| 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 | 41.3 | Very low | 43.1 | Very low | 247 Ų | 247 | 129.6 Ų | 129.6 | 100% | 1.217 | 84% | 0.836 | S | S | * | * | 0 | 105.2 | 0 | -154.4 | 161.1 | -176.7 | 0 | 0 | 106.6 | |||||
| 2 | S | 41.1 | Very low | 43 | Very low | 118 Ų | 118 | 126.6 Ų | 126.6 | 83% | 0.825 | 83% | 0.83 | S | S | * | * | trans | -103.8 | 112.7 | -165.4 | 46.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 3 | T | 39.3 | Very low | 42.8 | Very low | 136 Ų | 136 | 129.4 Ų | 129.4 | 83% | 0.834 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -87 | 130.6 | 170.9 | 39.7 | 0 | 0 | 0 | 0 | 110.1 | ||
| 4 | P | 45.3 | Very low | 42.8 | Very low | 122 Ų | 122 | 131.3 Ų | 131.3 | 79% | 0.792 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 146.9 | -177.6 | 31.5 | -34.1 | 0 | 0 | 0 | 112.1 | ||
| 5 | V | 46.6 | Very low | 42.9 | Very low | 142 Ų | 142 | 125.8 Ų | 125.8 | 86% | 0.861 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 129.7 | 173.3 | 175.6 | 0 | 0 | 0 | 0 | 109.8 | ||
| 6 | S | 40.3 | Very low | 42.9 | Very low | 104 Ų | 104 | 126.1 Ų | 126.1 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 135.4 | 174.3 | -45.1 | 0 | 0 | 0 | 0 | 111.4 | ||
| 7 | P | 45.8 | Very low | 43.3 | Very low | 123 Ų | 123 | 131.5 Ų | 131.5 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 148.4 | 175.7 | 30.5 | -34.1 | 0 | 0 | 0 | 111.7 | ||
| 8 | A | 43.6 | Very low | 43.2 | Very low | 92 Ų | 92 | 130.9 Ų | 130.9 | 76% | 0.76 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 150.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||
| 9 | P | 39.4 | Very low | 43.1 | Very low | 129 Ų | 129 | 136.9 Ų | 136.9 | 84% | 0.838 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 138 | 178.8 | 27.6 | -34.3 | 0 | 0 | 0 | 111.5 | ||
| 10 | A | 48.2 | Very low | 43.3 | Very low | 88 Ų | 88 | 134.9 Ų | 134.9 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 152 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | A12 | A10-A12 PolarHBondContact O-N 3Š|
| 11 | P | 43 | Very low | 42.9 | Very low | 125 Ų | 125 | 133.3 Ų | 133.3 | 81% | 0.812 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 134.7 | 174 | 26.6 | -34.4 | 0 | 0 | 0 | 110.3 | D13 | P11-D13 PolarHBondContact O-N 3.43Š|
| 12 | A | 42.6 | Very low | 43.3 | Very low | 93 Ų | 93 | 125.4 Ų | 125.4 | 77% | 0.769 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 125.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | A10 L14 | A10-A12 PolarHBondContact O-N 3Å; A12-L14 PolarHBondContact O-N 3.41Å |
| 13 | D | 40.3 | Very low | 43 | Very low | 163 Ų | 163 | 123.3 Ų | 123.3 | 87% | 0.872 | 74% | 0.743 | S | S | * | * | trans | -71.5 | 93.5 | -175.1 | -156.2 | 0.8 | 0 | 0 | 0 | 109.8 | P11 G15 | P11-D13 PolarHBondContact O-N 3.43Å; D13-G15 PolarHBondContact O-N 2.79Å | ||
| 14 | L | 42.5 | Very low | 43.1 | Very low | 156 Ų | 156 | 122.2 Ų | 122.2 | 82% | 0.817 | 74% | 0.738 | S | S | * | * | trans | -69.3 | 84.9 | 173.2 | -85.1 | 167.8 | 0 | 0 | 0 | 108.5 | A12 | A12-L14 PolarHBondContact O-N 3.41Š| ||
| 15 | G | 44.2 | Very low | 42.7 | Very low | 49 Ų | 49 | 126.2 Ų | 126.2 | 51% | 0.505 | 74% | 0.738 | S | S | . | * | trans | -47 | 146.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | D13 R17 | D13-G15 PolarHBondContact O-N 2.79Å; G15-R17 PolarHBondContact O-N 2.87Å | ||
| 16 | P | 42.7 | Very low | 42.3 | Very low | 131 Ų | 131 | 124.8 Ų | 124.8 | 85% | 0.851 | 73% | 0.729 | S | S | * | * | trans | -59.2 | 113.1 | -166.5 | 23.1 | -33.9 | 0 | 0 | 0 | 110.9 | ||||
| 17 | R | 50.1 | Low | 42.2 | Very low | 218 Ų | 218 | 124 Ų | 124 | 82% | 0.823 | 72% | 0.723 | S | S | * | * | trans | -52.5 | 138.4 | 168.5 | -68.8 | -176 | -178.7 | -176.9 | 0.9 | 108.3 | G15 R19 | G15-R17 PolarHBondContact O-N 2.87Å; R17-R19 PolarHBondContact O-N 3.41Å | ||
| 18 | P | 41 | Very low | 42 | Very low | 120 Ų | 120 | 124.9 Ų | 124.9 | 78% | 0.779 | 72% | 0.72 | S | S | * | * | trans | -55 | 127.2 | -175.2 | 22 | -33.3 | 0 | 0 | 0 | 109.7 | V20 | P18-V20 PolarHBondContact O-N 2.83Š| ||
| 19 | R | 41.1 | Very low | 41.6 | Very low | 245 Ų | 245 | 130.6 Ų | 130.6 | 93% | 0.925 | 72% | 0.723 | S | S | * | * | trans | -55.4 | 113.8 | 176.7 | -74.6 | -176.3 | 175.6 | -172.7 | -1.6 | 108.1 | R17 S21 | R17-R19 PolarHBondContact O-N 3.41Å; R19-S21 PolarHBondContact O-N 3.26Å | ||
| 20 | V | 46.6 | Very low | 41.5 | Very low | 96 Ų | 96 | 129.3 Ų | 129.3 | 58% | 0.582 | 72% | 0.718 | S | S | * | * | trans | -61.8 | 106.6 | 167.1 | 178 | 0 | 0 | 0 | 0 | 106 | P18 L22 | P18-V20 PolarHBondContact O-N 2.83Å; V20-L22 PolarHBondContact O-N 3.15Å | ||
| 21 | S | 36.9 | Very low | 41.2 | Very low | 102 Ų | 102 | 130 Ų | 130 | 71% | 0.713 | 72% | 0.723 | S | S | * | * | trans | -60 | 109.6 | 174.9 | -178 | 0 | 0 | 0 | 0 | 107.9 | R19 D23 | R19-S21 PolarHBondContact O-N 3.26Å; S21-D23 PolarHBondContact O-N 2.82Å | ||
| 22 | L | 48.4 | Very low | 41.2 | Very low | 82 Ų | 82 | 133.6 Ų | 133.6 | 43% | 0.429 | 72% | 0.721 | S | S | . | * | trans | -72.5 | 72.1 | 171.7 | -74.1 | 158 | 0 | 0 | 0 | 108.1 | V20 P24 Y317 N321 | V20-L22 PolarHBondContact O-N 3.15Å; L22-P24 WeakPolarHBondContact O-CD 3.46Å; L22-Y317 WeakPolarHBondContact CD2-OH 3.16Å; L22-N321 HydrophobicContact CD1-CB 3.8Å | ||
| 23 | D | 34.3 | Very low | 41.4 | Very low | 73 Ų | 73 | 139.7 Ų | 139.7 | 39% | 0.39 | 72% | 0.724 | S | S | . | * | trans | -53.7 | 120.3 | 178.6 | -168.6 | 5.3 | 0 | 0 | 0 | 108.2 | S21 R25 | S21-D23 PolarHBondContact O-N 2.82Å; D23-R25 PolarHBondContact O-N 3.28Å; D23-R25 IonicContact OD1-NH1 2.8Å; D23-R25 VanDerWaalsContact OD2-CD 3.31Å; D23-R25 WeakPolarHBondContact OD2-CD 3.23Å; D23-R25 IonicContact OD2-CZ 3.53Å; D23-R25 IonicContact OD2-NE 3.28Å; D23-R25 IonicContact OD2-NH1 3.4Å; D23-R25 PolarHBondContact OD2-NH1 2.9Å | ||
| 24 | P | 41.2 | Very low | 41.7 | Very low | 113 Ų | 113 | 137.2 Ų | 137.2 | 73% | 0.734 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -62 | 4.4 | -175.5 | -25.7 | 35.6 | 0 | 0 | 0 | 115.5 | L22 V26 S27 | L22-P24 WeakPolarHBondContact O-CD 3.46Å; P24-V26 PolarHBondContact O-N 2.75Å; P24-V26 VanDerWaalsContact O-N 3.08Å; P24-S27 PolarHBondContact O-N 3.34Å |
| 25 | R | 37.4 | Very low | 42.1 | Very low | 207 Ų | 207 | 135 Ų | 135 | 78% | 0.781 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -66 | -0.3 | 179.9 | -72.7 | -167.3 | 171.6 | 117.1 | -7.5 | 115.9 | D23 S27 | D23-R25 PolarHBondContact O-N 3.28Å; D23-R25 IonicContact OD1-NH1 2.8Å; D23-R25 VanDerWaalsContact OD2-CD 3.31Å; D23-R25 WeakPolarHBondContact OD2-CD 3.23Å; D23-R25 IonicContact OD2-CZ 3.53Å; D23-R25 IonicContact OD2-NE 3.28Å; D23-R25 IonicContact OD2-NH1 3.4Å; D23-R25 PolarHBondContact OD2-NH1 2.9Å; R25-S27 PolarHBondContact O-N 2.97Å |
| 26 | V | 38.8 | Very low | 42.4 | Very low | 111 Ų | 111 | 137.9 Ų | 137.9 | 67% | 0.673 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -81.2 | 11.5 | 170.5 | -155.6 | 0 | 0 | 0 | 0 | 112.6 | P24 I28 | P24-V26 PolarHBondContact O-N 2.75Å; P24-V26 VanDerWaalsContact O-N 3.08Å; V26-I28 VanDerWaalsContact C-N 3.29Å; V26-I28 HydrophobicContact CG1-CD1 4.45Å; V26-I28 PolarHBondContact O-N 3.46Å |
| 27 | S | 37.6 | Very low | 42.9 | Very low | 88 Ų | 88 | 134.8 Ų | 134.8 | 62% | 0.615 | 69% | 0.693 | S | S | * | * | trans | -73.7 | 82.1 | 159.9 | -169.5 | 0 | 0 | 0 | 0 | 111.1 | P24 R25 Y29 | P24-S27 PolarHBondContact O-N 3.34Å; R25-S27 PolarHBondContact O-N 2.97Å; S27-Y29 PolarHBondContact O-N 3.37Å | ||
| 28 | I | 41.5 | Very low | 43.4 | Very low | 141 Ų | 141 | 132.1 Ų | 132.1 | 72% | 0.723 | 68% | 0.684 | S | S | * | * | trans | -76.2 | 21.5 | 176 | -48.4 | 175.7 | 0 | 0 | 0 | 111.4 | V26 | V26-I28 VanDerWaalsContact C-N 3.29Å; V26-I28 HydrophobicContact CG1-CD1 4.45Å; V26-I28 PolarHBondContact O-N 3.46Å | ||
| 29 | Y | 35.5 | Very low | 44.9 | Very low | 213 Ų | 213 | 129.9 Ų | 129.9 | 84% | 0.835 | 67% | 0.668 | S | S | * | * | trans | -111.7 | 56.1 | 173.1 | -67.7 | -72.7 | 0 | 0 | 0 | 111 | S27 A31 | S27-Y29 PolarHBondContact O-N 3.37Å; Y29-A31 PolarHBondContact O-N 2.95Å; Y29-A31 VanDerWaalsContact O-N 3.15Å | ||
| 30 | S | 37 | Very low | 46.9 | Very low | 102 Ų | 102 | 123.8 Ų | 123.8 | 71% | 0.713 | 65% | 0.649 | S | S | * | * | trans | -59 | 116 | 167.7 | -175.8 | 0 | 0 | 0 | 0 | 109.9 | R32 | S30-R32 PolarHBondContact O-N 2.86Š| ||
| 31 | A | 41.7 | Very low | 49 | Very low | 103 Ų | 103 | 124 Ų | 124 | 85% | 0.851 | 65% | 0.646 | S | S | * | * | trans | -74.4 | 68.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y29 | Y29-A31 PolarHBondContact O-N 2.95Å; Y29-A31 VanDerWaalsContact O-N 3.15Å | ||
| 32 | R | 42.7 | Very low | 51.5 | Low | 200 Ų | 200 | 120.1 Ų | 120.1 | 76% | 0.755 | 62% | 0.617 | S | S | * | * | trans | -134.5 | 85.7 | 169.5 | -74.8 | -169.1 | 175.2 | -167.4 | -0.5 | 112 | S30 | S30-R32 PolarHBondContact O-N 2.86Š| ||
| 33 | R | 48.3 | Very low | 53.5 | Low | 221 Ų | 221 | 116.9 Ų | 116.9 | 83% | 0.834 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | 111.1 | 158.5 | -65.4 | -172.3 | 178.8 | -162.7 | 1.4 | 106.8 | L36 | R33-L36 HydrophobicContact CG-CD1 4.29Š|
| 34 | P | 45.3 | Very low | 56.3 | Low | 111 Ų | 111 | 121.4 Ų | 121.4 | 72% | 0.721 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | -132.3 | 13.7 | 84.7 | 24 | -4.6 | 0 | 0 | 0 | 114.9 | L36 | P34-L36 VanDerWaalsContact C-N 3.28Å; P34-L36 PolarHBondContact O-N 2.92Å | |
| 35 | L | 52 | Low | 58.7 | Low | 108 Ų | 108 | 118 Ų | 118 | 57% | 0.565 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.9 | -18.1 | -172.5 | -71.4 | 168.8 | 0 | 0 | 0 | 115.6 | A37 R38 T39 | L35-A37 PolarHBondContact O-N 2.91Å; L35-R38 PolarHBondContact O-N 3.15Å; L35-T39 PolarHBondContact O-N 2.78Å; L35-T39 PolarHBondContact O-OG1 3.23Å |
| 36 | L | 51.1 | Low | 61.4 | Low | 110 Ų | 110 | 108.3 Ų | 108.3 | 58% | 0.576 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65 | -34.2 | -174.9 | -81.4 | 163.7 | 0 | 0 | 0 | 114.7 | R33 P34 T39 H40 | R33-L36 HydrophobicContact CG-CD1 4.29Å; P34-L36 VanDerWaalsContact C-N 3.28Å; P34-L36 PolarHBondContact O-N 2.92Å; L36-T39 PolarHBondContact O-OG1 3.21Å; L36-H40 PolarHBondContact O-N 3.43Å |
| 37 | A | 51.7 | Low | 63.9 | Low | 66 Ų | 66 | 106.8 Ų | 106.8 | 55% | 0.545 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -69.8 | -40 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | L35 H40 I41 | L35-A37 PolarHBondContact O-N 2.91Å; A37-H40 PolarHBondContact O-N 3.32Å; A37-I41 PolarHBondContact O-N 2.95Å |
| 38 | R | 61.6 | Low | 66.6 | Low | 163 Ų | 163 | 105.9 Ų | 105.9 | 62% | 0.615 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.5 | -42.8 | 179.3 | -164.5 | 176.3 | -170.2 | 175.9 | 5.5 | 111.4 | L35 Q42 | L35-R38 PolarHBondContact O-N 3.15Å; R38-Q42 VanDerWaalsContact O-CB 3.22Å; R38-Q42 WeakPolarHBondContact O-CB 2.94Å; R38-Q42 PolarHBondContact O-N 3.06Å |
| 39 | T | 72.5 | Confident | 69 | Low | 72 Ų | 72 | 99.6 Ų | 99.6 | 44% | 0.442 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.7 | -34.9 | 177.4 | 53.2 | 0 | 0 | 0 | 0 | 112.6 | L35 L36 G43 | L35-T39 PolarHBondContact O-N 2.78Å; L35-T39 PolarHBondContact O-OG1 3.23Å; L36-T39 PolarHBondContact O-OG1 3.21Å; T39-G43 PolarHBondContact O-N 3.12Å |
| 40 | H | 83.2 | Confident | 71.6 | Confident | 117 Ų | 117 | 90.1 Ų | 90.1 | 54% | 0.542 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.7 | -48.3 | 176 | -178.8 | -127.7 | 0 | 0 | 0 | 112.6 | L36 A37 G43 R44 | L36-H40 PolarHBondContact O-N 3.43Å; A37-H40 PolarHBondContact O-N 3.32Å; H40-G43 PolarHBondContact O-N 3.26Å; H40-R44 WeakPolarHBondContact O-CG 3.43Å; H40-R44 PolarHBondContact O-N 3.23Å |
| 41 | I | 89.3 | Confident | 74.1 | Confident | 100 Ų | 100 | 90.8 Ų | 90.8 | 51% | 0.513 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -63.6 | -45.8 | 177.3 | -64.1 | 170.3 | 0 | 0 | 0 | 110.4 | A37 G43 R44 V45 | A37-I41 PolarHBondContact O-N 2.95Å; I41-G43 VanDerWaalsContact C-N 3.3Å; I41-G43 PolarHBondContact O-N 2.57Å; I41-R44 PolarHBondContact O-N 2.79Å; I41-R44 VanDerWaalsContact O-N 3.13Å; I41-V45 HydrophobicContact CG2-CG2 4.41Å; I41-V45 WeakPolarHBondContact O-CG2 3.46Å; I41-V45 PolarHBondContact O-N 2.94Å |
| 42 | Q | 90.4 | Very high | 76.4 | Confident | 21 Ų | 21 | 88.6 Ų | 88.6 | 10% | 0.098 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -57.5 | -42.5 | 178 | -165.3 | -174.7 | 9.6 | 0 | 0 | 111.7 | R38 Y46 W111 S112 C115 | R38-Q42 VanDerWaalsContact O-CB 3.22Å; R38-Q42 WeakPolarHBondContact O-CB 2.94Å; R38-Q42 PolarHBondContact O-N 3.06Å; Q42-Y46 WeakPolarHBondContact O-CB 3.26Å; Q42-Y46 PolarHBondContact O-N 2.84Å; Q42-W111 HydrophobicContact CB-CH2 4.22Å; Q42-W111 HydrophobicContact CB-CZ3 4.4Å; Q42-W111 HydrophobicContact CG-CE3 4.4Å; Q42-W111 HydrophobicContact CG-CH2 4.27Å; Q42-W111 HydrophobicContact CG-CZ3 4.18Å; Q42-W111 PolarHBondContact NE2-O 3.08Å; Q42-S112 WeakPolarHBondContact CG-O 3.38Å; Q42-C115 HydrophobicContact CB-CB 4.34Å; Q42-C115 HydrophobicContact CG-CB 4.07Å |
| 43 | G | 90.9 | Very high | 78.6 | Confident | 14 Ų | 14 | 84.4 Ų | 84.4 | 14% | 0.144 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -66.6 | -38.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114 | T39 H40 I41 N47 | T39-G43 PolarHBondContact O-N 3.12Å; H40-G43 PolarHBondContact O-N 3.26Å; I41-G43 VanDerWaalsContact C-N 3.3Å; I41-G43 PolarHBondContact O-N 2.57Å; G43-N47 WeakPolarHBondContact O-CB 3.27Å; G43-N47 VanDerWaalsContact O-CG 3.28Å; G43-N47 PolarHBondContact O-N 3.5Å; G43-N47 PolarHBondContact O-ND2 2.93Å |
| 44 | R | 91.8 | Very high | 80.7 | Confident | 169 Ų | 169 | 76.6 Ų | 76.6 | 64% | 0.638 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -64.1 | -45.8 | 175 | -75.8 | -178.9 | 64.5 | 175.9 | 0.1 | 112 | H40 I41 N47 F48 | H40-R44 WeakPolarHBondContact O-CG 3.43Å; H40-R44 PolarHBondContact O-N 3.23Å; I41-R44 PolarHBondContact O-N 2.79Å; I41-R44 VanDerWaalsContact O-N 3.13Å; R44-N47 PolarHBondContact O-N 2.68Å; R44-F48 WeakPolarHBondContact O-CB 3.45Å; R44-F48 PolarHBondContact O-N 2.87Å |
| 45 | V | 93.3 | Very high | 83.1 | Confident | 41 Ų | 41 | 80.7 Ų | 80.7 | 25% | 0.248 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -64.4 | -43.7 | 176.6 | 175.2 | 0 | 0 | 0 | 0 | 111 | I41 N47 F48 L49 V108 | I41-V45 HydrophobicContact CG2-CG2 4.41Å; I41-V45 WeakPolarHBondContact O-CG2 3.46Å; I41-V45 PolarHBondContact O-N 2.94Å; V45-N47 VanDerWaalsContact C-N 3.34Å; V45-N47 PolarHBondContact O-N 2.91Å; V45-F48 PolarHBondContact O-N 3.4Å; V45-L49 HydrophobicContact CG1-CD1 3.83Å; V45-L49 HydrophobicContact CG1-CG 4.34Å; V45-L49 PolarHBondContact O-N 3.4Å; V45-V108 HydrophobicContact CG1-CG1 3.73Å |
| 46 | Y | 93 | Very high | 85.1 | Confident | 4 Ų | 4 | 82.3 Ų | 82.3 | 2% | 0.016 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -60.3 | -42.7 | 176.2 | 177.7 | -102.9 | 0 | 0 | 0 | 112.3 | Q42 E50 A113 C115 R116 F128 | Q42-Y46 WeakPolarHBondContact O-CB 3.26Å; Q42-Y46 PolarHBondContact O-N 2.84Å; Y46-E50 HydrophobicContact CD2-CB 4.2Å; Y46-E50 HydrophobicContact CE2-CB 3.78Å; Y46-E50 HydrophobicContact CE2-CG 4.12Å; Y46-E50 WeakPolarHBondContact O-CB 3.37Å; Y46-E50 PolarHBondContact O-N 3Å; Y46-E50 PolarHBondContact OH-OE1 3.42Å; Y46-A113 HydrophobicContact CD2-CB 4.42Å; Y46-A113 HydrophobicContact CE2-CB 4.38Å; Y46-C115 VanDerWaalsContact CB-SG 3.59Å; Y46-C115 VanDerWaalsContact CD1-SG 3.58Å; Y46-R116 HydrophobicContact CD1-CG 4.36Å; Y46-R116 HydrophobicContact CE1-CG 3.82Å; Y46-F128 HydrophobicContact CE2-CE2 4.16Å |
| 47 | N | 92.1 | Very high | 87.1 | Confident | 79 Ų | 79 | 77.7 Ų | 77.7 | 42% | 0.422 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.6 | -44.4 | 176.1 | -72.9 | -26 | 0 | 0 | 0 | 111.5 | G43 R44 V45 L49 R51 | G43-N47 WeakPolarHBondContact O-CB 3.27Å; G43-N47 VanDerWaalsContact O-CG 3.28Å; G43-N47 PolarHBondContact O-N 3.5Å; G43-N47 PolarHBondContact O-ND2 2.93Å; R44-N47 PolarHBondContact O-N 2.68Å; V45-N47 VanDerWaalsContact C-N 3.34Å; V45-N47 PolarHBondContact O-N 2.91Å; N47-L49 PolarHBondContact O-N 3.46Å; N47-R51 CarbonylContact O-C 3.59Å; N47-R51 VanDerWaalsContact O-CA 3.22Å; N47-R51 WeakPolarHBondContact O-CA 3.47Å; N47-R51 PolarHBondContact O-N 3.45Å |
| 48 | F | 93.7 | Very high | 89 | Confident | 69 Ų | 69 | 80.9 Ų | 80.9 | 30% | 0.303 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -59.3 | -45.6 | 176.9 | -177.1 | -96 | 0 | 0 | 0 | 112.8 | R44 V45 C57 Y60 H61 | R44-F48 WeakPolarHBondContact O-CB 3.45Å; R44-F48 PolarHBondContact O-N 2.87Å; V45-F48 PolarHBondContact O-N 3.4Å; F48-C57 HydrophobicContact CD2-CB 4.44Å; F48-C57 WeakPolarHBondContact CD2-SG 3.4Å; F48-C57 HydrophobicContact CE2-CB 4.46Å; F48-Y60 AromaticContact CE1-CD1 3.66Å; F48-Y60 HydrophobicContact CE1-CD1 3.66Å; F48-Y60 HydrophobicContact CE1-CD2 4.15Å; F48-Y60 HydrophobicContact CE1-CE1 4.08Å; F48-Y60 AromaticContact CE1-CG 3.7Å; F48-Y60 HydrophobicContact CE1-CG 3.7Å; F48-Y60 HydrophobicContact CZ-CD1 4.01Å; F48-Y60 HydrophobicContact CZ-CD2 4.27Å; F48-Y60 AromaticContact CZ-CG 3.69Å; F48-Y60 HydrophobicContact CZ-CG 3.69Å; F48-H61 PolarHBondContact O-NE2 3.26Å |
| 49 | L | 91.9 | Very high | 90.6 | Very high | 9 Ų | 9 | 76.8 Ų | 76.8 | 5% | 0.047 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -80.7 | -45.5 | -176.2 | -66.4 | 178.2 | 0 | 0 | 0 | 113.5 | V45 N47 Y60 H61 E105 V108 R109 R178 | V45-L49 HydrophobicContact CG1-CD1 3.83Å; V45-L49 HydrophobicContact CG1-CG 4.34Å; V45-L49 PolarHBondContact O-N 3.4Å; N47-L49 PolarHBondContact O-N 3.46Å; L49-Y60 HydrophobicContact CD2-CE1 3.86Å; L49-H61 PolarHBondContact O-CE1 2.92Å; L49-H61 VanDerWaalsContact O-CE1 3.28Å; L49-E105 HydrophobicContact CD2-CG 4.25Å; L49-V108 HydrophobicContact CD1-CG1 3.88Å; L49-R109 HydrophobicContact CB-CG 4.33Å; L49-R109 HydrophobicContact CD1-CB 4.25Å; L49-R109 HydrophobicContact CD1-CG 4.43Å; L49-R178 VanDerWaalsContact O-CZ 3.29Å; L49-R178 PolarHBondContact O-NE 3.3Å; L49-R178 PolarHBondContact O-NH2 3.12Å |
| 50 | E | 89.9 | Confident | 91.6 | Very high | 14 Ų | 14 | 76.1 Ų | 76.1 | 7% | 0.065 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -98 | -24.3 | -174.2 | -172 | 143.2 | 117.2 | 0 | 0 | 113.8 | Y46 P52 F128 K131 Q179 | Y46-E50 HydrophobicContact CD2-CB 4.2Å; Y46-E50 HydrophobicContact CE2-CB 3.78Å; Y46-E50 HydrophobicContact CE2-CG 4.12Å; Y46-E50 WeakPolarHBondContact O-CB 3.37Å; Y46-E50 PolarHBondContact O-N 3Å; Y46-E50 PolarHBondContact OH-OE1 3.42Å; E50-P52 VanDerWaalsContact C-CD 3.46Å; E50-P52 WeakPolarHBondContact O-CD 3.37Å; E50-F128 WeakPolarHBondContact OE2-CE2 3.26Å; E50-F128 VanDerWaalsContact OE2-CZ 3.27Å; E50-F128 WeakPolarHBondContact OE2-CZ 3.41Å; E50-K131 VanDerWaalsContact CD-NZ 3.34Å; E50-K131 IonicContact OE1-NZ 2.73Å; E50-K131 PolarHBondContact OE1-NZ 3.35Å; E50-K131 IonicContact OE2-NZ 2.66Å; E50-K131 PolarHBondContact OE2-NZ 3.34Å; E50-Q179 WeakPolarHBondContact O-CG 3.44Å; E50-Q179 PolarHBondContact O-NE2 3.19Å |
| 51 | R | 89.8 | Confident | 92.1 | Very high | 116 Ų | 116 | 72.3 Ų | 72.3 | 44% | 0.438 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -129 | 60.9 | -174.9 | -65.6 | -179 | 163.9 | -157 | -12.9 | 111.8 | N47 T53 | N47-R51 CarbonylContact O-C 3.59Å; N47-R51 VanDerWaalsContact O-CA 3.22Å; N47-R51 WeakPolarHBondContact O-CA 3.47Å; N47-R51 PolarHBondContact O-N 3.45Å; R51-T53 PolarHBondContact O-N 2.94Å; R51-T53 VanDerWaalsContact O-N 3.17Å |
| 52 | P | 88.9 | Confident | 92.2 | Very high | 57 Ų | 57 | 72.5 Ų | 72.5 | 37% | 0.37 | 35% | 0.353 | S | S | . | . | trans | -56.1 | 122.1 | -175.4 | 23.2 | -33.8 | 0 | 0 | 0 | 111.3 | E50 C57 | E50-P52 VanDerWaalsContact C-CD 3.46Å; E50-P52 WeakPolarHBondContact O-CD 3.37Å; P52-C57 HydrophobicContact CB-CB 3.61Å | ||
| 53 | T | 89.1 | Confident | 92.4 | Very high | 111 Ų | 111 | 74.6 Ų | 74.6 | 68% | 0.681 | 37% | 0.368 | S | S | * | . | trans | -135.5 | 139.7 | 173.5 | 54.9 | 0 | 0 | 0 | 0 | 110.1 | R51 C57 | R51-T53 PolarHBondContact O-N 2.94Å; R51-T53 VanDerWaalsContact O-N 3.17Å; T53-C57 PolarHBondContact O-SG 3.42Å | ||
| 54 | G | 93.7 | Very high | 92.5 | Very high | 57 Ų | 57 | 74.5 Ų | 74.5 | 59% | 0.588 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | 72.6 | 169 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | K56 C57 F58 | G54-K56 PolarHBondContact O-N 3.06Å; G54-C57 PolarHBondContact O-N 3.2Å; G54-F58 PolarHBondContact O-N 3.35Å |
| 55 | W | 94.4 | Very high | 92.5 | Very high | 197 Ų | 197 | 69.2 Ų | 69.2 | 75% | 0.746 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -58.4 | -42.2 | -170.4 | 69.8 | -54.4 | 0 | 0 | 0 | 115.3 | C57 F58 V59 | W55-C57 VanDerWaalsContact C-N 3.3Å; W55-C57 PolarHBondContact O-N 3.1Å; W55-F58 WeakPolarHBondContact O-CB 3.32Å; W55-F58 PolarHBondContact O-N 3.29Å; W55-F58 VanDerWaalsContact O-N 3.1Å; W55-V59 WeakPolarHBondContact O-CG2 3.34Å; W55-V59 PolarHBondContact O-N 3.27Å |
| 56 | K | 94.4 | Very high | 92.4 | Very high | 143 Ų | 143 | 71.2 Ų | 71.2 | 62% | 0.622 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -61.2 | -38 | -179.4 | -63.4 | -173.1 | 179.5 | -174 | 0 | 112.8 | G54 Y60 | G54-K56 PolarHBondContact O-N 3.06Å; K56-Y60 PolarHBondContact O-N 3.37Å |
| 57 | C | 92.8 | Very high | 92.4 | Very high | 12 Ų | 12 | 74.3 Ų | 74.3 | 8% | 0.081 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -68.4 | -47 | 173.8 | -56.6 | 0 | 0 | 0 | 0 | 110 | F48 P52 T53 G54 W55 V59 Y60 H61 | F48-C57 HydrophobicContact CD2-CB 4.44Å; F48-C57 WeakPolarHBondContact CD2-SG 3.4Å; F48-C57 HydrophobicContact CE2-CB 4.46Å; P52-C57 HydrophobicContact CB-CB 3.61Å; T53-C57 PolarHBondContact O-SG 3.42Å; G54-C57 PolarHBondContact O-N 3.2Å; W55-C57 VanDerWaalsContact C-N 3.3Å; W55-C57 PolarHBondContact O-N 3.1Å; C57-V59 VanDerWaalsContact C-N 3.34Å; C57-V59 PolarHBondContact O-N 2.68Å; C57-Y60 PolarHBondContact O-N 2.85Å; C57-H61 PolarHBondContact O-CD2 3.19Å; C57-H61 PolarHBondContact O-N 2.89Å |
| 58 | F | 92.3 | Very high | 92.3 | Very high | 133 Ų | 133 | 70.8 Ų | 70.8 | 58% | 0.583 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -53.9 | -48.7 | 177.4 | 175.8 | -96.3 | 0 | 0 | 0 | 112.1 | G54 W55 Y60 H61 F62 | G54-F58 PolarHBondContact O-N 3.35Å; W55-F58 WeakPolarHBondContact O-CB 3.32Å; W55-F58 PolarHBondContact O-N 3.29Å; W55-F58 VanDerWaalsContact O-N 3.1Å; F58-Y60 PolarHBondContact O-N 3.4Å; F58-H61 PolarHBondContact O-N 3.07Å; F58-F62 HydrophobicContact CE1-CB 4.33Å; F58-F62 HydrophobicContact CE1-CG 4.43Å; F58-F62 HydrophobicContact CZ-CB 4.36Å; F58-F62 HydrophobicContact CZ-CD2 4.18Å; F58-F62 HydrophobicContact CZ-CG 4.33Å; F58-F62 WeakPolarHBondContact O-CB 3.15Å; F58-F62 PolarHBondContact O-N 3.31Å |
| 59 | V | 95.3 | Very high | 92.2 | Very high | 78 Ų | 78 | 70.2 Ų | 70.2 | 47% | 0.473 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -56.7 | -49 | 177.4 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | W55 C57 F62 T63 | W55-V59 WeakPolarHBondContact O-CG2 3.34Å; W55-V59 PolarHBondContact O-N 3.27Å; C57-V59 VanDerWaalsContact C-N 3.34Å; C57-V59 PolarHBondContact O-N 2.68Å; V59-F62 PolarHBondContact O-N 2.95Å; V59-T63 WeakPolarHBondContact O-CB 3.44Å; V59-T63 PolarHBondContact O-N 3Å; V59-T63 PolarHBondContact O-OG1 2.73Å |
| 60 | Y | 94.5 | Very high | 92.2 | Very high | 58 Ų | 58 | 72.3 Ų | 72.3 | 23% | 0.227 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.1 | -51.7 | 178.3 | 171.1 | -98.2 | 0 | 0 | 0 | 112.7 | F48 L49 K56 C57 F58 F62 T63 V64 F101 E105 | F48-Y60 AromaticContact CE1-CD1 3.66Å; F48-Y60 HydrophobicContact CE1-CD1 3.66Å; F48-Y60 HydrophobicContact CE1-CD2 4.15Å; F48-Y60 HydrophobicContact CE1-CE1 4.08Å; F48-Y60 AromaticContact CE1-CG 3.7Å; F48-Y60 HydrophobicContact CE1-CG 3.7Å; F48-Y60 HydrophobicContact CZ-CD1 4.01Å; F48-Y60 HydrophobicContact CZ-CD2 4.27Å; F48-Y60 AromaticContact CZ-CG 3.69Å; F48-Y60 HydrophobicContact CZ-CG 3.69Å; L49-Y60 HydrophobicContact CD2-CE1 3.86Å; K56-Y60 PolarHBondContact O-N 3.37Å; C57-Y60 PolarHBondContact O-N 2.85Å; F58-Y60 PolarHBondContact O-N 3.4Å; Y60-F62 VanDerWaalsContact C-N 3.33Å; Y60-F62 PolarHBondContact O-N 2.98Å; Y60-T63 PolarHBondContact O-N 3.02Å; Y60-V64 HydrophobicContact CD2-CG2 4.44Å; Y60-V64 HydrophobicContact CE1-CG2 4.34Å; Y60-V64 HydrophobicContact CE2-CG2 4.06Å; Y60-V64 WeakPolarHBondContact O-CG2 3.17Å; Y60-V64 PolarHBondContact O-N 3.26Å; Y60-F101 HydrophobicContact CE2-CZ 4.1Å; Y60-E105 WeakPolarHBondContact OH-CG 3.47Å |
| 61 | H | 92.1 | Very high | 92.1 | Very high | 37 Ų | 37 | 71.8 Ų | 71.8 | 17% | 0.171 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65.9 | -35.8 | -178.8 | -75.4 | -99.2 | 0 | 0 | 0 | 112 | F48 L49 C57 F58 F65 R178 | F48-H61 PolarHBondContact O-NE2 3.26Å; L49-H61 PolarHBondContact O-CE1 2.92Å; L49-H61 VanDerWaalsContact O-CE1 3.28Å; C57-H61 PolarHBondContact O-CD2 3.19Å; C57-H61 PolarHBondContact O-N 2.89Å; F58-H61 PolarHBondContact O-N 3.07Å; H61-F65 WeakPolarHBondContact O-CB 3.2Å; H61-F65 PolarHBondContact O-N 2.58Å; H61-R178 PolarHBondContact CE1-NH2 2.92Å; H61-R178 VanDerWaalsContact CE1-NH2 3.26Å |
