.79Å; Y61-V65 HydrophobicContact CE2-CG2 3.89Å; Y61-V65 HydrophobicContact CG-CG2 4.37Å; Y61-V65 WeakPolarHBondContact O-CB 3.13Å; Y61-V65 VanDerWaalsContact O-CG2 3.24Å; Y61-V65 WeakPolarHBondContact O-CG2 3.37Å; Y61-V65 PolarHBondContact O-N 2.86Å; V65-L67 VanDerWaalsContact C-N 3.34Å; V65-L67 PolarHBondContact O-N 3.28Å; V65-C68 PolarHBondContact O-N 2.93Å; V65-I69 HydrophobicContact CG1-CD1 3.61Å; V65-I69 HydrophobicContact CG1-CG1 4.39Å; V65-I69 WeakPolarHBondContact O-CB 3.08Å; V65-I69 WeakPolarHBondContact O-CD1 3.42Å; V65-I69 WeakPolarHBondContact O-CG1 3.25Å; V65-I69 PolarHBondContact O-N 3Å; V65-L80 HydrophobicContact CG1-CD2 3.92Å; V65-S103 WeakPolarHBondContact CA-OG 3.2Å; V65-S103 WeakPolarHBondContact CG2-OG 3.46Å; V65-S103 PolarHBondContact N-OG 3.29Å |
| 66 | S | 80.6 | Confident | 77.5 | Confident | 78 Ų | 78 | 69.4 Ų | 69.4 | 55% | 0.545 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61.3 | -40.9 | 178.1 | -174.7 | 0 | 0 | 0 | 0 | 112.5 | Y62 I63 V64 G70 | Y62-S66 VanDerWaalsContact O-CB 3.25Å; Y62-S66 WeakPolarHBondContact O-CB 3.5Å; Y62-S66 PolarHBondContact O-N 2.83Å; I63-S66 PolarHBondContact O-N 2.9Å; V64-S66 VanDerWaalsContact C-N 3.31Å; V64-S66 PolarHBondContact O-N 2.79Å; S66-G70 PolarHBondContact O-N 3.38Å |
| 67 | L | 82.6 | Confident | 76 | Confident | 117 Ų | 117 | 71.9 Ų | 71.9 | 61% | 0.613 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -66.4 | -44.2 | 176.8 | -73.3 | 171.6 | 0 | 0 | 0 | 111.5 | I63 V64 V65 G70 L71 | I63-L67 HydrophobicContact CG2-CD1 4Å; I63-L67 HydrophobicContact CG2-CG 4.47Å; I63-L67 WeakPolarHBondContact O-CG 3.46Å; I63-L67 PolarHBondContact O-N 2.96Å; V64-L67 PolarHBondContact O-N 3.45Å; V64-L67 VanDerWaalsContact O-N 3.15Å; V65-L67 VanDerWaalsContact C-N 3.34Å; V65-L67 PolarHBondContact O-N 3.28Å; L67-G70 PolarHBondContact O-N 3.14Å; L67-L71 VanDerWaalsContact O-CB 3.3Å; L67-L71 WeakPolarHBondContact O-CB 3.23Å; L67-L71 PolarHBondContact O-N 2.93Å |
| 68 | C | 76.4 | Confident | 74.4 | Confident | 14 Ų | 14 | 78.7 Ų | 78.7 | 10% | 0.095 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -65.2 | -39.8 | 177.8 | -66.8 | 0 | 0 | 0 | 0 | 111.5 | V64 V65 L71 F72 V99 | V64-C68 WeakPolarHBondContact O-CB 3.38Å; V64-C68 PolarHBondContact O-N 2.97Å; V64-C68 PolarHBondContact O-SG 3.48Å; V65-C68 PolarHBondContact O-N 2.93Å; C68-L71 PolarHBondContact O-N 3.32Å; C68-F72 WeakPolarHBondContact O-CB 3.48Å; C68-F72 WeakPolarHBondContact O-CD2 3.29Å; C68-F72 PolarHBondContact O-N 3.31Å; C68-V99 HydrophobicContact CB-CG1 3.73Å |
| 69 | I | 74.3 | Confident | 72.9 | Confident | 29 Ų | 29 | 79.4 Ų | 79.4 | 15% | 0.149 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -60.8 | -46.1 | 173.2 | -69.2 | 164.4 | 0 | 0 | 0 | 110.7 | V65 L71 R73 I77 L80 | V65-I69 HydrophobicContact CG1-CD1 3.61Å; V65-I69 HydrophobicContact CG1-CG1 4.39Å; V65-I69 WeakPolarHBondContact O-CB 3.08Å; V65-I69 WeakPolarHBondContact O-CD1 3.42Å; V65-I69 WeakPolarHBondContact O-CG1 3.25Å; V65-I69 PolarHBondContact O-N 3Å; I69-L71 PolarHBondContact O-N 3.07Å; I69-R73 WeakPolarHBondContact O-CA 3.21Å; I69-R73 PolarHBondContact O-N 3.21Å; I69-I77 HydrophobicContact CD1-CG2 4.13Å; I69-L80 HydrophobicContact CD1-CB 4.44Å; I69-L80 HydrophobicContact CG1-CD1 4.21Å |
| 70 | G | 75.1 | Confident | 71.2 | Confident | 52 Ų | 52 | 77.7 Ų | 77.7 | 54% | 0.536 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.3 | -40.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | S66 L67 | S66-G70 PolarHBondContact O-N 3.38Å; L67-G70 PolarHBondContact O-N 3.14Å |
| 71 | L | 79.5 | Confident | 69.5 | Low | 135 Ų | 135 | 81 Ų | 81 | 71% | 0.707 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -74.9 | -41 | -177.5 | -166.9 | 147.3 | 0 | 0 | 0 | 112.4 | L67 C68 I69 | L67-L71 VanDerWaalsContact O-CB 3.3Å; L67-L71 WeakPolarHBondContact O-CB 3.23Å; L67-L71 PolarHBondContact O-N 2.93Å; C68-L71 PolarHBondContact O-N 3.32Å; I69-L71 PolarHBondContact O-N 3.07Å |
| 72 | F | 71.6 | Confident | 67.7 | Low | 76 Ų | 76 | 83 Ų | 83 | 33% | 0.333 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -89.3 | -1.2 | 179.6 | -74.9 | -90 | 0 | 0 | 0 | 113.8 | C68 V74 L98 V99 I102 | C68-F72 WeakPolarHBondContact O-CB 3.48Å; C68-F72 WeakPolarHBondContact O-CD2 3.29Å; C68-F72 PolarHBondContact O-N 3.31Å; F72-V74 HydrophobicContact CB-CG2 3.88Å; F72-V74 PolarHBondContact O-N 2.89Å; F72-V74 VanDerWaalsContact O-N 3.16Å; F72-L98 HydrophobicContact CE1-CD2 3.76Å; F72-L98 HydrophobicContact CZ-CD2 3.78Å; F72-V99 HydrophobicContact CB-CG2 3.58Å; F72-V99 HydrophobicContact CD1-CG2 4.04Å; F72-V99 HydrophobicContact CD2-CG2 3.4Å; F72-V99 VanDerWaalsContact CD2-CG2 3.4Å; F72-V99 HydrophobicContact CE2-CG2 4.02Å; F72-V99 HydrophobicContact CG-CG2 3.4Å; F72-I102 HydrophobicContact CZ-CD1 4.42Å |
| 73 | R | 68.4 | Low | 66.2 | Low | 218 Ų | 218 | 78.9 Ų | 78.9 | 82% | 0.823 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.3 | 38.6 | 177.5 | -73.9 | -112.1 | -177.8 | 167.2 | 0 | 113.4 | I69 H75 | I69-R73 WeakPolarHBondContact O-CA 3.21Å; I69-R73 PolarHBondContact O-N 3.21Å; R73-H75 PolarHBondContact O-N 3.44Å |
| 74 | V | 63.6 | Low | 64.7 | Low | 19 Ų | 19 | 75.3 Ų | 75.3 | 12% | 0.115 | 40% | 0.397 | C | S | . | . | trans | -73.3 | 117.4 | -177.9 | -178.4 | 0 | 0 | 0 | 0 | 109.5 | F72 K96 V99 | F72-V74 HydrophobicContact CB-CG2 3.88Å; F72-V74 PolarHBondContact O-N 2.89Å; F72-V74 VanDerWaalsContact O-N 3.16Å; V74-K96 HydrophobicContact CG1-CG 4.08Å; V74-V99 HydrophobicContact CG2-CG2 4.33Å | ||
| 75 | H | 55.3 | Low | 63.2 | Low | 188 Ų | 188 | 76.9 Ų | 76.9 | 87% | 0.87 | 41% | 0.405 | S | S | * | . | S | Bend | trans | -82.2 | -10.3 | -172.7 | -136.3 | 60.9 | 0 | 0 | 0 | 114.2 | R73 | R73-H75 PolarHBondContact O-N 3.44Š|
| 76 | E | 57.2 | Low | 61.9 | Low | 123 Ų | 123 | 78.9 Ų | 78.9 | 58% | 0.575 | 41% | 0.412 | S | S | * | . | trans | -110.2 | 97.5 | 177.2 | -75.8 | -171.5 | 169.9 | 0 | 0 | 110.8 | K96 | E76-K96 IonicContact OE2-NZ 2.58Å; E76-K96 PolarHBondContact OE2-NZ 3.45Å | ||
| 77 | I | 54.6 | Low | 60.5 | Low | 86 Ų | 86 | 80.2 Ų | 80.2 | 44% | 0.441 | 42% | 0.417 | S | S | . | . | trans | -86.3 | -21.9 | -170.4 | -25 | 177 | 0 | 0 | 0 | 111.6 | I69 S79 L80 L81 | I69-I77 HydrophobicContact CD1-CG2 4.13Å; I77-S79 PolarHBondContact O-N 2.91Å; I77-L80 PolarHBondContact O-N 3.29Å; I77-L81 HydrophobicContact CG2-CD1 3.77Å; I77-L81 WeakPolarHBondContact O-CD1 3.43Å; I77-L81 PolarHBondContact O-N 2.91Å | ||
| 78 | N | 52.2 | Low | 59.2 | Low | 145 Ų | 145 | 76.9 Ų | 76.9 | 78% | 0.775 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.6 | -31.5 | -165.5 | -64.3 | -27.6 | 0 | 0 | 0 | 114.5 | ||
| 79 | S | 51.9 | Low | 58.2 | Low | 52 Ų | 52 | 84 Ų | 84 | 36% | 0.364 | 43% | 0.434 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.4 | -17.8 | 178.7 | 158 | 0 | 0 | 0 | 0 | 112.8 | I77 T82 D85 | I77-S79 PolarHBondContact O-N 2.91Å; S79-T82 PolarHBondContact O-OG1 3.33Å; S79-D85 PolarHBondContact OG-OD2 3.08Å |
| 80 | L | 52.1 | Low | 57.3 | Low | 21 Ų | 21 | 86 Ų | 86 | 11% | 0.11 | 45% | 0.448 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | -18.6 | 176.5 | -119.6 | 152 | 0 | 0 | 0 | 112.9 | V65 I69 I77 V99 | V65-L80 HydrophobicContact CG1-CD2 3.92Å; I69-L80 HydrophobicContact CD1-CB 4.44Å; I69-L80 HydrophobicContact CG1-CD1 4.21Å; I77-L80 PolarHBondContact O-N 3.29Å; L80-V99 HydrophobicContact CD1-CG1 3.81Å; L80-V99 HydrophobicContact CD2-CG1 4.09Å |
| 81 | L | 48.8 | Very low | 56.6 | Low | 105 Ų | 105 | 85.5 Ų | 85.5 | 55% | 0.55 | 44% | 0.436 | S | S | . | . | S | Bend | trans | -76.3 | -26.3 | 176 | -108.8 | 78.9 | 0 | 0 | 0 | 113 | I77 P83 | I77-L81 HydrophobicContact CG2-CD1 3.77Å; I77-L81 WeakPolarHBondContact O-CD1 3.43Å; I77-L81 PolarHBondContact O-N 2.91Å; L81-P83 WeakPolarHBondContact O-CD 3.39Å |
| 82 | T | 47.2 | Very low | 55.7 | Low | 56 Ų | 56 | 88.3 Ų | 88.3 | 34% | 0.344 | 44% | 0.438 | S | S | . | . | S | Bend | trans | -71.1 | 114.7 | 166.6 | 31.6 | 0 | 0 | 0 | 0 | 107.9 | S79 F84 | S79-T82 PolarHBondContact O-OG1 3.33Å; T82-F84 PolarHBondContact O-N 2.89Å |
| 83 | P | 49.7 | Very low | 55.2 | Low | 32 Ų | 32 | 93.5 Ų | 93.5 | 21% | 0.208 | 46% | 0.463 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | 120.7 | 175.7 | -15.1 | 28 | 0 | 0 | 0 | 107.4 | Y61 L81 | Y61-P83 HydrophobicContact CE1-CB 4.43Å; L81-P83 WeakPolarHBondContact O-CD 3.39Å |
| 84 | F | 55.3 | Low | 55.1 | Low | 22 Ų | 22 | 85.7 Ų | 85.7 | 10% | 0.096 | 44% | 0.437 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 60.9 | 66.2 | 172.2 | -61 | -94.2 | 0 | 0 | 0 | 115 | Y61 T82 Y86 T104 H134 T138 W151 L155 | Y61-F84 AromaticContact CE2-CE2 3.82Å; Y61-F84 HydrophobicContact CE2-CE2 3.82Å; Y61-F84 HydrophobicContact CE2-CZ 4.18Å; T82-F84 PolarHBondContact O-N 2.89Å; F84-Y86 VanDerWaalsContact O-CD1 3.24Å; F84-Y86 WeakPolarHBondContact O-CD1 3.47Å; F84-Y86 PolarHBondContact O-N 2.75Å; F84-Y86 VanDerWaalsContact O-N 3.11Å; F84-T104 HydrophobicContact CE1-CG2 3.49Å; F84-T104 VanDerWaalsContact CE1-CG2 3.49Å; F84-T104 WeakPolarHBondContact CE1-OG1 3.24Å; F84-T104 HydrophobicContact CZ-CG2 3.66Å; F84-H134 AromaticContact CD2-CE1 3.61Å; F84-H134 AromaticContact CD2-NE2 3.38Å; F84-H134 WeakPolarHBondContact CD2-NE2 3.46Å; F84-H134 AromaticContact CE2-CE1 3.23Å; F84-H134 WeakPolarHBondContact CE2-CE1 3.49Å; F84-H134 AromaticContact CE2-NE2 3.1Å; F84-H134 WeakPolarHBondContact CE2-NE2 3.43Å; F84-H134 AromaticContact CZ-NE2 3.59Å; F84-T138 HydrophobicContact CB-CG2 4.41Å; F84-W151 AromaticContact CD1-CD1 3.82Å; F84-W151 AromaticContact CD1-NE1 3.42Å; F84-W151 AromaticContact CG-NE1 3.73Å; F84-L155 HydrophobicContact CE1-CD2 4.39Å |
| 85 | D | 52.1 | Low | 55.3 | Low | 39 Ų | 39 | 88 Ų | 88 | 21% | 0.209 | 45% | 0.453 | C | S | . | . | trans | -70 | 98.9 | 164 | -172.4 | -4.9 | 0 | 0 | 0 | 110.5 | S79 T87 T88 | S79-D85 PolarHBondContact OG-OD2 3.08Å; D85-T87 VanDerWaalsContact C-N 3.27Å; D85-T87 PolarHBondContact O-N 3.07Å; D85-T87 WeakPolarHBondContact OD1-CB 3.32Å; D85-T87 PolarHBondContact OD1-N 3.34Å; D85-T87 VanDerWaalsContact OD1-N 3.07Å; D85-T87 PolarHBondContact OD1-OG1 3.42Å; D85-T88 PolarHBondContact O-OG1 3.26Å | ||
| 86 | Y | 51.8 | Low | 55.9 | Low | 49 Ų | 49 | 82.4 Ų | 82.4 | 19% | 0.192 | 43% | 0.426 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84 | 4.9 | 178.3 | 44.9 | -101.1 | 0 | 0 | 0 | 113.7 | F84 M142 P146 | F84-Y86 VanDerWaalsContact O-CD1 3.24Å; F84-Y86 WeakPolarHBondContact O-CD1 3.47Å; F84-Y86 PolarHBondContact O-N 2.75Å; F84-Y86 VanDerWaalsContact O-N 3.11Å; Y86-M142 HydrophobicContact CE1-CB 4.36Å; Y86-M142 HydrophobicContact CE1-CE 4.06Å; Y86-M142 HydrophobicContact CE1-CG 3.9Å; Y86-M142 WeakPolarHBondContact OH-CB 3.43Å; Y86-M142 WeakPolarHBondContact OH-CG 3.24Å; Y86-P146 HydrophobicContact CD1-CB 4.21Å; Y86-P146 HydrophobicContact CE1-CB 4.28Å |
| 87 | T | 50.7 | Low | 56.4 | Low | 107 Ų | 107 | 78.1 Ų | 78.1 | 66% | 0.656 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.7 | -10.2 | -179.7 | 71.3 | 0 | 0 | 0 | 0 | 113.2 | D85 Q89 | D85-T87 VanDerWaalsContact C-N 3.27Å; D85-T87 PolarHBondContact O-N 3.07Å; D85-T87 WeakPolarHBondContact OD1-CB 3.32Å; D85-T87 PolarHBondContact OD1-N 3.34Å; D85-T87 VanDerWaalsContact OD1-N 3.07Å; D85-T87 PolarHBondContact OD1-OG1 3.42Å; T87-Q89 PolarHBondContact O-N 3.21Å |
| 88 | T | 54.8 | Low | 57.2 | Low | 46 Ų | 46 | 76.2 Ų | 76.2 | 28% | 0.282 | 40% | 0.395 | S | S | . | . | S | Bend | trans | -72.7 | 127.4 | 177.3 | 25.3 | 0 | 0 | 0 | 0 | 111.3 | D85 | D85-T88 PolarHBondContact O-OG1 3.26Š|
| 89 | Q | 55.4 | Low | 58.2 | Low | 165 Ų | 165 | 69.3 Ų | 69.3 | 77% | 0.771 | 36% | 0.358 | S | S | * | . | trans | -57 | 135.8 | 175.4 | -78.2 | -179.4 | 21.5 | 0 | 0 | 110.8 | T87 S91 | T87-Q89 PolarHBondContact O-N 3.21Å; Q89-S91 PolarHBondContact O-N 3.08Å | ||
| 90 | P | 56.6 | Low | 59.2 | Low | 70 Ų | 70 | 68 Ų | 68 | 46% | 0.455 | 35% | 0.354 | S | S | . | . | trans | -67.4 | 96.7 | 178.8 | 28.2 | -34.4 | 0 | 0 | 0 | 109.3 | Y97 | P90-Y97 HydrophobicContact CB-CE2 4.4Š| ||
| 91 | S | 59.8 | Low | 60.3 | Low | 41 Ų | 41 | 68.6 Ų | 68.6 | 29% | 0.287 | 36% | 0.358 | S | S | . | . | trans | -129.2 | 107.2 | 178.7 | 167 | 0 | 0 | 0 | 0 | 108.4 | Q89 Q93 N94 | Q89-S91 PolarHBondContact O-N 3.08Å; S91-Q93 PolarHBondContact O-N 3.32Å; S91-Q93 VanDerWaalsContact O-N 3.11Å; S91-Q93 PolarHBondContact OG-N 2.93Å; S91-N94 PolarHBondContact O-N 3.48Å; S91-N94 PolarHBondContact OG-N 3Å | ||
| 92 | W | 60.3 | Low | 61.7 | Low | 195 Ų | 195 | 66.8 Ų | 66.8 | 74% | 0.739 | 35% | 0.348 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.7 | -13.8 | 172.2 | -64.9 | 98.2 | 0 | 0 | 0 | 113.1 | ||
| 93 | Q | 61.4 | Low | 63.2 | Low | 185 Ų | 185 | 64.1 Ų | 64.1 | 86% | 0.864 | 33% | 0.332 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | -13 | 175.1 | -62.9 | -176.7 | -3.5 | 0 | 0 | 112.5 | S91 P95 | S91-Q93 PolarHBondContact O-N 3.32Å; S91-Q93 VanDerWaalsContact O-N 3.11Å; S91-Q93 PolarHBondContact OG-N 2.93Å; Q93-P95 WeakPolarHBondContact O-CD 3.38Å |
| 94 | N | 66.4 | Low | 64.5 | Low | 53 Ų | 53 | 63 Ų | 63 | 28% | 0.283 | 33% | 0.325 | S | S | . | . | trans | -89.1 | 114.6 | 179 | -168.8 | -26.8 | 0 | 0 | 0 | 110 | S91 K96 Y97 L98 | S91-N94 PolarHBondContact O-N 3.48Å; S91-N94 PolarHBondContact OG-N 3Å; N94-K96 PolarHBondContact O-N 3.45Å; N94-K96 VanDerWaalsContact O-N 3.11Å; N94-K96 VanDerWaalsContact OD1-CB 3.31Å; N94-K96 WeakPolarHBondContact OD1-CB 3.42Å; N94-K96 PolarHBondContact OD1-N 2.83Å; N94-Y97 PolarHBondContact O-N 3.47Å; N94-L98 PolarHBondContact O-N 2.82Å | ||
| 95 | P | 67.7 | Low | 65.8 | Low | 68 Ų | 68 | 63.4 Ų | 63.4 | 44% | 0.442 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -61 | -23.9 | -179.4 | 25 | -34.1 | 0 | 0 | 0 | 112.7 | Q93 V99 | Q93-P95 WeakPolarHBondContact O-CD 3.38Å; P95-V99 VanDerWaalsContact O-CB 3.29Å; P95-V99 WeakPolarHBondContact O-CB 3.47Å; P95-V99 WeakPolarHBondContact O-CG2 3.37Å; P95-V99 PolarHBondContact O-N 3Å |
| 96 | K | 67.4 | Low | 67.3 | Low | 71 Ų | 71 | 64.3 Ų | 64.3 | 31% | 0.309 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -67.7 | -47.5 | 177.3 | -62.6 | 177.5 | 176 | 179.4 | 0 | 112.3 | V74 E76 N94 L98 V99 G100 | V74-K96 HydrophobicContact CG1-CG 4.08Å; E76-K96 IonicContact OE2-NZ 2.58Å; E76-K96 PolarHBondContact OE2-NZ 3.45Å; N94-K96 PolarHBondContact O-N 3.45Å; N94-K96 VanDerWaalsContact O-N 3.11Å; N94-K96 VanDerWaalsContact OD1-CB 3.31Å; N94-K96 WeakPolarHBondContact OD1-CB 3.42Å; N94-K96 PolarHBondContact OD1-N 2.83Å; K96-L98 VanDerWaalsContact C-N 3.35Å; K96-V99 PolarHBondContact O-N 3.37Å; K96-G100 PolarHBondContact O-N 3.24Å |
| 97 | Y | 67.9 | Low | 69 | Low | 33 Ų | 33 | 62 Ų | 62 | 13% | 0.129 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64.4 | -43.8 | 177.4 | 177.7 | -101 | 0 | 0 | 0 | 110.4 | P90 N94 V99 G100 V101 | P90-Y97 HydrophobicContact CB-CE2 4.4Å; N94-Y97 PolarHBondContact O-N 3.47Å; Y97-V99 PolarHBondContact O-N 3.5Å; Y97-G100 PolarHBondContact O-N 2.89Å; Y97-V101 HydrophobicContact CD1-CG2 4.39Å; Y97-V101 HydrophobicContact CD2-CG2 4.47Å; Y97-V101 HydrophobicContact CE1-CG2 3.96Å; Y97-V101 HydrophobicContact CE2-CG2 4.06Å; Y97-V101 WeakPolarHBondContact O-CG2 3.33Å; Y97-V101 PolarHBondContact O-N 3.47Å |
| 98 | L | 72.1 | Confident | 70.5 | Confident | 45 Ų | 45 | 57 Ų | 57 | 24% | 0.236 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.1 | -43.6 | 178.6 | -162.8 | 116.2 | 0 | 0 | 0 | 112.1 | F72 N94 K96 I102 | F72-L98 HydrophobicContact CE1-CD2 3.76Å; F72-L98 HydrophobicContact CZ-CD2 3.78Å; N94-L98 PolarHBondContact O-N 2.82Å; K96-L98 VanDerWaalsContact C-N 3.35Å; L98-I102 HydrophobicContact CD2-CD1 3.36Å; L98-I102 HydrophobicContact CG-CD1 3.66Å; L98-I102 HydrophobicContact CG-CG1 4.4Å; L98-I102 VanDerWaalsContact O-CB 3.27Å; L98-I102 WeakPolarHBondContact O-CB 3.44Å; L98-I102 WeakPolarHBondContact O-CG1 3.29Å; L98-I102 PolarHBondContact O-N 2.94Å |
| 99 | V | 72.8 | Confident | 71.9 | Confident | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.5 | -43.4 | 175.2 | 164.4 | 0 | 0 | 0 | 0 | 111.5 | C68 F72 V74 L80 P95 K96 Y97 S103 | C68-V99 HydrophobicContact CB-CG1 3.73Å; F72-V99 HydrophobicContact CB-CG2 3.58Å; F72-V99 HydrophobicContact CD1-CG2 4.04Å; F72-V99 HydrophobicContact CD2-CG2 3.4Å; F72-V99 VanDerWaalsContact CD2-CG2 3.4Å; F72-V99 HydrophobicContact CE2-CG2 4.02Å; F72-V99 HydrophobicContact CG-CG2 3.4Å; V74-V99 HydrophobicContact CG2-CG2 4.33Å; L80-V99 HydrophobicContact CD1-CG1 3.81Å; L80-V99 HydrophobicContact CD2-CG1 4.09Å; P95-V99 VanDerWaalsContact O-CB 3.29Å; P95-V99 WeakPolarHBondContact O-CB 3.47Å; P95-V99 WeakPolarHBondContact O-CG2 3.37Å; P95-V99 PolarHBondContact O-N 3Å; K96-V99 PolarHBondContact O-N 3.37Å; Y97-V99 PolarHBondContact O-N 3.5Å; V99-S103 WeakPolarHBondContact O-CB 3.16Å; V99-S103 PolarHBondContact O-N 3.29Å |
| 100 | G | 73.2 | Confident | 73.3 | Confident | 26 Ų | 26 | 52.9 Ų | 52.9 | 27% | 0.268 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61 | -48.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | K96 Y97 T104 | K96-G100 PolarHBondContact O-N 3.24Å; Y97-G100 PolarHBondContact O-N 2.89Å; G100-T104 WeakPolarHBondContact O-CB 3.3Å; G100-T104 PolarHBondContact O-N 3.17Å; G100-T104 PolarHBondContact O-OG1 3.46Å |
| 101 | V | 74.4 | Confident | 74.6 | Confident | 32 Ų | 32 | 49.6 Ų | 49.6 | 19% | 0.194 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65.8 | -49.7 | 178.8 | 176.3 | 0 | 0 | 0 | 0 | 111 | Y97 S103 T104 E105 | Y97-V101 HydrophobicContact CD1-CG2 4.39Å; Y97-V101 HydrophobicContact CD2-CG2 4.47Å; Y97-V101 HydrophobicContact CE1-CG2 3.96Å; Y97-V101 HydrophobicContact CE2-CG2 4.06Å; Y97-V101 WeakPolarHBondContact O-CG2 3.33Å; Y97-V101 PolarHBondContact O-N 3.47Å; V101-S103 VanDerWaalsContact C-N 3.34Å; V101-S103 PolarHBondContact O-N 3.49Å; V101-T104 WeakPolarHBondContact O-CB 3.38Å; V101-T104 PolarHBondContact O-N 3.47Å; V101-E105 HydrophobicContact CG1-CG 4.28Å; V101-E105 WeakPolarHBondContact O-CB 3.24Å; V101-E105 VanDerWaalsContact O-CG 3.3Å; V101-E105 WeakPolarHBondContact O-CG 3.44Å; V101-E105 PolarHBondContact O-N 3.39Å |