| 62 | F | 92.8 | Very high | 92.1 | Very high | 103 Ų | 103 | 68 Ų | 68 | 45% | 0.452 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -69.8 | -40.5 | 175.9 | -175.7 | -100 | 0 | 0 | 0 | 112.4 | F58 V59 Y60 F65 L66 | F58-F62 HydrophobicContact CE1-CB 4.33Å; F58-F62 HydrophobicContact CE1-CG 4.43Å; F58-F62 HydrophobicContact CZ-CB 4.36Å; F58-F62 HydrophobicContact CZ-CD2 4.18Å; F58-F62 HydrophobicContact CZ-CG 4.33Å; F58-F62 WeakPolarHBondContact O-CB 3.15Å; F58-F62 PolarHBondContact O-N 3.31Å; V59-F62 PolarHBondContact O-N 2.95Å; Y60-F62 VanDerWaalsContact C-N 3.33Å; Y60-F62 PolarHBondContact O-N 2.98Å; F62-F65 WeakPolarHBondContact O-CB 3.3Å; F62-F65 PolarHBondContact O-N 2.79Å; F62-L66 WeakPolarHBondContact O-CB 3.41Å; F62-L66 PolarHBondContact O-N 3.01Å |
| 63 | T | 93.6 | Very high | 92.2 | Very high | 66 Ų | 66 | 69.5 Ų | 69.5 | 41% | 0.405 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63.8 | -44.2 | 173.7 | -61.3 | 0 | 0 | 0 | 0 | 111.2 | V59 Y60 F65 L66 I67 | V59-T63 WeakPolarHBondContact O-CB 3.44Å; V59-T63 PolarHBondContact O-N 3Å; V59-T63 PolarHBondContact O-OG1 2.73Å; Y60-T63 PolarHBondContact O-N 3.02Å; T63-F65 VanDerWaalsContact C-N 3.35Å; T63-F65 PolarHBondContact O-N 3.08Å; T63-L66 PolarHBondContact O-N 3.48Å; T63-I67 HydrophobicContact CG2-CD1 3.91Å; T63-I67 HydrophobicContact CG2-CG1 4.49Å; T63-I67 VanDerWaalsContact O-CG1 3.28Å; T63-I67 WeakPolarHBondContact O-CG1 3.22Å; T63-I67 PolarHBondContact O-N 3.23Å |
| 64 | V | 92.5 | Very high | 92.3 | Very high | 12 Ų | 12 | 67.3 Ų | 67.3 | 7% | 0.073 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -60.4 | -44.7 | 174.6 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | Y60 L66 I67 V68 F101 F102 | Y60-V64 HydrophobicContact CD2-CG2 4.44Å; Y60-V64 HydrophobicContact CE1-CG2 4.34Å; Y60-V64 HydrophobicContact CE2-CG2 4.06Å; Y60-V64 WeakPolarHBondContact O-CG2 3.17Å; Y60-V64 PolarHBondContact O-N 3.26Å; V64-L66 PolarHBondContact O-N 2.64Å; V64-I67 PolarHBondContact O-N 3.35Å; V64-V68 WeakPolarHBondContact O-CG2 3.31Å; V64-V68 PolarHBondContact O-N 2.77Å; V64-V68 VanDerWaalsContact O-N 3.13Å; V64-F101 HydrophobicContact CG1-CE1 4.32Å; V64-F101 HydrophobicContact CG2-CE1 3.76Å; V64-F101 HydrophobicContact CG2-CZ 3.71Å; V64-F102 HydrophobicContact CG1-CE1 3.66Å; V64-F102 HydrophobicContact CG1-CZ 3.91Å |
| 65 | F | 91.8 | Very high | 91.9 | Very high | 58 Ų | 58 | 64.7 Ų | 64.7 | 25% | 0.254 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -57.2 | -47.1 | 173.5 | 169.4 | -103.3 | 0 | 0 | 0 | 112.4 | H61 F62 T63 I67 V68 L69 M173 V176 | H61-F65 WeakPolarHBondContact O-CB 3.2Å; H61-F65 PolarHBondContact O-N 2.58Å; F62-F65 WeakPolarHBondContact O-CB 3.3Å; F62-F65 PolarHBondContact O-N 2.79Å; T63-F65 VanDerWaalsContact C-N 3.35Å; T63-F65 PolarHBondContact O-N 3.08Å; F65-I67 PolarHBondContact O-N 3.37Å; F65-V68 PolarHBondContact O-N 3.23Å; F65-L69 HydrophobicContact CE1-CD2 4.19Å; F65-L69 HydrophobicContact CZ-CD2 4.3Å; F65-L69 WeakPolarHBondContact O-CB 3.33Å; F65-L69 PolarHBondContact O-N 2.97Å; F65-M173 HydrophobicContact CE2-CE 3.98Å; F65-M173 HydrophobicContact CZ-CE 4.47Å; F65-V176 HydrophobicContact CD2-CG1 4.2Å; F65-V176 HydrophobicContact CD2-CG2 4.03Å |
| 66 | L | 92.6 | Very high | 91.7 | Very high | 82 Ų | 82 | 59.3 Ų | 59.3 | 43% | 0.429 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -62.9 | -41.6 | -179.7 | -175.5 | 64.1 | 0 | 0 | 0 | 112.1 | F62 T63 V64 V68 L69 V70 | F62-L66 WeakPolarHBondContact O-CB 3.41Å; F62-L66 PolarHBondContact O-N 3.01Å; T63-L66 PolarHBondContact O-N 3.48Å; V64-L66 PolarHBondContact O-N 2.64Å; L66-V68 VanDerWaalsContact C-N 3.34Å; L66-V68 PolarHBondContact O-N 2.91Å; L66-L69 PolarHBondContact O-N 2.77Å; L66-V70 HydrophobicContact CD1-CG2 4.49Å; L66-V70 WeakPolarHBondContact O-CG2 3.3Å; L66-V70 PolarHBondContact O-N 3.2Å |
| 67 | I | 91.7 | Very high | 91.5 | Very high | 69 Ų | 69 | 55.3 Ų | 55.3 | 35% | 0.354 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -63.4 | -41.1 | 177.2 | -64.6 | 163.3 | 0 | 0 | 0 | 110.8 | T63 V64 F65 C71 L98 | T63-I67 HydrophobicContact CG2-CD1 3.91Å; T63-I67 HydrophobicContact CG2-CG1 4.49Å; T63-I67 VanDerWaalsContact O-CG1 3.28Å; T63-I67 WeakPolarHBondContact O-CG1 3.22Å; T63-I67 PolarHBondContact O-N 3.23Å; V64-I67 PolarHBondContact O-N 3.35Å; F65-I67 PolarHBondContact O-N 3.37Å; I67-C71 WeakPolarHBondContact O-CB 3.12Å; I67-C71 PolarHBondContact O-N 3.03Å; I67-L98 HydrophobicContact CG2-CD2 3.63Å |
| 68 | V | 91.1 | Very high | 91.2 | Very high | 6 Ų | 6 | 55.4 Ų | 55.4 | 4% | 0.036 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -65.5 | -42.2 | 175.3 | 174.7 | 0 | 0 | 0 | 0 | 111.4 | V64 F65 L66 C71 L72 F102 R172 | V64-V68 WeakPolarHBondContact O-CG2 3.31Å; V64-V68 PolarHBondContact O-N 2.77Å; V64-V68 VanDerWaalsContact O-N 3.13Å; F65-V68 PolarHBondContact O-N 3.23Å; L66-V68 VanDerWaalsContact C-N 3.34Å; L66-V68 PolarHBondContact O-N 2.91Å; V68-C71 WeakPolarHBondContact O-CB 3.33Å; V68-C71 PolarHBondContact O-N 3.49Å; V68-L72 PolarHBondContact O-N 3.32Å; V68-F102 HydrophobicContact CG2-CE2 4.02Å; V68-F102 HydrophobicContact CG2-CZ 3.57Å; V68-R172 HydrophobicContact CG1-CB 4.17Å; V68-R172 HydrophobicContact CG1-CG 3.82Å; V68-R172 HydrophobicContact CG2-CG 3.91Å |
| 69 | L | 91.1 | Very high | 91 | Very high | 57 Ų | 57 | 53.2 Ų | 53.2 | 30% | 0.298 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -62.7 | -44.1 | 177.3 | -178.1 | 63.9 | 0 | 0 | 0 | 111.9 | F65 L66 C71 L72 I73 | F65-L69 HydrophobicContact CE1-CD2 4.19Å; F65-L69 HydrophobicContact CZ-CD2 4.3Å; F65-L69 WeakPolarHBondContact O-CB 3.33Å; F65-L69 PolarHBondContact O-N 2.97Å; L66-L69 PolarHBondContact O-N 2.77Å; L69-C71 VanDerWaalsContact C-N 3.35Å; L69-C71 PolarHBondContact O-N 3.44Å; L69-L72 WeakPolarHBondContact O-CB 3.18Å; L69-L72 PolarHBondContact O-N 3.21Å; L69-I73 HydrophobicContact CG-CD1 4.2Å; L69-I73 WeakPolarHBondContact O-CG1 3.35Å; L69-I73 PolarHBondContact O-N 3.3Å |
| 70 | V | 91.4 | Very high | 90.8 | Very high | 53 Ų | 53 | 52.8 Ų | 52.8 | 32% | 0.321 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.1 | -42.3 | 175.3 | 169 | 0 | 0 | 0 | 0 | 111 | L66 L72 I73 F74 | L66-V70 HydrophobicContact CD1-CG2 4.49Å; L66-V70 WeakPolarHBondContact O-CG2 3.3Å; L66-V70 PolarHBondContact O-N 3.2Å; V70-L72 VanDerWaalsContact C-N 3.35Å; V70-L72 PolarHBondContact O-N 2.98Å; V70-I73 PolarHBondContact O-N 3.34Å; V70-F74 HydrophobicContact CG1-CD2 3.78Å; V70-F74 HydrophobicContact CG1-CE2 3.65Å; V70-F74 VanDerWaalsContact O-CD2 3.3Å; V70-F74 WeakPolarHBondContact O-CD2 3.33Å; V70-F74 PolarHBondContact O-N 3.2Å |
| 71 | C | 89.3 | Confident | 90.6 | Very high | 2 Ų | 2 | 58.7 Ų | 58.7 | 1% | 0.014 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.3 | -41.6 | 175 | -170.9 | 0 | 0 | 0 | 0 | 112.2 | I67 V68 L69 F74 S75 L98 Q169 | I67-C71 WeakPolarHBondContact O-CB 3.12Å; I67-C71 PolarHBondContact O-N 3.03Å; V68-C71 WeakPolarHBondContact O-CB 3.33Å; V68-C71 PolarHBondContact O-N 3.49Å; L69-C71 VanDerWaalsContact C-N 3.35Å; L69-C71 PolarHBondContact O-N 3.44Å; C71-F74 PolarHBondContact O-N 2.91Å; C71-S75 PolarHBondContact O-N 3.37Å; C71-L98 HydrophobicContact CB-CD1 3.81Å; C71-L98 VanDerWaalsContact SG-CD1 3.59Å; C71-Q169 PolarHBondContact SG-NE2 3.31Å; C71-Q169 VanDerWaalsContact SG-NE2 3.35Å |
| 72 | L | 89.8 | Confident | 90.6 | Very high | 37 Ų | 37 | 64.7 Ų | 64.7 | 19% | 0.194 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -62.2 | -42.2 | 173.4 | -179.4 | 64 | 0 | 0 | 0 | 112 | V68 L69 V70 S75 V76 I170 | V68-L72 PolarHBondContact O-N 3.32Å; L69-L72 WeakPolarHBondContact O-CB 3.18Å; L69-L72 PolarHBondContact O-N 3.21Å; V70-L72 VanDerWaalsContact C-N 3.35Å; V70-L72 PolarHBondContact O-N 2.98Å; L72-S75 WeakPolarHBondContact O-CA 3.43Å; L72-S75 VanDerWaalsContact O-CB 3.31Å; L72-S75 WeakPolarHBondContact O-CB 3.4Å; L72-S75 PolarHBondContact O-N 3.45Å; L72-S75 VanDerWaalsContact O-N 3.12Å; L72-V76 PolarHBondContact O-N 3.4Å; L72-I170 HydrophobicContact CD1-CG1 3.85Å |
| 73 | I | 90.8 | Very high | 90.6 | Very high | 88 Ų | 88 | 65.6 Ų | 65.6 | 45% | 0.451 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.1 | -47 | 176.4 | -68.8 | 163.2 | 0 | 0 | 0 | 110.8 | L69 V70 S75 V76 L77 | L69-I73 HydrophobicContact CG-CD1 4.2Å; L69-I73 WeakPolarHBondContact O-CG1 3.35Å; L69-I73 PolarHBondContact O-N 3.3Å; V70-I73 PolarHBondContact O-N 3.34Å; I73-S75 PolarHBondContact O-N 2.88Å; I73-V76 PolarHBondContact O-N 2.97Å; I73-V76 VanDerWaalsContact O-N 3.07Å; I73-L77 HydrophobicContact CG2-CD1 4.32Å; I73-L77 WeakPolarHBondContact O-CG 3.29Å; I73-L77 PolarHBondContact O-N 3.4Å |
| 74 | F | 89.7 | Confident | 90.2 | Very high | 65 Ų | 65 | 63.8 Ų | 63.8 | 29% | 0.285 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -59.5 | -33.1 | 174.6 | -83 | -70.7 | 0 | 0 | 0 | 112.7 | V70 C71 L77 S78 L91 | V70-F74 HydrophobicContact CG1-CD2 3.78Å; V70-F74 HydrophobicContact CG1-CE2 3.65Å; V70-F74 VanDerWaalsContact O-CD2 3.3Å; V70-F74 WeakPolarHBondContact O-CD2 3.33Å; V70-F74 PolarHBondContact O-N 3.2Å; C71-F74 PolarHBondContact O-N 2.91Å; F74-L77 HydrophobicContact CD1-CD1 4.35Å; F74-L77 PolarHBondContact O-N 3.27Å; F74-S78 PolarHBondContact O-N 3.38Å; F74-L91 HydrophobicContact CB-CD2 3.7Å; F74-L91 HydrophobicContact CB-CG 4.03Å |
| 75 | S | 87.1 | Confident | 89.9 | Confident | 3 Ų | 3 | 67.6 Ų | 67.6 | 2% | 0.021 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -71.8 | -26.2 | 175.5 | -163.6 | 0 | 0 | 0 | 0 | 114.4 | C71 L72 I73 S78 R166 Q169 | C71-S75 PolarHBondContact O-N 3.37Å; L72-S75 WeakPolarHBondContact O-CA 3.43Å; L72-S75 VanDerWaalsContact O-CB 3.31Å; L72-S75 WeakPolarHBondContact O-CB 3.4Å; L72-S75 PolarHBondContact O-N 3.45Å; L72-S75 VanDerWaalsContact O-N 3.12Å; I73-S75 PolarHBondContact O-N 2.88Å; S75-S78 PolarHBondContact O-OG 3.44Å; S75-R166 PolarHBondContact O-NE 2.89Å; S75-R166 PolarHBondContact O-NH2 3.27Å; S75-R166 WeakPolarHBondContact OG-CG 3.37Å; S75-Q169 PolarHBondContact OG-OE1 2.99Å |
| 76 | V | 89.6 | Confident | 89.7 | Confident | 83 Ų | 83 | 70.8 Ų | 70.8 | 50% | 0.503 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -75.5 | -43.6 | 166.9 | 176.9 | 0 | 0 | 0 | 0 | 109.8 | L72 I73 S78 T79 | L72-V76 PolarHBondContact O-N 3.4Å; I73-V76 PolarHBondContact O-N 2.97Å; I73-V76 VanDerWaalsContact O-N 3.07Å; V76-S78 PolarHBondContact O-N 3.32Å; V76-T79 PolarHBondContact O-N 3.33Å; V76-T79 PolarHBondContact O-OG1 3.32Å |
| 77 | L | 90.1 | Very high | 89.4 | Confident | 59 Ų | 59 | 67 Ų | 67 | 31% | 0.309 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -60.2 | -29.9 | 175.5 | -65.3 | 176.1 | 0 | 0 | 0 | 112.4 | I73 F74 T79 I80 A87 | I73-L77 HydrophobicContact CG2-CD1 4.32Å; I73-L77 WeakPolarHBondContact O-CG 3.29Å; I73-L77 PolarHBondContact O-N 3.4Å; F74-L77 HydrophobicContact CD1-CD1 4.35Å; F74-L77 PolarHBondContact O-N 3.27Å; L77-T79 PolarHBondContact O-N 2.95Å; L77-I80 HydrophobicContact CD2-CD1 4.15Å; L77-I80 PolarHBondContact O-N 2.86Å; L77-A87 HydrophobicContact CB-CB 4.43Å |
| 78 | S | 86.7 | Confident | 89 | Confident | 15 Ų | 15 | 66.3 Ų | 66.3 | 11% | 0.105 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -9.9 | 174.6 | 77.3 | 0 | 0 | 0 | 0 | 115.2 | F74 S75 V76 R166 | F74-S78 PolarHBondContact O-N 3.38Å; S75-S78 PolarHBondContact O-OG 3.44Å; V76-S78 PolarHBondContact O-N 3.32Å; S78-R166 PolarHBondContact OG-NH2 3.39Å |
| 79 | T | 88.2 | Confident | 88.6 | Confident | 86 Ų | 86 | 68 Ų | 68 | 53% | 0.528 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -16.1 | 167.6 | 59.1 | 0 | 0 | 0 | 0 | 113.3 | V76 L77 R166 | V76-T79 PolarHBondContact O-N 3.33Å; V76-T79 PolarHBondContact O-OG1 3.32Å; L77-T79 PolarHBondContact O-N 2.95Å; T79-R166 VanDerWaalsContact CG2-NH1 3.27Å |
| 80 | I | 90.8 | Very high | 88.5 | Confident | 69 Ų | 69 | 67.7 Ų | 67.7 | 35% | 0.354 | 38% | 0.377 | S | S | . | . | S | Bend | trans | -90.6 | 116.8 | -177.6 | -53 | 175.6 | 0 | 0 | 0 | 107.6 | L77 Q82 Y83 A84 | L77-I80 HydrophobicContact CD2-CD1 4.15Å; L77-I80 PolarHBondContact O-N 2.86Å; I80-Q82 HydrophobicContact CG2-CB 4.27Å; I80-Q82 PolarHBondContact O-N 3.41Å; I80-Q82 VanDerWaalsContact O-N 3.15Å; I80-Y83 HydrophobicContact CB-CD2 4.09Å; I80-Y83 HydrophobicContact CD1-CD2 4.4Å; I80-Y83 HydrophobicContact CG2-CD2 3.84Å; I80-Y83 HydrophobicContact CG2-CE2 4.36Å; I80-Y83 CarbonylContact O-C 3.6Å; I80-Y83 PolarHBondContact O-N 3.46Å; I80-A84 PolarHBondContact O-N 2.89Å |
| 81 | E | 90 | Very high | 88.2 | Confident | 183 Ų | 183 | 65.9 Ų | 65.9 | 86% | 0.855 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -52.1 | -41.1 | -174.2 | -171.6 | 169.9 | -161.8 | 0 | 0 | 112.8 | Y83 A84 | E81-Y83 PolarHBondContact O-N 2.94Å; E81-A84 PolarHBondContact O-N 2.94Å |
| 82 | Q | 93.1 | Very high | 88 | Confident | 162 Ų | 162 | 69.5 Ų | 69.5 | 76% | 0.757 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -57.1 | -31.2 | 176.3 | -64 | 177.6 | -16.7 | 0 | 0 | 114.4 | I80 | I80-Q82 HydrophobicContact CG2-CB 4.27Å; I80-Q82 PolarHBondContact O-N 3.41Å; I80-Q82 VanDerWaalsContact O-N 3.15Å |
| 83 | Y | 91.1 | Very high | 87.9 | Confident | 122 Ų | 122 | 76.1 Ų | 76.1 | 48% | 0.478 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -111.1 | -4.7 | -176.7 | -60 | -68.6 | 0 | 0 | 0 | 113.2 | I80 E81 A85 L86 A87 | I80-Y83 HydrophobicContact CB-CD2 4.09Å; I80-Y83 HydrophobicContact CD1-CD2 4.4Å; I80-Y83 HydrophobicContact CG2-CD2 3.84Å; I80-Y83 HydrophobicContact CG2-CE2 4.36Å; I80-Y83 CarbonylContact O-C 3.6Å; I80-Y83 PolarHBondContact O-N 3.46Å; E81-Y83 PolarHBondContact O-N 2.94Å; Y83-A85 VanDerWaalsContact C-N 3.35Å; Y83-A85 PolarHBondContact O-N 3.43Å; Y83-L86 PolarHBondContact O-N 3.42Å; Y83-A87 VanDerWaalsContact O-CB 3.27Å; Y83-A87 WeakPolarHBondContact O-CB 3.41Å; Y83-A87 PolarHBondContact O-N 3.04Å |
| 84 | A | 86.5 | Confident | 87.8 | Confident | 29 Ų | 29 | 74.7 Ų | 74.7 | 24% | 0.24 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -57.7 | -41.8 | -170.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | I80 E81 T88 | I80-A84 PolarHBondContact O-N 2.89Å; E81-A84 PolarHBondContact O-N 2.94Å; A84-T88 WeakPolarHBondContact O-CB 3.41Å; A84-T88 PolarHBondContact O-N 3.43Å; A84-T88 PolarHBondContact O-OG1 3.2Å |
| 85 | A | 85.1 | Confident | 87.7 | Confident | 91 Ų | 91 | 71.7 Ų | 71.7 | 75% | 0.752 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -64.2 | -51 | -179 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y83 G89 | Y83-A85 VanDerWaalsContact C-N 3.35Å; Y83-A85 PolarHBondContact O-N 3.43Å; A85-G89 PolarHBondContact O-N 3.01Å |
| 86 | L | 88.3 | Confident | 87.9 | Confident | 126 Ų | 126 | 74.1 Ų | 74.1 | 66% | 0.66 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -64.3 | -50.1 | 178.2 | -178.6 | 68.2 | 0 | 0 | 0 | 111 | Y83 T88 G89 T90 | Y83-L86 PolarHBondContact O-N 3.42Å; L86-T88 PolarHBondContact O-N 3.49Å; L86-G89 PolarHBondContact O-N 3.04Å; L86-T90 PolarHBondContact O-N 3.3Å; L86-T90 PolarHBondContact O-OG1 3.21Å; L86-T90 VanDerWaalsContact O-OG1 3.1Å |
| 87 | A | 86.8 | Confident | 88 | Confident | 3 Ų | 3 | 74.8 Ų | 74.8 | 3% | 0.025 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -61.6 | -43.4 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | L77 Y83 T90 L91 | L77-A87 HydrophobicContact CB-CB 4.43Å; Y83-A87 VanDerWaalsContact O-CB 3.27Å; Y83-A87 WeakPolarHBondContact O-CB 3.41Å; Y83-A87 PolarHBondContact O-N 3.04Å; A87-T90 PolarHBondContact O-N 3.25Å; A87-L91 WeakPolarHBondContact O-CB 3.42Å; A87-L91 WeakPolarHBondContact O-CD1 3.46Å; A87-L91 WeakPolarHBondContact O-CG 3.39Å; A87-L91 PolarHBondContact O-N 3.49Å |
| 88 | T | 82.3 | Confident | 88 | Confident | 54 Ų | 54 | 72.3 Ų | 72.3 | 33% | 0.331 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -65.4 | -41.7 | -179.3 | -55.2 | 0 | 0 | 0 | 0 | 111.9 | A84 L86 L91 F92 I162 | A84-T88 WeakPolarHBondContact O-CB 3.41Å; A84-T88 PolarHBondContact O-N 3.43Å; A84-T88 PolarHBondContact O-OG1 3.2Å; L86-T88 PolarHBondContact O-N 3.49Å; T88-L91 PolarHBondContact O-N 3.46Å; T88-F92 PolarHBondContact O-N 2.9Å; T88-I162 HydrophobicContact CG2-CD1 4.12Å |
| 89 | G | 83.6 | Confident | 88.3 | Confident | 41 Ų | 41 | 71.8 Ų | 71.8 | 42% | 0.423 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62.8 | -46 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A85 L86 | A85-G89 PolarHBondContact O-N 3.01Å; L86-G89 PolarHBondContact O-N 3.04Å |
| 90 | T | 88 | Confident | 88.6 | Confident | 51 Ų | 51 | 71.8 Ų | 71.8 | 31% | 0.313 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -66.9 | -40.3 | 177.5 | -53.8 | 0 | 0 | 0 | 0 | 112.3 | L86 A87 F92 W93 M94 | L86-T90 PolarHBondContact O-N 3.3Å; L86-T90 PolarHBondContact O-OG1 3.21Å; L86-T90 VanDerWaalsContact O-OG1 3.1Å; A87-T90 PolarHBondContact O-N 3.25Å; T90-F92 PolarHBondContact O-N 3.01Å; T90-W93 PolarHBondContact O-N 2.94Å; T90-M94 HydrophobicContact CG2-CG 4.17Å; T90-M94 WeakPolarHBondContact O-CB 3.27Å; T90-M94 VanDerWaalsContact O-CG 3.31Å; T90-M94 WeakPolarHBondContact O-CG 3.39Å; T90-M94 PolarHBondContact O-N 3.07Å |
| 91 | L | 86.6 | Confident | 88.8 | Confident | 15 Ų | 15 | 72.4 Ų | 72.4 | 8% | 0.079 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -61.2 | -40 | 179.2 | -80.2 | 167.8 | 0 | 0 | 0 | 112.8 | F74 A87 T88 W93 M94 E95 | F74-L91 HydrophobicContact CB-CD2 3.7Å; F74-L91 HydrophobicContact CB-CG 4.03Å; A87-L91 WeakPolarHBondContact O-CB 3.42Å; A87-L91 WeakPolarHBondContact O-CD1 3.46Å; A87-L91 WeakPolarHBondContact O-CG 3.39Å; A87-L91 PolarHBondContact O-N 3.49Å; T88-L91 PolarHBondContact O-N 3.46Å; L91-W93 PolarHBondContact O-N 3.07Å; L91-M94 PolarHBondContact O-N 3.4Å; L91-E95 WeakPolarHBondContact O-CB 3.35Å; L91-E95 PolarHBondContact O-N 2.97Å |
| 92 | F | 84.6 | Confident | 89 | Confident | 78 Ų | 78 | 63.8 Ų | 63.8 | 34% | 0.342 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -59.3 | -49 | 179.5 | -179.6 | -103.7 | 0 | 0 | 0 | 111.9 | T88 T90 E95 I96 L148 | T88-F92 PolarHBondContact O-N 2.9Å; T90-F92 PolarHBondContact O-N 3.01Å; F92-E95 PolarHBondContact O-N 2.71Å; F92-I96 HydrophobicContact CD1-CD1 3.97Å; F92-I96 HydrophobicContact CE1-CD1 3.53Å; F92-I96 HydrophobicContact CE2-CD1 4.37Å; F92-I96 HydrophobicContact CZ-CD1 3.76Å; F92-I96 WeakPolarHBondContact O-CG1 3.19Å; F92-I96 PolarHBondContact O-N 3.23Å; F92-I96 VanDerWaalsContact O-N 3.15Å; F92-L148 HydrophobicContact CD2-CD2 4.04Å; F92-L148 HydrophobicContact CE2-CD2 3.87Å |
| 93 | W | 87.6 | Confident | 89 | Confident | 176 Ų | 176 | 57 Ų | 57 | 67% | 0.667 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -66.2 | -43 | 176.9 | -73.2 | 108.2 | 0 | 0 | 0 | 112.8 | T90 L91 E95 I96 V97 | T90-W93 PolarHBondContact O-N 2.94Å; L91-W93 PolarHBondContact O-N 3.07Å; W93-E95 VanDerWaalsContact C-N 3.31Å; W93-E95 PolarHBondContact O-N 3.12Å; W93-I96 HydrophobicContact CE3-CD1 4.45Å; W93-I96 PolarHBondContact O-N 2.94Å; W93-V97 WeakPolarHBondContact O-CG2 3.45Å; W93-V97 PolarHBondContact O-N 3.28Å; W93-V97 VanDerWaalsContact O-N 3.08Å |
| 94 | M | 88.3 | Confident | 89.3 | Confident | 57 Ų | 57 | 55 Ų | 55 | 28% | 0.281 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -61.3 | -39.2 | 176.3 | -74.7 | -69.9 | -73.2 | 0 | 0 | 112.1 | T90 L91 V97 L98 | T90-M94 HydrophobicContact CG2-CG 4.17Å; T90-M94 WeakPolarHBondContact O-CB 3.27Å; T90-M94 VanDerWaalsContact O-CG 3.31Å; T90-M94 WeakPolarHBondContact O-CG 3.39Å; T90-M94 PolarHBondContact O-N 3.07Å; L91-M94 PolarHBondContact O-N 3.4Å; M94-V97 PolarHBondContact O-N 2.89Å; M94-L98 WeakPolarHBondContact O-CB 3.26Å; M94-L98 WeakPolarHBondContact O-CD1 3.18Å; M94-L98 WeakPolarHBondContact O-CG 3.25Å; M94-L98 PolarHBondContact O-N 3.47Å |
| 95 | E | 88.3 | Confident | 89.7 | Confident | 2 Ų | 2 | 54.2 Ų | 54.2 | 1% | 0.009 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -69 | -36.6 | 179.2 | -172 | 61 | -161 | 0 | 0 | 111.9 | L91 F92 W93 L98 V99 S144 L148 I165 R172 | L91-E95 WeakPolarHBondContact O-CB 3.35Å; L91-E95 PolarHBondContact O-N 2.97Å; F92-E95 PolarHBondContact O-N 2.71Å; W93-E95 VanDerWaalsContact C-N 3.31Å; W93-E95 PolarHBondContact O-N 3.12Å; E95-L98 PolarHBondContact O-N 3.27Å; E95-V99 PolarHBondContact O-N 3.2Å; E95-S144 WeakPolarHBondContact OE1-CB 3.38Å; E95-S144 PolarHBondContact OE1-OG 3.47Å; E95-L148 HydrophobicContact CB-CD2 4.48Å; E95-L148 HydrophobicContact CG-CD1 4.32Å; E95-L148 HydrophobicContact CG-CD2 4.25Å; E95-L148 HydrophobicContact CG-CG 4.45Å; E95-I165 HydrophobicContact CG-CG2 4.41Å; E95-R172 IonicContact OE1-CZ 2.64Å; E95-R172 IonicContact OE1-NH1 2.85Å; E95-R172 IonicContact OE1-NH2 3.75Å; E95-R172 PolarHBondContact OE1-NH2 2.87Å; E95-R172 IonicContact OE2-CZ 2.64Å; E95-R172 IonicContact OE2-NH1 3.36Å; E95-R172 PolarHBondContact OE2-NH1 3.48Å; E95-R172 IonicContact OE2-NH2 3.48Å; E95-R172 PolarHBondContact OE2-NH2 3.24Å |
| 96 | I | 89.6 | Confident | 90.1 | Very high | 54 Ų | 54 | 50.9 Ų | 50.9 | 28% | 0.277 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -61.4 | -48.1 | 171.1 | -68.3 | 167.3 | 0 | 0 | 0 | 110.8 | F92 W93 L98 V99 V100 L148 | F92-I96 HydrophobicContact CD1-CD1 3.97Å; F92-I96 HydrophobicContact CE1-CD1 3.53Å; F92-I96 HydrophobicContact CE2-CD1 4.37Å; F92-I96 HydrophobicContact CZ-CD1 3.76Å; F92-I96 WeakPolarHBondContact O-CG1 3.19Å; F92-I96 PolarHBondContact O-N 3.23Å; F92-I96 VanDerWaalsContact O-N 3.15Å; W93-I96 HydrophobicContact CE3-CD1 4.45Å; W93-I96 PolarHBondContact O-N 2.94Å; I96-L98 VanDerWaalsContact C-N 3.3Å; I96-L98 PolarHBondContact O-N 3.35Å; I96-V99 WeakPolarHBondContact O-CG1 3.39Å; I96-V100 WeakPolarHBondContact O-CG2 3.31Å; I96-V100 PolarHBondContact O-N 2.88Å; I96-L148 HydrophobicContact CG1-CD1 4.01Å; I96-L148 HydrophobicContact CG1-CD2 3.88Å |
| 97 | V | 92.3 | Very high | 90.5 | Very high | 97 Ų | 97 | 49.4 Ų | 49.4 | 59% | 0.588 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -61.1 | -41.6 | 177.6 | 173.4 | 0 | 0 | 0 | 0 | 110.8 | W93 M94 F101 | W93-V97 WeakPolarHBondContact O-CG2 3.45Å; W93-V97 PolarHBondContact O-N 3.28Å; W93-V97 VanDerWaalsContact O-N 3.08Å; M94-V97 PolarHBondContact O-N 2.89Å; V97-F101 WeakPolarHBondContact O-CB 3.44Å; V97-F101 PolarHBondContact O-N 2.92Å |
| 98 | L | 91.3 | Very high | 90.9 | Very high | 7 Ų | 7 | 52 Ų | 52 | 4% | 0.037 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -70.3 | -42 | -178.8 | -72.8 | 164.6 | 0 | 0 | 0 | 113 | I67 C71 M94 E95 I96 V100 F101 F102 | I67-L98 HydrophobicContact CG2-CD2 3.63Å; C71-L98 HydrophobicContact CB-CD1 3.81Å; C71-L98 VanDerWaalsContact SG-CD1 3.59Å; M94-L98 WeakPolarHBondContact O-CB 3.26Å; M94-L98 WeakPolarHBondContact O-CD1 3.18Å; M94-L98 WeakPolarHBondContact O-CG 3.25Å; M94-L98 PolarHBondContact O-N 3.47Å; E95-L98 PolarHBondContact O-N 3.27Å; I96-L98 VanDerWaalsContact C-N 3.3Å; I96-L98 PolarHBondContact O-N 3.35Å; L98-V100 VanDerWaalsContact C-N 3.32Å; L98-V100 PolarHBondContact O-N 3.18Å; L98-F101 PolarHBondContact O-N 2.92Å; L98-F102 HydrophobicContact CB-CD2 4.22Å; L98-F102 HydrophobicContact CB-CE2 4.11Å; L98-F102 HydrophobicContact CD2-CD2 4.4Å; L98-F102 HydrophobicContact CD2-CE2 3.57Å; L98-F102 HydrophobicContact CD2-CZ 4.22Å; L98-F102 HydrophobicContact CG-CE2 4.41Å; L98-F102 WeakPolarHBondContact O-CD2 3.46Å; L98-F102 PolarHBondContact O-N 2.93Å |
| 99 | V | 92.3 | Very high | 91.4 | Very high | 5 Ų | 5 | 49.7 Ų | 49.7 | 3% | 0.03 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -65.1 | -37.5 | 177.5 | 74.7 | 0 | 0 | 0 | 0 | 111.5 | E95 I96 G103 V141 M145 L148 | E95-V99 PolarHBondContact O-N 3.2Å; I96-V99 WeakPolarHBondContact O-CG1 3.39Å; V99-G103 WeakPolarHBondContact O-CA 3.5Å; V99-G103 PolarHBondContact O-N 3.3Å; V99-V141 HydrophobicContact CG2-CG1 4.25Å; V99-M145 HydrophobicContact CG1-CE 4.36Å; V99-M145 HydrophobicContact CG2-CB 4.49Å; V99-M145 HydrophobicContact CG2-CE 4.08Å; V99-L148 HydrophobicContact CB-CD1 4.33Å; V99-L148 HydrophobicContact CG1-CD1 3.6Å |
| 100 | V | 94.6 | Very high | 92 | Very high | 86 Ų | 86 | 49.6 Ų | 49.6 | 52% | 0.521 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -66.9 | -43.5 | 175 | 173.2 | 0 | 0 | 0 | 0 | 110.8 | I96 L98 T104 | I96-V100 WeakPolarHBondContact O-CG2 3.31Å; I96-V100 PolarHBondContact O-N 2.88Å; L98-V100 VanDerWaalsContact C-N 3.32Å; L98-V100 PolarHBondContact O-N 3.18Å; V100-T104 VanDerWaalsContact O-CB 3.29Å; V100-T104 WeakPolarHBondContact O-CB 3.43Å; V100-T104 PolarHBondContact O-N 3.33Å; V100-T104 PolarHBondContact O-OG1 3.14Å |
| 101 | F | 94.9 | Very high | 92.3 | Very high | 81 Ų | 81 | 51 Ų | 51 | 36% | 0.355 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.3 | -54.2 | 176.7 | -178.9 | -92.3 | 0 | 0 | 0 | 111.9 | Y60 V64 V97 L98 T104 E105 | Y60-F101 HydrophobicContact CE2-CZ 4.1Å; V64-F101 HydrophobicContact CG1-CE1 4.32Å; V64-F101 HydrophobicContact CG2-CE1 3.76Å; V64-F101 HydrophobicContact CG2-CZ 3.71Å; V97-F101 WeakPolarHBondContact O-CB 3.44Å; V97-F101 PolarHBondContact O-N 2.92Å; L98-F101 PolarHBondContact O-N 2.92Å; F101-T104 PolarHBondContact O-N 3.36Å; F101-E105 WeakPolarHBondContact O-CB 3.5Å; F101-E105 PolarHBondContact O-N 3.25Å |
| 102 | F | 93.3 | Very high | 92.6 | Very high | 3 Ų | 3 | 50.3 Ų | 50.3 | 1% | 0.013 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -70 | -35.9 | -178.4 | -68.8 | -59.6 | 0 | 0 | 0 | 113.2 | V64 V68 L98 E105 Y106 V141 R172 H175 | V64-F102 HydrophobicContact CG1-CE1 3.66Å; V64-F102 HydrophobicContact CG1-CZ 3.91Å; V68-F102 HydrophobicContact CG2-CE2 4.02Å; V68-F102 HydrophobicContact CG2-CZ 3.57Å; L98-F102 HydrophobicContact CB-CD2 4.22Å; L98-F102 HydrophobicContact CB-CE2 4.11Å; L98-F102 HydrophobicContact CD2-CD2 4.4Å; L98-F102 HydrophobicContact CD2-CE2 3.57Å; L98-F102 HydrophobicContact CD2-CZ 4.22Å; L98-F102 HydrophobicContact CG-CE2 4.41Å; L98-F102 WeakPolarHBondContact O-CD2 3.46Å; L98-F102 PolarHBondContact O-N 2.93Å; F102-E105 PolarHBondContact O-N 2.9Å; F102-Y106 VanDerWaalsContact O-CB 3.3Å; F102-Y106 WeakPolarHBondContact O-CB 3.46Å; F102-Y106 PolarHBondContact O-N 3.1Å; F102-V141 HydrophobicContact CB-CG2 3.9Å; F102-R172 HydrophobicContact CE2-CG 4.14Å; F102-R172 HydrophobicContact CZ-CG 4.43Å; F102-H175 AromaticContact CD1-NE2 3.99Å; F102-H175 AromaticContact CE1-CE1 3.87Å; F102-H175 AromaticContact CE1-NE2 3.3Å; F102-H175 VanDerWaalsContact CE1-NE2 3.3Å; F102-H175 WeakPolarHBondContact CE1-NE2 3.28Å; F102-H175 AromaticContact CZ-NE2 3.41Å; F102-H175 WeakPolarHBondContact CZ-NE2 3.43Å |
| 103 | G | 94.6 | Very high | 93 | Very high | 18 Ų | 18 | 46.6 Ų | 46.6 | 19% | 0.186 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.2 | -45.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | V99 Y106 V107 | V99-G103 WeakPolarHBondContact O-CA 3.5Å; V99-G103 PolarHBondContact O-N 3.3Å; G103-Y106 PolarHBondContact O-N 3.31Å; G103-V107 WeakPolarHBondContact O-CG2 3.43Å; G103-V107 PolarHBondContact O-N 3.21Å |
| 104 | T | 95.9 | Very high | 93.1 | Very high | 82 Ų | 82 | 38.9 Ų | 38.9 | 50% | 0.503 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -63.1 | -45.7 | 174.4 | -56.3 | 0 | 0 | 0 | 0 | 111.2 | V100 F101 Y106 V107 V108 | V100-T104 VanDerWaalsContact O-CB 3.29Å; V100-T104 WeakPolarHBondContact O-CB 3.43Å; V100-T104 PolarHBondContact O-N 3.33Å; V100-T104 PolarHBondContact O-OG1 3.14Å; F101-T104 PolarHBondContact O-N 3.36Å; T104-Y106 VanDerWaalsContact C-N 3.34Å; T104-Y106 PolarHBondContact O-N 3.18Å; T104-V107 PolarHBondContact O-N 2.91Å; T104-V108 HydrophobicContact CG2-CG2 4.4Å; T104-V108 WeakPolarHBondContact O-CG2 3.31Å; T104-V108 PolarHBondContact O-N 2.85Å |
| 105 | E | 95.2 | Very high | 93.2 | Very high | 11 Ų | 11 | 38.2 Ų | 38.2 | 5% | 0.051 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.5 | -42.4 | 179.1 | -152.2 | -150.7 | 134.7 | 0 | 0 | 111.7 | L49 Y60 F101 F102 V108 R109 R178 | L49-E105 HydrophobicContact CD2-CG 4.25Å; Y60-E105 WeakPolarHBondContact OH-CG 3.47Å; F101-E105 WeakPolarHBondContact O-CB 3.5Å; F101-E105 PolarHBondContact O-N 3.25Å; F102-E105 PolarHBondContact O-N 2.9Å; E105-V108 PolarHBondContact O-N 2.68Å; E105-R109 WeakPolarHBondContact O-CB 3.42Å; E105-R109 PolarHBondContact O-N 2.97Å; E105-R109 IonicContact OE1-CZ 3.44Å; E105-R109 IonicContact OE1-NE 3.05Å; E105-R109 PolarHBondContact OE1-NE 2.88Å; E105-R109 IonicContact OE1-NH2 2.74Å; E105-R109 PolarHBondContact OE1-NH2 2.93Å; E105-R109 IonicContact OE2-NH2 3.9Å; E105-R109 PolarHBondContact OE2-NH2 3.45Å; E105-R178 IonicContact OE1-CZ 2.69Å; E105-R178 IonicContact OE1-NH1 3.62Å; E105-R178 PolarHBondContact OE1-NH1 3.06Å; E105-R178 IonicContact OE1-NH2 3.63Å; E105-R178 PolarHBondContact OE1-NH2 3.29Å; E105-R178 IonicContact OE2-NH1 3.91Å |
| 106 | Y | 94.7 | Very high | 93.2 | Very high | 21 Ų | 21 | 42.6 Ų | 42.6 | 8% | 0.082 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -60.5 | -47.5 | 175.8 | -177.8 | -91.9 | 0 | 0 | 0 | 111.9 | F102 G103 T104 R109 L110 S134 D137 L138 | F102-Y106 VanDerWaalsContact O-CB 3.3Å; F102-Y106 WeakPolarHBondContact O-CB 3.46Å; F102-Y106 PolarHBondContact O-N 3.1Å; G103-Y106 PolarHBondContact O-N 3.31Å; T104-Y106 VanDerWaalsContact C-N 3.34Å; T104-Y106 PolarHBondContact O-N 3.18Å; Y106-R109 PolarHBondContact O-N 3.25Å; Y106-L110 HydrophobicContact CE1-CD2 4.19Å; Y106-L110 WeakPolarHBondContact O-CB 3.43Å; Y106-L110 PolarHBondContact O-N 3.04Å; Y106-S134 WeakPolarHBondContact CE2-O 3.44Å; Y106-D137 HydrophobicContact CD2-CB 4.12Å; Y106-D137 WeakPolarHBondContact CD2-OD2 3.42Å; Y106-D137 HydrophobicContact CE2-CB 4.42Å; Y106-L138 HydrophobicContact CE1-CD1 4.08Å; Y106-L138 HydrophobicContact CE2-CB 4.07Å |
| 107 | V | 95.8 | Very high | 93.1 | Very high | 95 Ų | 95 | 45.6 Ų | 45.6 | 58% | 0.576 | 26% | 0.258 | S | S | * | . | H | α-helix | trans | -62.2 | -46.2 | 177.8 | 171 | 0 | 0 | 0 | 0 | 111 | G103 T104 R109 L110 W111 | G103-V107 WeakPolarHBondContact O-CG2 3.43Å; G103-V107 PolarHBondContact O-N 3.21Å; T104-V107 PolarHBondContact O-N 2.91Å; V107-R109 VanDerWaalsContact C-N 3.33Å; V107-R109 PolarHBondContact O-N 3.12Å; V107-L110 PolarHBondContact O-N 3.34Å; V107-W111 WeakPolarHBondContact O-CB 3.47Å; V107-W111 PolarHBondContact O-N 2.96Å |
| 108 | V | 95.5 | Very high | 92.9 | Very high | 57 Ų | 57 | 47.3 Ų | 47.3 | 35% | 0.345 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.5 | -40.6 | 176.2 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | V45 L49 T104 E105 W111 S112 | V45-V108 HydrophobicContact CG1-CG1 3.73Å; L49-V108 HydrophobicContact CD1-CG1 3.88Å; T104-V108 HydrophobicContact CG2-CG2 4.4Å; T104-V108 WeakPolarHBondContact O-CG2 3.31Å; T104-V108 PolarHBondContact O-N 2.85Å; E105-V108 PolarHBondContact O-N 2.68Å; V108-W111 PolarHBondContact O-N 3.29Å; V108-S112 VanDerWaalsContact O-CB 3.29Å; V108-S112 WeakPolarHBondContact O-CB 3.14Å; V108-S112 PolarHBondContact O-N 3.03Å; V108-S112 PolarHBondContact O-OG 3.43Å |
| 109 | R | 93.7 | Very high | 92.9 | Very high | 6 Ų | 6 | 48.1 Ų | 48.1 | 2% | 0.023 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.3 | -48.2 | 178.3 | -156.6 | -179.1 | -44.8 | 110.7 | -6.9 | 111.4 | L49 E105 Y106 V107 W111 S112 A113 F128 D137 R178 | L49-R109 HydrophobicContact CB-CG 4.33Å; L49-R109 HydrophobicContact CD1-CB 4.25Å; L49-R109 HydrophobicContact CD1-CG 4.43Å; E105-R109 WeakPolarHBondContact O-CB 3.42Å; E105-R109 PolarHBondContact O-N 2.97Å; E105-R109 IonicContact OE1-CZ 3.44Å; E105-R109 IonicContact OE1-NE 3.05Å; E105-R109 PolarHBondContact OE1-NE 2.88Å; E105-R109 IonicContact OE1-NH2 2.74Å; E105-R109 PolarHBondContact OE1-NH2 2.93Å; E105-R109 IonicContact OE2-NH2 3.9Å; E105-R109 PolarHBondContact OE2-NH2 3.45Å; Y106-R109 PolarHBondContact O-N 3.25Å; V107-R109 VanDerWaalsContact C-N 3.33Å; V107-R109 PolarHBondContact O-N 3.12Å; R109-W111 VanDerWaalsContact C-N 3.32Å; R109-W111 PolarHBondContact O-N 3.23Å; R109-S112 PolarHBondContact O-N 3.3Å; R109-S112 PolarHBondContact O-OG 2.76Å; R109-A113 PolarHBondContact O-N 2.88Å; R109-F128 HydrophobicContact CG-CZ 4.32Å; R109-D137 IonicContact CZ-OD2 3.84Å; R109-D137 IonicContact NH1-OD2 3.51Å; R109-D137 PolarHBondContact NH1-OD2 3.36Å; R109-D137 IonicContact NH2-OD2 3.85Å; R109-D137 PolarHBondContact NH2-OD2 3.13Å; R109-R178 VanDerWaalsContact NH2-NH1 3.19Å |
| 110 | L | 94.3 | Very high | 92.7 | Very high | 40 Ų | 40 | 52.3 Ų | 52.3 | 21% | 0.209 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62 | -37.3 | 176.8 | -177.1 | 63.4 | 0 | 0 | 0 | 112.3 | Y106 V107 R125 F128 A129 | Y106-L110 HydrophobicContact CE1-CD2 4.19Å; Y106-L110 WeakPolarHBondContact O-CB 3.43Å; Y106-L110 PolarHBondContact O-N 3.04Å; V107-L110 PolarHBondContact O-N 3.34Å; L110-R125 HydrophobicContact CD1-CB 4.11Å; L110-F128 HydrophobicContact CD1-CB 4.47Å; L110-F128 HydrophobicContact CD1-CD1 3.8Å; L110-A129 HydrophobicContact CD1-CB 4.45Å |
| 111 | W | 94.4 | Very high | 92.5 | Very high | 81 Ų | 81 | 50.4 Ų | 50.4 | 31% | 0.307 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -66.4 | -46.2 | 171.8 | 174.5 | 90.2 | 0 | 0 | 0 | 112 | Q42 V107 V108 R109 A113 G114 | Q42-W111 HydrophobicContact CB-CH2 4.22Å; Q42-W111 HydrophobicContact CB-CZ3 4.4Å; Q42-W111 HydrophobicContact CG-CE3 4.4Å; Q42-W111 HydrophobicContact CG-CH2 4.27Å; Q42-W111 HydrophobicContact CG-CZ3 4.18Å; Q42-W111 PolarHBondContact NE2-O 3.08Å; V107-W111 WeakPolarHBondContact O-CB 3.47Å; V107-W111 PolarHBondContact O-N 2.96Å; V108-W111 PolarHBondContact O-N 3.29Å; R109-W111 VanDerWaalsContact C-N 3.32Å; R109-W111 PolarHBondContact O-N 3.23Å; W111-A113 VanDerWaalsContact C-N 3.32Å; W111-A113 PolarHBondContact O-N 2.95Å; W111-G114 PolarHBondContact O-N 3.37Å |
| 112 | S | 94.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.7 | -31.9 | -178.2 | 76.3 | 0 | 0 | 0 | 0 | 113.2 | Q42 V108 R109 G114 C115 | Q42-S112 WeakPolarHBondContact CG-O 3.38Å; V108-S112 VanDerWaalsContact O-CB 3.29Å; V108-S112 WeakPolarHBondContact O-CB 3.14Å; V108-S112 PolarHBondContact O-N 3.03Å; V108-S112 PolarHBondContact O-OG 3.43Å; R109-S112 PolarHBondContact O-N 3.3Å; R109-S112 PolarHBondContact O-OG 2.76Å; S112-G114 PolarHBondContact O-N 3.39Å; S112-C115 PolarHBondContact O-N 3.43Å |
| 113 | A | 92.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 63.3 Ų | 63.3 | 0% | 0 | 34% | 0.339 | C | S | . | . | G | 310 helix | trans | -54.9 | -26.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y46 R109 W111 C115 R116 F128 | Y46-A113 HydrophobicContact CD2-CB 4.42Å; Y46-A113 HydrophobicContact CE2-CB 4.38Å; R109-A113 PolarHBondContact O-N 2.88Å; W111-A113 VanDerWaalsContact C-N 3.32Å; W111-A113 PolarHBondContact O-N 2.95Å; A113-C115 PolarHBondContact O-N 3.5Å; A113-R116 PolarHBondContact O-N 3.08Å; A113-R116 VanDerWaalsContact O-N 3.12Å; A113-F128 HydrophobicContact CB-CB 4.39Å; A113-F128 HydrophobicContact CB-CD1 4.13Å; A113-F128 HydrophobicContact CB-CD2 3.47Å; A113-F128 VanDerWaalsContact CB-CD2 3.47Å; A113-F128 HydrophobicContact CB-CE1 4.28Å; A113-F128 HydrophobicContact CB-CE2 3.62Å; A113-F128 HydrophobicContact CB-CG 3.74Å; A113-F128 HydrophobicContact CB-CZ 4.04Å |
| 114 | G | 90.7 | Very high | 92 | Very high | 13 Ų | 13 | 62.7 Ų | 62.7 | 13% | 0.134 | 33% | 0.333 | C | S | . | . | G | 310 helix | trans | -62 | -8.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | W111 S112 R116 | W111-G114 PolarHBondContact O-N 3.37Å; S112-G114 PolarHBondContact O-N 3.39Å; G114-R116 PolarHBondContact O-N 3.33Å |
| 115 | C | 89.3 | Confident | 91.8 | Very high | 43 Ų | 43 | 62.9 Ų | 62.9 | 29% | 0.291 | 32% | 0.324 | S | S | . | . | G | 310 helix | trans | -70.3 | -13.9 | 171.2 | 79.7 | 0 | 0 | 0 | 0 | 113.2 | Q42 Y46 S112 A113 | Q42-C115 HydrophobicContact CB-CB 4.34Å; Q42-C115 HydrophobicContact CG-CB 4.07Å; Y46-C115 VanDerWaalsContact CB-SG 3.59Å; Y46-C115 VanDerWaalsContact CD1-SG 3.58Å; S112-C115 PolarHBondContact O-N 3.43Å; A113-C115 PolarHBondContact O-N 3.5Å |
| 116 | R | 88.1 | Confident | 91.7 | Very high | 95 Ų | 95 | 67.1 Ų | 67.1 | 36% | 0.358 | 35% | 0.347 | S | S | . | . | S | Bend | trans | -97.2 | 128 | 177.2 | -61.8 | -66.7 | -64.1 | -77.3 | 2.4 | 109.6 | Y46 A113 G114 K118 Y119 | Y46-R116 HydrophobicContact CD1-CG 4.36Å; Y46-R116 HydrophobicContact CE1-CG 3.82Å; A113-R116 PolarHBondContact O-N 3.08Å; A113-R116 VanDerWaalsContact O-N 3.12Å; G114-R116 PolarHBondContact O-N 3.33Å; R116-K118 PolarHBondContact O-N 3.15Å; R116-Y119 HydrophobicContact CB-CD2 3.85Å; R116-Y119 HydrophobicContact CG-CD2 4.34Å; R116-Y119 PolarHBondContact O-N 3.41Å |
| 117 | S | 88 | Confident | 91.7 | Very high | 116 Ų | 116 | 73.5 Ų | 73.5 | 81% | 0.811 | 37% | 0.371 | S | S | * | . | G | 310 helix | trans | -47.8 | -36.2 | 177.4 | -178.5 | 0 | 0 | 0 | 0 | 114.2 | Y119 | S117-Y119 PolarHBondContact O-N 3.02Š|
| 118 | K | 88.8 | Confident | 91.5 | Very high | 133 Ų | 133 | 69.1 Ų | 69.1 | 58% | 0.578 | 34% | 0.344 | S | S | * | . | G | 310 helix | trans | -63.2 | -20.5 | 176.1 | -174.4 | 170.8 | -179.2 | 172 | 0 | 115.1 | R116 | R116-K118 PolarHBondContact O-N 3.15Š|
| 119 | Y | 91 | Very high | 91.5 | Very high | 25 Ų | 25 | 67.2 Ų | 67.2 | 10% | 0.098 | 33% | 0.334 | C | S | . | . | G | 310 helix | trans | -123.2 | 18.6 | -171.7 | -53.8 | -52.3 | 0 | 0 | 0 | 113.2 | R116 S117 G124 R127 F128 K131 | R116-Y119 HydrophobicContact CB-CD2 3.85Å; R116-Y119 HydrophobicContact CG-CD2 4.34Å; R116-Y119 PolarHBondContact O-N 3.41Å; S117-Y119 PolarHBondContact O-N 3.02Å; Y119-G124 WeakPolarHBondContact CD1-O 3.35Å; Y119-G124 CarbonylContact O-C 3.5Å; Y119-R127 HydrophobicContact CD1-CB 4.45Å; Y119-R127 HydrophobicContact CE1-CG 4.33Å; Y119-F128 HydrophobicContact CD1-CB 3.87Å; Y119-F128 AromaticContact CD2-CD2 3.94Å; Y119-F128 HydrophobicContact CD2-CD2 3.94Å; Y119-F128 HydrophobicContact CE1-CB 4.15Å; Y119-F128 HydrophobicContact CE1-CD2 4.47Å; Y119-F128 AromaticContact CE2-CD2 3.9Å; Y119-F128 HydrophobicContact CE2-CD2 3.9Å; Y119-F128 HydrophobicContact CG-CB 4.12Å; Y119-F128 HydrophobicContact CG-CD2 4.29Å; Y119-K131 WeakPolarHBondContact OH-CE 3.41Å |
| 120 | V | 88.6 | Confident | 91.5 | Very high | 93 Ų | 93 | 76.6 Ų | 76.6 | 56% | 0.564 | 37% | 0.37 | S | S | * | . | trans | -73 | 144 | 174.5 | 178.6 | 0 | 0 | 0 | 0 | 110.6 | G124 | V120-G124 WeakPolarHBondContact O-CA 3.35Å; V120-G124 PolarHBondContact O-N 3.22Å | ||
| 121 | G | 88.7 | Confident | 91.4 | Very high | 45 Ų | 45 | 77 Ų | 77 | 46% | 0.464 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | 74.4 | 179.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | G124 R125 | G121-G124 PolarHBondContact O-N 3.36Å; G121-R125 WeakPolarHBondContact O-CG 3.42Å; G121-R125 PolarHBondContact O-N 2.9Å |
| 122 | I | 90.3 | Very high | 91.2 | Very high | 144 Ų | 144 | 78 Ų | 78 | 74% | 0.738 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -64.6 | -49.3 | -176.4 | -62.2 | 169.5 | 0 | 0 | 0 | 110.6 | G124 R125 L126 | I122-G124 VanDerWaalsContact C-N 3.26Å; I122-G124 PolarHBondContact O-N 3.4Å; I122-R125 PolarHBondContact O-N 3.37Å; I122-R125 VanDerWaalsContact O-N 3.12Å; I122-L126 PolarHBondContact O-N 3.48Å |
| 123 | W | 91.3 | Very high | 91 | Very high | 211 Ų | 211 | 80.2 Ų | 80.2 | 80% | 0.799 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -59.9 | -34.2 | 175 | -63.8 | 105.1 | 0 | 0 | 0 | 113.2 | L126 R127 | W123-L126 HydrophobicContact CE3-CD2 4.38Å; W123-L126 HydrophobicContact CZ3-CD2 4.46Å; W123-R127 WeakPolarHBondContact O-CB 3.48Å; W123-R127 PolarHBondContact O-N 2.83Å |
| 124 | G | 91.1 | Very high | 90.9 | Very high | 5 Ų | 5 | 80.5 Ų | 80.5 | 5% | 0.052 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -67 | -42.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y119 V120 G121 I122 R127 F128 | Y119-G124 WeakPolarHBondContact CD1-O 3.35Å; Y119-G124 CarbonylContact O-C 3.5Å; V120-G124 WeakPolarHBondContact O-CA 3.35Å; V120-G124 PolarHBondContact O-N 3.22Å; G121-G124 PolarHBondContact O-N 3.36Å; I122-G124 VanDerWaalsContact C-N 3.26Å; I122-G124 PolarHBondContact O-N 3.4Å; G124-R127 WeakPolarHBondContact O-CB 3.41Å; G124-R127 PolarHBondContact O-N 2.83Å; G124-F128 PolarHBondContact O-N 2.93Å; G124-F128 VanDerWaalsContact O-N 3.1Å |
| 125 | R | 92.7 | Very high | 91 | Very high | 87 Ų | 87 | 83.1 Ų | 83.1 | 33% | 0.328 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -66 | -41.9 | 174.6 | -71.5 | 176.4 | 178.9 | -141.1 | -4.1 | 112.3 | L110 G121 I122 R127 F128 A129 | L110-R125 HydrophobicContact CD1-CB 4.11Å; G121-R125 WeakPolarHBondContact O-CG 3.42Å; G121-R125 PolarHBondContact O-N 2.9Å; I122-R125 PolarHBondContact O-N 3.37Å; I122-R125 VanDerWaalsContact O-N 3.12Å; R125-R127 VanDerWaalsContact C-N 3.3Å; R125-R127 PolarHBondContact O-N 3.33Å; R125-F128 WeakPolarHBondContact O-CA 3.5Å; R125-F128 WeakPolarHBondContact O-CB 3.36Å; R125-F128 PolarHBondContact O-N 2.73Å; R125-A129 PolarHBondContact O-N 3.1Å |
| 126 | L | 93.3 | Very high | 91.1 | Very high | 100 Ų | 100 | 83.6 Ų | 83.6 | 52% | 0.524 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -61.2 | -39.4 | 174.2 | -175.4 | 60.4 | 0 | 0 | 0 | 111.5 | I122 W123 F128 A129 R130 | I122-L126 PolarHBondContact O-N 3.48Å; W123-L126 HydrophobicContact CE3-CD2 4.38Å; W123-L126 HydrophobicContact CZ3-CD2 4.46Å; L126-F128 VanDerWaalsContact C-N 3.25Å; L126-F128 PolarHBondContact O-N 3.3Å; L126-A129 PolarHBondContact O-N 3.38Å; L126-R130 PolarHBondContact O-N 2.91Å |
| 127 | R | 93.6 | Very high | 91.2 | Very high | 155 Ų | 155 | 79.3 Ų | 79.3 | 59% | 0.585 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -63.6 | -27.1 | 172.3 | -169.1 | -169.7 | -63.8 | -125.5 | 9.1 | 113.1 | Y119 W123 G124 R125 | Y119-R127 HydrophobicContact CD1-CB 4.45Å; Y119-R127 HydrophobicContact CE1-CG 4.33Å; W123-R127 WeakPolarHBondContact O-CB 3.48Å; W123-R127 PolarHBondContact O-N 2.83Å; G124-R127 WeakPolarHBondContact O-CB 3.41Å; G124-R127 PolarHBondContact O-N 2.83Å; R125-R127 VanDerWaalsContact C-N 3.3Å; R125-R127 PolarHBondContact O-N 3.33Å |
| 128 | F | 93.1 | Very high | 91.4 | Very high | 2 Ų | 2 | 77.2 Ų | 77.2 | 1% | 0.009 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -76.8 | -45.6 | 171.3 | -178.3 | -85.7 | 0 | 0 | 0 | 111.4 | Y46 E50 R109 L110 A113 Y119 G124 R125 L126 R130 K131 S134 | Y46-F128 HydrophobicContact CE2-CE2 4.16Å; E50-F128 WeakPolarHBondContact OE2-CE2 3.26Å; E50-F128 VanDerWaalsContact OE2-CZ 3.27Å; E50-F128 WeakPolarHBondContact OE2-CZ 3.41Å; R109-F128 HydrophobicContact CG-CZ 4.32Å; L110-F128 HydrophobicContact CD1-CB 4.47Å; L110-F128 HydrophobicContact CD1-CD1 3.8Å; A113-F128 HydrophobicContact CB-CB 4.39Å; A113-F128 HydrophobicContact CB-CD1 4.13Å; A113-F128 HydrophobicContact CB-CD2 3.47Å; A113-F128 VanDerWaalsContact CB-CD2 3.47Å; A113-F128 HydrophobicContact CB-CE1 4.28Å; A113-F128 HydrophobicContact CB-CE2 3.62Å; A113-F128 HydrophobicContact CB-CG 3.74Å; A113-F128 HydrophobicContact CB-CZ 4.04Å; Y119-F128 HydrophobicContact CD1-CB 3.87Å; Y119-F128 AromaticContact CD2-CD2 3.94Å; Y119-F128 HydrophobicContact CD2-CD2 3.94Å; Y119-F128 HydrophobicContact CE1-CB 4.15Å; Y119-F128 HydrophobicContact CE1-CD2 4.47Å; Y119-F128 AromaticContact CE2-CD2 3.9Å; Y119-F128 HydrophobicContact CE2-CD2 3.9Å; Y119-F128 HydrophobicContact CG-CB 4.12Å; Y119-F128 HydrophobicContact CG-CD2 4.29Å; G124-F128 PolarHBondContact O-N 2.93Å; G124-F128 VanDerWaalsContact O-N 3.1Å; R125-F128 WeakPolarHBondContact O-CA 3.5Å; R125-F128 WeakPolarHBondContact O-CB 3.36Å; R125-F128 PolarHBondContact O-N 2.73Å; L126-F128 VanDerWaalsContact C-N 3.25Å; L126-F128 PolarHBondContact O-N 3.3Å; F128-R130 VanDerWaalsContact C-N 3.25Å; F128-R130 PolarHBondContact O-N 2.99Å; F128-K131 HydrophobicContact CD2-CD 4.21Å; F128-K131 HydrophobicContact CE2-CD 4.3Å; F128-K131 WeakPolarHBondContact O-CB 3.34Å; F128-K131 VanDerWaalsContact O-CG 3.29Å; F128-K131 WeakPolarHBondContact O-CG 3.49Å; F128-K131 PolarHBondContact O-N 3.19Å; F128-K131 VanDerWaalsContact O-N 3.13Å; F128-S134 PolarHBondContact O-OG 3.45Å |
| 129 | A | 93.8 | Very high | 91.6 | Very high | 18 Ų | 18 | 75 Ų | 75 | 15% | 0.149 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -59.5 | -34.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L110 R125 L126 K131 S134 I135 | L110-A129 HydrophobicContact CD1-CB 4.45Å; R125-A129 PolarHBondContact O-N 3.1Å; L126-A129 PolarHBondContact O-N 3.38Å; A129-K131 PolarHBondContact O-N 3.35Å; A129-K131 VanDerWaalsContact O-N 3.16Å; A129-S134 WeakPolarHBondContact O-CB 3.13Å; A129-I135 WeakPolarHBondContact O-CG1 3.3Å |
| 130 | R | 94.8 | Very high | 91.5 | Very high | 203 Ų | 203 | 74 Ų | 74 | 77% | 0.766 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.9 | 9.9 | 176.4 | -147.8 | -176.9 | 81.9 | 170.9 | 6.9 | 115.2 | L126 F128 I135 | L126-R130 PolarHBondContact O-N 2.91Å; F128-R130 VanDerWaalsContact C-N 3.25Å; F128-R130 PolarHBondContact O-N 2.99Å; R130-I135 HydrophobicContact CG-CD1 4.43Å |
| 131 | K | 91.4 | Very high | 91.7 | Very high | 48 Ų | 48 | 70.6 Ų | 70.6 | 21% | 0.209 | 34% | 0.342 | C | S | . | . | S | Bend | trans | -74.2 | 141.8 | 167.6 | -71.5 | 172.8 | 172.4 | -176.2 | 0 | 109.4 | E50 Y119 F128 A129 I133 S134 I135 | E50-K131 VanDerWaalsContact CD-NZ 3.34Å; E50-K131 IonicContact OE1-NZ 2.73Å; E50-K131 PolarHBondContact OE1-NZ 3.35Å; E50-K131 IonicContact OE2-NZ 2.66Å; E50-K131 PolarHBondContact OE2-NZ 3.34Å; Y119-K131 WeakPolarHBondContact OH-CE 3.41Å; F128-K131 HydrophobicContact CD2-CD 4.21Å; F128-K131 HydrophobicContact CE2-CD 4.3Å; F128-K131 WeakPolarHBondContact O-CB 3.34Å; F128-K131 VanDerWaalsContact O-CG 3.29Å; F128-K131 WeakPolarHBondContact O-CG 3.49Å; F128-K131 PolarHBondContact O-N 3.19Å; F128-K131 VanDerWaalsContact O-N 3.13Å; A129-K131 PolarHBondContact O-N 3.35Å; A129-K131 VanDerWaalsContact O-N 3.16Å; K131-I133 PolarHBondContact O-N 3.19Å; K131-S134 CarbonylContact O-C 3.49Å; K131-S134 WeakPolarHBondContact O-CA 3.41Å; K131-S134 WeakPolarHBondContact O-CB 3.14Å; K131-S134 PolarHBondContact O-N 3.34Å; K131-I135 WeakPolarHBondContact O-CG1 3.24Å; K131-I135 PolarHBondContact O-N 3.3Å |
| 132 | P | 90.5 | Very high | 91.8 | Very high | 103 Ų | 103 | 72.3 Ų | 72.3 | 67% | 0.669 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -50.3 | -49.4 | -179.1 | -30 | 35.8 | 0 | 0 | 0 | 114.5 | S134 I135 I136 | P132-S134 VanDerWaalsContact C-N 3.32Å; P132-S134 PolarHBondContact O-N 3.42Å; P132-I135 WeakPolarHBondContact O-CB 3.36Å; P132-I135 PolarHBondContact O-N 3.36Å; P132-I135 VanDerWaalsContact O-N 3.09Å; P132-I136 WeakPolarHBondContact O-CG1 3.41Å; P132-I136 PolarHBondContact O-N 2.84Å |
| 133 | I | 89.1 | Confident | 91.8 | Very high | 46 Ų | 46 | 66.8 Ų | 66.8 | 24% | 0.236 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -65.5 | -35.2 | -179.7 | -63.4 | 161.3 | 0 | 0 | 0 | 112 | K131 I135 I136 D137 D177 R178 G180 | K131-I133 PolarHBondContact O-N 3.19Å; I133-I135 VanDerWaalsContact C-N 3.32Å; I133-I136 PolarHBondContact O-N 3.02Å; I133-D137 WeakPolarHBondContact O-CB 3.26Å; I133-D137 PolarHBondContact O-N 3.44Å; I133-D177 VanDerWaalsContact CD1-O 3.29Å; I133-D177 WeakPolarHBondContact CD1-O 3.38Å; I133-R178 WeakPolarHBondContact CD1-O 3.08Å; I133-G180 VanDerWaalsContact CD1-N 3.31Å |
| 134 | S | 91.3 | Very high | 91.6 | Very high | 6 Ų | 6 | 56.8 Ų | 56.8 | 4% | 0.042 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -72.1 | -25.8 | 175 | -56.1 | 0 | 0 | 0 | 0 | 112.9 | Y106 F128 A129 K131 P132 L138 | Y106-S134 WeakPolarHBondContact CE2-O 3.44Å; F128-S134 PolarHBondContact O-OG 3.45Å; A129-S134 WeakPolarHBondContact O-CB 3.13Å; K131-S134 CarbonylContact O-C 3.49Å; K131-S134 WeakPolarHBondContact O-CA 3.41Å; K131-S134 WeakPolarHBondContact O-CB 3.14Å; K131-S134 PolarHBondContact O-N 3.34Å; P132-S134 VanDerWaalsContact C-N 3.32Å; P132-S134 PolarHBondContact O-N 3.42Å; S134-L138 WeakPolarHBondContact O-CB 3.38Å; S134-L138 PolarHBondContact O-N 3.18Å |
| 135 | I | 92.2 | Very high | 91.5 | Very high | 68 Ų | 68 | 60.8 Ų | 60.8 | 35% | 0.349 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -73.2 | -45.9 | 171.1 | -64.8 | 168.9 | 0 | 0 | 0 | 109.8 | A129 R130 K131 P132 I133 D137 L138 I139 | A129-I135 WeakPolarHBondContact O-CG1 3.3Å; R130-I135 HydrophobicContact CG-CD1 4.43Å; K131-I135 WeakPolarHBondContact O-CG1 3.24Å; K131-I135 PolarHBondContact O-N 3.3Å; P132-I135 WeakPolarHBondContact O-CB 3.36Å; P132-I135 PolarHBondContact O-N 3.36Å; P132-I135 VanDerWaalsContact O-N 3.09Å; I133-I135 VanDerWaalsContact C-N 3.32Å; I135-D137 PolarHBondContact O-N 2.97Å; I135-L138 PolarHBondContact O-N 3.21Å; I135-I139 HydrophobicContact CG2-CD1 3.66Å; I135-I139 HydrophobicContact CG2-CG1 4.27Å; I135-I139 WeakPolarHBondContact O-CB 3.21Å; I135-I139 VanDerWaalsContact O-CG1 3.3Å; I135-I139 WeakPolarHBondContact O-CG1 3.46Å; I135-I139 PolarHBondContact O-N 3.43Å |
| 136 | I | 90.9 | Very high | 91.2 | Very high | 53 Ų | 53 | 60.6 Ų | 60.6 | 27% | 0.272 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -58.4 | -48 | 177 | -63.9 | -61.1 | 0 | 0 | 0 | 111.2 | P132 I133 L138 I139 V140 L174 | P132-I136 WeakPolarHBondContact O-CG1 3.41Å; P132-I136 PolarHBondContact O-N 2.84Å; I133-I136 PolarHBondContact O-N 3.02Å; I136-L138 VanDerWaalsContact C-N 3.34Å; I136-L138 PolarHBondContact O-N 3.01Å; I136-I139 PolarHBondContact O-N 3.36Å; I136-V140 HydrophobicContact CG2-CG2 4.39Å; I136-V140 WeakPolarHBondContact O-CG2 3.45Å; I136-V140 PolarHBondContact O-N 3.39Å; I136-L174 HydrophobicContact CG1-CD2 4.48Å; I136-L174 HydrophobicContact CG2-CD2 4.36Å |
| 137 | D | 91.4 | Very high | 90.7 | Very high | 5 Ų | 5 | 57.1 Ų | 57.1 | 3% | 0.027 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.3 | -42 | 178.9 | -163.6 | 19.8 | 0 | 0 | 0 | 111.8 | Y106 R109 I133 I135 V140 V141 | Y106-D137 HydrophobicContact CD2-CB 4.12Å; Y106-D137 WeakPolarHBondContact CD2-OD2 3.42Å; Y106-D137 HydrophobicContact CE2-CB 4.42Å; R109-D137 IonicContact CZ-OD2 3.84Å; R109-D137 IonicContact NH1-OD2 3.51Å; R109-D137 PolarHBondContact NH1-OD2 3.36Å; R109-D137 IonicContact NH2-OD2 3.85Å; R109-D137 PolarHBondContact NH2-OD2 3.13Å; I133-D137 WeakPolarHBondContact O-CB 3.26Å; I133-D137 PolarHBondContact O-N 3.44Å; I135-D137 PolarHBondContact O-N 2.97Å; D137-V140 PolarHBondContact O-N 3.48Å; D137-V141 WeakPolarHBondContact O-CG2 3.36Å; D137-V141 PolarHBondContact O-N 2.96Å |