| 102 | I | 78.3 | Confident | 75.7 | Confident | 67 Ų | 67 | 47.7 Ų | 47.7 | 34% | 0.344 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.7 | -43.2 | -179.7 | -69.1 | 173 | 0 | 0 | 0 | 110.9 | F72 L98 T104 E105 V106 | F72-I102 HydrophobicContact CZ-CD1 4.42Å; L98-I102 HydrophobicContact CD2-CD1 3.36Å; L98-I102 HydrophobicContact CG-CD1 3.66Å; L98-I102 HydrophobicContact CG-CG1 4.4Å; L98-I102 VanDerWaalsContact O-CB 3.27Å; L98-I102 WeakPolarHBondContact O-CB 3.44Å; L98-I102 WeakPolarHBondContact O-CG1 3.29Å; L98-I102 PolarHBondContact O-N 2.94Å; I102-T104 VanDerWaalsContact C-N 3.31Å; I102-T104 PolarHBondContact O-N 3.42Å; I102-E105 PolarHBondContact O-N 2.99Å; I102-V106 HydrophobicContact CG2-CG2 4.05Å; I102-V106 VanDerWaalsContact O-CB 3.32Å; I102-V106 WeakPolarHBondContact O-CB 3.3Å; I102-V106 WeakPolarHBondContact O-CG2 3.43Å; I102-V106 PolarHBondContact O-N 3.49Å |
| 103 | S | 79.8 | Confident | 76.7 | Confident | 1 Ų | 1 | 41.5 Ų | 41.5 | 1% | 0.007 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -60.8 | -45.1 | 178.2 | -175.2 | 0 | 0 | 0 | 0 | 110.7 | V64 V65 V99 V101 V106 T107 | V64-S103 WeakPolarHBondContact CG1-OG 3.42Å; V65-S103 WeakPolarHBondContact CA-OG 3.2Å; V65-S103 WeakPolarHBondContact CG2-OG 3.46Å; V65-S103 PolarHBondContact N-OG 3.29Å; V99-S103 WeakPolarHBondContact O-CB 3.16Å; V99-S103 PolarHBondContact O-N 3.29Å; V101-S103 VanDerWaalsContact C-N 3.34Å; V101-S103 PolarHBondContact O-N 3.49Å; S103-V106 PolarHBondContact O-N 3.49Å; S103-T107 WeakPolarHBondContact O-CB 3.39Å; S103-T107 PolarHBondContact O-N 2.92Å; S103-T107 PolarHBondContact O-OG1 2.98Å |
| 104 | T | 76.9 | Confident | 77.7 | Confident | 9 Ų | 9 | 35 Ų | 35 | 6% | 0.055 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -58.3 | -54.9 | 176.1 | -59 | 0 | 0 | 0 | 0 | 111 | F84 G100 V101 I102 V106 T107 Y108 | F84-T104 HydrophobicContact CE1-CG2 3.49Å; F84-T104 VanDerWaalsContact CE1-CG2 3.49Å; F84-T104 WeakPolarHBondContact CE1-OG1 3.24Å; F84-T104 HydrophobicContact CZ-CG2 3.66Å; G100-T104 WeakPolarHBondContact O-CB 3.3Å; G100-T104 PolarHBondContact O-N 3.17Å; G100-T104 PolarHBondContact O-OG1 3.46Å; V101-T104 WeakPolarHBondContact O-CB 3.38Å; V101-T104 PolarHBondContact O-N 3.47Å; I102-T104 VanDerWaalsContact C-N 3.31Å; I102-T104 PolarHBondContact O-N 3.42Å; T104-V106 VanDerWaalsContact C-N 3.33Å; T104-V106 PolarHBondContact O-N 3.4Å; T104-T107 WeakPolarHBondContact O-CB 3.2Å; T104-T107 PolarHBondContact O-N 3.47Å; T104-T107 VanDerWaalsContact O-N 3.13Å; T104-Y108 HydrophobicContact CG2-CD2 3.75Å; T104-Y108 HydrophobicContact CG2-CE2 3.79Å; T104-Y108 VanDerWaalsContact O-CD2 3.31Å; T104-Y108 WeakPolarHBondContact O-CD2 3.1Å; T104-Y108 PolarHBondContact O-N 2.96Å |
| 105 | E | 82.8 | Confident | 78.2 | Confident | 30 Ų | 30 | 32.5 Ų | 32.5 | 14% | 0.14 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -58.7 | -43.7 | -178.4 | -70.2 | -66.7 | 161.2 | 0 | 0 | 111.8 | V101 I102 Y108 V109 S157 M161 | V101-E105 HydrophobicContact CG1-CG 4.28Å; V101-E105 WeakPolarHBondContact O-CB 3.24Å; V101-E105 VanDerWaalsContact O-CG 3.3Å; V101-E105 WeakPolarHBondContact O-CG 3.44Å; V101-E105 PolarHBondContact O-N 3.39Å; I102-E105 PolarHBondContact O-N 2.99Å; E105-Y108 PolarHBondContact O-N 3.47Å; E105-V109 WeakPolarHBondContact O-CG2 3.24Å; E105-V109 PolarHBondContact O-N 2.97Å; E105-S157 PolarHBondContact OE1-OG 3.44Å; E105-M161 HydrophobicContact CB-CE 4.38Å; E105-M161 WeakPolarHBondContact OE2-CE 3.11Å |
| 106 | V | 83.3 | Confident | 78.6 | Confident | 58 Ų | 58 | 29.5 Ų | 29.5 | 35% | 0.352 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -65.4 | -40.8 | 177.3 | 172 | 0 | 0 | 0 | 0 | 111.1 | V64 I102 S103 T104 V109 L110 | V64-V106 HydrophobicContact CG1-CB 3.84Å; V64-V106 HydrophobicContact CG1-CG1 3.69Å; V64-V106 HydrophobicContact CG2-CG1 3.97Å; I102-V106 HydrophobicContact CG2-CG2 4.05Å; I102-V106 VanDerWaalsContact O-CB 3.32Å; I102-V106 WeakPolarHBondContact O-CB 3.3Å; I102-V106 WeakPolarHBondContact O-CG2 3.43Å; I102-V106 PolarHBondContact O-N 3.49Å; S103-V106 PolarHBondContact O-N 3.49Å; T104-V106 VanDerWaalsContact C-N 3.33Å; T104-V106 PolarHBondContact O-N 3.4Å; V106-V109 PolarHBondContact O-N 2.94Å; V106-L110 HydrophobicContact CG1-CD1 3.78Å; V106-L110 HydrophobicContact CG1-CG 4.2Å; V106-L110 WeakPolarHBondContact O-CB 3.23Å; V106-L110 VanDerWaalsContact O-CG 3.31Å; V106-L110 WeakPolarHBondContact O-CG 3.41Å; V106-L110 PolarHBondContact O-N 3.03Å |
| 107 | T | 86 | Confident | 78.8 | Confident | 1 Ų | 1 | 35.1 Ų | 35.1 | 1% | 0.006 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62.1 | -42.1 | 174.5 | -61.4 | 0 | 0 | 0 | 0 | 111.8 | F57 L60 Y61 S103 T104 G111 | F57-T107 HydrophobicContact CD2-CG2 4.36Å; F57-T107 HydrophobicContact CE2-CG2 4Å; F57-T107 HydrophobicContact CZ-CG2 4.14Å; L60-T107 HydrophobicContact CB-CG2 4.39Å; Y61-T107 WeakPolarHBondContact CA-OG1 3.5Å; Y61-T107 HydrophobicContact CD2-CG2 4.23Å; S103-T107 WeakPolarHBondContact O-CB 3.39Å; S103-T107 PolarHBondContact O-N 2.92Å; S103-T107 PolarHBondContact O-OG1 2.98Å; T104-T107 WeakPolarHBondContact O-CB 3.2Å; T104-T107 PolarHBondContact O-N 3.47Å; T104-T107 VanDerWaalsContact O-N 3.13Å; T107-G111 WeakPolarHBondContact O-CA 3.3Å; T107-G111 PolarHBondContact O-N 2.79Å |
| 108 | Y | 83.2 | Confident | 78.9 | Confident | 1 Ų | 1 | 36.5 Ų | 36.5 | 0% | 0.004 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -65.6 | -39.6 | 177.1 | -90.1 | -84.8 | 0 | 0 | 0 | 112.2 | F57 T104 E105 G112 L155 M162 | F57-Y108 HydrophobicContact CE2-CD1 4.25Å; F57-Y108 HydrophobicContact CE2-CE1 4.19Å; F57-Y108 HydrophobicContact CE2-CE2 4.46Å; F57-Y108 HydrophobicContact CE2-CG 4.4Å; F57-Y108 HydrophobicContact CZ-CD2 4.28Å; F57-Y108 HydrophobicContact CZ-CE1 4.13Å; F57-Y108 AromaticContact CZ-CE2 3.87Å; F57-Y108 HydrophobicContact CZ-CE2 3.87Å; F57-Y108 AromaticContact CZ-CZ 3.78Å; T104-Y108 HydrophobicContact CG2-CD2 3.75Å; T104-Y108 HydrophobicContact CG2-CE2 3.79Å; T104-Y108 VanDerWaalsContact O-CD2 3.31Å; T104-Y108 WeakPolarHBondContact O-CD2 3.1Å; T104-Y108 PolarHBondContact O-N 2.96Å; E105-Y108 PolarHBondContact O-N 3.47Å; Y108-G112 PolarHBondContact O-N 3.39Å; Y108-L155 HydrophobicContact CE2-CD2 4Å; Y108-L155 WeakPolarHBondContact OH-CD2 3.3Å; Y108-M162 HydrophobicContact CD1-CB 4.24Å; Y108-M162 HydrophobicContact CD1-CE 3.91Å; Y108-M162 HydrophobicContact CD1-SD 3.79Å; Y108-M162 HydrophobicContact CE1-CE 3.94Å; Y108-M162 HydrophobicContact CE1-SD 4.34Å |
| 109 | V | 84.6 | Confident | 78.6 | Confident | 58 Ų | 58 | 34.9 Ų | 34.9 | 35% | 0.352 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -65 | -52.2 | 174.9 | 171.6 | 0 | 0 | 0 | 0 | 111.1 | E105 V106 G111 G112 L113 M161 | E105-V109 WeakPolarHBondContact O-CG2 3.24Å; E105-V109 PolarHBondContact O-N 2.97Å; V106-V109 PolarHBondContact O-N 2.94Å; V109-G111 VanDerWaalsContact C-N 3.32Å; V109-G111 PolarHBondContact O-N 3.28Å; V109-G112 PolarHBondContact O-N 2.92Å; V109-L113 WeakPolarHBondContact O-CG 3.38Å; V109-L113 PolarHBondContact O-N 3.11Å; V109-L113 VanDerWaalsContact O-N 3.15Å; V109-M161 HydrophobicContact CG2-CB 4.29Å; V109-M161 HydrophobicContact CG2-CE 3.88Å; V109-M161 HydrophobicContact CG2-SD 4.12Å |
| 110 | L | 84.9 | Confident | 78 | Confident | 67 Ų | 67 | 41.2 Ų | 41.2 | 35% | 0.351 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -64.3 | -38.8 | 179.3 | -67.8 | 176.8 | 0 | 0 | 0 | 111.8 | L60 V64 V106 L113 V114 | L60-L110 HydrophobicContact CD1-CB 4.41Å; V64-L110 HydrophobicContact CG2-CD1 3.79Å; V106-L110 HydrophobicContact CG1-CD1 3.78Å; V106-L110 HydrophobicContact CG1-CG 4.2Å; V106-L110 WeakPolarHBondContact O-CB 3.23Å; V106-L110 VanDerWaalsContact O-CG 3.31Å; V106-L110 WeakPolarHBondContact O-CG 3.41Å; V106-L110 PolarHBondContact O-N 3.03Å; L110-L113 HydrophobicContact CD2-CD1 4.45Å; L110-L113 PolarHBondContact O-N 3.38Å; L110-V114 WeakPolarHBondContact O-CG2 3.47Å; L110-V114 PolarHBondContact O-N 3.14Å |
| 111 | G | 83.8 | Confident | 77.2 | Confident | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.1 | -45.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | T107 V109 L113 V114 F115 | T107-G111 WeakPolarHBondContact O-CA 3.3Å; T107-G111 PolarHBondContact O-N 2.79Å; V109-G111 VanDerWaalsContact C-N 3.32Å; V109-G111 PolarHBondContact O-N 3.28Å; G111-L113 VanDerWaalsContact C-N 3.34Å; G111-L113 PolarHBondContact O-N 3.26Å; G111-V114 PolarHBondContact O-N 3.42Å; G111-F115 WeakPolarHBondContact O-CB 3.34Å; G111-F115 VanDerWaalsContact O-CD1 3.26Å; G111-F115 WeakPolarHBondContact O-CD1 3.3Å; G111-F115 VanDerWaalsContact O-CG 3.24Å; G111-F115 WeakPolarHBondContact O-CG 3.38Å; G111-F115 PolarHBondContact O-N 3.16Å |
| 112 | G | 81.8 | Confident | 76.7 | Confident | 1 Ų | 1 | 52.2 Ų | 52.2 | 1% | 0.01 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -61.3 | -38.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y108 V109 F115 A116 M162 | Y108-G112 PolarHBondContact O-N 3.39Å; V109-G112 PolarHBondContact O-N 2.92Å; G112-F115 PolarHBondContact O-N 3.28Å; G112-A116 WeakPolarHBondContact O-CB 3.26Å; G112-A116 PolarHBondContact O-N 2.93Å; G112-M162 VanDerWaalsContact CA-CG 3.45Å |