| 138 | L | 92.6 | Very high | 90.2 | Very high | 71 Ų | 71 | 50.5 Ų | 50.5 | 37% | 0.372 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -63 | -44.1 | 174.4 | -178.7 | 63.4 | 0 | 0 | 0 | 112.3 | Y106 S134 I135 I136 V141 V142 | Y106-L138 HydrophobicContact CE1-CD1 4.08Å; Y106-L138 HydrophobicContact CE2-CB 4.07Å; S134-L138 WeakPolarHBondContact O-CB 3.38Å; S134-L138 PolarHBondContact O-N 3.18Å; I135-L138 PolarHBondContact O-N 3.21Å; I136-L138 VanDerWaalsContact C-N 3.34Å; I136-L138 PolarHBondContact O-N 3.01Å; L138-V141 PolarHBondContact O-N 3.13Å; L138-V142 HydrophobicContact CD1-CG2 3.92Å; L138-V142 HydrophobicContact CG-CG2 4.35Å; L138-V142 WeakPolarHBondContact O-CB 3.43Å; L138-V142 VanDerWaalsContact O-CG2 3.25Å; L138-V142 WeakPolarHBondContact O-CG2 3.21Å; L138-V142 PolarHBondContact O-N 3.38Å |
| 139 | I | 91.3 | Very high | 89.7 | Confident | 88 Ų | 88 | 54.2 Ų | 54.2 | 45% | 0.451 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.9 | -45.8 | 177.2 | -71.7 | 169.8 | 0 | 0 | 0 | 110.3 | I135 I136 V142 A143 | I135-I139 HydrophobicContact CG2-CD1 3.66Å; I135-I139 HydrophobicContact CG2-CG1 4.27Å; I135-I139 WeakPolarHBondContact O-CB 3.21Å; I135-I139 VanDerWaalsContact O-CG1 3.3Å; I135-I139 WeakPolarHBondContact O-CG1 3.46Å; I135-I139 PolarHBondContact O-N 3.43Å; I136-I139 PolarHBondContact O-N 3.36Å; I139-V142 PolarHBondContact O-N 3.1Å; I139-A143 WeakPolarHBondContact O-CB 3.45Å; I139-A143 PolarHBondContact O-N 3.39Å |
| 140 | V | 90.2 | Very high | 89.1 | Confident | 4 Ų | 4 | 56.6 Ų | 56.6 | 2% | 0.024 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.4 | -48.7 | 178.7 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | I136 D137 S144 L171 R172 | I136-V140 HydrophobicContact CG2-CG2 4.39Å; I136-V140 WeakPolarHBondContact O-CG2 3.45Å; I136-V140 PolarHBondContact O-N 3.39Å; D137-V140 PolarHBondContact O-N 3.48Å; V140-S144 VanDerWaalsContact O-CB 3.31Å; V140-S144 WeakPolarHBondContact O-CB 3.47Å; V140-S144 PolarHBondContact O-N 3.36Å; V140-S144 PolarHBondContact O-OG 3.49Å; V140-L171 HydrophobicContact CG2-CB 3.76Å; V140-R172 HydrophobicContact CG1-CB 4.28Å |
| 141 | V | 92 | Very high | 87.9 | Confident | 21 Ų | 21 | 48.2 Ų | 48.2 | 13% | 0.127 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.2 | -46.3 | 179.1 | 172.1 | 0 | 0 | 0 | 0 | 111.9 | V99 F102 D137 L138 M145 | V99-V141 HydrophobicContact CG2-CG1 4.25Å; F102-V141 HydrophobicContact CB-CG2 3.9Å; D137-V141 WeakPolarHBondContact O-CG2 3.36Å; D137-V141 PolarHBondContact O-N 2.96Å; L138-V141 PolarHBondContact O-N 3.13Å; V141-M145 WeakPolarHBondContact O-CB 3.35Å; V141-M145 PolarHBondContact O-N 3.4Å |
| 142 | V | 91.5 | Very high | 87 | Confident | 80 Ų | 80 | 50.2 Ų | 50.2 | 49% | 0.485 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -66.6 | -43.9 | -179.6 | 171.2 | 0 | 0 | 0 | 0 | 111.2 | L138 I139 M145 V146 | L138-V142 HydrophobicContact CD1-CG2 3.92Å; L138-V142 HydrophobicContact CG-CG2 4.35Å; L138-V142 WeakPolarHBondContact O-CB 3.43Å; L138-V142 VanDerWaalsContact O-CG2 3.25Å; L138-V142 WeakPolarHBondContact O-CG2 3.21Å; L138-V142 PolarHBondContact O-N 3.38Å; I139-V142 PolarHBondContact O-N 3.1Å; V142-M145 WeakPolarHBondContact O-CB 3.36Å; V142-M145 PolarHBondContact O-N 3.39Å; V142-V146 WeakPolarHBondContact O-CG2 3.21Å; V142-V146 PolarHBondContact O-N 3.1Å |
| 143 | A | 88.9 | Confident | 85.9 | Confident | 28 Ų | 28 | 53.6 Ų | 53.6 | 23% | 0.231 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -67.1 | -41.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | I139 M145 V146 V147 L168 | I139-A143 WeakPolarHBondContact O-CB 3.45Å; I139-A143 PolarHBondContact O-N 3.39Å; A143-M145 VanDerWaalsContact C-N 3.3Å; A143-M145 PolarHBondContact O-N 2.86Å; A143-V146 PolarHBondContact O-N 3.2Å; A143-V147 WeakPolarHBondContact O-CB 3.38Å; A143-V147 VanDerWaalsContact O-CG2 3.26Å; A143-V147 WeakPolarHBondContact O-CG2 3.34Å; A143-V147 PolarHBondContact O-N 3.31Å; A143-L168 HydrophobicContact CB-CD1 3.67Å; A143-L168 HydrophobicContact CB-CD2 3.51Å; A143-L168 HydrophobicContact CB-CG 4.24Å |
| 144 | S | 87.6 | Confident | 84.3 | Confident | 1 Ų | 1 | 54.7 Ų | 54.7 | 1% | 0.007 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -58.4 | -43 | 172.6 | -75.4 | 0 | 0 | 0 | 0 | 111.2 | E95 V140 V147 L148 R172 | E95-S144 WeakPolarHBondContact OE1-CB 3.38Å; E95-S144 PolarHBondContact OE1-OG 3.47Å; V140-S144 VanDerWaalsContact O-CB 3.31Å; V140-S144 WeakPolarHBondContact O-CB 3.47Å; V140-S144 PolarHBondContact O-N 3.36Å; V140-S144 PolarHBondContact O-OG 3.49Å; S144-V147 PolarHBondContact O-N 3.21Å; S144-L148 WeakPolarHBondContact O-CG 3.42Å; S144-L148 PolarHBondContact O-N 3Å; S144-R172 PolarHBondContact OG-NH2 3.29Å; S144-R172 VanDerWaalsContact OG-NH2 3.17Å |
| 145 | M | 88.7 | Confident | 82.4 | Confident | 90 Ų | 90 | 59.8 Ų | 59.8 | 44% | 0.443 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -62.3 | -47 | 176.5 | -170.5 | 64.8 | 66.7 | 0 | 0 | 112.2 | V99 V141 V142 A143 V147 L148 C149 | V99-M145 HydrophobicContact CG1-CE 4.36Å; V99-M145 HydrophobicContact CG2-CB 4.49Å; V99-M145 HydrophobicContact CG2-CE 4.08Å; V141-M145 WeakPolarHBondContact O-CB 3.35Å; V141-M145 PolarHBondContact O-N 3.4Å; V142-M145 WeakPolarHBondContact O-CB 3.36Å; V142-M145 PolarHBondContact O-N 3.39Å; A143-M145 VanDerWaalsContact C-N 3.3Å; A143-M145 PolarHBondContact O-N 2.86Å; M145-V147 VanDerWaalsContact C-N 3.35Å; M145-V147 PolarHBondContact O-N 3.37Å; M145-L148 PolarHBondContact O-N 3.25Å; M145-C149 WeakPolarHBondContact O-CB 3.4Å; M145-C149 PolarHBondContact O-N 2.89Å; M145-C149 PolarHBondContact O-SG 3.33Å |
| 146 | V | 87.1 | Confident | 80.5 | Confident | 82 Ų | 82 | 63 Ų | 63 | 50% | 0.497 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -59.4 | -46 | 177 | 169.3 | 0 | 0 | 0 | 0 | 111 | V142 A143 C149 V150 | V142-V146 WeakPolarHBondContact O-CG2 3.21Å; V142-V146 PolarHBondContact O-N 3.1Å; A143-V146 PolarHBondContact O-N 3.2Å; V146-C149 PolarHBondContact O-N 3.47Å; V146-V150 HydrophobicContact CG1-CG2 4.44Å; V146-V150 WeakPolarHBondContact O-CG2 3.35Å; V146-V150 PolarHBondContact O-N 3.33Å |
| 147 | V | 83.4 | Confident | 78.6 | Confident | 27 Ų | 27 | 66.2 Ų | 66.2 | 16% | 0.164 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -65.8 | -40 | -177.9 | 173.6 | 0 | 0 | 0 | 0 | 111.9 | A143 S144 M145 G151 A161 I165 L168 | A143-V147 WeakPolarHBondContact O-CB 3.38Å; A143-V147 VanDerWaalsContact O-CG2 3.26Å; A143-V147 WeakPolarHBondContact O-CG2 3.34Å; A143-V147 PolarHBondContact O-N 3.31Å; S144-V147 PolarHBondContact O-N 3.21Å; M145-V147 VanDerWaalsContact C-N 3.35Å; M145-V147 PolarHBondContact O-N 3.37Å; V147-G151 PolarHBondContact O-N 2.83Å; V147-A161 HydrophobicContact CG1-CB 4.1Å; V147-I165 HydrophobicContact CG1-CD1 4.02Å; V147-I165 HydrophobicContact CG1-CG1 3.44Å; V147-I165 VanDerWaalsContact CG1-CG1 3.44Å; V147-L168 HydrophobicContact CG2-CD1 4.18Å |
| 148 | L | 82.7 | Confident | 76.8 | Confident | 17 Ų | 17 | 68 Ų | 68 | 9% | 0.089 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -66.1 | -44.6 | 174.3 | -71.4 | 168.2 | 0 | 0 | 0 | 112.1 | F92 E95 I96 V99 S144 M145 V150 G151 S152 | F92-L148 HydrophobicContact CD2-CD2 4.04Å; F92-L148 HydrophobicContact CE2-CD2 3.87Å; E95-L148 HydrophobicContact CB-CD2 4.48Å; E95-L148 HydrophobicContact CG-CD1 4.32Å; E95-L148 HydrophobicContact CG-CD2 4.25Å; E95-L148 HydrophobicContact CG-CG 4.45Å; I96-L148 HydrophobicContact CG1-CD1 4.01Å; I96-L148 HydrophobicContact CG1-CD2 3.88Å; V99-L148 HydrophobicContact CB-CD1 4.33Å; V99-L148 HydrophobicContact CG1-CD1 3.6Å; S144-L148 WeakPolarHBondContact O-CG 3.42Å; S144-L148 PolarHBondContact O-N 3Å; M145-L148 PolarHBondContact O-N 3.25Å; L148-V150 VanDerWaalsContact C-N 3.34Å; L148-V150 PolarHBondContact O-N 3.41Å; L148-G151 PolarHBondContact O-N 3.38Å; L148-S152 WeakPolarHBondContact O-CB 3.23Å; L148-S152 PolarHBondContact O-N 3.19Å |
| 149 | C | 83.1 | Confident | 75.2 | Confident | 80 Ų | 80 | 69.4 Ų | 69.4 | 54% | 0.541 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63 | -36.7 | 177.9 | -73.5 | 0 | 0 | 0 | 0 | 113.3 | M145 V146 | M145-C149 WeakPolarHBondContact O-CB 3.4Å; M145-C149 PolarHBondContact O-N 2.89Å; M145-C149 PolarHBondContact O-SG 3.33Å; V146-C149 PolarHBondContact O-N 3.47Å |
| 150 | V | 80.1 | Confident | 73.8 | Confident | 68 Ų | 68 | 68.8 Ų | 68.8 | 41% | 0.412 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -75.2 | -44.9 | 175.5 | 172.6 | 0 | 0 | 0 | 0 | 111 | V146 L148 S152 K153 | V146-V150 HydrophobicContact CG1-CG2 4.44Å; V146-V150 WeakPolarHBondContact O-CG2 3.35Å; V146-V150 PolarHBondContact O-N 3.33Å; L148-V150 VanDerWaalsContact C-N 3.34Å; L148-V150 PolarHBondContact O-N 3.41Å; V150-S152 VanDerWaalsContact C-N 3.29Å; V150-S152 PolarHBondContact O-N 3.14Å; V150-K153 PolarHBondContact O-N 3.04Å |
| 151 | G | 71.1 | Confident | 72.5 | Confident | 27 Ų | 27 | 69.5 Ų | 69.5 | 28% | 0.278 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.4 | -34.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | V147 L148 K153 G154 | V147-G151 PolarHBondContact O-N 2.83Å; L148-G151 PolarHBondContact O-N 3.38Å; G151-K153 PolarHBondContact O-N 3.27Å; G151-K153 VanDerWaalsContact O-N 3.1Å; G151-G154 PolarHBondContact O-N 3Å |
| 152 | S | 71 | Confident | 71.1 | Confident | 90 Ų | 90 | 71.4 Ų | 71.4 | 63% | 0.629 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.9 | -15.2 | -180 | -173.2 | 0 | 0 | 0 | 0 | 114.9 | L148 V150 | L148-S152 WeakPolarHBondContact O-CB 3.23Å; L148-S152 PolarHBondContact O-N 3.19Å; V150-S152 VanDerWaalsContact C-N 3.29Å; V150-S152 PolarHBondContact O-N 3.14Å |
| 153 | K | 67.1 | Low | 69.9 | Low | 174 Ų | 174 | 76.8 Ų | 76.8 | 76% | 0.757 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | 6.4 | -178.7 | -70 | -170.4 | 175.4 | -176.7 | 0 | 114.4 | V150 G151 Q155 | V150-K153 PolarHBondContact O-N 3.04Å; G151-K153 PolarHBondContact O-N 3.27Å; G151-K153 VanDerWaalsContact O-N 3.1Å; K153-Q155 PolarHBondContact O-N 3.27Å |
| 154 | G | 56.9 | Low | 68.9 | Low | 69 Ų | 69 | 76.8 Ų | 76.8 | 71% | 0.711 | 45% | 0.447 | S | S | * | . | trans | 64.5 | 8.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | G151 | G151-G154 PolarHBondContact O-N 3Š| ||
| 155 | Q | 50.9 | Low | 68 | Low | 112 Ų | 112 | 78 Ų | 78 | 52% | 0.523 | 45% | 0.453 | S | S | . | . | trans | -70.3 | 149.2 | -177.4 | -147.9 | 172.1 | 4 | 0 | 0 | 110.1 | K153 F157 A158 | K153-Q155 PolarHBondContact O-N 3.27Å; Q155-F157 HydrophobicContact CB-CD2 4.41Å; Q155-F157 HydrophobicContact CG-CD2 4.16Å; Q155-F157 PolarHBondContact O-N 2.94Å; Q155-A158 PolarHBondContact O-N 3.34Å | ||
| 156 | V | 52.2 | Low | 67.2 | Low | 135 Ų | 135 | 77 Ų | 77 | 82% | 0.818 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.2 | -8.4 | -177.6 | -90.3 | 0 | 0 | 0 | 0 | 116.2 | A158 | V156-A158 PolarHBondContact O-N 2.94Š|
| 157 | F | 50 | Low | 66.7 | Low | 121 Ų | 121 | 79.3 Ų | 79.3 | 53% | 0.531 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.5 | -7.8 | 167.2 | -64.3 | -74 | 0 | 0 | 0 | 114.9 | Q155 T159 S160 A161 | Q155-F157 HydrophobicContact CB-CD2 4.41Å; Q155-F157 HydrophobicContact CG-CD2 4.16Å; Q155-F157 PolarHBondContact O-N 2.94Å; F157-T159 VanDerWaalsContact C-N 3.29Å; F157-T159 PolarHBondContact O-N 2.89Å; F157-S160 CarbonylContact O-C 3.59Å; F157-S160 WeakPolarHBondContact O-CA 3.36Å; F157-S160 WeakPolarHBondContact O-CB 3.43Å; F157-S160 PolarHBondContact O-N 3.18Å; F157-A161 PolarHBondContact O-N 3.07Å |
| 158 | A | 54.6 | Low | 66.4 | Low | 42 Ų | 42 | 78.7 Ų | 78.7 | 35% | 0.347 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -51.5 | -42.3 | -179 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q155 V156 S160 A161 I162 | Q155-A158 PolarHBondContact O-N 3.34Å; V156-A158 PolarHBondContact O-N 2.94Å; A158-S160 PolarHBondContact O-N 2.97Å; A158-A161 PolarHBondContact O-N 3.07Å; A158-I162 WeakPolarHBondContact O-CD1 3.21Å; A158-I162 VanDerWaalsContact O-CG1 3.26Å; A158-I162 WeakPolarHBondContact O-CG1 3.01Å; A158-I162 PolarHBondContact O-N 2.84Å |
| 159 | T | 58.6 | Low | 66.1 | Low | 101 Ų | 101 | 78 Ų | 78 | 62% | 0.62 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -69.7 | -28.2 | 176.1 | 37.4 | 0 | 0 | 0 | 0 | 113.9 | F157 | F157-T159 VanDerWaalsContact C-N 3.29Å; F157-T159 PolarHBondContact O-N 2.89Å |
| 160 | S | 61.6 | Low | 66.1 | Low | 76 Ų | 76 | 78.5 Ų | 78.5 | 53% | 0.531 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -76.2 | -42.4 | 172.3 | -169.5 | 0 | 0 | 0 | 0 | 111.2 | F157 A158 I162 R163 G164 | F157-S160 CarbonylContact O-C 3.59Å; F157-S160 WeakPolarHBondContact O-CA 3.36Å; F157-S160 WeakPolarHBondContact O-CB 3.43Å; F157-S160 PolarHBondContact O-N 3.18Å; A158-S160 PolarHBondContact O-N 2.97Å; S160-I162 VanDerWaalsContact C-N 3.33Å; S160-I162 PolarHBondContact O-N 3.41Å; S160-R163 WeakPolarHBondContact O-CB 3.23Å; S160-R163 PolarHBondContact O-N 2.92Å; S160-R163 VanDerWaalsContact O-N 3.1Å; S160-G164 PolarHBondContact O-N 3.05Å |
| 161 | A | 62.7 | Low | 66.2 | Low | 19 Ų | 19 | 77.4 Ų | 77.4 | 16% | 0.157 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -56.4 | -44 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | V147 F157 A158 R163 G164 I165 | V147-A161 HydrophobicContact CG1-CB 4.1Å; F157-A161 PolarHBondContact O-N 3.07Å; A158-A161 PolarHBondContact O-N 3.07Å; A161-R163 VanDerWaalsContact C-N 3.29Å; A161-R163 PolarHBondContact O-N 3.37Å; A161-G164 CarbonylContact O-C 3.6Å; A161-G164 WeakPolarHBondContact O-CA 3.4Å; A161-G164 PolarHBondContact O-N 3.04Å; A161-I165 WeakPolarHBondContact O-CG1 3.34Å; A161-I165 PolarHBondContact O-N 2.86Å |
| 162 | I | 63.3 | Low | 66.7 | Low | 60 Ų | 60 | 76.2 Ų | 76.2 | 31% | 0.308 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -56.4 | -39.1 | 175.9 | -71.9 | 162.5 | 0 | 0 | 0 | 112.3 | T88 A158 S160 I165 R166 | T88-I162 HydrophobicContact CG2-CD1 4.12Å; A158-I162 WeakPolarHBondContact O-CD1 3.21Å; A158-I162 VanDerWaalsContact O-CG1 3.26Å; A158-I162 WeakPolarHBondContact O-CG1 3.01Å; A158-I162 PolarHBondContact O-N 2.84Å; S160-I162 VanDerWaalsContact C-N 3.33Å; S160-I162 PolarHBondContact O-N 3.41Å; I162-I165 PolarHBondContact O-N 3.42Å; I162-R166 PolarHBondContact O-N 3.39Å |
| 163 | R | 66.1 | Low | 67.3 | Low | 193 Ų | 193 | 76.2 Ų | 76.2 | 73% | 0.728 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -66.6 | -38.3 | 174.8 | -61.3 | 179.6 | -172.1 | -179.1 | 2 | 111.6 | S160 A161 F167 | S160-R163 WeakPolarHBondContact O-CB 3.23Å; S160-R163 PolarHBondContact O-N 2.92Å; S160-R163 VanDerWaalsContact O-N 3.1Å; A161-R163 VanDerWaalsContact C-N 3.29Å; A161-R163 PolarHBondContact O-N 3.37Å; R163-F167 PolarHBondContact O-N 2.96Å |
| 164 | G | 67.8 | Low | 67.9 | Low | 28 Ų | 28 | 71.3 Ų | 71.3 | 29% | 0.289 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.2 | -45.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | S160 A161 R166 F167 L168 | S160-G164 PolarHBondContact O-N 3.05Å; A161-G164 CarbonylContact O-C 3.6Å; A161-G164 WeakPolarHBondContact O-CA 3.4Å; A161-G164 PolarHBondContact O-N 3.04Å; G164-R166 VanDerWaalsContact C-N 3.31Å; G164-R166 PolarHBondContact O-N 3.09Å; G164-F167 PolarHBondContact O-N 2.99Å; G164-L168 WeakPolarHBondContact O-CG 3.39Å; G164-L168 PolarHBondContact O-N 2.93Å; G164-L168 VanDerWaalsContact O-N 3.09Å |
| 165 | I | 69.4 | Low | 69 | Low | 28 Ų | 28 | 68.6 Ų | 68.6 | 14% | 0.144 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -54.1 | -48.3 | 177 | -64.6 | 175.8 | 0 | 0 | 0 | 110.6 | E95 V147 A161 I162 F167 L168 Q169 | E95-I165 HydrophobicContact CG-CG2 4.41Å; V147-I165 HydrophobicContact CG1-CD1 4.02Å; V147-I165 HydrophobicContact CG1-CG1 3.44Å; V147-I165 VanDerWaalsContact CG1-CG1 3.44Å; A161-I165 WeakPolarHBondContact O-CG1 3.34Å; A161-I165 PolarHBondContact O-N 2.86Å; I162-I165 PolarHBondContact O-N 3.42Å; I165-F167 VanDerWaalsContact C-N 3.31Å; I165-F167 PolarHBondContact O-N 2.93Å; I165-L168 PolarHBondContact O-N 2.98Å; I165-Q169 HydrophobicContact CG2-CG 4.38Å; I165-Q169 WeakPolarHBondContact O-CG 3.34Å; I165-Q169 PolarHBondContact O-N 3.1Å |
| 166 | R | 72.4 | Confident | 70.4 | Confident | 68 Ų | 68 | 66.2 Ų | 66.2 | 26% | 0.257 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -58.8 | -40.4 | -179.4 | -174.6 | 175.1 | -61.3 | 138 | 3.7 | 112.8 | S75 S78 T79 I162 G164 Q169 I170 | S75-R166 PolarHBondContact O-NE 2.89Å; S75-R166 PolarHBondContact O-NH2 3.27Å; S75-R166 WeakPolarHBondContact OG-CG 3.37Å; S78-R166 PolarHBondContact OG-NH2 3.39Å; T79-R166 VanDerWaalsContact CG2-NH1 3.27Å; I162-R166 PolarHBondContact O-N 3.39Å; G164-R166 VanDerWaalsContact C-N 3.31Å; G164-R166 PolarHBondContact O-N 3.09Å; R166-Q169 PolarHBondContact O-N 3.32Å; R166-I170 PolarHBondContact O-N 3.19Å |
| 167 | F | 76.4 | Confident | 71.7 | Confident | 130 Ų | 130 | 61.5 Ų | 61.5 | 57% | 0.57 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -68.2 | -41.4 | 177.2 | -177 | -107.3 | 0 | 0 | 0 | 112.4 | R163 G164 I165 Q169 I170 L171 | R163-F167 PolarHBondContact O-N 2.96Å; G164-F167 PolarHBondContact O-N 2.99Å; I165-F167 VanDerWaalsContact C-N 3.31Å; I165-F167 PolarHBondContact O-N 2.93Å; F167-Q169 VanDerWaalsContact C-N 3.3Å; F167-Q169 PolarHBondContact O-N 2.99Å; F167-I170 PolarHBondContact O-N 3.41Å; F167-L171 HydrophobicContact CD1-CD1 4.09Å; F167-L171 HydrophobicContact CE1-CD1 3.63Å; F167-L171 HydrophobicContact CE1-CG 4.14Å; F167-L171 HydrophobicContact CZ-CD1 4.21Å; F167-L171 HydrophobicContact CZ-CD2 4.49Å; F167-L171 HydrophobicContact CZ-CG 4.34Å; F167-L171 PolarHBondContact O-N 3.43Å; F167-L171 VanDerWaalsContact O-N 3.1Å |
| 168 | L | 76.6 | Confident | 73 | Confident | 14 Ų | 14 | 56.9 Ų | 56.9 | 7% | 0.073 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64 | -33.6 | 176.9 | -64.9 | 175.6 | 0 | 0 | 0 | 112.7 | A143 V147 G164 I165 L171 R172 | A143-L168 HydrophobicContact CB-CD1 3.67Å; A143-L168 HydrophobicContact CB-CD2 3.51Å; A143-L168 HydrophobicContact CB-CG 4.24Å; V147-L168 HydrophobicContact CG2-CD1 4.18Å; G164-L168 WeakPolarHBondContact O-CG 3.39Å; G164-L168 PolarHBondContact O-N 2.93Å; G164-L168 VanDerWaalsContact O-N 3.09Å; I165-L168 PolarHBondContact O-N 2.98Å; L168-L171 HydrophobicContact CD2-CD1 4.43Å; L168-L171 PolarHBondContact O-N 3.34Å; L168-R172 WeakPolarHBondContact O-CB 3.27Å; L168-R172 PolarHBondContact O-N 3.39Å |
| 169 | Q | 77.1 | Confident | 74.2 | Confident | 2 Ų | 2 | 59.6 Ų | 59.6 | 1% | 0.009 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -67.4 | -34.6 | 174.8 | -71.2 | 165.3 | -17.4 | 0 | 0 | 113 | C71 S75 I165 R166 F167 R172 | C71-Q169 PolarHBondContact SG-NE2 3.31Å; C71-Q169 VanDerWaalsContact SG-NE2 3.35Å; S75-Q169 PolarHBondContact OG-OE1 2.99Å; I165-Q169 HydrophobicContact CG2-CG 4.38Å; I165-Q169 WeakPolarHBondContact O-CG 3.34Å; I165-Q169 PolarHBondContact O-N 3.1Å; R166-Q169 PolarHBondContact O-N 3.32Å; F167-Q169 VanDerWaalsContact C-N 3.3Å; F167-Q169 PolarHBondContact O-N 2.99Å; Q169-R172 WeakPolarHBondContact O-CB 3.41Å; Q169-R172 PolarHBondContact O-N 3.1Å |
| 170 | I | 82.4 | Confident | 75.4 | Confident | 92 Ų | 92 | 55.1 Ų | 55.1 | 47% | 0.472 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -68.2 | -44.7 | 172.9 | -62.9 | 166.5 | 0 | 0 | 0 | 109.8 | L72 R166 F167 R172 M173 | L72-I170 HydrophobicContact CD1-CG1 3.85Å; R166-I170 PolarHBondContact O-N 3.19Å; F167-I170 PolarHBondContact O-N 3.41Å; I170-R172 PolarHBondContact O-N 3.42Å; I170-M173 WeakPolarHBondContact O-CB 3.35Å; I170-M173 PolarHBondContact O-N 2.95Å; I170-M173 VanDerWaalsContact O-N 3.1Å |
| 171 | L | 81.7 | Confident | 76.5 | Confident | 44 Ų | 44 | 53.1 Ų | 53.1 | 23% | 0.23 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -59.9 | -32.8 | 174.4 | -72.6 | -177.6 | 0 | 0 | 0 | 113.1 | V140 F167 L168 M173 L174 | V140-L171 HydrophobicContact CG2-CB 3.76Å; F167-L171 HydrophobicContact CD1-CD1 4.09Å; F167-L171 HydrophobicContact CE1-CD1 3.63Å; F167-L171 HydrophobicContact CE1-CG 4.14Å; F167-L171 HydrophobicContact CZ-CD1 4.21Å; F167-L171 HydrophobicContact CZ-CD2 4.49Å; F167-L171 HydrophobicContact CZ-CG 4.34Å; F167-L171 PolarHBondContact O-N 3.43Å; F167-L171 VanDerWaalsContact O-N 3.1Å; L168-L171 HydrophobicContact CD2-CD1 4.43Å; L168-L171 PolarHBondContact O-N 3.34Å; L171-M173 VanDerWaalsContact C-N 3.29Å; L171-M173 PolarHBondContact O-N 3.44Å; L171-L174 VanDerWaalsContact O-CB 3.26Å; L171-L174 WeakPolarHBondContact O-CB 3.33Å; L171-L174 PolarHBondContact O-N 2.87Å; L171-L174 VanDerWaalsContact O-N 3.08Å |
| 172 | R | 81.7 | Confident | 77.7 | Confident | 2 Ų | 2 | 56.8 Ų | 56.8 | 1% | 0.008 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -59 | -37.6 | 174.8 | -169.9 | 177.2 | -77 | 156.2 | 2.9 | 111.8 | V68 E95 F102 V140 S144 L168 Q169 I170 L174 H175 | V68-R172 HydrophobicContact CG1-CB 4.17Å; V68-R172 HydrophobicContact CG1-CG 3.82Å; V68-R172 HydrophobicContact CG2-CG 3.91Å; E95-R172 IonicContact OE1-CZ 2.64Å; E95-R172 IonicContact OE1-NH1 2.85Å; E95-R172 IonicContact OE1-NH2 3.75Å; E95-R172 PolarHBondContact OE1-NH2 2.87Å; E95-R172 IonicContact OE2-CZ 2.64Å; E95-R172 IonicContact OE2-NH1 3.36Å; E95-R172 PolarHBondContact OE2-NH1 3.48Å; E95-R172 IonicContact OE2-NH2 3.48Å; E95-R172 PolarHBondContact OE2-NH2 3.24Å; F102-R172 HydrophobicContact CE2-CG 4.14Å; F102-R172 HydrophobicContact CZ-CG 4.43Å; V140-R172 HydrophobicContact CG1-CB 4.28Å; S144-R172 PolarHBondContact OG-NH2 3.29Å; S144-R172 VanDerWaalsContact OG-NH2 3.17Å; L168-R172 WeakPolarHBondContact O-CB 3.27Å; L168-R172 PolarHBondContact O-N 3.39Å; Q169-R172 WeakPolarHBondContact O-CB 3.41Å; Q169-R172 PolarHBondContact O-N 3.1Å; I170-R172 PolarHBondContact O-N 3.42Å; R172-L174 PolarHBondContact O-N 3.01Å; R172-L174 VanDerWaalsContact O-N 3.12Å; R172-H175 VanDerWaalsContact CG-NE2 3.3Å; R172-H175 WeakPolarHBondContact CG-NE2 3.26Å; R172-H175 PolarHBondContact O-CD2 2.69Å; R172-H175 PolarHBondContact O-N 2.89Å; R172-H175 PolarHBondContact O-ND1 2.73Å; R172-H175 PolarHBondContact O-NE2 3.42Å |
| 173 | M | 83.6 | Confident | 78.9 | Confident | 91 Ų | 91 | 61.2 Ų | 61.2 | 45% | 0.448 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -58.6 | -28.2 | 175.9 | -164.4 | -178.2 | -175.6 | 0 | 0 | 113 | F65 I170 L171 H175 V176 | F65-M173 HydrophobicContact CE2-CE 3.98Å; F65-M173 HydrophobicContact CZ-CE 4.47Å; I170-M173 WeakPolarHBondContact O-CB 3.35Å; I170-M173 PolarHBondContact O-N 2.95Å; I170-M173 VanDerWaalsContact O-N 3.1Å; L171-M173 VanDerWaalsContact C-N 3.29Å; L171-M173 PolarHBondContact O-N 3.44Å; M173-H175 VanDerWaalsContact C-N 3.29Å; M173-H175 PolarHBondContact O-N 2.87Å; M173-V176 WeakPolarHBondContact O-CB 3.43Å; M173-V176 VanDerWaalsContact O-CG2 3.23Å; M173-V176 WeakPolarHBondContact O-CG2 3.35Å; M173-V176 PolarHBondContact O-N 3.17Å |
| 174 | L | 80.4 | Confident | 80 | Confident | 71 Ų | 71 | 60.4 Ų | 60.4 | 37% | 0.372 | 30% | 0.3 | S | S | . | . | G | 310 helix | trans | -68.6 | -22.4 | 178.4 | -169.4 | 60.9 | 0 | 0 | 0 | 113.4 | I136 L171 R172 V176 W183 | I136-L174 HydrophobicContact CG1-CD2 4.48Å; I136-L174 HydrophobicContact CG2-CD2 4.36Å; L171-L174 VanDerWaalsContact O-CB 3.26Å; L171-L174 WeakPolarHBondContact O-CB 3.33Å; L171-L174 PolarHBondContact O-N 2.87Å; L171-L174 VanDerWaalsContact O-N 3.08Å; R172-L174 PolarHBondContact O-N 3.01Å; R172-L174 VanDerWaalsContact O-N 3.12Å; L174-V176 PolarHBondContact O-N 3.18Å; L174-W183 HydrophobicContact CD1-CZ2 3.81Å |
| 175 | H | 78.3 | Confident | 81 | Confident | 12 Ų | 12 | 62.7 Ų | 62.7 | 6% | 0.056 | 31% | 0.305 | C | S | . | . | G | 310 helix | trans | -68.9 | -12.5 | 179.3 | 74.3 | 38.3 | 0 | 0 | 0 | 113.7 | F102 R172 M173 | F102-H175 AromaticContact CD1-NE2 3.99Å; F102-H175 AromaticContact CE1-CE1 3.87Å; F102-H175 AromaticContact CE1-NE2 3.3Å; F102-H175 VanDerWaalsContact CE1-NE2 3.3Å; F102-H175 WeakPolarHBondContact CE1-NE2 3.28Å; F102-H175 AromaticContact CZ-NE2 3.41Å; F102-H175 WeakPolarHBondContact CZ-NE2 3.43Å; R172-H175 VanDerWaalsContact CG-NE2 3.3Å; R172-H175 WeakPolarHBondContact CG-NE2 3.26Å; R172-H175 PolarHBondContact O-CD2 2.69Å; R172-H175 PolarHBondContact O-N 2.89Å; R172-H175 PolarHBondContact O-ND1 2.73Å; R172-H175 PolarHBondContact O-NE2 3.42Å; M173-H175 VanDerWaalsContact C-N 3.29Å; M173-H175 PolarHBondContact O-N 2.87Å |
| 176 | V | 82.2 | Confident | 82.1 | Confident | 61 Ų | 61 | 64.1 Ų | 64.1 | 37% | 0.37 | 31% | 0.313 | S | S | . | . | G | 310 helix | trans | -70.7 | -37.5 | -173.6 | -179.1 | 0 | 0 | 0 | 0 | 111.6 | F65 M173 L174 R178 | F65-V176 HydrophobicContact CD2-CG1 4.2Å; F65-V176 HydrophobicContact CD2-CG2 4.03Å; M173-V176 WeakPolarHBondContact O-CB 3.43Å; M173-V176 VanDerWaalsContact O-CG2 3.23Å; M173-V176 WeakPolarHBondContact O-CG2 3.35Å; M173-V176 PolarHBondContact O-N 3.17Å; L174-V176 PolarHBondContact O-N 3.18Å; V176-R178 PolarHBondContact O-N 3.09Å |
| 177 | D | 79.2 | Confident | 83.1 | Confident | 36 Ų | 36 | 62.7 Ų | 62.7 | 19% | 0.193 | 32% | 0.319 | C | S | . | . | S | Bend | trans | -79.2 | 67.4 | 169.9 | -176.3 | 10.3 | 0 | 0 | 0 | 111.1 | I133 Q179 G180 G181 T182 | I133-D177 VanDerWaalsContact CD1-O 3.29Å; I133-D177 WeakPolarHBondContact CD1-O 3.38Å; D177-Q179 PolarHBondContact O-N 3.37Å; D177-G180 PolarHBondContact O-N 3.28Å; D177-G180 PolarHBondContact OD1-N 3.44Å; D177-G180 WeakPolarHBondContact OD2-CA 3.33Å; D177-G181 PolarHBondContact OD1-N 3.28Å; D177-G181 PolarHBondContact OD2-N 3.39Å; D177-T182 VanDerWaalsContact OD2-CB 3.31Å; D177-T182 WeakPolarHBondContact OD2-CB 3.33Å; D177-T182 PolarHBondContact OD2-N 2.93Å; D177-T182 VanDerWaalsContact OD2-N 3.09Å |