| 113 | L | 82.8 | Confident | 76.2 | Confident | 66 Ų | 66 | 49.5 Ų | 49.5 | 35% | 0.346 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -65.8 | -44.9 | 175.3 | -63.4 | 172.3 | 0 | 0 | 0 | 111.4 | V109 L110 G111 F115 A116 W117 L169 | V109-L113 WeakPolarHBondContact O-CG 3.38Å; V109-L113 PolarHBondContact O-N 3.11Å; V109-L113 VanDerWaalsContact O-N 3.15Å; L110-L113 HydrophobicContact CD2-CD1 4.45Å; L110-L113 PolarHBondContact O-N 3.38Å; G111-L113 VanDerWaalsContact C-N 3.34Å; G111-L113 PolarHBondContact O-N 3.26Å; L113-F115 VanDerWaalsContact C-N 3.35Å; L113-A116 PolarHBondContact O-N 3.46Å; L113-W117 PolarHBondContact O-N 2.97Å; L113-W117 VanDerWaalsContact O-N 3.16Å; L113-L169 HydrophobicContact CB-CD2 4.11Å; L113-L169 HydrophobicContact CD2-CB 4.16Å; L113-L169 HydrophobicContact CD2-CD1 4.42Å; L113-L169 HydrophobicContact CD2-CD2 3.79Å; L113-L169 HydrophobicContact CD2-CG 4.33Å; L113-L169 WeakPolarHBondContact O-CD2 3.31Å |
| 114 | V | 81.9 | Confident | 75.9 | Confident | 49 Ų | 49 | 55.3 Ų | 55.3 | 30% | 0.297 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -66.7 | -37.4 | 177.3 | 171.1 | 0 | 0 | 0 | 0 | 111.2 | C56 L60 L110 G111 W117 I118 | C56-V114 HydrophobicContact CB-CG1 4.44Å; L60-V114 HydrophobicContact CD1-CB 4.34Å; L60-V114 HydrophobicContact CD1-CG2 4.02Å; L110-V114 WeakPolarHBondContact O-CG2 3.47Å; L110-V114 PolarHBondContact O-N 3.14Å; G111-V114 PolarHBondContact O-N 3.42Å; V114-W117 WeakPolarHBondContact O-CB 3.09Å; V114-W117 PolarHBondContact O-N 3.25Å; V114-W117 VanDerWaalsContact O-N 3.14Å; V114-I118 HydrophobicContact CG1-CD1 3.53Å; V114-I118 HydrophobicContact CG1-CG1 4.25Å; V114-I118 VanDerWaalsContact O-CG1 3.3Å; V114-I118 WeakPolarHBondContact O-CG1 3.24Å; V114-I118 PolarHBondContact O-N 3.48Å |
| 115 | F | 77.3 | Confident | 76.1 | Confident | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -68.9 | -38 | 178.2 | -74.9 | 10.4 | 0 | 0 | 0 | 112 | C53 F57 G111 G112 L113 W117 I118 V119 V123 V130 M162 | C53-F115 HydrophobicContact CB-CD1 4.23Å; C53-F115 HydrophobicContact CB-CE1 3.61Å; C53-F115 HydrophobicContact CB-CE2 4.25Å; C53-F115 HydrophobicContact CB-CZ 3.62Å; C53-F115 VanDerWaalsContact O-CE1 3.3Å; C53-F115 WeakPolarHBondContact O-CE1 3.35Å; C53-F115 WeakPolarHBondContact O-CZ 3.36Å; F57-F115 HydrophobicContact CB-CE1 4.42Å; F57-F115 HydrophobicContact CB-CZ 4.04Å; F57-F115 HydrophobicContact CD2-CZ 4.42Å; G111-F115 WeakPolarHBondContact O-CB 3.34Å; G111-F115 VanDerWaalsContact O-CD1 3.26Å; G111-F115 WeakPolarHBondContact O-CD1 3.3Å; G111-F115 VanDerWaalsContact O-CG 3.24Å; G111-F115 WeakPolarHBondContact O-CG 3.38Å; G111-F115 PolarHBondContact O-N 3.16Å; G112-F115 PolarHBondContact O-N 3.28Å; L113-F115 VanDerWaalsContact C-N 3.35Å; F115-W117 PolarHBondContact O-N 2.88Å; F115-I118 PolarHBondContact O-N 3.41Å; F115-V119 WeakPolarHBondContact O-CA 3.43Å; F115-V119 WeakPolarHBondContact O-CB 3.34Å; F115-V119 PolarHBondContact O-N 2.9Å; F115-V123 HydrophobicContact CB-CG1 4.16Å; F115-V130 HydrophobicContact CE2-CB 4.2Å; F115-V130 HydrophobicContact CE2-CG1 4.21Å; F115-V130 HydrophobicContact CE2-CG2 3.99Å; F115-V130 HydrophobicContact CZ-CG1 4.2Å; F115-V130 HydrophobicContact CZ-CG2 4.12Å; F115-M162 HydrophobicContact CD2-SD 4.38Å; F115-M162 HydrophobicContact CE2-SD 4.39Å |
| 116 | A | 75.4 | Confident | 75.9 | Confident | 4 Ų | 4 | 58.9 Ų | 58.9 | 3% | 0.033 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -66 | -25.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | G112 L113 V123 L169 | G112-A116 WeakPolarHBondContact O-CB 3.26Å; G112-A116 PolarHBondContact O-N 2.93Å; L113-A116 PolarHBondContact O-N 3.46Å; A116-V123 HydrophobicContact CB-CG2 4.17Å; A116-L169 HydrophobicContact CB-CB 4.21Å; A116-L169 HydrophobicContact CB-CD2 3.98Å; A116-L169 HydrophobicContact CB-CG 4.43Å |
| 117 | W | 71.9 | Confident | 75.9 | Confident | 190 Ų | 190 | 56.1 Ų | 56.1 | 72% | 0.72 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -77.8 | -37 | 171.9 | -168.9 | -83.6 | 0 | 0 | 0 | 113 | L113 V114 F115 L173 | L113-W117 PolarHBondContact O-N 2.97Å; L113-W117 VanDerWaalsContact O-N 3.16Å; V114-W117 WeakPolarHBondContact O-CB 3.09Å; V114-W117 PolarHBondContact O-N 3.25Å; V114-W117 VanDerWaalsContact O-N 3.14Å; F115-W117 PolarHBondContact O-N 2.88Å; W117-L173 HydrophobicContact CE3-CD1 4.14Å; W117-L173 HydrophobicContact CZ3-CD1 4.39Å; W117-L173 HydrophobicContact CZ3-CD2 4.02Å |
| 118 | I | 68.9 | Low | 75.7 | Confident | 61 Ų | 61 | 58.2 Ų | 58.2 | 31% | 0.313 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -83.3 | -37.7 | -176.9 | -66.1 | 170.6 | 0 | 0 | 0 | 111.9 | V114 F115 | V114-I118 HydrophobicContact CG1-CD1 3.53Å; V114-I118 HydrophobicContact CG1-CG1 4.25Å; V114-I118 VanDerWaalsContact O-CG1 3.3Å; V114-I118 WeakPolarHBondContact O-CG1 3.24Å; V114-I118 PolarHBondContact O-N 3.48Å; F115-I118 PolarHBondContact O-N 3.41Å |
| 119 | V | 65.4 | Low | 75.8 | Confident | 11 Ų | 11 | 60.1 Ų | 60.1 | 7% | 0.067 | 28% | 0.282 | C | S | . | . | trans | -120.8 | 83.5 | -169.6 | -171.2 | 0 | 0 | 0 | 0 | 109.3 | F115 E121 V123 Y126 | F115-V119 WeakPolarHBondContact O-CA 3.43Å; F115-V119 WeakPolarHBondContact O-CB 3.34Å; F115-V119 PolarHBondContact O-N 2.9Å; V119-E121 VanDerWaalsContact C-N 3.32Å; V119-E121 PolarHBondContact O-N 3.29Å; V119-V123 WeakPolarHBondContact O-CG2 3.29Å; V119-Y126 HydrophobicContact CB-CD2 4.34Å; V119-Y126 HydrophobicContact CG1-CD2 3.41Å; V119-Y126 VanDerWaalsContact CG1-CD2 3.41Å; V119-Y126 HydrophobicContact CG1-CE2 3.37Å; V119-Y126 HydrophobicContact CG1-CG 4.25Å; V119-Y126 HydrophobicContact CG2-CD2 4.22Å; V119-Y126 HydrophobicContact CG2-CE2 4.42Å; V119-Y126 HydrophobicContact CG2-CG 4.26Å | ||
| 120 | E | 61.4 | Low | 75.9 | Confident | 133 Ų | 133 | 57.4 Ų | 57.4 | 62% | 0.621 | 27% | 0.265 | S | S | * | . | S | Bend | trans | -61.1 | -29.7 | -173.9 | -75.7 | -174.8 | 144 | 0 | 0 | 115 | ||
| 121 | E | 55.2 | Low | 75.9 | Confident | 144 Ų | 144 | 54.8 Ų | 54.8 | 67% | 0.673 | 25% | 0.252 | S | S | * | . | S | Bend | trans | -114.1 | -8.9 | -169.7 | -72.5 | -163.7 | 148.9 | 0 | 0 | 117.2 | V119 | V119-E121 VanDerWaalsContact C-N 3.32Å; V119-E121 PolarHBondContact O-N 3.29Å |
| 122 | W | 64.4 | Low | 76 | Confident | 146 Ų | 146 | 60.2 Ų | 60.2 | 55% | 0.553 | 28% | 0.281 | S | S | * | . | trans | -148.1 | 35.6 | -172.5 | -66.2 | 92.4 | 0 | 0 | 0 | 115.2 | W124 D125 Y126 | W122-W124 PolarHBondContact O-N 2.97Å; W122-D125 PolarHBondContact O-N 2.74Å; W122-Y126 HydrophobicContact CB-CD2 4.37Å; W122-Y126 HydrophobicContact CB-CE2 4.23Å; W122-Y126 WeakPolarHBondContact O-CD2 3.46Å; W122-Y126 PolarHBondContact O-N 3.1Å | ||
| 123 | V | 69.1 | Low | 76.2 | Confident | 10 Ų | 10 | 64.2 Ų | 64.2 | 6% | 0.061 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -48.7 | -36.5 | -175.4 | -174.8 | 0 | 0 | 0 | 0 | 113.9 | F115 A116 V119 A127 | F115-V123 HydrophobicContact CB-CG1 4.16Å; A116-V123 HydrophobicContact CB-CG2 4.17Å; V119-V123 WeakPolarHBondContact O-CG2 3.29Å; V123-A127 WeakPolarHBondContact O-CB 3.22Å; V123-A127 PolarHBondContact O-N 2.98Å |
| 124 | W | 73.4 | Confident | 76.2 | Confident | 123 Ų | 123 | 61.1 Ų | 61.1 | 47% | 0.466 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -66.4 | -38.5 | -178 | -170.8 | 65.6 | 0 | 0 | 0 | 113.8 | W122 A127 I128 I163 | W122-W124 PolarHBondContact O-N 2.97Å; W124-A127 PolarHBondContact O-N 2.95Å; W124-I128 HydrophobicContact CD2-CD1 3.66Å; W124-I128 HydrophobicContact CE3-CD1 4Å; W124-I128 HydrophobicContact CG-CD1 4.3Å; W124-I128 HydrophobicContact CH2-CD1 3.78Å; W124-I128 HydrophobicContact CZ2-CD1 3.41Å; W124-I128 VanDerWaalsContact CZ2-CD1 3.41Å; W124-I128 HydrophobicContact CZ3-CD1 4.06Å; W124-I128 WeakPolarHBondContact O-CG1 3.43Å; W124-I128 PolarHBondContact O-N 2.98Å; W124-I163 VanDerWaalsContact CD1-CG1 3.45Å; W124-I163 VanDerWaalsContact CD1-CG2 3.44Å; W124-I163 HydrophobicContact CG-CG2 4.46Å |
| 125 | D | 79.9 | Confident | 76.2 | Confident | 89 Ų | 89 | 59.9 Ų | 59.9 | 48% | 0.476 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -71.4 | -40.8 | -179.1 | -167.4 | 54.6 | 0 | 0 | 0 | 110.9 | W122 I128 T129 | W122-D125 PolarHBondContact O-N 2.74Å; D125-I128 PolarHBondContact O-N 3.34Å; D125-T129 WeakPolarHBondContact O-CB 3.32Å; D125-T129 WeakPolarHBondContact O-CG2 2.86Å; D125-T129 PolarHBondContact O-N 2.62Å; D125-T129 PolarHBondContact O-OG1 2.83Å |
| 126 | Y | 78.7 | Confident | 76.5 | Confident | 24 Ų | 24 | 61.9 Ų | 61.9 | 9% | 0.094 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -67.2 | -38.4 | 172.4 | -70.7 | -89.6 | 0 | 0 | 0 | 112.1 | N49 L50 V119 W122 T129 V130 | N49-Y126 HydrophobicContact CB-CE1 4.25Å; L50-Y126 HydrophobicContact CB-CD1 4.24Å; L50-Y126 HydrophobicContact CB-CE1 4.05Å; V119-Y126 HydrophobicContact CB-CD2 4.34Å; V119-Y126 HydrophobicContact CG1-CD2 3.41Å; V119-Y126 VanDerWaalsContact CG1-CD2 3.41Å; V119-Y126 HydrophobicContact CG1-CE2 3.37Å; V119-Y126 HydrophobicContact CG1-CG 4.25Å; V119-Y126 HydrophobicContact CG2-CD2 4.22Å; V119-Y126 HydrophobicContact CG2-CE2 4.42Å; V119-Y126 HydrophobicContact CG2-CG 4.26Å; W122-Y126 HydrophobicContact CB-CD2 4.37Å; W122-Y126 HydrophobicContact CB-CE2 4.23Å; W122-Y126 WeakPolarHBondContact O-CD2 3.46Å; W122-Y126 PolarHBondContact O-N 3.1Å; Y126-T129 VanDerWaalsContact CA-OG1 3.27Å; Y126-T129 WeakPolarHBondContact CA-OG1 3.36Å; Y126-T129 PolarHBondContact O-N 2.9Å; Y126-T129 PolarHBondContact O-OG1 2.85Å; Y126-V130 VanDerWaalsContact O-CB 3.25Å; Y126-V130 WeakPolarHBondContact O-CB 3.42Å; Y126-V130 WeakPolarHBondContact O-CG2 3.21Å; Y126-V130 PolarHBondContact O-N 3.35Å |
| 127 | A | 82.9 | Confident | 76.7 | Confident | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59.4 | -48.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | V123 W124 T131 L159 M162 I163 | V123-A127 WeakPolarHBondContact O-CB 3.22Å; V123-A127 PolarHBondContact O-N 2.98Å; W124-A127 PolarHBondContact O-N 2.95Å; A127-T131 WeakPolarHBondContact O-CB 3.13Å; A127-T131 PolarHBondContact O-N 2.79Å; A127-T131 PolarHBondContact O-OG1 3.01Å; A127-L159 HydrophobicContact CB-CD1 4.2Å; A127-M162 HydrophobicContact CB-CE 3.57Å; A127-I163 HydrophobicContact CB-CG1 4.34Å |
| 128 | I | 83.3 | Confident | 76.9 | Confident | 46 Ų | 46 | 57.2 Ų | 57.2 | 24% | 0.236 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.8 | -48 | 178.3 | -69.7 | 169.5 | 0 | 0 | 0 | 111.2 | W124 D125 T131 L132 | W124-I128 HydrophobicContact CD2-CD1 3.66Å; W124-I128 HydrophobicContact CE3-CD1 4Å; W124-I128 HydrophobicContact CG-CD1 4.3Å; W124-I128 HydrophobicContact CH2-CD1 3.78Å; W124-I128 HydrophobicContact CZ2-CD1 3.41Å; W124-I128 VanDerWaalsContact CZ2-CD1 3.41Å; W124-I128 HydrophobicContact CZ3-CD1 4.06Å; W124-I128 WeakPolarHBondContact O-CG1 3.43Å; W124-I128 PolarHBondContact O-N 2.98Å; D125-I128 PolarHBondContact O-N 3.34Å; I128-T131 PolarHBondContact O-N 2.98Å; I128-L132 HydrophobicContact CG2-CD1 3.82Å; I128-L132 HydrophobicContact CG2-CG 4.23Å; I128-L132 WeakPolarHBondContact O-CB 3.44Å; I128-L132 WeakPolarHBondContact O-CG 3.35Å; I128-L132 PolarHBondContact O-N 3.1Å |
| 129 | T | 85.3 | Confident | 77.3 | Confident | 41 Ų | 41 | 56.1 Ų | 56.1 | 25% | 0.252 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -64.7 | -41.5 | -177.8 | 45.3 | 0 | 0 | 0 | 0 | 112.4 | D125 Y126 L132 L133 | D125-T129 WeakPolarHBondContact O-CB 3.32Å; D125-T129 WeakPolarHBondContact O-CG2 2.86Å; D125-T129 PolarHBondContact O-N 2.62Å; D125-T129 PolarHBondContact O-OG1 2.83Å; Y126-T129 VanDerWaalsContact CA-OG1 3.27Å; Y126-T129 WeakPolarHBondContact CA-OG1 3.36Å; Y126-T129 PolarHBondContact O-N 2.9Å; Y126-T129 PolarHBondContact O-OG1 2.85Å; T129-L132 PolarHBondContact O-N 3.32Å; T129-L133 WeakPolarHBondContact O-CB 3.31Å; T129-L133 VanDerWaalsContact O-CG 3.27Å; T129-L133 WeakPolarHBondContact O-CG 3.39Å; T129-L133 PolarHBondContact O-N 3.48Å |
| 130 | V | 85.4 | Confident | 78 | Confident | 0 Ų | 0 | 59.3 Ų | 59.3 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.3 | -43.6 | 174.2 | 169 | 0 | 0 | 0 | 0 | 110.9 | C53 M54 F57 F115 Y126 L133 H134 | C53-V130 HydrophobicContact CB-CG2 4.25Å; M54-V130 HydrophobicContact SD-CG1 3.91Å; M54-V130 HydrophobicContact SD-CG2 4.42Å; F57-V130 HydrophobicContact CB-CG1 4.46Å; F57-V130 HydrophobicContact CD1-CG1 4.44Å; F57-V130 HydrophobicContact CG-CG1 4.23Å; F115-V130 HydrophobicContact CE2-CB 4.2Å; F115-V130 HydrophobicContact CE2-CG1 4.21Å; F115-V130 HydrophobicContact CE2-CG2 3.99Å; F115-V130 HydrophobicContact CZ-CG1 4.2Å; F115-V130 HydrophobicContact CZ-CG2 4.12Å; Y126-V130 VanDerWaalsContact O-CB 3.25Å; Y126-V130 WeakPolarHBondContact O-CB 3.42Å; Y126-V130 WeakPolarHBondContact O-CG2 3.21Å; Y126-V130 PolarHBondContact O-N 3.35Å; V130-L133 PolarHBondContact O-N 3.2Å; V130-H134 VanDerWaalsContact O-CB 3.23Å; V130-H134 WeakPolarHBondContact O-CB 3.37Å; V130-H134 PolarHBondContact O-N 3.07Å |
| 131 | T | 85.6 | Confident | 78.6 | Confident | 13 Ų | 13 | 57.7 Ų | 57.7 | 8% | 0.08 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -64.9 | -40.2 | 176.5 | -63.5 | 0 | 0 | 0 | 0 | 112.2 | A127 I128 H134 V135 | A127-T131 WeakPolarHBondContact O-CB 3.13Å; A127-T131 PolarHBondContact O-N 2.79Å; A127-T131 PolarHBondContact O-OG1 3.01Å; I128-T131 PolarHBondContact O-N 2.98Å; T131-H134 WeakPolarHBondContact O-CB 3.35Å; T131-H134 PolarHBondContact O-N 2.88Å; T131-V135 VanDerWaalsContact O-CG2 3.31Å; T131-V135 WeakPolarHBondContact O-CG2 3.39Å; T131-V135 PolarHBondContact O-N 3.43Å |
| 132 | L | 86.1 | Confident | 79.3 | Confident | 114 Ų | 114 | 53.1 Ų | 53.1 | 60% | 0.597 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -64.7 | -43.6 | 175.3 | -74.1 | 175.2 | 0 | 0 | 0 | 112.2 | I128 T129 H134 V135 G136 | I128-L132 HydrophobicContact CG2-CD1 3.82Å; I128-L132 HydrophobicContact CG2-CG 4.23Å; I128-L132 WeakPolarHBondContact O-CB 3.44Å; I128-L132 WeakPolarHBondContact O-CG 3.35Å; I128-L132 PolarHBondContact O-N 3.1Å; T129-L132 PolarHBondContact O-N 3.32Å; L132-H134 VanDerWaalsContact C-N 3.29Å; L132-H134 PolarHBondContact O-N 2.98Å; L132-V135 PolarHBondContact O-N 2.81Å; L132-G136 PolarHBondContact O-N 3.49Å |
| 133 | L | 84.9 | Confident | 79.6 | Confident | 84 Ų | 84 | 51.1 Ų | 51.1 | 44% | 0.44 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -63.4 | -39 | 174.8 | -74.1 | 171.1 | 0 | 0 | 0 | 111.4 | L50 M54 T129 V130 G136 M137 | L50-L133 HydrophobicContact CD2-CD1 3.83Å; M54-L133 HydrophobicContact CE-CB 3.83Å; T129-L133 WeakPolarHBondContact O-CB 3.31Å; T129-L133 VanDerWaalsContact O-CG 3.27Å; T129-L133 WeakPolarHBondContact O-CG 3.39Å; T129-L133 PolarHBondContact O-N 3.48Å; V130-L133 PolarHBondContact O-N 3.2Å; L133-G136 PolarHBondContact O-N 3.3Å; L133-M137 WeakPolarHBondContact O-CB 3.33Å; L133-M137 PolarHBondContact O-N 3.37Å |
| 134 | H | 83.5 | Confident | 79.7 | Confident | 2 Ų | 2 | 55.6 Ų | 55.6 | 1% | 0.009 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.7 | -47.7 | 174.8 | 179.6 | 76.2 | 0 | 0 | 0 | 111.4 | F84 V130 T131 L132 G136 M137 T138 | F84-H134 AromaticContact CD2-CE1 3.61Å; F84-H134 AromaticContact CD2-NE2 3.38Å; F84-H134 WeakPolarHBondContact CD2-NE2 3.46Å; F84-H134 AromaticContact CE2-CE1 3.23Å; F84-H134 WeakPolarHBondContact CE2-CE1 3.49Å; F84-H134 AromaticContact CE2-NE2 3.1Å; F84-H134 WeakPolarHBondContact CE2-NE2 3.43Å; F84-H134 AromaticContact CZ-NE2 3.59Å; V130-H134 VanDerWaalsContact O-CB 3.23Å; V130-H134 WeakPolarHBondContact O-CB 3.37Å; V130-H134 PolarHBondContact O-N 3.07Å; T131-H134 WeakPolarHBondContact O-CB 3.35Å; T131-H134 PolarHBondContact O-N 2.88Å; L132-H134 VanDerWaalsContact C-N 3.29Å; L132-H134 PolarHBondContact O-N 2.98Å; H134-G136 PolarHBondContact O-N 2.96Å; H134-M137 PolarHBondContact O-N 2.9Å; H134-T138 WeakPolarHBondContact O-CB 3.47Å; H134-T138 PolarHBondContact O-N 3.15Å; H134-T138 PolarHBondContact O-OG1 2.84Å |
| 135 | V | 82.8 | Confident | 79.5 | Confident | 23 Ų | 23 | 56.8 Ų | 56.8 | 14% | 0.139 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -58.8 | -47.4 | 174.6 | 169.4 | 0 | 0 | 0 | 0 | 110.9 | T131 L132 M137 T138 V139 W151 W152 L155 | T131-V135 VanDerWaalsContact O-CG2 3.31Å; T131-V135 WeakPolarHBondContact O-CG2 3.39Å; T131-V135 PolarHBondContact O-N 3.43Å; L132-V135 PolarHBondContact O-N 2.81Å; V135-M137 PolarHBondContact O-N 3.37Å; V135-T138 PolarHBondContact O-N 3.29Å; V135-V139 HydrophobicContact CG1-CG2 4.49Å; V135-V139 VanDerWaalsContact O-CG2 3.3Å; V135-V139 WeakPolarHBondContact O-CG2 3.38Å; V135-V139 PolarHBondContact O-N 3.39Å; V135-W151 HydrophobicContact CB-CH2 4.4Å; V135-W151 HydrophobicContact CG1-CH2 4.11Å; V135-W151 HydrophobicContact CG2-CH2 3.88Å; V135-W152 HydrophobicContact CG1-CH2 4.4Å; V135-L155 HydrophobicContact CG2-CD1 4.1Å |
| 136 | G | 82.6 | Confident | 78.7 | Confident | 41 Ų | 41 | 52.6 Ų | 52.6 | 42% | 0.423 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.3 | -41 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113 | L132 L133 H134 A140 | L132-G136 PolarHBondContact O-N 3.49Å; L133-G136 PolarHBondContact O-N 3.3Å; H134-G136 PolarHBondContact O-N 2.96Å; G136-A140 WeakPolarHBondContact O-CB 3.44Å; G136-A140 PolarHBondContact O-N 3Å |
| 137 | M | 80 | Confident | 78 | Confident | 88 Ų | 88 | 56.6 Ų | 56.6 | 43% | 0.433 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -66.3 | -43.3 | 175.7 | -170.7 | 179.9 | -60.7 | 0 | 0 | 111.6 | M54 Y58 L133 H134 V135 V139 A140 V141 | M54-M137 HydrophobicContact CE-CE 4.2Å; Y58-M137 HydrophobicContact CE2-CE 4.18Å; Y58-M137 HydrophobicContact CE2-SD 4.35Å; Y58-M137 PolarHBondContact OH-SD 2.94Å; L133-M137 WeakPolarHBondContact O-CB 3.33Å; L133-M137 PolarHBondContact O-N 3.37Å; H134-M137 PolarHBondContact O-N 2.9Å; V135-M137 PolarHBondContact O-N 3.37Å; M137-V139 PolarHBondContact O-N 3.27Å; M137-A140 PolarHBondContact O-N 3.5Å; M137-V141 HydrophobicContact CG-CG2 4.23Å; M137-V141 WeakPolarHBondContact O-CB 3.37Å; M137-V141 VanDerWaalsContact O-CG2 3.29Å; M137-V141 WeakPolarHBondContact O-CG2 3.4Å; M137-V141 PolarHBondContact O-N 3.43Å |
| 138 | T | 75.3 | Confident | 77.6 | Confident | 8 Ų | 8 | 57.8 Ų | 57.8 | 5% | 0.049 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -61.7 | -43.7 | 177.5 | -60.5 | 0 | 0 | 0 | 0 | 111.4 | F84 H134 V135 V141 M142 W151 | F84-T138 HydrophobicContact CB-CG2 4.41Å; H134-T138 WeakPolarHBondContact O-CB 3.47Å; H134-T138 PolarHBondContact O-N 3.15Å; H134-T138 PolarHBondContact O-OG1 2.84Å; V135-T138 PolarHBondContact O-N 3.29Å; T138-V141 PolarHBondContact O-N 3.45Å; T138-M142 HydrophobicContact CG2-CG 4.48Å; T138-M142 WeakPolarHBondContact O-CB 3.35Å; T138-M142 WeakPolarHBondContact O-CG 3.35Å; T138-M142 PolarHBondContact O-N 2.92Å; T138-W151 HydrophobicContact CG2-CZ2 4.14Å |