| 178 | R | 76.8 | Confident | 83.8 | Confident | 24 Ų | 24 | 58.9 Ų | 58.9 | 9% | 0.091 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.4 | -26.4 | -172.4 | -160.1 | 110.4 | 84.6 | -175.9 | 16.3 | 115.1 | L49 H61 E105 R109 I133 V176 | L49-R178 VanDerWaalsContact O-CZ 3.29Å; L49-R178 PolarHBondContact O-NE 3.3Å; L49-R178 PolarHBondContact O-NH2 3.12Å; H61-R178 PolarHBondContact CE1-NH2 2.92Å; H61-R178 VanDerWaalsContact CE1-NH2 3.26Å; E105-R178 IonicContact OE1-CZ 2.69Å; E105-R178 IonicContact OE1-NH1 3.62Å; E105-R178 PolarHBondContact OE1-NH1 3.06Å; E105-R178 IonicContact OE1-NH2 3.63Å; E105-R178 PolarHBondContact OE1-NH2 3.29Å; E105-R178 IonicContact OE2-NH1 3.91Å; R109-R178 VanDerWaalsContact NH2-NH1 3.19Å; I133-R178 WeakPolarHBondContact CD1-O 3.08Å; V176-R178 PolarHBondContact O-N 3.09Å |
| 179 | Q | 80.5 | Confident | 84.7 | Confident | 99 Ų | 99 | 58.2 Ų | 58.2 | 46% | 0.463 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100 | -5.7 | -178 | -65.4 | -173 | 18.6 | 0 | 0 | 113.7 | E50 D177 G181 R184 | E50-Q179 WeakPolarHBondContact O-CG 3.44Å; E50-Q179 PolarHBondContact O-NE2 3.19Å; D177-Q179 PolarHBondContact O-N 3.37Å; Q179-G181 PolarHBondContact O-N 3.1Å; Q179-R184 PolarHBondContact O-NH2 3.13Å |
| 180 | G | 82.8 | Confident | 85.6 | Confident | 8 Ų | 8 | 60.6 Ų | 60.6 | 8% | 0.082 | 32% | 0.32 | C | S | . | . | trans | 55.8 | 37.2 | -165.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | I133 D177 R184 | I133-G180 VanDerWaalsContact CD1-N 3.31Å; D177-G180 PolarHBondContact O-N 3.28Å; D177-G180 PolarHBondContact OD1-N 3.44Å; D177-G180 WeakPolarHBondContact OD2-CA 3.33Å; G180-R184 WeakPolarHBondContact O-CB 3.41Å; G180-R184 PolarHBondContact O-N 3.36Å | ||
| 181 | G | 85.6 | Confident | 86.3 | Confident | 34 Ų | 34 | 62.5 Ų | 62.5 | 35% | 0.351 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -68.5 | -44.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 110.4 | D177 Q179 L185 | D177-G181 PolarHBondContact OD1-N 3.28Å; D177-G181 PolarHBondContact OD2-N 3.39Å; Q179-G181 PolarHBondContact O-N 3.1Å; G181-L185 WeakPolarHBondContact O-CB 3.31Å; G181-L185 PolarHBondContact O-N 3.22Å |
| 182 | T | 87.1 | Confident | 86.9 | Confident | 96 Ų | 96 | 65.2 Ų | 65.2 | 59% | 0.589 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -66.1 | -50 | 177 | -52 | 0 | 0 | 0 | 0 | 110.2 | D177 R184 L185 L186 | D177-T182 VanDerWaalsContact OD2-CB 3.31Å; D177-T182 WeakPolarHBondContact OD2-CB 3.33Å; D177-T182 PolarHBondContact OD2-N 2.93Å; D177-T182 VanDerWaalsContact OD2-N 3.09Å; T182-R184 VanDerWaalsContact C-N 3.34Å; T182-R184 PolarHBondContact O-N 2.91Å; T182-L185 PolarHBondContact O-N 3.17Å; T182-L185 VanDerWaalsContact O-N 3.11Å; T182-L186 WeakPolarHBondContact O-CB 3.46Å; T182-L186 PolarHBondContact O-N 3.4Å |
| 183 | W | 89.4 | Confident | 87.6 | Confident | 153 Ų | 153 | 66.6 Ų | 66.6 | 58% | 0.58 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -58.7 | -40.9 | 178 | -64.2 | 102.8 | 0 | 0 | 0 | 113.3 | L174 G187 | L174-W183 HydrophobicContact CD1-CZ2 3.81Å; W183-G187 PolarHBondContact O-N 3.11Å |
| 184 | R | 89.1 | Confident | 88.2 | Confident | 175 Ų | 175 | 68 Ų | 68 | 66% | 0.66 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -69.1 | -36.9 | 175.7 | -171.8 | -166.4 | -41.7 | -78.2 | -12.1 | 112.3 | Q179 G180 T182 S188 | Q179-R184 PolarHBondContact O-NH2 3.13Å; G180-R184 WeakPolarHBondContact O-CB 3.41Å; G180-R184 PolarHBondContact O-N 3.36Å; T182-R184 VanDerWaalsContact C-N 3.34Å; T182-R184 PolarHBondContact O-N 2.91Å; R184-S188 WeakPolarHBondContact O-CB 3.26Å; R184-S188 PolarHBondContact O-N 3.08Å; R184-S188 VanDerWaalsContact O-N 3.1Å |
| 185 | L | 88.7 | Confident | 89 | Confident | 76 Ų | 76 | 70.8 Ų | 70.8 | 40% | 0.398 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -66.7 | -53.1 | 177.2 | -175.2 | 70.5 | 0 | 0 | 0 | 110.3 | G181 T182 S188 V189 F286 K289 | G181-L185 WeakPolarHBondContact O-CB 3.31Å; G181-L185 PolarHBondContact O-N 3.22Å; T182-L185 PolarHBondContact O-N 3.17Å; T182-L185 VanDerWaalsContact O-N 3.11Å; L185-S188 PolarHBondContact O-N 3.17Å; L185-V189 WeakPolarHBondContact O-CG2 3.41Å; L185-V189 PolarHBondContact O-N 3.2Å; L185-F286 HydrophobicContact CD2-CD1 4.06Å; L185-F286 HydrophobicContact CD2-CE1 3.94Å; L185-F286 HydrophobicContact CG-CD1 4.2Å; L185-F286 HydrophobicContact CG-CE1 3.9Å; L185-K289 HydrophobicContact CD1-CD 3.78Å; L185-K289 HydrophobicContact CD1-CG 4.4Å; L185-K289 PolarHBondContact O-NZ 3.09Å |
| 186 | L | 91.3 | Very high | 89.9 | Confident | 58 Ų | 58 | 75 Ų | 75 | 30% | 0.304 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -56.1 | -58.2 | 176.7 | 173.7 | 64.7 | 0 | 0 | 0 | 110.9 | T182 S188 V189 V190 F286 | T182-L186 WeakPolarHBondContact O-CB 3.46Å; T182-L186 PolarHBondContact O-N 3.4Å; L186-S188 PolarHBondContact O-N 3.2Å; L186-S188 VanDerWaalsContact O-N 3.15Å; L186-V189 PolarHBondContact O-N 2.89Å; L186-V190 HydrophobicContact CD1-CG2 3.98Å; L186-V190 HydrophobicContact CG-CG2 4.33Å; L186-V190 WeakPolarHBondContact O-CG2 3.3Å; L186-V190 PolarHBondContact O-N 3.35Å; L186-F286 HydrophobicContact CB-CZ 4.26Å; L186-F286 HydrophobicContact CD1-CE2 4.31Å; L186-F286 HydrophobicContact CD1-CZ 3.78Å |
| 187 | G | 93.8 | Very high | 90.6 | Very high | 38 Ų | 38 | 73.5 Ų | 73.5 | 39% | 0.392 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -58.3 | -31.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113 | W183 F191 | W183-G187 PolarHBondContact O-N 3.11Å; G187-F191 WeakPolarHBondContact O-CB 3.41Å; G187-F191 PolarHBondContact O-N 3.24Å |
| 188 | S | 92.6 | Very high | 91.4 | Very high | 50 Ų | 50 | 76.6 Ų | 76.6 | 35% | 0.35 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -78.1 | -27.3 | 173.9 | 172.9 | 0 | 0 | 0 | 0 | 113.8 | R184 L185 L186 I192 K289 | R184-S188 WeakPolarHBondContact O-CB 3.26Å; R184-S188 PolarHBondContact O-N 3.08Å; R184-S188 VanDerWaalsContact O-N 3.1Å; L185-S188 PolarHBondContact O-N 3.17Å; L186-S188 PolarHBondContact O-N 3.2Å; L186-S188 VanDerWaalsContact O-N 3.15Å; S188-I192 VanDerWaalsContact O-CD1 3.24Å; S188-I192 WeakPolarHBondContact O-CD1 3.3Å; S188-I192 WeakPolarHBondContact O-CG1 3.47Å; S188-I192 PolarHBondContact O-N 2.86Å; S188-K289 PolarHBondContact OG-NZ 2.88Å |
| 189 | V | 94.5 | Very high | 92.4 | Very high | 1 Ų | 1 | 78.3 Ų | 78.3 | 1% | 0.006 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -72.8 | -49.4 | 169.7 | 174.9 | 0 | 0 | 0 | 0 | 109.6 | L185 L186 F191 I192 H193 L282 F286 K289 | L185-V189 WeakPolarHBondContact O-CG2 3.41Å; L185-V189 PolarHBondContact O-N 3.2Å; L186-V189 PolarHBondContact O-N 2.89Å; V189-F191 VanDerWaalsContact C-N 3.28Å; V189-F191 PolarHBondContact O-N 3.14Å; V189-I192 PolarHBondContact O-N 3.15Å; V189-I192 VanDerWaalsContact O-N 3.08Å; V189-H193 PolarHBondContact O-CD2 2.92Å; V189-H193 PolarHBondContact O-N 2.85Å; V189-L282 HydrophobicContact CG1-CD2 3.95Å; V189-F286 HydrophobicContact CB-CE1 4.46Å; V189-F286 HydrophobicContact CG2-CD1 3.86Å; V189-F286 HydrophobicContact CG2-CE1 3.93Å; V189-F286 HydrophobicContact CG2-CG 4.42Å; V189-K289 HydrophobicContact CG2-CD 3.66Å |
| 190 | V | 96 | Very high | 93.2 | Very high | 52 Ų | 52 | 74.3 Ų | 74.3 | 32% | 0.315 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -53.8 | -44.3 | 174.4 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | L186 H193 R194 L282 | L186-V190 HydrophobicContact CD1-CG2 3.98Å; L186-V190 HydrophobicContact CG-CG2 4.33Å; L186-V190 WeakPolarHBondContact O-CG2 3.3Å; L186-V190 PolarHBondContact O-N 3.35Å; V190-H193 CarbonylContact O-C 2.93Å; V190-H193 PolarHBondContact O-N 3.2Å; V190-R194 VanDerWaalsContact O-CA 3.28Å; V190-R194 WeakPolarHBondContact O-CA 3.49Å; V190-R194 WeakPolarHBondContact O-CB 3.44Å; V190-R194 PolarHBondContact O-N 3.27Å; V190-L282 HydrophobicContact CG2-CD2 3.76Å |
| 191 | F | 96.3 | Very high | 93.8 | Very high | 132 Ų | 132 | 77.8 Ų | 77.8 | 58% | 0.579 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -66.2 | -37.7 | 178.3 | -175.1 | -97.5 | 0 | 0 | 0 | 113.1 | G187 V189 R194 | G187-F191 WeakPolarHBondContact O-CB 3.41Å; G187-F191 PolarHBondContact O-N 3.24Å; V189-F191 VanDerWaalsContact C-N 3.28Å; V189-F191 PolarHBondContact O-N 3.14Å; F191-R194 VanDerWaalsContact O-CD 3.26Å; F191-R194 WeakPolarHBondContact O-CD 3.32Å; F191-R194 VanDerWaalsContact O-CG 3.27Å; F191-R194 WeakPolarHBondContact O-CG 3.26Å; F191-R194 PolarHBondContact O-NH1 3.11Å |
| 192 | I | 94.7 | Very high | 94.4 | Very high | 101 Ų | 101 | 83.4 Ų | 83.4 | 52% | 0.518 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -64 | -51.6 | 176 | -71.6 | 164 | 0 | 0 | 0 | 109.6 | S188 V189 R194 | S188-I192 VanDerWaalsContact O-CD1 3.24Å; S188-I192 WeakPolarHBondContact O-CD1 3.3Å; S188-I192 WeakPolarHBondContact O-CG1 3.47Å; S188-I192 PolarHBondContact O-N 2.86Å; V189-I192 PolarHBondContact O-N 3.15Å; V189-I192 VanDerWaalsContact O-N 3.08Å; I192-R194 VanDerWaalsContact C-N 3.27Å; I192-R194 PolarHBondContact O-N 3.24Å |
| 193 | H | 96.5 | Very high | 94.9 | Very high | 30 Ų | 30 | 82 Ų | 82 | 14% | 0.139 | 39% | 0.393 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.8 | 20.3 | -176 | -63.3 | -82.4 | 0 | 0 | 0 | 113.9 | V189 V190 Q195 E196 L197 I281 | V189-H193 PolarHBondContact O-CD2 2.92Å; V189-H193 PolarHBondContact O-N 2.85Å; V190-H193 CarbonylContact O-C 2.93Å; V190-H193 PolarHBondContact O-N 3.2Å; H193-Q195 VanDerWaalsContact C-N 3.29Å; H193-Q195 PolarHBondContact O-N 3.37Å; H193-E196 IonicContact CE1-OE2 3.49Å; H193-E196 IonicContact CG-OE2 3.6Å; H193-E196 IonicContact ND1-OE1 2.73Å; H193-E196 IonicContact ND1-OE2 3.33Å; H193-E196 PolarHBondContact ND1-OE2 3.21Å; H193-E196 PolarHBondContact O-N 3.3Å; H193-L197 WeakPolarHBondContact O-CB 3.42Å; H193-L197 PolarHBondContact O-N 3.1Å; H193-I281 HydrophobicContact CB-CG2 3.6Å |
| 194 | R | 96.8 | Very high | 95.2 | Very high | 122 Ų | 122 | 74.7 Ų | 74.7 | 46% | 0.46 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -59.1 | -37.2 | -172.3 | 65.7 | -170.7 | 179.2 | -71.9 | -4.8 | 113.3 | V190 F191 I192 I198 | V190-R194 VanDerWaalsContact O-CA 3.28Å; V190-R194 WeakPolarHBondContact O-CA 3.49Å; V190-R194 WeakPolarHBondContact O-CB 3.44Å; V190-R194 PolarHBondContact O-N 3.27Å; F191-R194 VanDerWaalsContact O-CD 3.26Å; F191-R194 WeakPolarHBondContact O-CD 3.32Å; F191-R194 VanDerWaalsContact O-CG 3.27Å; F191-R194 WeakPolarHBondContact O-CG 3.26Å; F191-R194 PolarHBondContact O-NH1 3.11Å; I192-R194 VanDerWaalsContact C-N 3.27Å; I192-R194 PolarHBondContact O-N 3.24Å; R194-I198 VanDerWaalsContact O-CB 3.31Å; R194-I198 WeakPolarHBondContact O-CB 3.31Å; R194-I198 WeakPolarHBondContact O-CD1 3.39Å; R194-I198 WeakPolarHBondContact O-CG1 3.35Å; R194-I198 PolarHBondContact O-N 3.22Å |
| 195 | Q | 97.1 | Very high | 95.5 | Very high | 129 Ų | 129 | 72.3 Ų | 72.3 | 60% | 0.603 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -68.3 | -50.3 | -178.8 | -173.4 | 59.5 | 46.5 | 0 | 0 | 111.1 | H193 L197 I198 T199 | H193-Q195 VanDerWaalsContact C-N 3.29Å; H193-Q195 PolarHBondContact O-N 3.37Å; Q195-L197 VanDerWaalsContact C-N 3.32Å; Q195-L197 PolarHBondContact O-N 2.85Å; Q195-I198 PolarHBondContact O-N 2.74Å; Q195-T199 PolarHBondContact NE2-OG1 3.24Å; Q195-T199 WeakPolarHBondContact O-CB 3.49Å; Q195-T199 PolarHBondContact O-N 3Å; Q195-T199 PolarHBondContact O-OG1 3.45Å; Q195-T199 VanDerWaalsContact O-OG1 3.14Å |
| 196 | E | 96.6 | Very high | 95.9 | Very high | 101 Ų | 101 | 72.1 Ų | 72.1 | 47% | 0.472 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -58 | -46 | 177.6 | -61.4 | 160.4 | -173.5 | 0 | 0 | 110.8 | H193 T199 T200 I281 | H193-E196 IonicContact CE1-OE2 3.49Å; H193-E196 IonicContact CG-OE2 3.6Å; H193-E196 IonicContact ND1-OE1 2.73Å; H193-E196 IonicContact ND1-OE2 3.33Å; H193-E196 PolarHBondContact ND1-OE2 3.21Å; H193-E196 PolarHBondContact O-N 3.3Å; E196-T199 PolarHBondContact O-N 3.43Å; E196-T200 WeakPolarHBondContact O-CG2 3.35Å; E196-T200 PolarHBondContact O-N 3.33Å; E196-T200 PolarHBondContact O-OG1 3.46Å; E196-I281 HydrophobicContact CB-CD1 4.05Å; E196-I281 HydrophobicContact CB-CG2 4.43Å; E196-I281 WeakPolarHBondContact OE2-CG2 3.22Å |
| 197 | L | 96.8 | Very high | 96.1 | Very high | 28 Ų | 28 | 70.2 Ų | 70.2 | 15% | 0.147 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -67.3 | -41.5 | -179.8 | -167.6 | 145.3 | 0 | 0 | 0 | 112.4 | H193 Q195 T200 L201 P278 L282 | H193-L197 WeakPolarHBondContact O-CB 3.42Å; H193-L197 PolarHBondContact O-N 3.1Å; Q195-L197 VanDerWaalsContact C-N 3.32Å; Q195-L197 PolarHBondContact O-N 2.85Å; L197-T200 PolarHBondContact O-OG1 2.95Å; L197-T200 VanDerWaalsContact O-OG1 3.05Å; L197-L201 HydrophobicContact CD2-CD1 3.63Å; L197-L201 HydrophobicContact CD2-CG 4.38Å; L197-L201 HydrophobicContact CG-CD1 4.48Å; L197-L201 WeakPolarHBondContact O-CB 3.44Å; L197-L201 WeakPolarHBondContact O-CG 3.48Å; L197-L201 PolarHBondContact O-N 3.49Å; L197-L201 VanDerWaalsContact O-N 3.07Å; L197-P278 HydrophobicContact CD1-CB 4.5Å; L197-L282 HydrophobicContact CD1-CD1 4.33Å; L197-L282 HydrophobicContact CD1-CD2 4.2Å; L197-L282 HydrophobicContact CD1-CG 4.27Å |
| 198 | I | 97.5 | Very high | 96.3 | Very high | 102 Ų | 102 | 68.7 Ų | 68.7 | 52% | 0.523 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64 | -45.7 | 173.6 | -71.4 | 165.5 | 0 | 0 | 0 | 110.9 | R194 Q195 T200 L201 Y202 | R194-I198 VanDerWaalsContact O-CB 3.31Å; R194-I198 WeakPolarHBondContact O-CB 3.31Å; R194-I198 WeakPolarHBondContact O-CD1 3.39Å; R194-I198 WeakPolarHBondContact O-CG1 3.35Å; R194-I198 PolarHBondContact O-N 3.22Å; Q195-I198 PolarHBondContact O-N 2.74Å; I198-T200 PolarHBondContact O-N 3.07Å; I198-L201 PolarHBondContact O-N 3.4Å; I198-Y202 WeakPolarHBondContact O-CB 3.3Å; I198-Y202 PolarHBondContact O-N 2.9Å |
| 199 | T | 97.4 | Very high | 96.5 | Very high | 60 Ų | 60 | 68.9 Ų | 68.9 | 37% | 0.368 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.1 | -45.9 | 179.4 | -67.3 | 0 | 0 | 0 | 0 | 111.8 | Q195 E196 Y202 I203 | Q195-T199 PolarHBondContact NE2-OG1 3.24Å; Q195-T199 WeakPolarHBondContact O-CB 3.49Å; Q195-T199 PolarHBondContact O-N 3Å; Q195-T199 PolarHBondContact O-OG1 3.45Å; Q195-T199 VanDerWaalsContact O-OG1 3.14Å; E196-T199 PolarHBondContact O-N 3.43Å; T199-Y202 PolarHBondContact O-N 3.35Å; T199-I203 HydrophobicContact CG2-CD1 3.8Å; T199-I203 WeakPolarHBondContact O-CG1 3.29Å; T199-I203 PolarHBondContact O-N 2.94Å |
| 200 | T | 96.6 | Very high | 96.6 | Very high | 14 Ų | 14 | 73.6 Ų | 73.6 | 9% | 0.086 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -65.2 | -43.8 | 178.3 | 53.7 | 0 | 0 | 0 | 0 | 113.1 | E196 L197 I198 G204 L277 I281 | E196-T200 WeakPolarHBondContact O-CG2 3.35Å; E196-T200 PolarHBondContact O-N 3.33Å; E196-T200 PolarHBondContact O-OG1 3.46Å; L197-T200 PolarHBondContact O-OG1 2.95Å; L197-T200 VanDerWaalsContact O-OG1 3.05Å; I198-T200 PolarHBondContact O-N 3.07Å; T200-G204 PolarHBondContact O-N 3.02Å; T200-L277 HydrophobicContact CG2-CB 3.8Å; T200-L277 HydrophobicContact CG2-CD1 3.68Å; T200-L277 HydrophobicContact CG2-CG 4.39Å; T200-I281 HydrophobicContact CG2-CD1 4.01Å |
| 201 | L | 96.1 | Very high | 96.6 | Very high | 81 Ų | 81 | 71.4 Ų | 71.4 | 42% | 0.424 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -66.2 | -37.4 | 175.4 | -70.7 | -179.9 | 0 | 0 | 0 | 112.5 | L197 I198 F205 P278 | L197-L201 HydrophobicContact CD2-CD1 3.63Å; L197-L201 HydrophobicContact CD2-CG 4.38Å; L197-L201 HydrophobicContact CG-CD1 4.48Å; L197-L201 WeakPolarHBondContact O-CB 3.44Å; L197-L201 WeakPolarHBondContact O-CG 3.48Å; L197-L201 PolarHBondContact O-N 3.49Å; L197-L201 VanDerWaalsContact O-N 3.07Å; I198-L201 PolarHBondContact O-N 3.4Å; L201-F205 WeakPolarHBondContact O-CB 3.46Å; L201-F205 PolarHBondContact O-N 3.41Å; L201-P278 HydrophobicContact CD2-CG 4.07Å; L201-P278 HydrophobicContact CG-CG 4.44Å |
| 202 | Y | 97.4 | Very high | 96.7 | Very high | 152 Ų | 152 | 65.1 Ų | 65.1 | 60% | 0.596 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -63.2 | -50.9 | 176.7 | 174.2 | -101.4 | 0 | 0 | 0 | 111.6 | I198 T199 F205 L206 | I198-Y202 WeakPolarHBondContact O-CB 3.3Å; I198-Y202 PolarHBondContact O-N 2.9Å; T199-Y202 PolarHBondContact O-N 3.35Å; Y202-F205 PolarHBondContact O-N 2.86Å; Y202-L206 HydrophobicContact CE1-CD2 4.44Å; Y202-L206 WeakPolarHBondContact O-CB 3.48Å; Y202-L206 PolarHBondContact O-N 3.12Å |
| 203 | I | 96.8 | Very high | 96.8 | Very high | 66 Ų | 66 | 65.5 Ų | 65.5 | 34% | 0.338 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 179.1 | -62.4 | 167.8 | 0 | 0 | 0 | 110.6 | T199 L206 G207 F274 | T199-I203 HydrophobicContact CG2-CD1 3.8Å; T199-I203 WeakPolarHBondContact O-CG1 3.29Å; T199-I203 PolarHBondContact O-N 2.94Å; I203-L206 PolarHBondContact O-N 3.4Å; I203-G207 PolarHBondContact O-N 3.28Å; I203-F274 HydrophobicContact CB-CD1 4.14Å; I203-F274 HydrophobicContact CB-CE1 4.16Å; I203-F274 HydrophobicContact CB-CG 4.49Å; I203-F274 HydrophobicContact CD1-CE1 4.11Å; I203-F274 HydrophobicContact CG2-CD1 3.93Å; I203-F274 HydrophobicContact CG2-CD2 3.9Å; I203-F274 HydrophobicContact CG2-CE1 3.71Å; I203-F274 HydrophobicContact CG2-CE2 3.69Å; I203-F274 HydrophobicContact CG2-CG 4.03Å; I203-F274 HydrophobicContact CG2-CZ 3.6Å |
| 204 | G | 96.3 | Very high | 96.9 | Very high | 1 Ų | 1 | 68.2 Ų | 68.2 | 1% | 0.01 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59.9 | -46.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | T200 G207 L208 F275 | T200-G204 PolarHBondContact O-N 3.02Å; G204-G207 PolarHBondContact O-N 3.36Å; G204-L208 WeakPolarHBondContact O-CB 3.33Å; G204-L208 PolarHBondContact O-N 2.96Å; G204-F275 WeakPolarHBondContact O-CE2 3.49Å |
| 205 | F | 96.8 | Very high | 96.9 | Very high | 125 Ų | 125 | 62.4 Ų | 62.4 | 55% | 0.548 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -67.2 | -39.5 | 178.6 | -167.4 | -99 | 0 | 0 | 0 | 112.3 | L201 Y202 L208 I209 | L201-F205 WeakPolarHBondContact O-CB 3.46Å; L201-F205 PolarHBondContact O-N 3.41Å; Y202-F205 PolarHBondContact O-N 2.86Å; F205-L208 HydrophobicContact CD2-CD2 4.21Å; F205-L208 HydrophobicContact CE2-CD2 4.41Å; F205-L208 WeakPolarHBondContact O-CB 3.39Å; F205-L208 PolarHBondContact O-N 3.46Å; F205-I209 HydrophobicContact CD1-CG1 4.04Å; F205-I209 HydrophobicContact CE1-CD1 4.04Å; F205-I209 HydrophobicContact CE1-CG1 3.72Å; F205-I209 HydrophobicContact CZ-CD1 3.99Å; F205-I209 HydrophobicContact CZ-CG1 4.12Å; F205-I209 WeakPolarHBondContact O-CG1 3.34Å; F205-I209 PolarHBondContact O-N 3.41Å |
| 206 | L | 96.3 | Very high | 97 | Very high | 71 Ų | 71 | 59 Ų | 59 | 37% | 0.372 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.3 | -45.2 | 174.3 | -171.2 | 64 | 0 | 0 | 0 | 111.3 | Y202 I203 I209 F210 | Y202-L206 HydrophobicContact CE1-CD2 4.44Å; Y202-L206 WeakPolarHBondContact O-CB 3.48Å; Y202-L206 PolarHBondContact O-N 3.12Å; I203-L206 PolarHBondContact O-N 3.4Å; L206-I209 PolarHBondContact O-N 2.73Å; L206-F210 HydrophobicContact CD1-CD2 4.05Å; L206-F210 HydrophobicContact CD1-CE2 3.55Å; L206-F210 HydrophobicContact CD1-CZ 4.42Å; L206-F210 HydrophobicContact CD2-CE2 4.4Å; L206-F210 HydrophobicContact CG-CD2 3.96Å; L206-F210 HydrophobicContact CG-CE2 3.74Å; L206-F210 VanDerWaalsContact O-CD2 3.26Å; L206-F210 WeakPolarHBondContact O-CD2 3.4Å; L206-F210 PolarHBondContact O-N 3Å; L206-F210 VanDerWaalsContact O-N 3.1Å |
| 207 | G | 95.6 | Very high | 97 | Very high | 18 Ų | 18 | 58 Ų | 58 | 19% | 0.186 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.4 | -40.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | I203 G204 S211 | I203-G207 PolarHBondContact O-N 3.28Å; G204-G207 PolarHBondContact O-N 3.36Å; G207-S211 WeakPolarHBondContact O-CB 3.21Å; G207-S211 PolarHBondContact O-N 2.99Å |
| 208 | L | 96.9 | Very high | 97 | Very high | 6 Ų | 6 | 57.9 Ų | 57.9 | 3% | 0.031 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60.5 | -47.8 | 174.5 | 169.5 | 64.4 | 0 | 0 | 0 | 111.8 | G204 F205 S212 L238 V242 V245 F275 | G204-L208 WeakPolarHBondContact O-CB 3.33Å; G204-L208 PolarHBondContact O-N 2.96Å; F205-L208 HydrophobicContact CD2-CD2 4.21Å; F205-L208 HydrophobicContact CE2-CD2 4.41Å; F205-L208 WeakPolarHBondContact O-CB 3.39Å; F205-L208 PolarHBondContact O-N 3.46Å; L208-S212 VanDerWaalsContact O-CB 3.3Å; L208-S212 WeakPolarHBondContact O-CB 3.5Å; L208-S212 PolarHBondContact O-N 3.02Å; L208-S212 PolarHBondContact O-OG 3.3Å; L208-L238 HydrophobicContact CD1-CD1 4.38Å; L208-L238 HydrophobicContact CD2-CD1 4.48Å; L208-L238 HydrophobicContact CG-CD1 4.16Å; L208-V242 HydrophobicContact CD1-CG2 4.26Å; L208-V242 HydrophobicContact CD2-CG2 3.88Å; L208-V245 HydrophobicContact CD1-CG1 4.26Å; L208-V245 HydrophobicContact CD1-CG2 4.15Å; L208-F275 HydrophobicContact CB-CE2 4.36Å; L208-F275 HydrophobicContact CD2-CZ 4.24Å |
| 209 | I | 97.4 | Very high | 96.9 | Very high | 54 Ų | 54 | 53.1 Ų | 53.1 | 28% | 0.277 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -63.1 | -47.3 | -179.2 | -69.3 | -66.2 | 0 | 0 | 0 | 111.1 | F205 L206 Y213 Y234 L238 | F205-I209 HydrophobicContact CD1-CG1 4.04Å; F205-I209 HydrophobicContact CE1-CD1 4.04Å; F205-I209 HydrophobicContact CE1-CG1 3.72Å; F205-I209 HydrophobicContact CZ-CD1 3.99Å; F205-I209 HydrophobicContact CZ-CG1 4.12Å; F205-I209 WeakPolarHBondContact O-CG1 3.34Å; F205-I209 PolarHBondContact O-N 3.41Å; L206-I209 PolarHBondContact O-N 2.73Å; I209-Y213 WeakPolarHBondContact O-CB 3.43Å; I209-Y213 PolarHBondContact O-N 2.93Å; I209-Y213 VanDerWaalsContact O-N 3.1Å; I209-Y234 PolarHBondContact O-OH 2.89Å; I209-L238 HydrophobicContact CD1-CD1 3.99Å |
| 210 | F | 96.9 | Very high | 96.7 | Very high | 101 Ų | 101 | 53.9 Ų | 53.9 | 44% | 0.443 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -65.5 | -47 | 177.1 | -78.5 | -58.7 | 0 | 0 | 0 | 112.7 | L206 S212 Y213 F214 F267 | L206-F210 HydrophobicContact CD1-CD2 4.05Å; L206-F210 HydrophobicContact CD1-CE2 3.55Å; L206-F210 HydrophobicContact CD1-CZ 4.42Å; L206-F210 HydrophobicContact CD2-CE2 4.4Å; L206-F210 HydrophobicContact CG-CD2 3.96Å; L206-F210 HydrophobicContact CG-CE2 3.74Å; L206-F210 VanDerWaalsContact O-CD2 3.26Å; L206-F210 WeakPolarHBondContact O-CD2 3.4Å; L206-F210 PolarHBondContact O-N 3Å; L206-F210 VanDerWaalsContact O-N 3.1Å; F210-S212 PolarHBondContact O-N 3.41Å; F210-Y213 PolarHBondContact O-N 3.29Å; F210-F214 HydrophobicContact CB-CD2 4.32Å; F210-F214 HydrophobicContact CB-CE2 4.09Å; F210-F214 HydrophobicContact CD1-CE2 4.12Å; F210-F214 HydrophobicContact CD1-CZ 4.42Å; F210-F214 HydrophobicContact CG-CE2 4.45Å; F210-F214 WeakPolarHBondContact O-CD2 3.29Å; F210-F214 PolarHBondContact O-N 3.33Å; F210-F267 HydrophobicContact CB-CE1 4.2Å; F210-F267 HydrophobicContact CB-CZ 4.38Å |
| 211 | S | 96.5 | Very high | 96.6 | Very high | 5 Ų | 5 | 59.1 Ų | 59.1 | 4% | 0.035 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -56.8 | -49.9 | 178 | -177.7 | 0 | 0 | 0 | 0 | 111.4 | G207 Y213 F214 V215 F267 | G207-S211 WeakPolarHBondContact O-CB 3.21Å; G207-S211 PolarHBondContact O-N 2.99Å; S211-Y213 VanDerWaalsContact C-N 3.27Å; S211-Y213 PolarHBondContact O-N 2.94Å; S211-F214 PolarHBondContact O-N 2.87Å; S211-V215 WeakPolarHBondContact O-CB 3.38Å; S211-V215 WeakPolarHBondContact O-CG2 3.36Å; S211-V215 PolarHBondContact O-N 3.43Å; S211-F267 WeakPolarHBondContact OG-CB 3.35Å |
| 212 | S | 97.6 | Very high | 96.3 | Very high | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61.6 | -35.8 | 179.2 | -51.5 | 0 | 0 | 0 | 0 | 111.9 | L208 F210 Y216 A237 | L208-S212 VanDerWaalsContact O-CB 3.3Å; L208-S212 WeakPolarHBondContact O-CB 3.5Å; L208-S212 PolarHBondContact O-N 3.02Å; L208-S212 PolarHBondContact O-OG 3.3Å; F210-S212 PolarHBondContact O-N 3.41Å; S212-Y216 VanDerWaalsContact O-CB 3.24Å; S212-Y216 WeakPolarHBondContact O-CB 3.22Å; S212-Y216 PolarHBondContact O-N 3.43Å; S212-A237 WeakPolarHBondContact O-CB 3.29Å |
| 213 | Y | 97.9 | Very high | 96.1 | Very high | 110 Ų | 110 | 53 Ų | 53 | 43% | 0.431 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -73.4 | -43.9 | 179.8 | -176.8 | -106.7 | 0 | 0 | 0 | 112.3 | I209 F210 S211 Y216 L217 Y234 | I209-Y213 WeakPolarHBondContact O-CB 3.43Å; I209-Y213 PolarHBondContact O-N 2.93Å; I209-Y213 VanDerWaalsContact O-N 3.1Å; F210-Y213 PolarHBondContact O-N 3.29Å; S211-Y213 VanDerWaalsContact C-N 3.27Å; S211-Y213 PolarHBondContact O-N 2.94Å; Y213-Y216 WeakPolarHBondContact O-CB 3.46Å; Y213-Y216 PolarHBondContact O-N 2.85Å; Y213-L217 HydrophobicContact CD1-CD1 4.11Å; Y213-L217 HydrophobicContact CE1-CD1 3.51Å; Y213-L217 HydrophobicContact CE1-CG 4.24Å; Y213-L217 HydrophobicContact CE2-CG 4.49Å; Y213-L217 WeakPolarHBondContact O-CG 3.48Å; Y213-L217 PolarHBondContact O-N 2.93Å; Y213-Y234 HydrophobicContact CD2-CD2 4.22Å; Y213-Y234 HydrophobicContact CD2-CE2 4.1Å; Y213-Y234 HydrophobicContact CG-CE2 4.48Å |