| 139 | V | 79.1 | Confident | 77.1 | Confident | 39 Ų | 39 | 62.9 Ų | 62.9 | 24% | 0.236 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -62 | -43.2 | 173.8 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | V135 M137 S143 F145 P146 | V135-V139 HydrophobicContact CG1-CG2 4.49Å; V135-V139 VanDerWaalsContact O-CG2 3.3Å; V135-V139 WeakPolarHBondContact O-CG2 3.38Å; V135-V139 PolarHBondContact O-N 3.39Å; M137-V139 PolarHBondContact O-N 3.27Å; V139-S143 WeakPolarHBondContact O-CA 3.21Å; V139-S143 PolarHBondContact O-N 3.16Å; V139-F145 HydrophobicContact CG1-CD2 4.31Å; V139-F145 HydrophobicContact CG2-CD2 4.28Å; V139-F145 HydrophobicContact CG2-CE2 4.4Å; V139-P146 HydrophobicContact CG2-CG 4.18Å |
| 140 | A | 79.7 | Confident | 76.3 | Confident | 77 Ų | 77 | 65.5 Ų | 65.5 | 64% | 0.636 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -66.5 | -40 | 180 | 0 | 0 | 0 | 0 | 0 | 112.8 | G136 M137 | G136-A140 WeakPolarHBondContact O-CB 3.44Å; G136-A140 PolarHBondContact O-N 3Å; M137-A140 PolarHBondContact O-N 3.5Å |
| 141 | V | 73.8 | Confident | 75.8 | Confident | 100 Ų | 100 | 66.3 Ų | 66.3 | 61% | 0.606 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -71.7 | -44 | -179.9 | 168.2 | 0 | 0 | 0 | 0 | 111.2 | M137 T138 S143 | M137-V141 HydrophobicContact CG-CG2 4.23Å; M137-V141 WeakPolarHBondContact O-CB 3.37Å; M137-V141 VanDerWaalsContact O-CG2 3.29Å; M137-V141 WeakPolarHBondContact O-CG2 3.4Å; M137-V141 PolarHBondContact O-N 3.43Å; T138-V141 PolarHBondContact O-N 3.45Å; V141-S143 VanDerWaalsContact C-N 3.31Å |
| 142 | M | 69.3 | Low | 75.5 | Confident | 47 Ų | 47 | 71.1 Ų | 71.1 | 23% | 0.232 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -81.6 | -14.4 | -177.9 | -63.7 | -65.4 | -142.4 | 0 | 0 | 112.9 | Y86 T138 D144 | Y86-M142 HydrophobicContact CE1-CB 4.36Å; Y86-M142 HydrophobicContact CE1-CE 4.06Å; Y86-M142 HydrophobicContact CE1-CG 3.9Å; Y86-M142 WeakPolarHBondContact OH-CB 3.43Å; Y86-M142 WeakPolarHBondContact OH-CG 3.24Å; T138-M142 HydrophobicContact CG2-CG 4.48Å; T138-M142 WeakPolarHBondContact O-CB 3.35Å; T138-M142 WeakPolarHBondContact O-CG 3.35Å; T138-M142 PolarHBondContact O-N 2.92Å; M142-D144 PolarHBondContact O-N 3.35Å |
| 143 | S | 70.9 | Confident | 75.2 | Confident | 104 Ų | 104 | 71 Ų | 71 | 73% | 0.727 | 40% | 0.397 | S | S | * | . | S | Bend | trans | 55.3 | 10.7 | -173.6 | -170.9 | 0 | 0 | 0 | 0 | 114.4 | V139 V141 | V139-S143 WeakPolarHBondContact O-CA 3.21Å; V139-S143 PolarHBondContact O-N 3.16Å; V141-S143 VanDerWaalsContact C-N 3.31Å |
| 144 | D | 72.4 | Confident | 75 | Confident | 105 Ų | 105 | 67.8 Ų | 67.8 | 56% | 0.561 | 38% | 0.382 | S | S | * | . | S | Bend | trans | -129.4 | 144.8 | -176.7 | -79.3 | -32.9 | 0 | 0 | 0 | 109 | M142 | M142-D144 PolarHBondContact O-N 3.35Š|
| 145 | F | 67.5 | Low | 74.9 | Confident | 147 Ų | 147 | 68 Ų | 68 | 65% | 0.645 | 38% | 0.383 | S | S | * | . | trans | -80.5 | 127.5 | 178.4 | -152.6 | -96 | 0 | 0 | 0 | 109.6 | V139 S147 W152 | V139-F145 HydrophobicContact CG1-CD2 4.31Å; V139-F145 HydrophobicContact CG2-CD2 4.28Å; V139-F145 HydrophobicContact CG2-CE2 4.4Å; F145-S147 PolarHBondContact O-N 3.46Å; F145-W152 HydrophobicContact CE1-CZ2 4.22Å | ||
| 146 | P | 64.8 | Low | 75 | Confident | 1 Ų | 1 | 68.4 Ų | 68.4 | 1% | 0.006 | 39% | 0.393 | C | S | . | . | trans | -69.4 | 97.3 | 179.7 | 26.9 | -32.5 | 0 | 0 | 0 | 109.3 | Y86 V139 A148 W151 W152 | Y86-P146 HydrophobicContact CD1-CB 4.21Å; Y86-P146 HydrophobicContact CE1-CB 4.28Å; V139-P146 HydrophobicContact CG2-CG 4.18Å; P146-A148 VanDerWaalsContact C-N 3.33Å; P146-W151 HydrophobicContact CB-CD2 3.95Å; P146-W151 HydrophobicContact CB-CE3 3.68Å; P146-W151 HydrophobicContact CB-CH2 3.93Å; P146-W151 HydrophobicContact CB-CZ2 4.18Å; P146-W151 HydrophobicContact CB-CZ3 3.69Å; P146-W151 HydrophobicContact CG-CD2 4.47Å; P146-W151 HydrophobicContact CG-CE3 3.91Å; P146-W151 HydrophobicContact CG-CH2 3.39Å; P146-W151 HydrophobicContact CG-CZ2 4Å; P146-W151 HydrophobicContact CG-CZ3 3.36Å; P146-W152 PolarHBondContact O-NE1 3.01Å | ||
| 147 | S | 63.6 | Low | 75.1 | Confident | 108 Ų | 108 | 68.5 Ų | 68.5 | 76% | 0.755 | 39% | 0.387 | S | S | * | . | trans | -89.8 | 1.5 | 177.3 | 65.6 | 0 | 0 | 0 | 0 | 113.1 | F145 E149 | F145-S147 PolarHBondContact O-N 3.46Å; S147-E149 PolarHBondContact O-N 3.46Å | ||
| 148 | A | 73.8 | Confident | 75.4 | Confident | 26 Ų | 26 | 64.3 Ų | 64.3 | 22% | 0.215 | 37% | 0.366 | C | S | . | . | trans | -75.2 | 113.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111 | P146 H150 W151 W152 | P146-A148 VanDerWaalsContact C-N 3.33Å; A148-H150 VanDerWaalsContact C-N 3.3Å; A148-H150 PolarHBondContact O-N 3.01Å; A148-W151 HydrophobicContact CB-CB 4.04Å; A148-W151 WeakPolarHBondContact O-CB 3.41Å; A148-W151 PolarHBondContact O-N 3.5Å; A148-W151 VanDerWaalsContact O-N 3.08Å; A148-W152 PolarHBondContact O-N 2.59Å | ||
| 149 | E | 72.4 | Confident | 75.9 | Confident | 152 Ų | 152 | 65.8 Ų | 65.8 | 71% | 0.71 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -59.6 | -38.9 | -179.7 | -62.9 | -178.2 | -179 | 0 | 0 | 112.6 | S147 W151 W152 I153 | S147-E149 PolarHBondContact O-N 3.46Å; E149-W151 PolarHBondContact O-N 3.01Å; E149-W152 PolarHBondContact O-N 2.74Å; E149-I153 WeakPolarHBondContact O-CG1 3.44Å; E149-I153 PolarHBondContact O-N 3.44Å |
| 150 | H | 68.9 | Low | 76.2 | Confident | 96 Ų | 96 | 67.3 Ų | 67.3 | 44% | 0.444 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.1 | -31 | 177.1 | -64.3 | -62.1 | 0 | 0 | 0 | 113.2 | A148 I153 A154 | A148-H150 VanDerWaalsContact C-N 3.3Å; A148-H150 PolarHBondContact O-N 3.01Å; H150-I153 PolarHBondContact O-N 3.44Å; H150-A154 WeakPolarHBondContact O-CB 3.37Å; H150-A154 PolarHBondContact O-N 3.4Å |
| 151 | W | 74.8 | Confident | 76.4 | Confident | 17 Ų | 17 | 67.7 Ų | 67.7 | 6% | 0.064 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -70.2 | -43.2 | 177.4 | 178.5 | 86.9 | 0 | 0 | 0 | 111.3 | F84 V135 T138 P146 A148 E149 I153 A154 L155 | F84-W151 AromaticContact CD1-CD1 3.82Å; F84-W151 AromaticContact CD1-NE1 3.42Å; F84-W151 AromaticContact CG-NE1 3.73Å; V135-W151 HydrophobicContact CB-CH2 4.4Å; V135-W151 HydrophobicContact CG1-CH2 4.11Å; V135-W151 HydrophobicContact CG2-CH2 3.88Å; T138-W151 HydrophobicContact CG2-CZ2 4.14Å; P146-W151 HydrophobicContact CB-CD2 3.95Å; P146-W151 HydrophobicContact CB-CE3 3.68Å; P146-W151 HydrophobicContact CB-CH2 3.93Å; P146-W151 HydrophobicContact CB-CZ2 4.18Å; P146-W151 HydrophobicContact CB-CZ3 3.69Å; P146-W151 HydrophobicContact CG-CD2 4.47Å; P146-W151 HydrophobicContact CG-CE3 3.91Å; P146-W151 HydrophobicContact CG-CH2 3.39Å; P146-W151 HydrophobicContact CG-CZ2 4Å; P146-W151 HydrophobicContact CG-CZ3 3.36Å; A148-W151 HydrophobicContact CB-CB 4.04Å; A148-W151 WeakPolarHBondContact O-CB 3.41Å; A148-W151 PolarHBondContact O-N 3.5Å; A148-W151 VanDerWaalsContact O-N 3.08Å; E149-W151 PolarHBondContact O-N 3.01Å; W151-I153 VanDerWaalsContact C-N 3.3Å; W151-I153 PolarHBondContact O-N 2.88Å; W151-A154 PolarHBondContact O-N 2.71Å; W151-L155 HydrophobicContact CD2-CD1 3.61Å; W151-L155 HydrophobicContact CD2-CG 4.43Å; W151-L155 HydrophobicContact CE3-CD1 3.65Å; W151-L155 HydrophobicContact CH2-CD1 3.28Å; W151-L155 HydrophobicContact CZ2-CD1 3.23Å; W151-L155 HydrophobicContact CZ2-CG 4.44Å; W151-L155 HydrophobicContact CZ3-CD1 3.48Å; W151-L155 VanDerWaalsContact CZ3-CD1 3.48Å; W151-L155 WeakPolarHBondContact O-CB 3.23Å; W151-L155 PolarHBondContact O-N 2.9Å |
| 152 | W | 79.5 | Confident | 76.9 | Confident | 115 Ų | 115 | 63 Ų | 63 | 44% | 0.436 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -63.6 | -37.4 | 173.8 | -72.6 | 101.6 | 0 | 0 | 0 | 112.3 | V135 F145 P146 A148 E149 G156 | V135-W152 HydrophobicContact CG1-CH2 4.4Å; F145-W152 HydrophobicContact CE1-CZ2 4.22Å; P146-W152 PolarHBondContact O-NE1 3.01Å; A148-W152 PolarHBondContact O-N 2.59Å; E149-W152 PolarHBondContact O-N 2.74Å; W152-G156 PolarHBondContact O-N 2.71Å |
| 153 | I | 80.6 | Confident | 77.6 | Confident | 111 Ų | 111 | 62.2 Ų | 62.2 | 57% | 0.569 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -65.9 | -47.8 | 176.6 | -66.2 | 166.8 | 0 | 0 | 0 | 110.4 | E149 H150 W151 L155 G156 S157 | E149-I153 WeakPolarHBondContact O-CG1 3.44Å; E149-I153 PolarHBondContact O-N 3.44Å; H150-I153 PolarHBondContact O-N 3.44Å; W151-I153 VanDerWaalsContact C-N 3.3Å; W151-I153 PolarHBondContact O-N 2.88Å; I153-L155 PolarHBondContact O-N 2.92Å; I153-G156 PolarHBondContact O-N 2.88Å; I153-S157 PolarHBondContact O-N 3.31Å; I153-S157 PolarHBondContact O-OG 3.13Å |
| 154 | A | 79 | Confident | 78.1 | Confident | 16 Ų | 16 | 64.3 Ų | 64.3 | 13% | 0.132 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -63.3 | -39.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | H150 W151 S157 G158 | H150-A154 WeakPolarHBondContact O-CB 3.37Å; H150-A154 PolarHBondContact O-N 3.4Å; W151-A154 PolarHBondContact O-N 2.71Å; A154-S157 VanDerWaalsContact CA-OG 3.32Å; A154-S157 WeakPolarHBondContact CA-OG 3.42Å; A154-S157 PolarHBondContact O-OG 3.3Å; A154-G158 PolarHBondContact O-N 3.5Å |
| 155 | L | 82 | Confident | 78.3 | Confident | 6 Ų | 6 | 60.4 Ų | 60.4 | 3% | 0.031 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -67.4 | -41.9 | 173.4 | -80.9 | 175.3 | 0 | 0 | 0 | 112.2 | F84 Y108 V135 W151 I153 G158 L159 | F84-L155 HydrophobicContact CE1-CD2 4.39Å; Y108-L155 HydrophobicContact CE2-CD2 4Å; Y108-L155 WeakPolarHBondContact OH-CD2 3.3Å; V135-L155 HydrophobicContact CG2-CD1 4.1Å; W151-L155 HydrophobicContact CD2-CD1 3.61Å; W151-L155 HydrophobicContact CD2-CG 4.43Å; W151-L155 HydrophobicContact CE3-CD1 3.65Å; W151-L155 HydrophobicContact CH2-CD1 3.28Å; W151-L155 HydrophobicContact CZ2-CD1 3.23Å; W151-L155 HydrophobicContact CZ2-CG 4.44Å; W151-L155 HydrophobicContact CZ3-CD1 3.48Å; W151-L155 VanDerWaalsContact CZ3-CD1 3.48Å; W151-L155 WeakPolarHBondContact O-CB 3.23Å; W151-L155 PolarHBondContact O-N 2.9Å; I153-L155 PolarHBondContact O-N 2.92Å; L155-G158 PolarHBondContact O-N 2.75Å; L155-L159 VanDerWaalsContact O-CB 3.29Å; L155-L159 WeakPolarHBondContact O-CB 3.5Å; L155-L159 PolarHBondContact O-N 3.39Å |
| 156 | G | 84.5 | Confident | 78.7 | Confident | 32 Ų | 32 | 53.4 Ų | 53.4 | 33% | 0.33 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -62.5 | -45.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | W152 I153 L159 V160 | W152-G156 PolarHBondContact O-N 2.71Å; I153-G156 PolarHBondContact O-N 2.88Å; G156-L159 PolarHBondContact O-N 2.86Å; G156-V160 WeakPolarHBondContact O-CB 3.11Å; G156-V160 VanDerWaalsContact O-CG2 3.24Å; G156-V160 WeakPolarHBondContact O-CG2 3.44Å; G156-V160 PolarHBondContact O-N 3Å |
| 157 | S | 86 | Confident | 79 | Confident | 44 Ų | 44 | 56.1 Ų | 56.1 | 31% | 0.308 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -63.8 | -46.4 | 176.1 | 47.8 | 0 | 0 | 0 | 0 | 111.9 | E105 I153 A154 L159 V160 M161 | E105-S157 PolarHBondContact OE1-OG 3.44Å; I153-S157 PolarHBondContact O-N 3.31Å; I153-S157 PolarHBondContact O-OG 3.13Å; A154-S157 VanDerWaalsContact CA-OG 3.32Å; A154-S157 WeakPolarHBondContact CA-OG 3.42Å; A154-S157 PolarHBondContact O-OG 3.3Å; S157-L159 PolarHBondContact O-N 3.31Å; S157-V160 PolarHBondContact O-N 3.35Å; S157-M161 PolarHBondContact O-N 2.84Å |
| 158 | G | 85.1 | Confident | 79.7 | Confident | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.5 | -45.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | A154 L155 M161 M162 | A154-G158 PolarHBondContact O-N 3.5Å; L155-G158 PolarHBondContact O-N 2.75Å; G158-M161 PolarHBondContact O-N 3.25Å; G158-M162 VanDerWaalsContact O-CB 3.3Å; G158-M162 WeakPolarHBondContact O-CB 3.05Å; G158-M162 PolarHBondContact O-N 3Å |
| 159 | L | 86.4 | Confident | 79.6 | Confident | 38 Ų | 38 | 57.1 Ų | 57.1 | 20% | 0.199 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -60.4 | -48.3 | 176.1 | 177.3 | 62.4 | 0 | 0 | 0 | 111.1 | A127 L155 G156 S157 M161 M162 I163 | A127-L159 HydrophobicContact CB-CD1 4.2Å; L155-L159 VanDerWaalsContact O-CB 3.29Å; L155-L159 WeakPolarHBondContact O-CB 3.5Å; L155-L159 PolarHBondContact O-N 3.39Å; G156-L159 PolarHBondContact O-N 2.86Å; S157-L159 PolarHBondContact O-N 3.31Å; L159-M161 VanDerWaalsContact C-N 3.34Å; L159-M161 PolarHBondContact O-N 3.39Å; L159-M162 HydrophobicContact CD1-CE 4.09Å; L159-M162 WeakPolarHBondContact O-CB 3.35Å; L159-M162 PolarHBondContact O-N 3.49Å; L159-I163 HydrophobicContact CD1-CD1 3.86Å; L159-I163 HydrophobicContact CD1-CG1 4.19Å; L159-I163 HydrophobicContact CG-CD1 3.78Å; L159-I163 HydrophobicContact CG-CG1 4.5Å; L159-I163 WeakPolarHBondContact O-CD1 3.49Å; L159-I163 WeakPolarHBondContact O-CG1 3.31Å; L159-I163 PolarHBondContact O-N 2.89Å |
| 160 | V | 85.8 | Confident | 79.4 | Confident | 72 Ų | 72 | 50.3 Ų | 50.3 | 44% | 0.436 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -59.4 | -45.6 | 178.7 | 169.1 | 0 | 0 | 0 | 0 | 110.9 | G156 S157 M162 I163 F164 | G156-V160 WeakPolarHBondContact O-CB 3.11Å; G156-V160 VanDerWaalsContact O-CG2 3.24Å; G156-V160 WeakPolarHBondContact O-CG2 3.44Å; G156-V160 PolarHBondContact O-N 3Å; S157-V160 PolarHBondContact O-N 3.35Å; V160-M162 VanDerWaalsContact C-N 3.34Å; V160-M162 PolarHBondContact O-N 3.03Å; V160-I163 PolarHBondContact O-N 2.87Å; V160-F164 HydrophobicContact CG1-CD2 3.46Å; V160-F164 VanDerWaalsContact CG1-CD2 3.46Å; V160-F164 HydrophobicContact CG1-CE2 3.48Å; V160-F164 VanDerWaalsContact CG1-CE2 3.48Å; V160-F164 VanDerWaalsContact O-CD2 3.22Å; V160-F164 WeakPolarHBondContact O-CD2 3.48Å; V160-F164 PolarHBondContact O-N 3.47Å |
| 161 | M | 83.1 | Confident | 79.3 | Confident | 85 Ų | 85 | 50.4 Ų | 50.4 | 42% | 0.419 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.4 | -38.5 | 176 | -76.5 | -142.9 | -77.7 | 0 | 0 | 112.8 | E105 V109 S157 G158 L159 I163 G165 | E105-M161 HydrophobicContact CB-CE 4.38Å; E105-M161 WeakPolarHBondContact OE2-CE 3.11Å; V109-M161 HydrophobicContact CG2-CB 4.29Å; V109-M161 HydrophobicContact CG2-CE 3.88Å; V109-M161 HydrophobicContact CG2-SD 4.12Å; S157-M161 PolarHBondContact O-N 2.84Å; G158-M161 PolarHBondContact O-N 3.25Å; L159-M161 VanDerWaalsContact C-N 3.34Å; L159-M161 PolarHBondContact O-N 3.39Å; M161-I163 VanDerWaalsContact C-N 3.32Å; M161-I163 PolarHBondContact O-N 3.42Å; M161-G165 WeakPolarHBondContact O-CA 3.46Å; M161-G165 PolarHBondContact O-N 3.04Å |
| 162 | M | 84.6 | Confident | 78.9 | Confident | 0 Ų | 0 | 54.8 Ų | 54.8 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.2 | -41.5 | 176.4 | -171.6 | 159.8 | 72.5 | 0 | 0 | 111.4 | Y108 G112 F115 A127 G158 L159 V160 G166 | Y108-M162 HydrophobicContact CD1-CB 4.24Å; Y108-M162 HydrophobicContact CD1-CE 3.91Å; Y108-M162 HydrophobicContact CD1-SD 3.79Å; Y108-M162 HydrophobicContact CE1-CE 3.94Å; Y108-M162 HydrophobicContact CE1-SD 4.34Å; G112-M162 VanDerWaalsContact CA-CG 3.45Å; F115-M162 HydrophobicContact CD2-SD 4.38Å; F115-M162 HydrophobicContact CE2-SD 4.39Å; A127-M162 HydrophobicContact CB-CE 3.57Å; G158-M162 VanDerWaalsContact O-CB 3.3Å; G158-M162 WeakPolarHBondContact O-CB 3.05Å; G158-M162 PolarHBondContact O-N 3Å; L159-M162 HydrophobicContact CD1-CE 4.09Å; L159-M162 WeakPolarHBondContact O-CB 3.35Å; L159-M162 PolarHBondContact O-N 3.49Å; V160-M162 VanDerWaalsContact C-N 3.34Å; V160-M162 PolarHBondContact O-N 3.03Å; M162-G166 PolarHBondContact O-N 2.88Å |
| 163 | I | 83.3 | Confident | 78.3 | Confident | 31 Ų | 31 | 52 Ų | 52 | 16% | 0.159 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -68.9 | -52.4 | 178.5 | -62 | 165.1 | 0 | 0 | 0 | 110.8 | W124 A127 L159 V160 M161 G165 G166 Q167 | W124-I163 VanDerWaalsContact CD1-CG1 3.45Å; W124-I163 VanDerWaalsContact CD1-CG2 3.44Å; W124-I163 HydrophobicContact CG-CG2 4.46Å; A127-I163 HydrophobicContact CB-CG1 4.34Å; L159-I163 HydrophobicContact CD1-CD1 3.86Å; L159-I163 HydrophobicContact CD1-CG1 4.19Å; L159-I163 HydrophobicContact CG-CD1 3.78Å; L159-I163 HydrophobicContact CG-CG1 4.5Å; L159-I163 WeakPolarHBondContact O-CD1 3.49Å; L159-I163 WeakPolarHBondContact O-CG1 3.31Å; L159-I163 PolarHBondContact O-N 2.89Å; V160-I163 PolarHBondContact O-N 2.87Å; M161-I163 VanDerWaalsContact C-N 3.32Å; M161-I163 PolarHBondContact O-N 3.42Å; I163-G165 VanDerWaalsContact C-N 3.34Å; I163-G165 PolarHBondContact O-N 3.24Å; I163-G166 PolarHBondContact O-N 3.48Å; I163-Q167 WeakPolarHBondContact O-CB 3.18Å; I163-Q167 WeakPolarHBondContact O-CG 3.32Å; I163-Q167 PolarHBondContact O-N 2.87Å |
| 164 | F | 81.3 | Confident | 77.4 | Confident | 148 Ų | 148 | 50.8 Ų | 50.8 | 65% | 0.649 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -63.1 | -41 | 179 | -80.5 | -67.2 | 0 | 0 | 0 | 111.9 | V160 Q167 L168 | V160-F164 HydrophobicContact CG1-CD2 3.46Å; V160-F164 VanDerWaalsContact CG1-CD2 3.46Å; V160-F164 HydrophobicContact CG1-CE2 3.48Å; V160-F164 VanDerWaalsContact CG1-CE2 3.48Å; V160-F164 VanDerWaalsContact O-CD2 3.22Å; V160-F164 WeakPolarHBondContact O-CD2 3.48Å; V160-F164 PolarHBondContact O-N 3.47Å; F164-Q167 PolarHBondContact O-N 2.82Å; F164-L168 WeakPolarHBondContact O-CB 3.22Å; F164-L168 PolarHBondContact O-N 3.36Å |
| 165 | G | 78 | Confident | 76.5 | Confident | 23 Ų | 23 | 56 Ų | 56 | 24% | 0.237 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.2 | -43.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | M161 I163 L168 L169 | M161-G165 WeakPolarHBondContact O-CA 3.46Å; M161-G165 PolarHBondContact O-N 3.04Å; I163-G165 VanDerWaalsContact C-N 3.34Å; I163-G165 PolarHBondContact O-N 3.24Å; G165-L168 PolarHBondContact O-N 2.92Å; G165-L169 WeakPolarHBondContact O-CB 3.27Å; G165-L169 PolarHBondContact O-N 3.39Å |
| 166 | G | 74.9 | Confident | 75.1 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.1 | -45.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | M162 I163 L169 A170 | M162-G166 PolarHBondContact O-N 2.88Å; I163-G166 PolarHBondContact O-N 3.48Å; G166-L169 PolarHBondContact O-N 3.46Å; G166-A170 WeakPolarHBondContact O-CB 3.32Å; G166-A170 PolarHBondContact O-N 3.22Å |
| 167 | Q | 72.5 | Confident | 73.6 | Confident | 58 Ų | 58 | 65.4 Ų | 65.4 | 27% | 0.271 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -66.1 | -40.1 | 177.2 | -66.1 | -68.5 | -5.7 | 0 | 0 | 112.2 | I163 F164 Y171 | I163-Q167 WeakPolarHBondContact O-CB 3.18Å; I163-Q167 WeakPolarHBondContact O-CG 3.32Å; I163-Q167 PolarHBondContact O-N 2.87Å; F164-Q167 PolarHBondContact O-N 2.82Å; Q167-Y171 VanDerWaalsContact O-CB 3.3Å; Q167-Y171 WeakPolarHBondContact O-CB 3.25Å; Q167-Y171 PolarHBondContact O-N 3.36Å |