| 214 | F | 97.6 | Very high | 95.7 | Very high | 86 Ų | 86 | 51.6 Ų | 51.6 | 38% | 0.377 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -68.5 | -37.8 | 177.3 | -67.9 | -51.7 | 0 | 0 | 0 | 112.5 | F210 S211 L217 A218 I263 F267 | F210-F214 HydrophobicContact CB-CD2 4.32Å; F210-F214 HydrophobicContact CB-CE2 4.09Å; F210-F214 HydrophobicContact CD1-CE2 4.12Å; F210-F214 HydrophobicContact CD1-CZ 4.42Å; F210-F214 HydrophobicContact CG-CE2 4.45Å; F210-F214 WeakPolarHBondContact O-CD2 3.29Å; F210-F214 PolarHBondContact O-N 3.33Å; S211-F214 PolarHBondContact O-N 2.87Å; F214-L217 PolarHBondContact O-N 3.3Å; F214-A218 WeakPolarHBondContact O-CB 3.32Å; F214-A218 PolarHBondContact O-N 2.92Å; F214-I263 HydrophobicContact CB-CD1 4.31Å; F214-I263 HydrophobicContact CB-CG2 3.81Å; F214-F267 HydrophobicContact CD2-CE2 4.03Å; F214-F267 AromaticContact CD2-CZ 3.97Å; F214-F267 HydrophobicContact CD2-CZ 3.97Å; F214-F267 HydrophobicContact CE2-CZ 4.21Å |
| 215 | V | 97.6 | Very high | 95.1 | Very high | 0 Ų | 0 | 60.6 Ų | 60.6 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -68.1 | -40 | 173.6 | 174.5 | 0 | 0 | 0 | 0 | 111.2 | S211 L217 A218 E219 F231 W240 P255 I263 A264 | S211-V215 WeakPolarHBondContact O-CB 3.38Å; S211-V215 WeakPolarHBondContact O-CG2 3.36Å; S211-V215 PolarHBondContact O-N 3.43Å; V215-L217 PolarHBondContact O-N 3.44Å; V215-A218 PolarHBondContact O-N 2.81Å; V215-E219 HydrophobicContact CG1-CG 3.98Å; V215-E219 VanDerWaalsContact O-CB 3.32Å; V215-E219 WeakPolarHBondContact O-CB 3.37Å; V215-E219 WeakPolarHBondContact O-CG 3.3Å; V215-E219 PolarHBondContact O-N 2.82Å; V215-F231 HydrophobicContact CG1-CE1 4.15Å; V215-F231 HydrophobicContact CG1-CZ 4.29Å; V215-W240 HydrophobicContact CB-CE3 4.3Å; V215-W240 HydrophobicContact CB-CH2 4.34Å; V215-W240 HydrophobicContact CB-CZ3 3.82Å; V215-W240 HydrophobicContact CG1-CE3 4.04Å; V215-W240 HydrophobicContact CG1-CH2 4.26Å; V215-W240 HydrophobicContact CG1-CZ3 3.9Å; V215-W240 HydrophobicContact CG2-CH2 3.76Å; V215-W240 HydrophobicContact CG2-CZ3 3.66Å; V215-P255 HydrophobicContact CG1-CB 4.3Å; V215-I263 HydrophobicContact CG2-CB 4.21Å; V215-I263 HydrophobicContact CG2-CG2 3.73Å; V215-A264 HydrophobicContact CG2-CB 4.28Å |
| 216 | Y | 97.9 | Very high | 94.7 | Very high | 58 Ų | 58 | 59.3 Ų | 59.3 | 23% | 0.227 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -55.4 | -49.6 | 170.7 | 171.9 | -110.4 | 0 | 0 | 0 | 112 | S212 Y213 A218 E219 K220 F231 S233 Y234 A237 | S212-Y216 VanDerWaalsContact O-CB 3.24Å; S212-Y216 WeakPolarHBondContact O-CB 3.22Å; S212-Y216 PolarHBondContact O-N 3.43Å; Y213-Y216 WeakPolarHBondContact O-CB 3.46Å; Y213-Y216 PolarHBondContact O-N 2.85Å; Y216-A218 VanDerWaalsContact C-N 3.28Å; Y216-A218 PolarHBondContact O-N 3.31Å; Y216-E219 PolarHBondContact O-N 2.93Å; Y216-K220 HydrophobicContact CD2-CB 4.36Å; Y216-K220 HydrophobicContact CE2-CB 4.03Å; Y216-K220 VanDerWaalsContact O-CB 3.27Å; Y216-K220 WeakPolarHBondContact O-CB 3.37Å; Y216-K220 PolarHBondContact O-N 2.98Å; Y216-F231 WeakPolarHBondContact CE2-O 3.49Å; Y216-S233 VanDerWaalsContact CE2-C 3.49Å; Y216-Y234 HydrophobicContact CG-CD2 4.45Å; Y216-A237 HydrophobicContact CD2-CB 4.5Å; Y216-A237 HydrophobicContact CG-CB 4.49Å |
| 217 | L | 97.3 | Very high | 94.2 | Very high | 80 Ų | 80 | 58.7 Ų | 58.7 | 42% | 0.419 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -63.6 | -31.7 | 178.8 | -70.2 | -178.2 | 0 | 0 | 0 | 113.3 | Y213 F214 V215 | Y213-L217 HydrophobicContact CD1-CD1 4.11Å; Y213-L217 HydrophobicContact CE1-CD1 3.51Å; Y213-L217 HydrophobicContact CE1-CG 4.24Å; Y213-L217 HydrophobicContact CE2-CG 4.49Å; Y213-L217 WeakPolarHBondContact O-CG 3.48Å; Y213-L217 PolarHBondContact O-N 2.93Å; F214-L217 PolarHBondContact O-N 3.3Å; V215-L217 PolarHBondContact O-N 3.44Å |
| 218 | A | 96.6 | Very high | 93.9 | Very high | 26 Ų | 26 | 66.6 Ų | 66.6 | 22% | 0.215 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -78.1 | -28.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | F214 V215 Y216 V259 I263 | F214-A218 WeakPolarHBondContact O-CB 3.32Å; F214-A218 PolarHBondContact O-N 2.92Å; V215-A218 PolarHBondContact O-N 2.81Å; Y216-A218 VanDerWaalsContact C-N 3.28Å; Y216-A218 PolarHBondContact O-N 3.31Å; A218-V259 HydrophobicContact CB-CB 4.35Å; A218-V259 HydrophobicContact CB-CG1 3.98Å; A218-I263 HydrophobicContact CB-CD1 4.16Å |
| 219 | E | 96 | Very high | 93.6 | Very high | 1 Ų | 1 | 70.8 Ų | 70.8 | 1% | 0.005 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -113.4 | -7 | -170.1 | -62.5 | -66.6 | 146.6 | 0 | 0 | 114.8 | V215 Y216 D221 A222 F231 P255 Q256 T257 G260 | V215-E219 HydrophobicContact CG1-CG 3.98Å; V215-E219 VanDerWaalsContact O-CB 3.32Å; V215-E219 WeakPolarHBondContact O-CB 3.37Å; V215-E219 WeakPolarHBondContact O-CG 3.3Å; V215-E219 PolarHBondContact O-N 2.82Å; Y216-E219 PolarHBondContact O-N 2.93Å; E219-D221 PolarHBondContact O-N 3.49Å; E219-D221 VanDerWaalsContact O-N 3.08Å; E219-A222 WeakPolarHBondContact O-CB 3.22Å; E219-A222 PolarHBondContact O-N 2.85Å; E219-A222 WeakPolarHBondContact OE2-CB 3.49Å; E219-F231 HydrophobicContact CB-CB 3.92Å; E219-F231 HydrophobicContact CB-CD2 3.4Å; E219-F231 HydrophobicContact CB-CE2 4.06Å; E219-F231 HydrophobicContact CB-CG 3.75Å; E219-F231 HydrophobicContact CG-CD2 3.96Å; E219-F231 HydrophobicContact CG-CE2 4.1Å; E219-P255 HydrophobicContact CG-CB 3.79Å; E219-P255 WeakPolarHBondContact OE1-CB 3.37Å; E219-Q256 VanDerWaalsContact CD-N 3.29Å; E219-Q256 PolarHBondContact OE1-N 3.38Å; E219-Q256 PolarHBondContact OE2-N 3.45Å; E219-T257 WeakPolarHBondContact OE1-CA 3.13Å; E219-T257 VanDerWaalsContact OE1-CB 3.26Å; E219-T257 WeakPolarHBondContact OE1-CB 3.47Å; E219-T257 PolarHBondContact OE1-N 2.92Å; E219-T257 PolarHBondContact OE1-OG1 3.48Å; E219-T257 PolarHBondContact OE2-N 3.05Å; E219-G260 WeakPolarHBondContact OE1-CA 3.45Å |
| 220 | K | 93.4 | Very high | 93.3 | Very high | 77 Ų | 77 | 69.8 Ų | 69.8 | 34% | 0.335 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | -28.5 | -175.5 | 60.9 | 171.1 | -165.1 | 73.8 | 0 | 115.1 | Y216 | Y216-K220 HydrophobicContact CD2-CB 4.36Å; Y216-K220 HydrophobicContact CE2-CB 4.03Å; Y216-K220 VanDerWaalsContact O-CB 3.27Å; Y216-K220 WeakPolarHBondContact O-CB 3.37Å; Y216-K220 PolarHBondContact O-N 2.98Å |
| 221 | D | 92.9 | Very high | 93.2 | Very high | 123 Ų | 123 | 65.1 Ų | 65.1 | 66% | 0.658 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.6 | 1.5 | 179.6 | -51.6 | -36.5 | 0 | 0 | 0 | 112.2 | E219 | E219-D221 PolarHBondContact O-N 3.49Å; E219-D221 VanDerWaalsContact O-N 3.08Å |
| 222 | A | 91.6 | Very high | 93 | Very high | 17 Ų | 17 | 67.3 Ų | 67.3 | 14% | 0.14 | 36% | 0.361 | C | S | . | . | trans | -81.4 | 132.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | E219 T257 | E219-A222 WeakPolarHBondContact O-CB 3.22Å; E219-A222 PolarHBondContact O-N 2.85Å; E219-A222 WeakPolarHBondContact OE2-CB 3.49Å; A222-T257 HydrophobicContact CB-CG2 3.84Å | ||
| 223 | V | 91.4 | Very high | 93 | Very high | 89 Ų | 89 | 69.3 Ų | 69.3 | 54% | 0.539 | 38% | 0.375 | S | S | . | . | B | Isolated β-bridge | trans | -107.6 | 127.7 | 178.1 | -173.3 | 0 | 0 | 0 | 0 | 108.7 | G227 I229 | V223-G227 VanDerWaalsContact CG1-C 3.46Å; V223-I229 HydrophobicContact CG2-CG1 4.35Å |
| 224 | N | 88.5 | Confident | 92.9 | Very high | 35 Ų | 35 | 67.7 Ų | 67.7 | 19% | 0.187 | 37% | 0.369 | C | S | . | . | trans | -76.8 | 167.5 | 178.2 | -163.3 | 5.3 | 0 | 0 | 0 | 111.3 | S226 G227 R228 E230 Q256 | N224-S226 PolarHBondContact O-N 2.85Å; N224-G227 PolarHBondContact O-N 3.26Å; N224-R228 WeakPolarHBondContact CB-O 3.45Å; N224-R228 PolarHBondContact N-O 2.8Å; N224-E230 HydrophobicContact CB-CG 3.92Å; N224-E230 PolarHBondContact ND2-OE1 3.28Å; N224-Q256 PolarHBondContact OD1-NE2 3.27Å | ||
| 225 | E | 85.4 | Confident | 92.9 | Very high | 190 Ų | 190 | 66.8 Ų | 66.8 | 89% | 0.888 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.1 | -28.1 | -178 | -61.9 | 178 | 169.7 | 0 | 0 | 113.5 | G227 | E225-G227 VanDerWaalsContact C-N 3.3Å; E225-G227 PolarHBondContact O-N 2.66Å |
| 226 | S | 86.9 | Confident | 92.9 | Very high | 98 Ų | 98 | 69.1 Ų | 69.1 | 69% | 0.685 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.5 | 9.6 | 175.7 | -63.5 | 0 | 0 | 0 | 0 | 114.9 | N224 R228 | N224-S226 PolarHBondContact O-N 2.85Å; S226-R228 VanDerWaalsContact C-N 3.32Å; S226-R228 PolarHBondContact O-N 2.73Å |
| 227 | G | 86.6 | Confident | 92.9 | Very high | 59 Ų | 59 | 66.3 Ų | 66.3 | 61% | 0.608 | 38% | 0.379 | S | S | * | . | S | Bend | trans | 72.9 | 17.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115 | V223 N224 E225 | V223-G227 VanDerWaalsContact CG1-C 3.46Å; N224-G227 PolarHBondContact O-N 3.26Å; E225-G227 VanDerWaalsContact C-N 3.3Å; E225-G227 PolarHBondContact O-N 2.66Å |
| 228 | R | 89.4 | Confident | 92.9 | Very high | 184 Ų | 184 | 65 Ų | 65 | 69% | 0.694 | 37% | 0.372 | S | S | * | . | trans | -111.8 | 149.1 | -177.7 | -63.1 | -175.8 | -178.7 | -171 | 0.3 | 111.6 | N224 S226 | N224-R228 WeakPolarHBondContact CB-O 3.45Å; N224-R228 PolarHBondContact N-O 2.8Å; S226-R228 VanDerWaalsContact C-N 3.32Å; S226-R228 PolarHBondContact O-N 2.73Å | ||
| 229 | I | 90.9 | Very high | 93 | Very high | 94 Ų | 94 | 69.2 Ų | 69.2 | 48% | 0.482 | 38% | 0.383 | S | S | . | . | B | Isolated β-bridge | trans | -89.1 | 115.5 | 172.8 | -59 | 167.6 | 0 | 0 | 0 | 107.9 | V223 | V223-I229 HydrophobicContact CG2-CG1 4.35Å |
| 230 | E | 91.3 | Very high | 93.1 | Very high | 33 Ų | 33 | 69.9 Ų | 69.9 | 15% | 0.154 | 39% | 0.385 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | -32 | -177.3 | -62.4 | -57.5 | 160.1 | 0 | 0 | 113.1 | N224 K253 | N224-E230 HydrophobicContact CB-CG 3.92Å; N224-E230 PolarHBondContact ND2-OE1 3.28Å; E230-K253 PolarHBondContact O-NZ 3.29Å |
| 231 | F | 94.6 | Very high | 93.2 | Very high | 2 Ų | 2 | 66.2 Ų | 66.2 | 1% | 0.009 | 37% | 0.369 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -109.9 | 44.6 | -174.3 | -64 | -85.1 | 0 | 0 | 0 | 111.7 | V215 Y216 E219 S233 A237 W240 K253 | V215-F231 HydrophobicContact CG1-CE1 4.15Å; V215-F231 HydrophobicContact CG1-CZ 4.29Å; Y216-F231 WeakPolarHBondContact CE2-O 3.49Å; E219-F231 HydrophobicContact CB-CB 3.92Å; E219-F231 HydrophobicContact CB-CD2 3.4Å; E219-F231 HydrophobicContact CB-CE2 4.06Å; E219-F231 HydrophobicContact CB-CG 3.75Å; E219-F231 HydrophobicContact CG-CD2 3.96Å; E219-F231 HydrophobicContact CG-CE2 4.1Å; F231-S233 PolarHBondContact O-N 2.64Å; F231-A237 HydrophobicContact CD1-CB 3.8Å; F231-A237 HydrophobicContact CE1-CB 4.35Å; F231-W240 HydrophobicContact CE1-CB 3.74Å; F231-W240 HydrophobicContact CE1-CD2 4.1Å; F231-W240 HydrophobicContact CE1-CE3 4.44Å; F231-W240 AromaticContact CE1-CG 3.75Å; F231-W240 HydrophobicContact CE1-CG 3.75Å; F231-W240 HydrophobicContact CZ-CB 4.3Å; F231-W240 HydrophobicContact CZ-CD2 4.31Å; F231-W240 AromaticContact CZ-CG 3.94Å; F231-W240 HydrophobicContact CZ-CG 3.94Å; F231-K253 HydrophobicContact CZ-CB 4.27Å |
| 232 | G | 92.5 | Very high | 93.5 | Very high | 52 Ų | 52 | 63.2 Ų | 63.2 | 54% | 0.536 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -64.9 | -18.6 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 233 | S | 96.3 | Very high | 93.8 | Very high | 42 Ų | 42 | 62.7 Ų | 62.7 | 29% | 0.294 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -139.4 | 160.9 | 173 | 78 | 0 | 0 | 0 | 0 | 112.3 | Y216 F231 A235 D236 A237 | Y216-S233 VanDerWaalsContact CE2-C 3.49Å; F231-S233 PolarHBondContact O-N 2.64Å; S233-A235 PolarHBondContact O-N 3.46Å; S233-A235 PolarHBondContact OG-N 3.48Å; S233-D236 WeakPolarHBondContact CB-OD2 3.45Å; S233-D236 PolarHBondContact N-OD2 3.43Å; S233-D236 VanDerWaalsContact N-OD2 3.08Å; S233-D236 WeakPolarHBondContact O-CB 3.49Å; S233-D236 PolarHBondContact O-N 3.04Å; S233-D236 VanDerWaalsContact O-N 3.14Å; S233-D236 PolarHBondContact OG-N 3.4Å; S233-D236 PolarHBondContact OG-OD2 2.91Å; S233-A237 PolarHBondContact O-N 3.46Å |
| 234 | Y | 97.1 | Very high | 94 | Very high | 76 Ų | 76 | 60.1 Ų | 60.1 | 30% | 0.298 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -60.8 | -27.9 | 171.3 | 179.4 | -115.6 | 0 | 0 | 0 | 112.5 | I209 Y213 Y216 A237 L238 | I209-Y234 PolarHBondContact O-OH 2.89Å; Y213-Y234 HydrophobicContact CD2-CD2 4.22Å; Y213-Y234 HydrophobicContact CD2-CE2 4.1Å; Y213-Y234 HydrophobicContact CG-CE2 4.48Å; Y216-Y234 HydrophobicContact CG-CD2 4.45Å; Y234-A237 PolarHBondContact O-N 2.87Å; Y234-L238 WeakPolarHBondContact O-CB 3.36Å; Y234-L238 PolarHBondContact O-N 3.43Å |
| 235 | A | 97.8 | Very high | 94.4 | Very high | 67 Ų | 67 | 58.8 Ų | 58.8 | 55% | 0.554 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -68 | -35.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | S233 L238 W239 | S233-A235 PolarHBondContact O-N 3.46Å; S233-A235 PolarHBondContact OG-N 3.48Å; A235-L238 PolarHBondContact O-N 2.8Å; A235-W239 PolarHBondContact O-N 3.37Å |
| 236 | D | 96.7 | Very high | 94.9 | Very high | 48 Ų | 48 | 52.4 Ų | 52.4 | 26% | 0.257 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.3 | -42.2 | 173.3 | -67.1 | -75.7 | 0 | 0 | 0 | 111.7 | S233 W239 W240 K253 | S233-D236 WeakPolarHBondContact CB-OD2 3.45Å; S233-D236 PolarHBondContact N-OD2 3.43Å; S233-D236 VanDerWaalsContact N-OD2 3.08Å; S233-D236 WeakPolarHBondContact O-CB 3.49Å; S233-D236 PolarHBondContact O-N 3.04Å; S233-D236 VanDerWaalsContact O-N 3.14Å; S233-D236 PolarHBondContact OG-N 3.4Å; S233-D236 PolarHBondContact OG-OD2 2.91Å; D236-W239 PolarHBondContact O-N 3.22Å; D236-W240 PolarHBondContact O-N 2.98Å; D236-K253 HydrophobicContact CB-CD 4.13Å; D236-K253 WeakPolarHBondContact OD1-CE 3.27Å; D236-K253 IonicContact OD1-NZ 2.73Å; D236-K253 PolarHBondContact OD1-NZ 3.43Å |
| 237 | A | 97.3 | Very high | 95.3 | Very high | 0 Ų | 0 | 52.4 Ų | 52.4 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -69.1 | -35.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S212 Y216 F231 S233 Y234 W240 G241 | S212-A237 WeakPolarHBondContact O-CB 3.29Å; Y216-A237 HydrophobicContact CD2-CB 4.5Å; Y216-A237 HydrophobicContact CG-CB 4.49Å; F231-A237 HydrophobicContact CD1-CB 3.8Å; F231-A237 HydrophobicContact CE1-CB 4.35Å; S233-A237 PolarHBondContact O-N 3.46Å; Y234-A237 PolarHBondContact O-N 2.87Å; A237-W240 PolarHBondContact O-N 3Å; A237-G241 PolarHBondContact O-N 2.87Å |
| 238 | L | 97.8 | Very high | 95.9 | Very high | 53 Ų | 53 | 53.9 Ų | 53.9 | 28% | 0.277 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -69.7 | -37.7 | 174.8 | -171.2 | 64.9 | 0 | 0 | 0 | 112.1 | L208 I209 Y234 A235 G241 V242 | L208-L238 HydrophobicContact CD1-CD1 4.38Å; L208-L238 HydrophobicContact CD2-CD1 4.48Å; L208-L238 HydrophobicContact CG-CD1 4.16Å; I209-L238 HydrophobicContact CD1-CD1 3.99Å; Y234-L238 WeakPolarHBondContact O-CB 3.36Å; Y234-L238 PolarHBondContact O-N 3.43Å; A235-L238 PolarHBondContact O-N 2.8Å; L238-G241 PolarHBondContact O-N 2.98Å; L238-V242 WeakPolarHBondContact O-CG2 3.24Å; L238-V242 PolarHBondContact O-N 3.29Å |
| 239 | W | 98.1 | Very high | 96.1 | Very high | 114 Ų | 114 | 47.7 Ų | 47.7 | 43% | 0.432 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -59.1 | -52.1 | 170.3 | 164.7 | -107.6 | 0 | 0 | 0 | 111.1 | A235 D236 G241 V242 V243 Y250 D252 | A235-W239 PolarHBondContact O-N 3.37Å; D236-W239 PolarHBondContact O-N 3.22Å; W239-G241 VanDerWaalsContact C-N 3.28Å; W239-G241 PolarHBondContact O-N 3.02Å; W239-V242 PolarHBondContact O-N 3.01Å; W239-V243 HydrophobicContact CD2-CG2 3.9Å; W239-V243 HydrophobicContact CE3-CG2 4.08Å; W239-V243 HydrophobicContact CH2-CG2 3.87Å; W239-V243 HydrophobicContact CZ2-CG2 3.65Å; W239-V243 HydrophobicContact CZ3-CG2 4.07Å; W239-V243 WeakPolarHBondContact O-CG2 3.18Å; W239-V243 PolarHBondContact O-N 2.86Å; W239-Y250 HydrophobicContact CH2-CD2 4.27Å; W239-Y250 AromaticContact CH2-CE2 3.8Å; W239-Y250 HydrophobicContact CH2-CE2 3.8Å; W239-Y250 AromaticContact CZ2-CD2 3.83Å; W239-Y250 HydrophobicContact CZ2-CD2 3.83Å; W239-Y250 AromaticContact CZ2-CE2 3.83Å; W239-Y250 HydrophobicContact CZ2-CE2 3.83Å; W239-D252 PolarHBondContact NE1-OD2 3.14Å |
| 240 | W | 97.8 | Very high | 96.4 | Very high | 15 Ų | 15 | 50.4 Ų | 50.4 | 6% | 0.057 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -54.2 | -45.4 | 174 | 166.8 | 78.1 | 0 | 0 | 0 | 111.9 | V215 F231 D236 A237 V243 T244 K253 A264 | V215-W240 HydrophobicContact CB-CE3 4.3Å; V215-W240 HydrophobicContact CB-CH2 4.34Å; V215-W240 HydrophobicContact CB-CZ3 3.82Å; V215-W240 HydrophobicContact CG1-CE3 4.04Å; V215-W240 HydrophobicContact CG1-CH2 4.26Å; V215-W240 HydrophobicContact CG1-CZ3 3.9Å; V215-W240 HydrophobicContact CG2-CH2 3.76Å; V215-W240 HydrophobicContact CG2-CZ3 3.66Å; F231-W240 HydrophobicContact CE1-CB 3.74Å; F231-W240 HydrophobicContact CE1-CD2 4.1Å; F231-W240 HydrophobicContact CE1-CE3 4.44Å; F231-W240 AromaticContact CE1-CG 3.75Å; F231-W240 HydrophobicContact CE1-CG 3.75Å; F231-W240 HydrophobicContact CZ-CB 4.3Å; F231-W240 HydrophobicContact CZ-CD2 4.31Å; F231-W240 AromaticContact CZ-CG 3.94Å; F231-W240 HydrophobicContact CZ-CG 3.94Å; D236-W240 PolarHBondContact O-N 2.98Å; A237-W240 PolarHBondContact O-N 3Å; W240-V243 PolarHBondContact O-N 2.76Å; W240-T244 HydrophobicContact CZ2-CG2 4.15Å; W240-T244 PolarHBondContact NE1-OG1 2.98Å; W240-T244 VanDerWaalsContact O-CB 3.29Å; W240-T244 WeakPolarHBondContact O-CB 3.12Å; W240-T244 PolarHBondContact O-N 3.3Å; W240-T244 PolarHBondContact O-OG1 3.46Å; W240-K253 HydrophobicContact CB-CB 4.28Å; W240-A264 HydrophobicContact CH2-CB 3.56Å; W240-A264 HydrophobicContact CZ2-CB 3.57Å |
| 241 | G | 97.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -58.1 | -49.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A237 L238 W239 T244 V245 | A237-G241 PolarHBondContact O-N 2.87Å; L238-G241 PolarHBondContact O-N 2.98Å; W239-G241 VanDerWaalsContact C-N 3.28Å; W239-G241 PolarHBondContact O-N 3.02Å; G241-T244 PolarHBondContact O-N 2.89Å; G241-V245 WeakPolarHBondContact O-CG1 3.47Å; G241-V245 WeakPolarHBondContact O-CG2 3.11Å; G241-V245 PolarHBondContact O-N 3.08Å |
| 242 | V | 97.9 | Very high | 96.5 | Very high | 60 Ų | 60 | 54.8 Ų | 54.8 | 36% | 0.364 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60.2 | -47.5 | 178 | 170 | 0 | 0 | 0 | 0 | 111.4 | L208 L238 W239 T244 T246 | L208-V242 HydrophobicContact CD1-CG2 4.26Å; L208-V242 HydrophobicContact CD2-CG2 3.88Å; L238-V242 WeakPolarHBondContact O-CG2 3.24Å; L238-V242 PolarHBondContact O-N 3.29Å; W239-V242 PolarHBondContact O-N 3.01Å; V242-T244 VanDerWaalsContact C-N 3.26Å; V242-T244 PolarHBondContact O-N 2.99Å; V242-T246 WeakPolarHBondContact O-CB 3.16Å; V242-T246 WeakPolarHBondContact O-CG2 3.44Å; V242-T246 PolarHBondContact O-N 3.1Å; V242-T246 PolarHBondContact O-OG1 2.97Å |
| 243 | V | 97.9 | Very high | 96.6 | Very high | 5 Ų | 5 | 53.8 Ų | 53.8 | 3% | 0.03 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62 | -33.8 | 178.5 | 170.6 | 0 | 0 | 0 | 0 | 111.9 | W239 W240 T246 I248 G249 Y250 | W239-V243 HydrophobicContact CD2-CG2 3.9Å; W239-V243 HydrophobicContact CE3-CG2 4.08Å; W239-V243 HydrophobicContact CH2-CG2 3.87Å; W239-V243 HydrophobicContact CZ2-CG2 3.65Å; W239-V243 HydrophobicContact CZ3-CG2 4.07Å; W239-V243 WeakPolarHBondContact O-CG2 3.18Å; W239-V243 PolarHBondContact O-N 2.86Å; W240-V243 PolarHBondContact O-N 2.76Å; V243-T246 PolarHBondContact O-OG1 3.48Å; V243-I248 HydrophobicContact CG1-CB 4.21Å; V243-I248 HydrophobicContact CG1-CG2 4.42Å; V243-I248 PolarHBondContact O-N 2.9Å; V243-G249 PolarHBondContact O-N 3.05Å; V243-Y250 HydrophobicContact CB-CD2 4.45Å; V243-Y250 HydrophobicContact CG1-CD2 3.71Å; V243-Y250 HydrophobicContact CG1-CE2 4.45Å; V243-Y250 HydrophobicContact CG1-CG 4.27Å; V243-Y250 HydrophobicContact CG2-CD2 3.79Å; V243-Y250 HydrophobicContact CG2-CE2 4.03Å |
| 244 | T | 96.4 | Very high | 96.6 | Very high | 35 Ų | 35 | 54.9 Ų | 54.9 | 22% | 0.215 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -79.1 | -50 | -179.3 | -57.4 | 0 | 0 | 0 | 0 | 112.3 | W240 G241 V242 T246 T247 | W240-T244 HydrophobicContact CZ2-CG2 4.15Å; W240-T244 PolarHBondContact NE1-OG1 2.98Å; W240-T244 VanDerWaalsContact O-CB 3.29Å; W240-T244 WeakPolarHBondContact O-CB 3.12Å; W240-T244 PolarHBondContact O-N 3.3Å; W240-T244 PolarHBondContact O-OG1 3.46Å; G241-T244 PolarHBondContact O-N 2.89Å; V242-T244 VanDerWaalsContact C-N 3.26Å; V242-T244 PolarHBondContact O-N 2.99Å; T244-T246 PolarHBondContact O-N 3.39Å; T244-T247 PolarHBondContact O-N 2.99Å |
| 245 | V | 96.1 | Very high | 96.5 | Very high | 7 Ų | 7 | 51.6 Ų | 51.6 | 4% | 0.042 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -69.4 | -22.9 | -178.2 | -56.6 | 0 | 0 | 0 | 0 | 113.2 | L208 G241 T247 A271 F275 | L208-V245 HydrophobicContact CD1-CG1 4.26Å; L208-V245 HydrophobicContact CD1-CG2 4.15Å; G241-V245 WeakPolarHBondContact O-CG1 3.47Å; G241-V245 WeakPolarHBondContact O-CG2 3.11Å; G241-V245 PolarHBondContact O-N 3.08Å; V245-T247 VanDerWaalsContact C-N 3.3Å; V245-A271 HydrophobicContact CB-CB 4.35Å; V245-A271 HydrophobicContact CG1-CB 3.63Å; V245-F275 HydrophobicContact CB-CD2 3.78Å; V245-F275 HydrophobicContact CB-CE2 3.98Å; V245-F275 HydrophobicContact CB-CG 4.4Å; V245-F275 HydrophobicContact CG2-CD1 4.44Å; V245-F275 HydrophobicContact CG2-CD2 3.7Å; V245-F275 HydrophobicContact CG2-CE1 4.32Å; V245-F275 HydrophobicContact CG2-CE2 3.55Å; V245-F275 HydrophobicContact CG2-CG 4.15Å; V245-F275 HydrophobicContact CG2-CZ 3.88Å |
| 246 | T | 96.1 | Very high | 96.4 | Very high | 56 Ų | 56 | 51.1 Ų | 51.1 | 34% | 0.344 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | 3.2 | 172 | 58.4 | 0 | 0 | 0 | 0 | 113.3 | V242 V243 T244 I248 | V242-T246 WeakPolarHBondContact O-CB 3.16Å; V242-T246 WeakPolarHBondContact O-CG2 3.44Å; V242-T246 PolarHBondContact O-N 3.1Å; V242-T246 PolarHBondContact O-OG1 2.97Å; V243-T246 PolarHBondContact O-OG1 3.48Å; T244-T246 PolarHBondContact O-N 3.39Å; T246-I248 PolarHBondContact O-N 3.28Å; T246-I248 WeakPolarHBondContact OG1-CD1 3.26Å; T246-I248 WeakPolarHBondContact OG1-CG1 3.28Å |
| 247 | T | 96.6 | Very high | 96.4 | Very high | 99 Ų | 99 | 50.8 Ų | 50.8 | 61% | 0.607 | 29% | 0.286 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58 | 25.9 | 179.6 | 60.7 | 0 | 0 | 0 | 0 | 114.9 | T244 V245 I272 | T244-T247 PolarHBondContact O-N 2.99Å; V245-T247 VanDerWaalsContact C-N 3.3Å; T247-I272 HydrophobicContact CG2-CB 4.34Å; T247-I272 HydrophobicContact CG2-CD1 3.84Å; T247-I272 HydrophobicContact CG2-CG1 3.83Å; T247-I272 HydrophobicContact CG2-CG2 3.56Å |
| 248 | I | 97.3 | Very high | 96.3 | Very high | 90 Ų | 90 | 60.2 Ų | 60.2 | 46% | 0.462 | 32% | 0.322 | S | S | . | . | trans | -76.9 | -47.2 | 177.4 | -63.6 | 172.3 | 0 | 0 | 0 | 110.3 | V243 T246 Y250 | V243-I248 HydrophobicContact CG1-CB 4.21Å; V243-I248 HydrophobicContact CG1-CG2 4.42Å; V243-I248 PolarHBondContact O-N 2.9Å; T246-I248 PolarHBondContact O-N 3.28Å; T246-I248 WeakPolarHBondContact OG1-CD1 3.26Å; T246-I248 WeakPolarHBondContact OG1-CG1 3.28Å; I248-Y250 HydrophobicContact CG2-CD1 3.85Å; I248-Y250 HydrophobicContact CG2-CD2 3.94Å; I248-Y250 HydrophobicContact CG2-CE1 3.57Å; I248-Y250 HydrophobicContact CG2-CE2 3.65Å; I248-Y250 HydrophobicContact CG2-CG 4.02Å; I248-Y250 VanDerWaalsContact CG2-CZ 3.46Å | ||
| 249 | G | 95.6 | Very high | 96.3 | Very high | 54 Ų | 54 | 60.3 Ų | 60.3 | 56% | 0.557 | 33% | 0.325 | S | S | * | . | trans | 57.5 | 51.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | V243 G251 | V243-G249 PolarHBondContact O-N 3.05Å; G249-G251 PolarHBondContact O-N 3.29Å; G249-G251 VanDerWaalsContact O-N 3.12Å | ||
| 250 | Y | 96.3 | Very high | 96.2 | Very high | 150 Ų | 150 | 54.9 Ų | 54.9 | 59% | 0.588 | 30% | 0.304 | S | S | * | . | trans | -56.6 | -26.4 | 179.7 | -68.6 | -56.7 | 0 | 0 | 0 | 114.6 | W239 V243 I248 D252 | W239-Y250 HydrophobicContact CH2-CD2 4.27Å; W239-Y250 AromaticContact CH2-CE2 3.8Å; W239-Y250 HydrophobicContact CH2-CE2 3.8Å; W239-Y250 AromaticContact CZ2-CD2 3.83Å; W239-Y250 HydrophobicContact CZ2-CD2 3.83Å; W239-Y250 AromaticContact CZ2-CE2 3.83Å; W239-Y250 HydrophobicContact CZ2-CE2 3.83Å; V243-Y250 HydrophobicContact CB-CD2 4.45Å; V243-Y250 HydrophobicContact CG1-CD2 3.71Å; V243-Y250 HydrophobicContact CG1-CE2 4.45Å; V243-Y250 HydrophobicContact CG1-CG 4.27Å; V243-Y250 HydrophobicContact CG2-CD2 3.79Å; V243-Y250 HydrophobicContact CG2-CE2 4.03Å; I248-Y250 HydrophobicContact CG2-CD1 3.85Å; I248-Y250 HydrophobicContact CG2-CD2 3.94Å; I248-Y250 HydrophobicContact CG2-CE1 3.57Å; I248-Y250 HydrophobicContact CG2-CE2 3.65Å; I248-Y250 HydrophobicContact CG2-CG 4.02Å; I248-Y250 VanDerWaalsContact CG2-CZ 3.46Å; Y250-D252 PolarHBondContact O-N 2.76Å | ||
| 251 | G | 94.6 | Very high | 96.2 | Very high | 53 Ų | 53 | 58.7 Ų | 58.7 | 55% | 0.546 | 32% | 0.321 | S | S | . | . | S | Bend | trans | 76.5 | 7.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | G249 | G249-G251 PolarHBondContact O-N 3.29Å; G249-G251 VanDerWaalsContact O-N 3.12Å |
| 252 | D | 94.3 | Very high | 96.2 | Very high | 75 Ų | 75 | 62.7 Ų | 62.7 | 40% | 0.401 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -70 | -35.2 | 177.2 | 64.2 | -42.4 | 0 | 0 | 0 | 112.8 | W239 Y250 | W239-D252 PolarHBondContact NE1-OD2 3.14Å; Y250-D252 PolarHBondContact O-N 2.76Å |
| 253 | K | 94.5 | Very high | 96.1 | Very high | 31 Ų | 31 | 61.7 Ų | 61.7 | 14% | 0.135 | 34% | 0.338 | C | S | . | . | S | Bend | trans | -125.5 | 131 | 169.3 | -63 | -175.7 | -172.8 | -74.1 | 0 | 109.6 | E230 F231 D236 W240 | E230-K253 PolarHBondContact O-NZ 3.29Å; F231-K253 HydrophobicContact CZ-CB 4.27Å; D236-K253 HydrophobicContact CB-CD 4.13Å; D236-K253 WeakPolarHBondContact OD1-CE 3.27Å; D236-K253 IonicContact OD1-NZ 2.73Å; D236-K253 PolarHBondContact OD1-NZ 3.43Å; W240-K253 HydrophobicContact CB-CB 4.28Å |
| 254 | V | 95.6 | Very high | 96 | Very high | 64 Ų | 64 | 62 Ų | 62 | 39% | 0.388 | 34% | 0.34 | S | S | . | . | trans | -141.3 | 131 | 178.6 | -176.7 | 0 | 0 | 0 | 0 | 108.4 | Q256 | V254-Q256 PolarHBondContact O-N 2.84Å; V254-Q256 PolarHBondContact O-NE2 3.44Å; V254-Q256 VanDerWaalsContact O-NE2 3.15Å | ||
| 255 | P | 95.8 | Very high | 96 | Very high | 8 Ų | 8 | 63.7 Ų | 63.7 | 5% | 0.052 | 35% | 0.354 | C | S | . | . | trans | -60.7 | 133.9 | 174.2 | 26 | -34.4 | 0 | 0 | 0 | 109.8 | V215 E219 K261 A264 | V215-P255 HydrophobicContact CG1-CB 4.3Å; E219-P255 HydrophobicContact CG-CB 3.79Å; E219-P255 WeakPolarHBondContact OE1-CB 3.37Å; P255-K261 HydrophobicContact CB-CG 4.45Å; P255-K261 HydrophobicContact CG-CG 4.27Å; P255-K261 WeakPolarHBondContact O-CE 3.35Å; P255-K261 WeakPolarHBondContact O-CG 3.15Å; P255-A264 HydrophobicContact CG-CB 4.11Å | ||
| 256 | Q | 94.9 | Very high | 96 | Very high | 56 Ų | 56 | 66.7 Ų | 66.7 | 26% | 0.262 | 38% | 0.375 | S | S | . | . | trans | -98.3 | -39.2 | -176.5 | -62.2 | -55.8 | -27.4 | 0 | 0 | 112.1 | E219 N224 V254 K261 | E219-Q256 VanDerWaalsContact CD-N 3.29Å; E219-Q256 PolarHBondContact OE1-N 3.38Å; E219-Q256 PolarHBondContact OE2-N 3.45Å; N224-Q256 PolarHBondContact OD1-NE2 3.27Å; V254-Q256 PolarHBondContact O-N 2.84Å; V254-Q256 PolarHBondContact O-NE2 3.44Å; V254-Q256 VanDerWaalsContact O-NE2 3.15Å; Q256-K261 VanDerWaalsContact O-CE 3.23Å; Q256-K261 WeakPolarHBondContact O-CE 3.25Å; Q256-K261 PolarHBondContact O-NZ 2.93Å | ||
| 257 | T | 96.1 | Very high | 95.9 | Very high | 41 Ų | 41 | 66.7 Ų | 66.7 | 25% | 0.252 | 37% | 0.37 | S | S | . | . | S | Bend | trans | -68.2 | 150.7 | 179.8 | 78.2 | 0 | 0 | 0 | 0 | 110.9 | E219 A222 V259 G260 K261 | E219-T257 WeakPolarHBondContact OE1-CA 3.13Å; E219-T257 VanDerWaalsContact OE1-CB 3.26Å; E219-T257 WeakPolarHBondContact OE1-CB 3.47Å; E219-T257 PolarHBondContact OE1-N 2.92Å; E219-T257 PolarHBondContact OE1-OG1 3.48Å; E219-T257 PolarHBondContact OE2-N 3.05Å; A222-T257 HydrophobicContact CB-CG2 3.84Å; T257-V259 PolarHBondContact O-N 2.85Å; T257-G260 PolarHBondContact O-N 3.13Å; T257-G260 PolarHBondContact OG1-N 2.95Å; T257-K261 WeakPolarHBondContact O-CB 3.34Å; T257-K261 VanDerWaalsContact O-CG 3.26Å; T257-K261 WeakPolarHBondContact O-CG 3.35Å; T257-K261 PolarHBondContact O-N 2.97Å |
| 258 | W | 96.2 | Very high | 95.7 | Very high | 199 Ų | 199 | 63.4 Ų | 63.4 | 75% | 0.754 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -62.8 | -33.7 | 173.9 | 70 | -91.4 | 0 | 0 | 0 | 111.4 | K261 T262 | W258-K261 PolarHBondContact O-N 3.43Å; W258-T262 WeakPolarHBondContact O-CB 3.31Å; W258-T262 PolarHBondContact O-N 3.35Å; W258-T262 PolarHBondContact O-OG1 2.96Å |
| 259 | V | 96.8 | Very high | 95.6 | Very high | 55 Ų | 55 | 63.6 Ų | 63.6 | 33% | 0.333 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -63.1 | -52.9 | 177.5 | -177.9 | 0 | 0 | 0 | 0 | 110.7 | A218 T257 K261 T262 I263 | A218-V259 HydrophobicContact CB-CB 4.35Å; A218-V259 HydrophobicContact CB-CG1 3.98Å; T257-V259 PolarHBondContact O-N 2.85Å; V259-K261 VanDerWaalsContact C-N 3.34Å; V259-K261 PolarHBondContact O-N 3.27Å; V259-T262 PolarHBondContact O-N 3.39Å; V259-I263 HydrophobicContact CG1-CD1 3.79Å; V259-I263 VanDerWaalsContact O-CG1 3.31Å; V259-I263 WeakPolarHBondContact O-CG1 3.42Å; V259-I263 PolarHBondContact O-N 2.8Å |
| 260 | G | 96.4 | Very high | 95.4 | Very high | 0 Ų | 0 | 67.2 Ų | 67.2 | 0% | 0 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -61.8 | -41 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | E219 T257 T262 I263 A264 | E219-G260 WeakPolarHBondContact OE1-CA 3.45Å; T257-G260 PolarHBondContact O-N 3.13Å; T257-G260 PolarHBondContact OG1-N 2.95Å; G260-T262 PolarHBondContact O-N 3.36Å; G260-I263 PolarHBondContact O-N 2.97Å; G260-A264 WeakPolarHBondContact O-CB 3.45Å; G260-A264 PolarHBondContact O-N 2.95Å |
| 261 | K | 97.1 | Very high | 95.2 | Very high | 95 Ų | 95 | 60.3 Ų | 60.3 | 41% | 0.413 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -59.8 | -43.4 | 172.7 | -73.5 | 168.5 | -178.7 | 163.5 | 0 | 112.4 | P255 Q256 T257 W258 V259 S265 | P255-K261 HydrophobicContact CB-CG 4.45Å; P255-K261 HydrophobicContact CG-CG 4.27Å; P255-K261 WeakPolarHBondContact O-CE 3.35Å; P255-K261 WeakPolarHBondContact O-CG 3.15Å; Q256-K261 VanDerWaalsContact O-CE 3.23Å; Q256-K261 WeakPolarHBondContact O-CE 3.25Å; Q256-K261 PolarHBondContact O-NZ 2.93Å; T257-K261 WeakPolarHBondContact O-CB 3.34Å; T257-K261 VanDerWaalsContact O-CG 3.26Å; T257-K261 WeakPolarHBondContact O-CG 3.35Å; T257-K261 PolarHBondContact O-N 2.97Å; W258-K261 PolarHBondContact O-N 3.43Å; V259-K261 VanDerWaalsContact C-N 3.34Å; V259-K261 PolarHBondContact O-N 3.27Å; K261-S265 VanDerWaalsContact O-CB 3.3Å; K261-S265 WeakPolarHBondContact O-CB 3.29Å; K261-S265 PolarHBondContact O-N 3.25Å; K261-S265 PolarHBondContact O-OG 3.29Å |
| 262 | T | 97.5 | Very high | 95.3 | Very high | 83 Ų | 83 | 60.4 Ų | 60.4 | 51% | 0.509 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -65.9 | -45.8 | 177.6 | -61.9 | 0 | 0 | 0 | 0 | 111.8 | W258 V259 G260 S265 C266 | W258-T262 WeakPolarHBondContact O-CB 3.31Å; W258-T262 PolarHBondContact O-N 3.35Å; W258-T262 PolarHBondContact O-OG1 2.96Å; V259-T262 PolarHBondContact O-N 3.39Å; G260-T262 PolarHBondContact O-N 3.36Å; T262-S265 PolarHBondContact O-N 2.86Å; T262-C266 WeakPolarHBondContact O-CB 3.33Å; T262-C266 PolarHBondContact O-N 2.95Å |
| 263 | I | 96.3 | Very high | 95.3 | Very high | 39 Ų | 39 | 60.1 Ų | 60.1 | 20% | 0.2 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61.4 | -51 | 177.1 | -66.4 | 164.1 | 0 | 0 | 0 | 110 | F214 V215 A218 V259 G260 S265 C266 F267 | F214-I263 HydrophobicContact CB-CD1 4.31Å; F214-I263 HydrophobicContact CB-CG2 3.81Å; V215-I263 HydrophobicContact CG2-CB 4.21Å; V215-I263 HydrophobicContact CG2-CG2 3.73Å; A218-I263 HydrophobicContact CB-CD1 4.16Å; V259-I263 HydrophobicContact CG1-CD1 3.79Å; V259-I263 VanDerWaalsContact O-CG1 3.31Å; V259-I263 WeakPolarHBondContact O-CG1 3.42Å; V259-I263 PolarHBondContact O-N 2.8Å; G260-I263 PolarHBondContact O-N 2.97Å; I263-S265 VanDerWaalsContact C-N 3.34Å; I263-S265 PolarHBondContact O-N 3.28Å; I263-C266 PolarHBondContact O-N 2.7Å; I263-F267 HydrophobicContact CG2-CD2 3.84Å; I263-F267 HydrophobicContact CG2-CE2 4.13Å; I263-F267 WeakPolarHBondContact O-CD2 3.36Å; I263-F267 PolarHBondContact O-N 3.36Å |
| 264 | A | 96.3 | Very high | 95.4 | Very high | 11 Ų | 11 | 61.7 Ų | 61.7 | 9% | 0.091 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -56.3 | -46.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V215 W240 P255 G260 S268 | V215-A264 HydrophobicContact CG2-CB 4.28Å; W240-A264 HydrophobicContact CH2-CB 3.56Å; W240-A264 HydrophobicContact CZ2-CB 3.57Å; P255-A264 HydrophobicContact CG-CB 4.11Å; G260-A264 WeakPolarHBondContact O-CB 3.45Å; G260-A264 PolarHBondContact O-N 2.95Å; A264-S268 WeakPolarHBondContact O-CB 3.47Å; A264-S268 PolarHBondContact O-N 3.17Å; A264-S268 PolarHBondContact O-OG 3.22Å |
| 265 | S | 96.3 | Very high | 95.4 | Very high | 72 Ų | 72 | 61.6 Ų | 61.6 | 50% | 0.503 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -60.5 | -50.4 | 178.8 | -58.4 | 0 | 0 | 0 | 0 | 111 | K261 T262 I263 S268 | K261-S265 VanDerWaalsContact O-CB 3.3Å; K261-S265 WeakPolarHBondContact O-CB 3.29Å; K261-S265 PolarHBondContact O-N 3.25Å; K261-S265 PolarHBondContact O-OG 3.29Å; T262-S265 PolarHBondContact O-N 2.86Å; I263-S265 VanDerWaalsContact C-N 3.34Å; I263-S265 PolarHBondContact O-N 3.28Å; S265-S268 PolarHBondContact O-N 2.99Å; S265-S268 PolarHBondContact O-OG 3.09Å |
| 266 | C | 94.8 | Very high | 95.4 | Very high | 70 Ų | 70 | 64 Ų | 64 | 47% | 0.473 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -59.5 | -52.1 | 179.4 | -174.2 | 0 | 0 | 0 | 0 | 112.1 | T262 I263 S268 F270 | T262-C266 WeakPolarHBondContact O-CB 3.33Å; T262-C266 PolarHBondContact O-N 2.95Å; I263-C266 PolarHBondContact O-N 2.7Å; C266-S268 PolarHBondContact O-N 2.95Å; C266-F270 VanDerWaalsContact O-CD2 3.26Å; C266-F270 WeakPolarHBondContact O-CD2 3.3Å |
| 267 | F | 94.1 | Very high | 95.5 | Very high | 56 Ų | 56 | 65 Ų | 65 | 25% | 0.246 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -67.3 | -33.2 | -179.3 | -86.7 | -88.2 | 0 | 0 | 0 | 113.1 | F210 S211 F214 I263 V269 F270 A271 | F210-F267 HydrophobicContact CB-CE1 4.2Å; F210-F267 HydrophobicContact CB-CZ 4.38Å; S211-F267 WeakPolarHBondContact OG-CB 3.35Å; F214-F267 HydrophobicContact CD2-CE2 4.03Å; F214-F267 AromaticContact CD2-CZ 3.97Å; F214-F267 HydrophobicContact CD2-CZ 3.97Å; F214-F267 HydrophobicContact CE2-CZ 4.21Å; I263-F267 HydrophobicContact CG2-CD2 3.84Å; I263-F267 HydrophobicContact CG2-CE2 4.13Å; I263-F267 WeakPolarHBondContact O-CD2 3.36Å; I263-F267 PolarHBondContact O-N 3.36Å; F267-V269 PolarHBondContact O-N 2.64Å; F267-F270 PolarHBondContact O-N 3.43Å; F267-A271 WeakPolarHBondContact O-CB 3.37Å; F267-A271 PolarHBondContact O-N 3.38Å |
| 268 | S | 94 | Very high | 95.5 | Very high | 29 Ų | 29 | 64 Ų | 64 | 20% | 0.203 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -60.3 | -45.6 | -178.8 | 69.5 | 0 | 0 | 0 | 0 | 112.5 | A264 S265 C266 F270 A271 I272 | A264-S268 WeakPolarHBondContact O-CB 3.47Å; A264-S268 PolarHBondContact O-N 3.17Å; A264-S268 PolarHBondContact O-OG 3.22Å; S265-S268 PolarHBondContact O-N 2.99Å; S265-S268 PolarHBondContact O-OG 3.09Å; C266-S268 PolarHBondContact O-N 2.95Å; S268-F270 VanDerWaalsContact C-N 3.32Å; S268-F270 PolarHBondContact O-N 3.09Å; S268-A271 PolarHBondContact O-N 2.93Å; S268-I272 VanDerWaalsContact O-CB 3.25Å; S268-I272 WeakPolarHBondContact O-CB 3.5Å; S268-I272 WeakPolarHBondContact O-CD1 3.44Å; S268-I272 WeakPolarHBondContact O-CG1 3.42Å; S268-I272 PolarHBondContact O-N 3Å |
| 269 | V | 93.6 | Very high | 95.5 | Very high | 95 Ų | 95 | 58 Ų | 58 | 58% | 0.576 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -56.2 | -45.4 | -179.3 | 174.5 | 0 | 0 | 0 | 0 | 111.5 | F267 S273 | F267-V269 PolarHBondContact O-N 2.64Å; V269-S273 PolarHBondContact O-OG 3.34Å |
| 270 | F | 91.4 | Very high | 95.4 | Very high | 130 Ų | 130 | 57.5 Ų | 57.5 | 57% | 0.57 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -77.4 | -47.6 | 179 | -61.5 | -69.1 | 0 | 0 | 0 | 112.4 | C266 F267 S268 S273 F274 | C266-F270 VanDerWaalsContact O-CD2 3.26Å; C266-F270 WeakPolarHBondContact O-CD2 3.3Å; F267-F270 PolarHBondContact O-N 3.43Å; S268-F270 VanDerWaalsContact C-N 3.32Å; S268-F270 PolarHBondContact O-N 3.09Å; F270-S273 WeakPolarHBondContact O-CB 3.27Å; F270-S273 PolarHBondContact O-N 3.18Å; F270-F274 WeakPolarHBondContact O-CD2 3.43Å; F270-F274 PolarHBondContact O-N 3.38Å |
| 271 | A | 92.5 | Very high | 95.4 | Very high | 5 Ų | 5 | 58.6 Ų | 58.6 | 4% | 0.041 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -66.8 | -42.8 | -173.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | V245 F267 S268 S273 F274 F275 | V245-A271 HydrophobicContact CB-CB 4.35Å; V245-A271 HydrophobicContact CG1-CB 3.63Å; F267-A271 WeakPolarHBondContact O-CB 3.37Å; F267-A271 PolarHBondContact O-N 3.38Å; S268-A271 PolarHBondContact O-N 2.93Å; A271-S273 PolarHBondContact O-N 2.93Å; A271-F274 PolarHBondContact O-N 3.18Å; A271-F274 VanDerWaalsContact O-N 3.12Å; A271-F275 WeakPolarHBondContact O-CD2 3.48Å; A271-F275 PolarHBondContact O-N 3.42Å |
| 272 | I | 96 | Very high | 95.4 | Very high | 55 Ų | 55 | 55.8 Ų | 55.8 | 28% | 0.282 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -57.1 | -41.9 | 176.1 | -68.8 | 165.9 | 0 | 0 | 0 | 110.2 | T247 S268 F274 F275 A276 | T247-I272 HydrophobicContact CG2-CB 4.34Å; T247-I272 HydrophobicContact CG2-CD1 3.84Å; T247-I272 HydrophobicContact CG2-CG1 3.83Å; T247-I272 HydrophobicContact CG2-CG2 3.56Å; S268-I272 VanDerWaalsContact O-CB 3.25Å; S268-I272 WeakPolarHBondContact O-CB 3.5Å; S268-I272 WeakPolarHBondContact O-CD1 3.44Å; S268-I272 WeakPolarHBondContact O-CG1 3.42Å; S268-I272 PolarHBondContact O-N 3Å; I272-F274 PolarHBondContact O-N 3.38Å; I272-F275 PolarHBondContact O-N 3.19Å; I272-A276 WeakPolarHBondContact O-CB 3.42Å; I272-A276 PolarHBondContact O-N 2.94Å |
| 273 | S | 95.5 | Very high | 95.3 | Very high | 69 Ų | 69 | 53.8 Ų | 53.8 | 48% | 0.483 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -58.5 | -46.3 | 177.1 | -58.7 | 0 | 0 | 0 | 0 | 111.6 | V269 F270 A271 A276 L277 | V269-S273 PolarHBondContact O-OG 3.34Å; F270-S273 WeakPolarHBondContact O-CB 3.27Å; F270-S273 PolarHBondContact O-N 3.18Å; A271-S273 PolarHBondContact O-N 2.93Å; S273-A276 PolarHBondContact O-N 3.05Å; S273-L277 WeakPolarHBondContact O-CG 3.46Å; S273-L277 PolarHBondContact O-N 3.06Å |
| 274 | F | 95.7 | Very high | 95.2 | Very high | 63 Ų | 63 | 54.8 Ų | 54.8 | 28% | 0.276 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -66.8 | -37 | 177.8 | -74.3 | -70.5 | 0 | 0 | 0 | 113.8 | I203 F270 A271 I272 A276 L277 P278 | I203-F274 HydrophobicContact CB-CD1 4.14Å; I203-F274 HydrophobicContact CB-CE1 4.16Å; I203-F274 HydrophobicContact CB-CG 4.49Å; I203-F274 HydrophobicContact CD1-CE1 4.11Å; I203-F274 HydrophobicContact CG2-CD1 3.93Å; I203-F274 HydrophobicContact CG2-CD2 3.9Å; I203-F274 HydrophobicContact CG2-CE1 3.71Å; I203-F274 HydrophobicContact CG2-CE2 3.69Å; I203-F274 HydrophobicContact CG2-CG 4.03Å; I203-F274 HydrophobicContact CG2-CZ 3.6Å; F270-F274 WeakPolarHBondContact O-CD2 3.43Å; F270-F274 PolarHBondContact O-N 3.38Å; A271-F274 PolarHBondContact O-N 3.18Å; A271-F274 VanDerWaalsContact O-N 3.12Å; I272-F274 PolarHBondContact O-N 3.38Å; F274-A276 VanDerWaalsContact C-N 3.34Å; F274-L277 HydrophobicContact CD1-CD1 4.1Å; F274-P278 VanDerWaalsContact O-CD 3.27Å; F274-P278 WeakPolarHBondContact O-CD 3.43Å |
| 275 | F | 95.3 | Very high | 95.1 | Very high | 62 Ų | 62 | 54.4 Ų | 54.4 | 27% | 0.272 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -72.9 | -24.1 | 176 | -85 | -88.1 | 0 | 0 | 0 | 113.4 | G204 L208 V245 A271 I272 | G204-F275 WeakPolarHBondContact O-CE2 3.49Å; L208-F275 HydrophobicContact CB-CE2 4.36Å; L208-F275 HydrophobicContact CD2-CZ 4.24Å; V245-F275 HydrophobicContact CB-CD2 3.78Å; V245-F275 HydrophobicContact CB-CE2 3.98Å; V245-F275 HydrophobicContact CB-CG 4.4Å; V245-F275 HydrophobicContact CG2-CD1 4.44Å; V245-F275 HydrophobicContact CG2-CD2 3.7Å; V245-F275 HydrophobicContact CG2-CE1 4.32Å; V245-F275 HydrophobicContact CG2-CE2 3.55Å; V245-F275 HydrophobicContact CG2-CG 4.15Å; V245-F275 HydrophobicContact CG2-CZ 3.88Å; A271-F275 WeakPolarHBondContact O-CD2 3.48Å; A271-F275 PolarHBondContact O-N 3.42Å; I272-F275 PolarHBondContact O-N 3.19Å |
| 276 | A | 96.3 | Very high | 94.9 | Very high | 58 Ų | 58 | 54.2 Ų | 54.2 | 48% | 0.479 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -78.1 | -30.6 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | I272 S273 F274 A279 | I272-A276 WeakPolarHBondContact O-CB 3.42Å; I272-A276 PolarHBondContact O-N 2.94Å; S273-A276 PolarHBondContact O-N 3.05Å; F274-A276 VanDerWaalsContact C-N 3.34Å; A276-A279 WeakPolarHBondContact O-CB 3.45Å; A276-A279 PolarHBondContact O-N 2.83Å; A276-A279 VanDerWaalsContact O-N 3.14Å |
| 277 | L | 96.6 | Very high | 94.7 | Very high | 78 Ų | 78 | 53.9 Ų | 53.9 | 41% | 0.408 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -55.3 | -42.1 | -175.5 | -78.5 | 172.2 | 0 | 0 | 0 | 115.2 | T200 S273 F274 A279 G280 I281 | T200-L277 HydrophobicContact CG2-CB 3.8Å; T200-L277 HydrophobicContact CG2-CD1 3.68Å; T200-L277 HydrophobicContact CG2-CG 4.39Å; S273-L277 WeakPolarHBondContact O-CG 3.46Å; S273-L277 PolarHBondContact O-N 3.06Å; F274-L277 HydrophobicContact CD1-CD1 4.1Å; L277-A279 PolarHBondContact O-N 3.02Å; L277-G280 PolarHBondContact O-N 3.4Å; L277-I281 HydrophobicContact CB-CD1 4.28Å; L277-I281 WeakPolarHBondContact O-CG1 3.48Å; L277-I281 PolarHBondContact O-N 2.89Å |
| 278 | P | 96.4 | Very high | 94.4 | Very high | 19 Ų | 19 | 55.3 Ų | 55.3 | 12% | 0.123 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -53.7 | -36.4 | 176.5 | -29.8 | 35.7 | 0 | 0 | 0 | 114.1 | L197 L201 F274 L282 | L197-P278 HydrophobicContact CD1-CB 4.5Å; L201-P278 HydrophobicContact CD2-CG 4.07Å; L201-P278 HydrophobicContact CG-CG 4.44Å; F274-P278 VanDerWaalsContact O-CD 3.27Å; F274-P278 WeakPolarHBondContact O-CD 3.43Å; P278-L282 WeakPolarHBondContact O-CB 3.48Å; P278-L282 VanDerWaalsContact O-CG 3.23Å; P278-L282 WeakPolarHBondContact O-CG 3.34Å; P278-L282 PolarHBondContact O-N 3.06Å |
| 279 | A | 96.1 | Very high | 94 | Very high | 73 Ų | 73 | 56 Ų | 56 | 60% | 0.603 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -67.9 | -42.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | A276 L277 G283 | A276-A279 WeakPolarHBondContact O-CB 3.45Å; A276-A279 PolarHBondContact O-N 2.83Å; A276-A279 VanDerWaalsContact O-N 3.14Å; L277-A279 PolarHBondContact O-N 3.02Å; A279-G283 PolarHBondContact O-N 3.42Å |
| 280 | G | 96.4 | Very high | 93.6 | Very high | 46 Ų | 46 | 55.6 Ų | 55.6 | 47% | 0.474 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -66.8 | -41.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | L277 G283 S284 | L277-G280 PolarHBondContact O-N 3.4Å; G280-G283 PolarHBondContact O-N 3.12Å; G280-S284 WeakPolarHBondContact O-CB 3.29Å; G280-S284 PolarHBondContact O-N 3.16Å; G280-S284 PolarHBondContact O-OG 3.13Å |
| 281 | I | 96 | Very high | 93.3 | Very high | 22 Ų | 22 | 54 Ų | 54 | 11% | 0.113 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -63 | -47.9 | 176.1 | -66.3 | 161.1 | 0 | 0 | 0 | 110.3 | H193 E196 T200 L277 S284 G285 | H193-I281 HydrophobicContact CB-CG2 3.6Å; E196-I281 HydrophobicContact CB-CD1 4.05Å; E196-I281 HydrophobicContact CB-CG2 4.43Å; E196-I281 WeakPolarHBondContact OE2-CG2 3.22Å; T200-I281 HydrophobicContact CG2-CD1 4.01Å; L277-I281 HydrophobicContact CB-CD1 4.28Å; L277-I281 WeakPolarHBondContact O-CG1 3.48Å; L277-I281 PolarHBondContact O-N 2.89Å; I281-S284 PolarHBondContact O-OG 3.31Å; I281-S284 VanDerWaalsContact O-OG 3.07Å; I281-G285 PolarHBondContact O-N 2.94Å |
| 282 | L | 96.3 | Very high | 92.7 | Very high | 37 Ų | 37 | 60 Ų | 60 | 19% | 0.194 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65.7 | -43.5 | 177.6 | -67.9 | 176 | 0 | 0 | 0 | 111.8 | V189 V190 L197 P278 G285 F286 | V189-L282 HydrophobicContact CG1-CD2 3.95Å; V190-L282 HydrophobicContact CG2-CD2 3.76Å; L197-L282 HydrophobicContact CD1-CD1 4.33Å; L197-L282 HydrophobicContact CD1-CD2 4.2Å; L197-L282 HydrophobicContact CD1-CG 4.27Å; P278-L282 WeakPolarHBondContact O-CB 3.48Å; P278-L282 VanDerWaalsContact O-CG 3.23Å; P278-L282 WeakPolarHBondContact O-CG 3.34Å; P278-L282 PolarHBondContact O-N 3.06Å; L282-G285 PolarHBondContact O-N 3.25Å; L282-F286 HydrophobicContact CB-CE2 4.36Å; L282-F286 WeakPolarHBondContact O-CD2 3.37Å; L282-F286 PolarHBondContact O-N 2.93Å |
| 283 | G | 95.5 | Very high | 91.7 | Very high | 40 Ų | 40 | 65.6 Ų | 65.6 | 41% | 0.412 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -59.3 | -48.8 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | A279 G280 F286 A287 | A279-G283 PolarHBondContact O-N 3.42Å; G280-G283 PolarHBondContact O-N 3.12Å; G283-F286 PolarHBondContact O-N 3.29Å; G283-A287 PolarHBondContact O-N 3.38Å |
| 284 | S | 94.5 | Very high | 90.7 | Very high | 60 Ų | 60 | 68.5 Ų | 68.5 | 42% | 0.42 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -65.3 | -41.2 | 175.6 | 57.9 | 0 | 0 | 0 | 0 | 112.2 | G280 I281 F286 A287 L288 | G280-S284 WeakPolarHBondContact O-CB 3.29Å; G280-S284 PolarHBondContact O-N 3.16Å; G280-S284 PolarHBondContact O-OG 3.13Å; I281-S284 PolarHBondContact O-OG 3.31Å; I281-S284 VanDerWaalsContact O-OG 3.07Å; S284-F286 PolarHBondContact O-N 3.2Å; S284-A287 PolarHBondContact O-N 3.24Å; S284-L288 WeakPolarHBondContact O-CG 3.39Å; S284-L288 PolarHBondContact O-N 3.12Å |
| 285 | G | 93 | Very high | 89.3 | Confident | 4 Ų | 4 | 74.3 Ų | 74.3 | 4% | 0.041 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -59.5 | -39 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | I281 L282 K289 | I281-G285 PolarHBondContact O-N 2.94Å; L282-G285 PolarHBondContact O-N 3.25Å; G285-K289 VanDerWaalsContact O-CB 3.29Å; G285-K289 WeakPolarHBondContact O-CB 3.37Å; G285-K289 PolarHBondContact O-N 2.99Å |
| 286 | F | 92.9 | Very high | 87.8 | Confident | 67 Ų | 67 | 76.6 Ų | 76.6 | 29% | 0.294 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -66 | -45.9 | 171.7 | -76.2 | -64.5 | 0 | 0 | 0 | 112.1 | L185 L186 V189 L282 G283 S284 K289 V290 | L185-F286 HydrophobicContact CD2-CD1 4.06Å; L185-F286 HydrophobicContact CD2-CE1 3.94Å; L185-F286 HydrophobicContact CG-CD1 4.2Å; L185-F286 HydrophobicContact CG-CE1 3.9Å; L186-F286 HydrophobicContact CB-CZ 4.26Å; L186-F286 HydrophobicContact CD1-CE2 4.31Å; L186-F286 HydrophobicContact CD1-CZ 3.78Å; V189-F286 HydrophobicContact CB-CE1 4.46Å; V189-F286 HydrophobicContact CG2-CD1 3.86Å; V189-F286 HydrophobicContact CG2-CE1 3.93Å; V189-F286 HydrophobicContact CG2-CG 4.42Å; L282-F286 HydrophobicContact CB-CE2 4.36Å; L282-F286 WeakPolarHBondContact O-CD2 3.37Å; L282-F286 PolarHBondContact O-N 2.93Å; G283-F286 PolarHBondContact O-N 3.29Å; S284-F286 PolarHBondContact O-N 3.2Å; F286-K289 PolarHBondContact O-N 3.44Å; F286-V290 WeakPolarHBondContact O-CG2 3.45Å; F286-V290 PolarHBondContact O-N 3.04Å |
| 287 | A | 91 | Very high | 86 | Confident | 63 Ų | 63 | 82.5 Ų | 82.5 | 52% | 0.521 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -60 | -49.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112 | G283 S284 K289 V290 Q291 | G283-A287 PolarHBondContact O-N 3.38Å; S284-A287 PolarHBondContact O-N 3.24Å; A287-K289 VanDerWaalsContact C-N 3.29Å; A287-K289 PolarHBondContact O-N 3.36Å; A287-V290 PolarHBondContact O-N 2.99Å; A287-Q291 PolarHBondContact O-N 3.21Å |
| 288 | L | 87.9 | Confident | 84.4 | Confident | 86 Ų | 86 | 85 Ų | 85 | 45% | 0.45 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -57.9 | -41.4 | 176.2 | -71 | 172.3 | 0 | 0 | 0 | 111.8 | S284 Q291 Q292 | S284-L288 WeakPolarHBondContact O-CG 3.39Å; S284-L288 PolarHBondContact O-N 3.12Å; L288-Q291 PolarHBondContact O-N 3.01Å; L288-Q292 WeakPolarHBondContact O-CB 3.44Å; L288-Q292 VanDerWaalsContact O-CG 3.3Å; L288-Q292 WeakPolarHBondContact O-CG 3.35Å; L288-Q292 PolarHBondContact O-N 3.1Å |
| 289 | K | 85.3 | Confident | 82.9 | Confident | 45 Ų | 45 | 90.5 Ų | 90.5 | 20% | 0.196 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -69.2 | -34.8 | -179.6 | -164.2 | 166.1 | -169.3 | 169.1 | 0 | 113.1 | L185 S188 V189 G285 F286 A287 K293 | L185-K289 HydrophobicContact CD1-CD 3.78Å; L185-K289 HydrophobicContact CD1-CG 4.4Å; L185-K289 PolarHBondContact O-NZ 3.09Å; S188-K289 PolarHBondContact OG-NZ 2.88Å; V189-K289 HydrophobicContact CG2-CD 3.66Å; G285-K289 VanDerWaalsContact O-CB 3.29Å; G285-K289 WeakPolarHBondContact O-CB 3.37Å; G285-K289 PolarHBondContact O-N 2.99Å; F286-K289 PolarHBondContact O-N 3.44Å; A287-K289 VanDerWaalsContact C-N 3.29Å; A287-K289 PolarHBondContact O-N 3.36Å; K289-K293 WeakPolarHBondContact O-CB 3.36Å; K289-K293 PolarHBondContact O-N 3.31Å; K289-K293 VanDerWaalsContact O-N 3.14Å |
| 290 | V | 85.4 | Confident | 81.6 | Confident | 86 Ų | 86 | 93 Ų | 93 | 52% | 0.521 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.5 | -44.9 | 170.8 | 171.9 | 0 | 0 | 0 | 0 | 110.4 | F286 A287 K293 Q294 | F286-V290 WeakPolarHBondContact O-CG2 3.45Å; F286-V290 PolarHBondContact O-N 3.04Å; A287-V290 PolarHBondContact O-N 2.99Å; V290-K293 WeakPolarHBondContact O-CB 3.45Å; V290-K293 PolarHBondContact O-N 3.4Å; V290-Q294 PolarHBondContact O-N 2.83Å |
| 291 | Q | 84.4 | Confident | 80.8 | Confident | 97 Ų | 97 | 100.5 Ų | 100.5 | 45% | 0.453 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.8 | -43.2 | 178.7 | -162.9 | -172.8 | 24.7 | 0 | 0 | 112.4 | A287 L288 K293 Q294 R295 | A287-Q291 PolarHBondContact O-N 3.21Å; L288-Q291 PolarHBondContact O-N 3.01Å; Q291-K293 VanDerWaalsContact C-N 3.34Å; Q291-K293 PolarHBondContact O-N 3.35Å; Q291-Q294 WeakPolarHBondContact O-CB 3.36Å; Q291-Q294 PolarHBondContact O-N 3.01Å; Q291-R295 PolarHBondContact O-N 3.13Å |
| 292 | Q | 79.6 | Confident | 80.2 | Confident | 130 Ų | 130 | 104.1 Ų | 104.1 | 61% | 0.607 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60 | -42.5 | 174.1 | -75.1 | 174.3 | -2.7 | 0 | 0 | 111.8 | L288 Q294 R295 Q296 | L288-Q292 WeakPolarHBondContact O-CB 3.44Å; L288-Q292 VanDerWaalsContact O-CG 3.3Å; L288-Q292 WeakPolarHBondContact O-CG 3.35Å; L288-Q292 PolarHBondContact O-N 3.1Å; Q292-Q294 PolarHBondContact O-N 3.47Å; Q292-R295 PolarHBondContact O-N 3.44Å; Q292-R295 VanDerWaalsContact O-N 3.11Å; Q292-Q296 PolarHBondContact O-N 3.34Å; Q292-Q296 VanDerWaalsContact O-N 3.1Å |