| 168 | L | 76.8 | Confident | 71.9 | Confident | 109 Ų | 109 | 70.4 Ų | 70.4 | 57% | 0.571 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -65 | -41 | 176.2 | -177.8 | 66.5 | 0 | 0 | 0 | 111.8 | F164 G165 Y171 K172 | F164-L168 WeakPolarHBondContact O-CB 3.22Å; F164-L168 PolarHBondContact O-N 3.36Å; G165-L168 PolarHBondContact O-N 2.92Å; L168-Y171 PolarHBondContact O-N 3.31Å; L168-K172 WeakPolarHBondContact O-CG 3.2Å; L168-K172 PolarHBondContact O-N 2.9Å |
| 169 | L | 72.4 | Confident | 70.1 | Confident | 46 Ų | 46 | 76 Ų | 76 | 24% | 0.241 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -70 | -44.1 | 178.9 | -174.1 | 66 | 0 | 0 | 0 | 111.4 | L113 A116 G165 G166 Y171 K172 L173 | L113-L169 HydrophobicContact CB-CD2 4.11Å; L113-L169 HydrophobicContact CD2-CB 4.16Å; L113-L169 HydrophobicContact CD2-CD1 4.42Å; L113-L169 HydrophobicContact CD2-CD2 3.79Å; L113-L169 HydrophobicContact CD2-CG 4.33Å; L113-L169 WeakPolarHBondContact O-CD2 3.31Å; A116-L169 HydrophobicContact CB-CB 4.21Å; A116-L169 HydrophobicContact CB-CD2 3.98Å; A116-L169 HydrophobicContact CB-CG 4.43Å; G165-L169 WeakPolarHBondContact O-CB 3.27Å; G165-L169 PolarHBondContact O-N 3.39Å; G166-L169 PolarHBondContact O-N 3.46Å; L169-Y171 VanDerWaalsContact C-N 3.29Å; L169-Y171 PolarHBondContact O-N 3.42Å; L169-K172 PolarHBondContact O-N 3.41Å; L169-K172 VanDerWaalsContact O-N 3.1Å; L169-L173 HydrophobicContact CD1-CD1 4.46Å; L169-L173 HydrophobicContact CD2-CD1 4.41Å; L169-L173 HydrophobicContact CG-CD1 3.99Å; L169-L173 WeakPolarHBondContact O-CB 3.45Å; L169-L173 PolarHBondContact O-N 2.96Å |
| 170 | A | 68.1 | Low | 68.1 | Low | 10 Ų | 10 | 82.2 Ų | 82.2 | 8% | 0.083 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -56 | -47.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | G166 K172 L173 F174 | G166-A170 WeakPolarHBondContact O-CB 3.32Å; G166-A170 PolarHBondContact O-N 3.22Å; A170-K172 VanDerWaalsContact C-N 3.31Å; A170-K172 PolarHBondContact O-N 3.11Å; A170-L173 PolarHBondContact O-N 3.28Å; A170-F174 WeakPolarHBondContact O-CB 3.29Å; A170-F174 WeakPolarHBondContact O-CD2 3.3Å; A170-F174 PolarHBondContact O-N 2.88Å |
| 171 | Y | 66.4 | Low | 66 | Low | 98 Ų | 98 | 82.9 Ų | 82.9 | 38% | 0.384 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -58.2 | -40.3 | 175.6 | 179.9 | -105.2 | 0 | 0 | 0 | 113.3 | Q167 L168 L169 R175 | Q167-Y171 VanDerWaalsContact O-CB 3.3Å; Q167-Y171 WeakPolarHBondContact O-CB 3.25Å; Q167-Y171 PolarHBondContact O-N 3.36Å; L168-Y171 PolarHBondContact O-N 3.31Å; L169-Y171 VanDerWaalsContact C-N 3.29Å; L169-Y171 PolarHBondContact O-N 3.42Å; Y171-R175 WeakPolarHBondContact O-CB 3.14Å; Y171-R175 PolarHBondContact O-N 2.82Å; Y171-R175 PolarHBondContact OH-NH1 3.15Å; Y171-R175 VanDerWaalsContact OH-NH1 3.1Å; Y171-R175 PolarHBondContact OH-NH2 2.58Å |
| 172 | K | 67.5 | Low | 64.5 | Low | 109 Ų | 109 | 83.5 Ų | 83.5 | 47% | 0.474 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -69.8 | -43.3 | 176.8 | -76 | -75.3 | -168.6 | 171.6 | 0 | 112.7 | L168 L169 A170 R175 N176 | L168-K172 WeakPolarHBondContact O-CG 3.2Å; L168-K172 PolarHBondContact O-N 2.9Å; L169-K172 PolarHBondContact O-N 3.41Å; L169-K172 VanDerWaalsContact O-N 3.1Å; A170-K172 VanDerWaalsContact C-N 3.31Å; A170-K172 PolarHBondContact O-N 3.11Å; K172-R175 PolarHBondContact O-N 2.93Å; K172-N176 WeakPolarHBondContact O-CB 3.36Å; K172-N176 VanDerWaalsContact O-CG 3.28Å; K172-N176 PolarHBondContact O-N 3.3Å; K172-N176 PolarHBondContact O-ND2 3.18Å |
| 173 | L | 65.6 | Low | 63.1 | Low | 55 Ų | 55 | 91 Ų | 91 | 29% | 0.288 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -62.3 | -49 | 177.6 | -90.8 | 158.1 | 0 | 0 | 0 | 111.2 | W117 L169 A170 R175 N176 N177 | W117-L173 HydrophobicContact CE3-CD1 4.14Å; W117-L173 HydrophobicContact CZ3-CD1 4.39Å; W117-L173 HydrophobicContact CZ3-CD2 4.02Å; L169-L173 HydrophobicContact CD1-CD1 4.46Å; L169-L173 HydrophobicContact CD2-CD1 4.41Å; L169-L173 HydrophobicContact CG-CD1 3.99Å; L169-L173 WeakPolarHBondContact O-CB 3.45Å; L169-L173 PolarHBondContact O-N 2.96Å; A170-L173 PolarHBondContact O-N 3.28Å; L173-R175 PolarHBondContact O-N 3.29Å; L173-N176 PolarHBondContact O-N 3.49Å; L173-N177 PolarHBondContact O-N 3.17Å; L173-N177 PolarHBondContact O-ND2 3.11Å |
| 174 | F | 61.2 | Low | 61.7 | Low | 87 Ų | 87 | 96.5 Ų | 96.5 | 38% | 0.382 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.8 | -38.9 | 176.7 | -78 | -69.3 | 0 | 0 | 0 | 112.2 | A170 N176 N177 F178 | A170-F174 WeakPolarHBondContact O-CB 3.29Å; A170-F174 WeakPolarHBondContact O-CD2 3.3Å; A170-F174 PolarHBondContact O-N 2.88Å; F174-N176 VanDerWaalsContact C-N 3.31Å; F174-N176 PolarHBondContact O-N 2.95Å; F174-N177 PolarHBondContact O-N 3.21Å; F174-F178 WeakPolarHBondContact O-CD2 3.38Å; F174-F178 PolarHBondContact O-N 2.98Å; F174-F178 VanDerWaalsContact O-N 3.16Å |
| 175 | R | 60.2 | Low | 60.2 | Low | 124 Ų | 124 | 98.1 Ų | 98.1 | 47% | 0.468 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.4 | -37.6 | 174.4 | 173.5 | 169.3 | -92.2 | 169.6 | -7.9 | 112.8 | Y171 K172 L173 F178 | Y171-R175 WeakPolarHBondContact O-CB 3.14Å; Y171-R175 PolarHBondContact O-N 2.82Å; Y171-R175 PolarHBondContact OH-NH1 3.15Å; Y171-R175 VanDerWaalsContact OH-NH1 3.1Å; Y171-R175 PolarHBondContact OH-NH2 2.58Å; K172-R175 PolarHBondContact O-N 2.93Å; L173-R175 PolarHBondContact O-N 3.29Å; R175-F178 PolarHBondContact O-N 2.9Å |
| 176 | N | 54 | Low | 58.8 | Low | 111 Ų | 111 | 103.8 Ų | 103.8 | 59% | 0.594 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -78.1 | -28.9 | 179.7 | -70.8 | -14.7 | 0 | 0 | 0 | 112.9 | K172 L173 F174 F178 V179 | K172-N176 WeakPolarHBondContact O-CB 3.36Å; K172-N176 VanDerWaalsContact O-CG 3.28Å; K172-N176 PolarHBondContact O-N 3.3Å; K172-N176 PolarHBondContact O-ND2 3.18Å; L173-N176 PolarHBondContact O-N 3.49Å; F174-N176 VanDerWaalsContact C-N 3.31Å; F174-N176 PolarHBondContact O-N 2.95Å; N176-F178 VanDerWaalsContact C-N 3.28Å; N176-V179 WeakPolarHBondContact O-CG2 3.41Å; N176-V179 PolarHBondContact O-N 2.87Å |
| 177 | N | 52.9 | Low | 57.3 | Low | 126 Ų | 126 | 116.7 Ų | 116.7 | 67% | 0.674 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -73.3 | -19.1 | 171.9 | -83.4 | -41.9 | 0 | 0 | 0 | 113.1 | L173 F174 V179 | L173-N177 PolarHBondContact O-N 3.17Å; L173-N177 PolarHBondContact O-ND2 3.11Å; F174-N177 PolarHBondContact O-N 3.21Å; N177-V179 VanDerWaalsContact C-N 3.28Å; N177-V179 PolarHBondContact O-N 3.27Å |
| 178 | F | 49 | Very low | 56.5 | Low | 148 Ų | 148 | 119.6 Ų | 119.6 | 65% | 0.649 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.6 | 27.9 | 170.1 | -88.1 | -79.8 | 0 | 0 | 0 | 113.5 | F174 R175 N176 Y180 | F174-F178 WeakPolarHBondContact O-CD2 3.38Å; F174-F178 PolarHBondContact O-N 2.98Å; F174-F178 VanDerWaalsContact O-N 3.16Å; R175-F178 PolarHBondContact O-N 2.9Å; N176-F178 VanDerWaalsContact C-N 3.28Å; F178-Y180 PolarHBondContact O-N 3.37Å |
| 179 | V | 48.4 | Very low | 55.4 | Low | 117 Ų | 117 | 120.2 Ų | 120.2 | 71% | 0.709 | 59% | 0.594 | S | S | * | * | trans | -62.7 | 94.3 | 152.6 | 175.4 | 0 | 0 | 0 | 0 | 105.4 | N176 N177 | N176-V179 WeakPolarHBondContact O-CG2 3.41Å; N176-V179 PolarHBondContact O-N 2.87Å; N177-V179 VanDerWaalsContact C-N 3.28Å; N177-V179 PolarHBondContact O-N 3.27Å | ||
| 180 | Y | 44.5 | Very low | 54.5 | Low | 170 Ų | 170 | 124.3 Ų | 124.3 | 67% | 0.667 | 61% | 0.613 | S | S | * | * | trans | -41.2 | 129.4 | 171.9 | -91.5 | -99.7 | 0 | 0 | 0 | 107.9 | F178 A182 | F178-Y180 PolarHBondContact O-N 3.37Å; Y180-A182 PolarHBondContact O-N 3.02Å | ||
| 181 | P | 41.4 | Very low | 53.7 | Low | 85 Ų | 85 | 131 Ų | 131 | 55% | 0.552 | 64% | 0.644 | S | S | * | * | trans | -54.8 | 123.6 | 163.6 | 24.8 | -30.5 | 0 | 0 | 0 | 105.3 | E183 | P181-E183 HydrophobicContact CB-CB 4.34Å; P181-E183 HydrophobicContact CB-CG 4.31Å; P181-E183 PolarHBondContact O-N 3.16Å | ||
| 182 | A | 52.5 | Low | 52.9 | Low | 99 Ų | 99 | 133.1 Ų | 133.1 | 82% | 0.818 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | 32.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y180 | Y180-A182 PolarHBondContact O-N 3.02Š|
| 183 | E | 54.2 | Low | 51.9 | Low | 157 Ų | 157 | 134.7 Ų | 134.7 | 73% | 0.734 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.9 | -5.6 | -174.5 | -59.6 | -145.2 | 154.4 | 0 | 0 | 113.1 | P181 Q185 | P181-E183 HydrophobicContact CB-CB 4.34Å; P181-E183 HydrophobicContact CB-CG 4.31Å; P181-E183 PolarHBondContact O-N 3.16Å; E183-Q185 VanDerWaalsContact C-N 3.35Å |
| 184 | L | 53.2 | Low | 51 | Low | 147 Ų | 147 | 140.4 Ų | 140.4 | 77% | 0.77 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.7 | 15.4 | 176 | -98.3 | 135.2 | 0 | 0 | 0 | 114.4 | ||
| 185 | Q | 51.1 | Low | 50.2 | Low | 181 Ų | 181 | 144.5 Ų | 144.5 | 85% | 0.846 | 73% | 0.725 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.4 | 7.4 | 176.1 | -134.2 | 177.5 | -16 | 0 | 0 | 113.7 | E183 | E183-Q185 VanDerWaalsContact C-N 3.35Š|
| 186 | N | 47.3 | Very low | 49.3 | Very low | 143 Ų | 143 | 146.2 Ų | 146.2 | 77% | 0.765 | 75% | 0.747 | S | S | * | * | trans | -128.2 | 46.4 | 177.9 | -84 | -47.5 | 0 | 0 | 0 | 112.8 | ||||
| 187 | F | 43.5 | Very low | 48.9 | Very low | 270 Ų | 270 | 149.4 Ų | 149.4 | 100% | 1.184 | 76% | 0.761 | S | S | * | * | trans | -139.4 | 0 | 160.9 | -81.7 | -75.3 | 0 | 0 | 0 | 110.6 |
Retrieved 187 of 187 residues in 172.2 ms
(Link to these results)