| 293 | K | 75 | Confident | 79.9 | Confident | 173 Ų | 173 | 106.6 Ų | 106.6 | 75% | 0.752 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.2 | -31 | 177.7 | -168.7 | 178.4 | -179.1 | -175.6 | 0 | 112.7 | K289 V290 Q291 | K289-K293 WeakPolarHBondContact O-CB 3.36Å; K289-K293 PolarHBondContact O-N 3.31Å; K289-K293 VanDerWaalsContact O-N 3.14Å; V290-K293 WeakPolarHBondContact O-CB 3.45Å; V290-K293 PolarHBondContact O-N 3.4Å; Q291-K293 VanDerWaalsContact C-N 3.34Å; Q291-K293 PolarHBondContact O-N 3.35Å |
| 294 | Q | 74.9 | Confident | 79.7 | Confident | 130 Ų | 130 | 108.7 Ų | 108.7 | 61% | 0.607 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -70.3 | -40.6 | 172.9 | -67.8 | 176.1 | -18.3 | 0 | 0 | 112.2 | V290 Q291 Q292 Q296 | V290-Q294 PolarHBondContact O-N 2.83Å; Q291-Q294 WeakPolarHBondContact O-CB 3.36Å; Q291-Q294 PolarHBondContact O-N 3.01Å; Q292-Q294 PolarHBondContact O-N 3.47Å; Q294-Q296 VanDerWaalsContact C-N 3.26Å; Q294-Q296 PolarHBondContact O-N 2.99Å |
| 295 | R | 67.7 | Low | 79.6 | Confident | 185 Ų | 185 | 108.9 Ų | 108.9 | 70% | 0.698 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.5 | -24.6 | 176.1 | -67.8 | -174.3 | -177.5 | -97.8 | 4.2 | 113.3 | Q291 Q292 K297 | Q291-R295 PolarHBondContact O-N 3.13Å; Q292-R295 PolarHBondContact O-N 3.44Å; Q292-R295 VanDerWaalsContact O-N 3.11Å; R295-K297 PolarHBondContact O-N 3.38Å |
| 296 | Q | 63.7 | Low | 79.6 | Confident | 109 Ų | 109 | 111.1 Ų | 111.1 | 51% | 0.509 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | 5 | -179.6 | -162.2 | 51.5 | 57.5 | 0 | 0 | 114.9 | Q292 Q294 H298 | Q292-Q296 PolarHBondContact O-N 3.34Å; Q292-Q296 VanDerWaalsContact O-N 3.1Å; Q294-Q296 VanDerWaalsContact C-N 3.26Å; Q294-Q296 PolarHBondContact O-N 2.99Å; Q296-H298 PolarHBondContact O-N 3.33Å |
| 297 | K | 56.8 | Low | 79.8 | Confident | 183 Ų | 183 | 109.9 Ų | 109.9 | 80% | 0.796 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -8.1 | 176.1 | -81.3 | -177.4 | 174.4 | -179.4 | 0 | 115.2 | R295 F299 | R295-K297 PolarHBondContact O-N 3.38Å; K297-F299 PolarHBondContact O-N 3Å |
| 298 | H | 64.1 | Low | 80 | Confident | 130 Ų | 130 | 109.9 Ų | 109.9 | 60% | 0.602 | 54% | 0.544 | S | S | * | . | G | 310 helix | trans | -71.7 | 35.2 | 169.4 | -62.7 | -72.2 | 0 | 0 | 0 | 114.6 | Q296 N300 R301 | Q296-H298 PolarHBondContact O-N 3.33Å; H298-N300 PolarHBondContact O-N 2.91Å; H298-R301 WeakPolarHBondContact O-CB 3.48Å; H298-R301 PolarHBondContact O-N 3.24Å |
| 299 | F | 63.9 | Low | 80.5 | Confident | 134 Ų | 134 | 111.5 Ų | 111.5 | 59% | 0.588 | 55% | 0.552 | S | S | * | * | G | 310 helix | trans | -54 | -35.8 | 177.1 | -176.7 | -106.2 | 0 | 0 | 0 | 112.3 | K297 R301 Q302 I303 | K297-F299 PolarHBondContact O-N 3Å; F299-R301 PolarHBondContact O-N 3.3Å; F299-R301 VanDerWaalsContact O-N 3.09Å; F299-Q302 WeakPolarHBondContact O-CB 3.35Å; F299-Q302 PolarHBondContact O-N 3.42Å; F299-I303 HydrophobicContact CD1-CD1 4.43Å; F299-I303 HydrophobicContact CD1-CG1 4.47Å; F299-I303 HydrophobicContact CE1-CD1 4.42Å; F299-I303 HydrophobicContact CE1-CG1 4.32Å |
| 300 | N | 69.1 | Low | 81 | Confident | 127 Ų | 127 | 115.2 Ų | 115.2 | 68% | 0.679 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -58.4 | -25.2 | 177.7 | -65.1 | 2.1 | 0 | 0 | 0 | 113.6 | H298 Q302 P304 | H298-N300 PolarHBondContact O-N 2.91Å; N300-Q302 VanDerWaalsContact C-N 3.32Å; N300-P304 WeakPolarHBondContact O-CD 3.38Å |
| 301 | R | 79.4 | Confident | 81.5 | Confident | 203 Ų | 203 | 115.8 Ų | 115.8 | 77% | 0.766 | 57% | 0.57 | S | S | * | * | G | 310 helix | trans | -76.3 | -19 | 176.5 | -158.2 | 169 | 79.2 | -171.8 | 6.2 | 112.9 | H298 F299 | H298-R301 WeakPolarHBondContact O-CB 3.48Å; H298-R301 PolarHBondContact O-N 3.24Å; F299-R301 PolarHBondContact O-N 3.3Å; F299-R301 VanDerWaalsContact O-N 3.09Å |
| 302 | Q | 84.6 | Confident | 82 | Confident | 97 Ų | 97 | 114.1 Ų | 114.1 | 45% | 0.453 | 57% | 0.566 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87 | -23.7 | 177.8 | -64.7 | 177.3 | -21.7 | 0 | 0 | 112.8 | F299 N300 A305 A306 | F299-Q302 WeakPolarHBondContact O-CB 3.35Å; F299-Q302 PolarHBondContact O-N 3.42Å; N300-Q302 VanDerWaalsContact C-N 3.32Å; Q302-A305 PolarHBondContact O-N 3.41Å; Q302-A306 WeakPolarHBondContact O-CB 3.37Å; Q302-A306 PolarHBondContact O-N 3.07Å |
| 303 | I | 88.2 | Confident | 82.8 | Confident | 90 Ų | 90 | 110.7 Ų | 110.7 | 46% | 0.462 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -54.2 | -53.5 | 179.3 | -58.8 | 177.4 | 0 | 0 | 0 | 112.9 | F299 A305 A306 A307 | F299-I303 HydrophobicContact CD1-CD1 4.43Å; F299-I303 HydrophobicContact CD1-CG1 4.47Å; F299-I303 HydrophobicContact CE1-CD1 4.42Å; F299-I303 HydrophobicContact CE1-CG1 4.32Å; I303-A305 VanDerWaalsContact C-N 3.33Å; I303-A305 PolarHBondContact O-N 3.41Å; I303-A306 PolarHBondContact O-N 3.19Å; I303-A307 WeakPolarHBondContact O-CB 3.25Å; I303-A307 PolarHBondContact O-N 3.36Å |
| 304 | P | 92.4 | Very high | 83.8 | Confident | 84 Ų | 84 | 109.3 Ų | 109.3 | 55% | 0.545 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -66.3 | -33.8 | -179.5 | 25.7 | -34.8 | 0 | 0 | 0 | 112.8 | N300 A307 S308 | N300-P304 WeakPolarHBondContact O-CD 3.38Å; P304-A307 PolarHBondContact O-N 2.84Å; P304-S308 WeakPolarHBondContact O-CB 3.46Å; P304-S308 PolarHBondContact O-N 3.13Å |
| 305 | A | 92 | Very high | 84.6 | Confident | 63 Ų | 63 | 107.3 Ų | 107.3 | 52% | 0.521 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.7 | -43.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q302 I303 S308 L309 | Q302-A305 PolarHBondContact O-N 3.41Å; I303-A305 VanDerWaalsContact C-N 3.33Å; I303-A305 PolarHBondContact O-N 3.41Å; A305-S308 PolarHBondContact O-N 3.38Å; A305-L309 PolarHBondContact O-N 3.04Å |
| 306 | A | 94.1 | Very high | 85.9 | Confident | 51 Ų | 51 | 102.9 Ų | 102.9 | 42% | 0.421 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.4 | -41 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q302 I303 L309 I310 | Q302-A306 WeakPolarHBondContact O-CB 3.37Å; Q302-A306 PolarHBondContact O-N 3.07Å; I303-A306 PolarHBondContact O-N 3.19Å; A306-L309 PolarHBondContact O-N 2.85Å; A306-I310 WeakPolarHBondContact O-CG1 3.31Å; A306-I310 PolarHBondContact O-N 3.15Å; A306-I310 VanDerWaalsContact O-N 3.13Å |
| 307 | A | 95.4 | Very high | 87.3 | Confident | 42 Ų | 42 | 103.2 Ų | 103.2 | 35% | 0.347 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | I303 P304 I310 Q311 | I303-A307 WeakPolarHBondContact O-CB 3.25Å; I303-A307 PolarHBondContact O-N 3.36Å; P304-A307 PolarHBondContact O-N 2.84Å; A307-I310 PolarHBondContact O-N 3.01Å; A307-Q311 VanDerWaalsContact O-CG 3.31Å; A307-Q311 WeakPolarHBondContact O-CG 3.46Å; A307-Q311 PolarHBondContact O-N 3.4Å; A307-Q311 VanDerWaalsContact O-N 3.07Å |
| 308 | S | 96.5 | Very high | 89 | Confident | 63 Ų | 63 | 94.9 Ų | 94.9 | 44% | 0.441 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -58.5 | -49.5 | 175.8 | -171.5 | 0 | 0 | 0 | 0 | 111.5 | P304 A305 I310 Q311 T312 | P304-S308 WeakPolarHBondContact O-CB 3.46Å; P304-S308 PolarHBondContact O-N 3.13Å; A305-S308 PolarHBondContact O-N 3.38Å; S308-I310 PolarHBondContact O-N 3.38Å; S308-Q311 PolarHBondContact O-N 3.33Å; S308-Q311 VanDerWaalsContact O-N 3.13Å; S308-T312 PolarHBondContact O-N 3.15Å; S308-T312 PolarHBondContact O-OG1 3.01Å |
| 309 | L | 97.1 | Very high | 90.4 | Very high | 120 Ų | 120 | 90.6 Ų | 90.6 | 63% | 0.628 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -57.7 | -43.8 | 178.6 | 178.9 | 63.1 | 0 | 0 | 0 | 113 | A305 A306 Q311 T312 A313 | A305-L309 PolarHBondContact O-N 3.04Å; A306-L309 PolarHBondContact O-N 2.85Å; L309-Q311 VanDerWaalsContact C-N 3.35Å; L309-T312 PolarHBondContact O-OG1 2.99Å; L309-A313 VanDerWaalsContact O-CB 3.25Å; L309-A313 WeakPolarHBondContact O-CB 3.27Å; L309-A313 PolarHBondContact O-N 2.95Å |
| 310 | I | 96.3 | Very high | 91.8 | Very high | 123 Ų | 123 | 90.2 Ų | 90.2 | 63% | 0.631 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.3 | -44 | 177.2 | -67.1 | 164.9 | 0 | 0 | 0 | 110.3 | A306 A307 S308 W314 | A306-I310 WeakPolarHBondContact O-CG1 3.31Å; A306-I310 PolarHBondContact O-N 3.15Å; A306-I310 VanDerWaalsContact O-N 3.13Å; A307-I310 PolarHBondContact O-N 3.01Å; S308-I310 PolarHBondContact O-N 3.38Å; I310-W314 WeakPolarHBondContact O-CB 3.36Å; I310-W314 PolarHBondContact O-N 3.08Å |
| 311 | Q | 95.6 | Very high | 92.8 | Very high | 97 Ų | 97 | 86.6 Ų | 86.6 | 45% | 0.453 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -69.9 | -39.8 | -178.9 | -68.2 | 179.4 | 22.9 | 0 | 0 | 113 | A307 S308 L309 R315 | A307-Q311 VanDerWaalsContact O-CG 3.31Å; A307-Q311 WeakPolarHBondContact O-CG 3.46Å; A307-Q311 PolarHBondContact O-N 3.4Å; A307-Q311 VanDerWaalsContact O-N 3.07Å; S308-Q311 PolarHBondContact O-N 3.33Å; S308-Q311 VanDerWaalsContact O-N 3.13Å; L309-Q311 VanDerWaalsContact C-N 3.35Å; Q311-R315 WeakPolarHBondContact O-CB 3.37Å; Q311-R315 VanDerWaalsContact O-CG 3.28Å; Q311-R315 WeakPolarHBondContact O-CG 3.28Å; Q311-R315 PolarHBondContact O-N 3.13Å |
| 312 | T | 95.7 | Very high | 93.1 | Very high | 63 Ų | 63 | 81.9 Ų | 81.9 | 39% | 0.387 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -68.4 | -45.5 | 177.6 | 52.7 | 0 | 0 | 0 | 0 | 110.9 | S308 L309 W314 R315 C316 | S308-T312 PolarHBondContact O-N 3.15Å; S308-T312 PolarHBondContact O-OG1 3.01Å; L309-T312 PolarHBondContact O-OG1 2.99Å; T312-W314 VanDerWaalsContact C-N 3.33Å; T312-W314 PolarHBondContact O-N 3.37Å; T312-R315 PolarHBondContact O-N 3.29Å; T312-R315 VanDerWaalsContact O-N 3.13Å; T312-C316 PolarHBondContact O-N 2.82Å; T312-C316 PolarHBondContact O-SG 2.95Å; T312-C316 VanDerWaalsContact O-SG 3.33Å |
| 313 | A | 96.4 | Very high | 93.3 | Very high | 57 Ų | 57 | 84.4 Ų | 84.4 | 47% | 0.471 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.2 | -43.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | L309 C316 Y317 | L309-A313 VanDerWaalsContact O-CB 3.25Å; L309-A313 WeakPolarHBondContact O-CB 3.27Å; L309-A313 PolarHBondContact O-N 2.95Å; A313-C316 PolarHBondContact O-N 2.77Å; A313-Y317 PolarHBondContact O-N 3.32Å; A313-Y317 VanDerWaalsContact O-N 3.08Å |
| 314 | W | 95.3 | Very high | 93.4 | Very high | 145 Ų | 145 | 81 Ų | 81 | 55% | 0.549 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.7 | -38.8 | 175 | -178 | 82.4 | 0 | 0 | 0 | 112.7 | I310 T312 Y317 A318 T326 | I310-W314 WeakPolarHBondContact O-CB 3.36Å; I310-W314 PolarHBondContact O-N 3.08Å; T312-W314 VanDerWaalsContact C-N 3.33Å; T312-W314 PolarHBondContact O-N 3.37Å; W314-Y317 PolarHBondContact O-N 3.08Å; W314-A318 HydrophobicContact CD2-CB 4.29Å; W314-A318 HydrophobicContact CE3-CB 4.31Å; W314-A318 HydrophobicContact CH2-CB 4.08Å; W314-A318 HydrophobicContact CZ2-CB 4.05Å; W314-A318 HydrophobicContact CZ3-CB 4.2Å; W314-A318 WeakPolarHBondContact O-CB 3.48Å; W314-A318 PolarHBondContact O-N 3.03Å; W314-T326 WeakPolarHBondContact CZ3-OG1 3.35Å |
| 315 | R | 92.8 | Very high | 93.1 | Very high | 88 Ų | 88 | 80.1 Ų | 80.1 | 33% | 0.332 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.5 | -38.9 | 175.4 | -75.6 | 177.6 | -168.1 | 111.5 | 6.4 | 112.2 | Q311 T312 A318 A319 T326 | Q311-R315 WeakPolarHBondContact O-CB 3.37Å; Q311-R315 VanDerWaalsContact O-CG 3.28Å; Q311-R315 WeakPolarHBondContact O-CG 3.28Å; Q311-R315 PolarHBondContact O-N 3.13Å; T312-R315 PolarHBondContact O-N 3.29Å; T312-R315 VanDerWaalsContact O-N 3.13Å; R315-A318 PolarHBondContact O-N 3.13Å; R315-A319 WeakPolarHBondContact O-CB 3.46Å; R315-A319 PolarHBondContact O-N 3.41Å; R315-T326 HydrophobicContact CB-CG2 4.39Å; R315-T326 HydrophobicContact CG-CG2 4.26Å |
| 316 | C | 93.8 | Very high | 92.9 | Very high | 92 Ų | 92 | 77.4 Ų | 77.4 | 62% | 0.622 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -61.7 | -49.1 | 173.9 | -66.7 | 0 | 0 | 0 | 0 | 111.5 | T312 A313 A318 A319 | T312-C316 PolarHBondContact O-N 2.82Å; T312-C316 PolarHBondContact O-SG 2.95Å; T312-C316 VanDerWaalsContact O-SG 3.33Å; A313-C316 PolarHBondContact O-N 2.77Å; C316-A318 PolarHBondContact O-N 3.4Å; C316-A319 WeakPolarHBondContact O-CB 3.4Å; C316-A319 PolarHBondContact O-N 3.47Å |
| 317 | Y | 94.6 | Very high | 92.6 | Very high | 116 Ų | 116 | 80.2 Ų | 80.2 | 46% | 0.455 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -59.5 | -45.4 | 174.5 | 173.5 | -106.2 | 0 | 0 | 0 | 112.2 | L22 A313 W314 A319 E320 | L22-Y317 WeakPolarHBondContact CD2-OH 3.16Å; A313-Y317 PolarHBondContact O-N 3.32Å; A313-Y317 VanDerWaalsContact O-N 3.08Å; W314-Y317 PolarHBondContact O-N 3.08Å; Y317-A319 PolarHBondContact O-N 3.24Å; Y317-E320 WeakPolarHBondContact O-CB 3.41Å; Y317-E320 PolarHBondContact O-N 2.93Å |
| 318 | A | 92.4 | Very high | 92.2 | Very high | 8 Ų | 8 | 85.3 Ų | 85.3 | 7% | 0.066 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -71.9 | -8.5 | -179 | 0 | 0 | 0 | 0 | 0 | 114.1 | W314 R315 C316 S324 T326 | W314-A318 HydrophobicContact CD2-CB 4.29Å; W314-A318 HydrophobicContact CE3-CB 4.31Å; W314-A318 HydrophobicContact CH2-CB 4.08Å; W314-A318 HydrophobicContact CZ2-CB 4.05Å; W314-A318 HydrophobicContact CZ3-CB 4.2Å; W314-A318 WeakPolarHBondContact O-CB 3.48Å; W314-A318 PolarHBondContact O-N 3.03Å; R315-A318 PolarHBondContact O-N 3.13Å; C316-A318 PolarHBondContact O-N 3.4Å; A318-S324 WeakPolarHBondContact O-CB 3.38Å; A318-S324 PolarHBondContact O-OG 2.85Å; A318-T326 WeakPolarHBondContact CB-OG1 3.06Å |
| 319 | A | 92.4 | Very high | 91.8 | Very high | 39 Ų | 39 | 87.1 Ų | 87.1 | 32% | 0.322 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -81 | -19.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | R315 C316 Y317 N321 W327 | R315-A319 WeakPolarHBondContact O-CB 3.46Å; R315-A319 PolarHBondContact O-N 3.41Å; C316-A319 WeakPolarHBondContact O-CB 3.4Å; C316-A319 PolarHBondContact O-N 3.47Å; Y317-A319 PolarHBondContact O-N 3.24Å; A319-N321 PolarHBondContact O-N 3.22Å; A319-W327 HydrophobicContact CB-CH2 4.25Å; A319-W327 HydrophobicContact CB-CZ2 3.81Å; A319-W327 WeakPolarHBondContact O-CZ2 3.44Å |
| 320 | E | 92.8 | Very high | 91.1 | Very high | 127 Ų | 127 | 89.5 Ų | 89.5 | 59% | 0.593 | 46% | 0.457 | S | S | * | . | S | Bend | trans | -65.6 | -17.3 | 172.9 | -62.6 | -177.6 | 175.7 | 0 | 0 | 112.6 | Y317 | Y317-E320 WeakPolarHBondContact O-CB 3.41Å; Y317-E320 PolarHBondContact O-N 2.93Å |
| 321 | N | 90.8 | Very high | 90.3 | Very high | 51 Ų | 51 | 89.3 Ų | 89.3 | 27% | 0.273 | 46% | 0.461 | S | S | . | . | trans | -102.6 | 112.4 | 174.5 | -174.6 | -8.7 | 0 | 0 | 0 | 110.7 | L22 A319 D323 S324 W327 | L22-N321 HydrophobicContact CD1-CB 3.8Å; A319-N321 PolarHBondContact O-N 3.22Å; N321-D323 VanDerWaalsContact C-N 3.29Å; N321-D323 PolarHBondContact O-N 2.88Å; N321-D323 PolarHBondContact OD1-N 2.87Å; N321-S324 WeakPolarHBondContact O-CB 3.31Å; N321-S324 PolarHBondContact O-N 3.07Å; N321-W327 PolarHBondContact O-NE1 3.14Å; N321-W327 VanDerWaalsContact O-NE1 3.09Å | ||
| 322 | P | 86.9 | Confident | 89 | Confident | 104 Ų | 104 | 95 Ų | 95 | 68% | 0.675 | 48% | 0.478 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -32.3 | 177.1 | -24.8 | 35.7 | 0 | 0 | 0 | 114.1 | S324 | P322-S324 PolarHBondContact O-N 3.14Š|
| 323 | D | 88.4 | Confident | 87.1 | Confident | 150 Ų | 150 | 100.9 Ų | 100.9 | 80% | 0.802 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.8 | 1.8 | -179.1 | -60.5 | -46 | 0 | 0 | 0 | 113 | N321 | N321-D323 VanDerWaalsContact C-N 3.29Å; N321-D323 PolarHBondContact O-N 2.88Å; N321-D323 PolarHBondContact OD1-N 2.87Å |
| 324 | S | 89.4 | Confident | 85.2 | Confident | 18 Ų | 18 | 104 Ų | 104 | 13% | 0.126 | 51% | 0.513 | C | S | . | . | trans | -62.9 | 137.6 | -177.7 | -176.5 | 0 | 0 | 0 | 0 | 113.1 | A318 N321 P322 T326 W327 | A318-S324 WeakPolarHBondContact O-CB 3.38Å; A318-S324 PolarHBondContact O-OG 2.85Å; N321-S324 WeakPolarHBondContact O-CB 3.31Å; N321-S324 PolarHBondContact O-N 3.07Å; P322-S324 PolarHBondContact O-N 3.14Å; S324-T326 PolarHBondContact O-N 3.12Å; S324-T326 PolarHBondContact OG-N 3.34Å; S324-T326 PolarHBondContact OG-OG1 3.32Å; S324-W327 PolarHBondContact O-N 3.35Å; S324-W327 VanDerWaalsContact O-N 3.14Å | ||
| 325 | A | 86.2 | Confident | 83.2 | Confident | 65 Ų | 65 | 101.7 Ų | 101.7 | 54% | 0.537 | 53% | 0.525 | S | S | . | . | G | 310 helix | trans | -60.5 | -15.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | W327 K328 | A325-W327 VanDerWaalsContact C-N 3.25Å; A325-W327 PolarHBondContact O-N 2.76Å; A325-K328 HydrophobicContact CB-CD 4.49Å; A325-K328 WeakPolarHBondContact O-CB 3.35Å; A325-K328 PolarHBondContact O-N 2.81Å; A325-K328 VanDerWaalsContact O-N 3.12Å |
| 326 | T | 88.1 | Confident | 80.9 | Confident | 7 Ų | 7 | 108.3 Ų | 108.3 | 4% | 0.043 | 55% | 0.55 | C | S | . | * | G | 310 helix | trans | -54.9 | -39.5 | 172.2 | -62.8 | 0 | 0 | 0 | 0 | 112.1 | W314 R315 A318 S324 K328 I329 | W314-T326 WeakPolarHBondContact CZ3-OG1 3.35Å; R315-T326 HydrophobicContact CB-CG2 4.39Å; R315-T326 HydrophobicContact CG-CG2 4.26Å; A318-T326 WeakPolarHBondContact CB-OG1 3.06Å; S324-T326 PolarHBondContact O-N 3.12Å; S324-T326 PolarHBondContact OG-N 3.34Å; S324-T326 PolarHBondContact OG-OG1 3.32Å; T326-K328 VanDerWaalsContact C-N 3.28Å; T326-K328 PolarHBondContact O-N 3.09Å; T326-I329 WeakPolarHBondContact O-CB 3.05Å; T326-I329 WeakPolarHBondContact O-CG1 3.47Å; T326-I329 PolarHBondContact O-N 3.21Å |
| 327 | W | 87.8 | Confident | 78.3 | Confident | 110 Ų | 110 | 109.1 Ų | 109.1 | 42% | 0.417 | 56% | 0.557 | S | S | . | * | G | 310 helix | trans | -68.4 | -26.6 | 179.5 | -59.9 | 111.9 | 0 | 0 | 0 | 113.3 | A319 N321 S324 A325 I329 Y330 V331 | A319-W327 HydrophobicContact CB-CH2 4.25Å; A319-W327 HydrophobicContact CB-CZ2 3.81Å; A319-W327 WeakPolarHBondContact O-CZ2 3.44Å; N321-W327 PolarHBondContact O-NE1 3.14Å; N321-W327 VanDerWaalsContact O-NE1 3.09Å; S324-W327 PolarHBondContact O-N 3.35Å; S324-W327 VanDerWaalsContact O-N 3.14Å; A325-W327 VanDerWaalsContact C-N 3.25Å; A325-W327 PolarHBondContact O-N 2.76Å; W327-I329 PolarHBondContact O-N 3.21Å; W327-I329 VanDerWaalsContact O-N 3.12Å; W327-Y330 HydrophobicContact CE3-CD2 4.36Å; W327-Y330 PolarHBondContact O-N 3.04Å; W327-V331 PolarHBondContact O-N 2.99Å |
| 328 | K | 87.6 | Confident | 75.8 | Confident | 148 Ų | 148 | 111.7 Ų | 111.7 | 64% | 0.643 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -63 | -19.6 | 177 | -60.3 | -177.5 | 179.3 | 179.2 | 0 | 112.8 | A325 T326 Y330 R332 | A325-K328 HydrophobicContact CB-CD 4.49Å; A325-K328 WeakPolarHBondContact O-CB 3.35Å; A325-K328 PolarHBondContact O-N 2.81Å; A325-K328 VanDerWaalsContact O-N 3.12Å; T326-K328 VanDerWaalsContact C-N 3.28Å; T326-K328 PolarHBondContact O-N 3.09Å; K328-Y330 VanDerWaalsContact C-N 3.3Å; K328-R332 WeakPolarHBondContact O-CB 3.49Å; K328-R332 PolarHBondContact O-N 3.23Å |
| 329 | I | 86.4 | Confident | 73.3 | Confident | 102 Ų | 102 | 117.2 Ų | 117.2 | 52% | 0.523 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -63.7 | -37.6 | 173.7 | -59.7 | 173.6 | 0 | 0 | 0 | 110.9 | T326 W327 | T326-I329 WeakPolarHBondContact O-CB 3.05Å; T326-I329 WeakPolarHBondContact O-CG1 3.47Å; T326-I329 PolarHBondContact O-N 3.21Å; W327-I329 PolarHBondContact O-N 3.21Å; W327-I329 VanDerWaalsContact O-N 3.12Å |
| 330 | Y | 83.9 | Confident | 70.8 | Confident | 170 Ų | 170 | 122.9 Ų | 122.9 | 67% | 0.667 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -88.6 | -28.5 | -177.5 | -55.6 | -80.9 | 0 | 0 | 0 | 112.8 | W327 K328 | W327-Y330 HydrophobicContact CE3-CD2 4.36Å; W327-Y330 PolarHBondContact O-N 3.04Å; K328-Y330 VanDerWaalsContact C-N 3.3Å |
| 331 | V | 79.3 | Confident | 68.2 | Low | 118 Ų | 118 | 124.5 Ų | 124.5 | 72% | 0.715 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -80.1 | -28.4 | 177.7 | 179.8 | 0 | 0 | 0 | 0 | 112.3 | W327 K333 | W327-V331 PolarHBondContact O-N 2.99Å; V331-K333 PolarHBondContact O-N 3.12Å |
| 332 | R | 67.8 | Low | 65.4 | Low | 218 Ų | 218 | 127.2 Ų | 127.2 | 82% | 0.823 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -72.4 | 98.5 | 177.7 | -165.9 | 173.8 | -156.9 | 167.8 | 5.6 | 109.5 | K328 | K328-R332 WeakPolarHBondContact O-CB 3.49Å; K328-R332 PolarHBondContact O-N 3.23Å |
| 333 | K | 55.6 | Low | 63.2 | Low | 186 Ų | 186 | 128.1 Ų | 128.1 | 81% | 0.809 | 67% | 0.671 | S | S | * | * | trans | -43.6 | 135.5 | 170.4 | -69.5 | -177.6 | 178.9 | 177.9 | 0 | 109.3 | V331 A335 | V331-K333 PolarHBondContact O-N 3.12Å; K333-A335 PolarHBondContact O-N 3.27Å | ||
| 334 | P | 56.4 | Low | 60.6 | Low | 121 Ų | 121 | 126 Ų | 126 | 79% | 0.786 | 67% | 0.668 | S | S | * | * | trans | -54.7 | 131.5 | 172.8 | 24.5 | -33 | 0 | 0 | 0 | 107.8 | R336 | P334-R336 PolarHBondContact O-N 3.06Š| ||
| 335 | A | 53.7 | Low | 58.2 | Low | 97 Ų | 97 | 130.8 Ų | 130.8 | 80% | 0.802 | 70% | 0.698 | S | S | * | * | trans | -55.7 | 121.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 107.1 | K333 S337 | K333-A335 PolarHBondContact O-N 3.27Å; A335-S337 PolarHBondContact O-N 3.36Å | ||
| 336 | R | 45.5 | Very low | 55.9 | Low | 227 Ų | 227 | 137.1 Ų | 137.1 | 86% | 0.857 | 71% | 0.714 | S | S | * | * | trans | -55.7 | 109.6 | 171.2 | -81.5 | 179.8 | 169.9 | 171 | -4.9 | 106.1 | P334 H338 | P334-R336 PolarHBondContact O-N 3.06Å; R336-H338 VanDerWaalsContact C-N 3.29Å; R336-H338 PolarHBondContact O-N 3.24Å | ||
| 337 | S | 39.3 | Very low | 53.5 | Low | 109 Ų | 109 | 142.7 Ų | 142.7 | 76% | 0.762 | 75% | 0.75 | S | S | * | * | trans | -59.3 | 101.5 | 163.8 | 48.4 | 0 | 0 | 0 | 0 | 105.8 | A335 T339 | A335-S337 PolarHBondContact O-N 3.36Å; S337-T339 PolarHBondContact O-N 3.02Å; S337-T339 VanDerWaalsContact O-N 3.14Å | ||
| 338 | H | 40.8 | Very low | 51.1 | Low | 170 Ų | 170 | 147.5 Ų | 147.5 | 79% | 0.787 | 77% | 0.774 | S | S | * | * | trans | -55.3 | 124.1 | 168.8 | -85.2 | -98.2 | 0 | 0 | 0 | 106.7 | R336 L340 | R336-H338 VanDerWaalsContact C-N 3.29Å; R336-H338 PolarHBondContact O-N 3.24Å; H338-L340 VanDerWaalsContact C-N 3.29Å; H338-L340 PolarHBondContact O-N 2.99Å | ||
| 339 | T | 40.3 | Very low | 48.5 | Very low | 125 Ų | 125 | 150 Ų | 150 | 77% | 0.767 | 79% | 0.785 | S | S | * | * | trans | -60.7 | 90.9 | -178.1 | -41.3 | 0 | 0 | 0 | 0 | 108.8 | S337 L341 | S337-T339 PolarHBondContact O-N 3.02Å; S337-T339 VanDerWaalsContact O-N 3.14Å; T339-L341 PolarHBondContact O-N 2.97Å; T339-L341 VanDerWaalsContact O-N 3.13Å | ||
| 340 | L | 39.8 | Very low | 46.2 | Very low | 158 Ų | 158 | 150.8 Ų | 150.8 | 83% | 0.827 | 80% | 0.799 | S | S | * | * | trans | -61.6 | 116.2 | 161 | -73 | 179 | 0 | 0 | 0 | 105.6 | H338 S342 | H338-L340 VanDerWaalsContact C-N 3.29Å; H338-L340 PolarHBondContact O-N 2.99Å; L340-S342 PolarHBondContact O-N 3.22Å | ||
| 341 | L | 38 | Very low | 43.7 | Very low | 161 Ų | 161 | 149.3 Ų | 149.3 | 84% | 0.843 | 81% | 0.808 | S | S | * | * | trans | -57.7 | 109.2 | -175.3 | -73 | 95.9 | 0 | 0 | 0 | 109.5 | T339 P343 | T339-L341 PolarHBondContact O-N 2.97Å; T339-L341 VanDerWaalsContact O-N 3.13Å; L341-P343 VanDerWaalsContact O-CD 3.27Å; L341-P343 WeakPolarHBondContact O-CD 3.19Å | ||
| 342 | S | 33.2 | Very low | 41.6 | Very low | 108 Ų | 108 | 151.2 Ų | 151.2 | 76% | 0.755 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 118.7 | 169.2 | -51.8 | 0 | 0 | 0 | 0 | 109.1 | L340 S344 | L340-S342 PolarHBondContact O-N 3.22Å; S342-S344 PolarHBondContact O-N 2.93Å |
| 343 | P | 39.3 | Very low | 39.8 | Very low | 122 Ų | 122 | 147.3 Ų | 147.3 | 79% | 0.792 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 126.8 | 159.7 | -7.6 | 24.8 | 0 | 0 | 0 | 107.1 | L341 | L341-P343 VanDerWaalsContact O-CD 3.27Å; L341-P343 WeakPolarHBondContact O-CD 3.19Å |
| 344 | S | 34 | Very low | 38.6 | Very low | 106 Ų | 106 | 147.5 Ų | 147.5 | 74% | 0.741 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 139.7 | -179.4 | -168 | 0 | 0 | 0 | 0 | 111.6 | S342 K346 | S342-S344 PolarHBondContact O-N 2.93Å; S344-K346 PolarHBondContact O-N 3.02Å |
| 345 | P | 40 | Very low | 37.4 | Very low | 119 Ų | 119 | 151.5 Ų | 151.5 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 120 | -174.9 | 27 | -34.7 | 0 | 0 | 0 | 111.5 | ||
| 346 | K | 36.5 | Very low | 36.1 | Very low | 197 Ų | 197 | 156.5 Ų | 156.5 | 86% | 0.857 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -63 | 141.6 | 168.1 | -70.2 | -176.3 | 178.6 | 179.7 | 0 | 109.8 | S344 | S344-K346 PolarHBondContact O-N 3.02Š|
| 347 | P | 38 | Very low | 35.3 | Very low | 124 Ų | 124 | 155.2 Ų | 155.2 | 81% | 0.805 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 150.7 | -172.7 | 25.1 | -34.2 | 0 | 0 | 0 | 113 | K349 | P347-K349 PolarHBondContact O-N 2.98Š|
| 348 | K | 37.8 | Very low | 34.7 | Very low | 212 Ų | 212 | 159.4 Ų | 159.4 | 92% | 0.922 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -49 | 123.8 | -176 | -62.9 | 169.8 | 179.4 | 172.9 | 0 | 112.3 | ||
| 349 | K | 33.8 | Very low | 33.9 | Very low | 201 Ų | 201 | 161 Ų | 161 | 87% | 0.874 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 125.1 | 149.1 | -77.8 | -170 | 175 | -176.2 | 0 | 108.5 | P347 V351 | P347-K349 PolarHBondContact O-N 2.98Å; K349-V351 PolarHBondContact O-N 3.3Å |
| 350 | S | 37.5 | Very low | 33.3 | Very low | 118 Ų | 118 | 161.8 Ų | 161.8 | 83% | 0.825 | 83% | 0.829 | S | S | * | * | trans | -66.1 | 114.1 | 177.7 | 37.2 | 0 | 0 | 0 | 0 | 110.8 | M352 | S350-M352 PolarHBondContact O-N 3.2Å; S350-M352 VanDerWaalsContact O-N 3.12Å | ||
| 351 | V | 31 | Very low | 32.8 | Very low | 139 Ų | 139 | 160.6 Ų | 160.6 | 84% | 0.842 | 82% | 0.824 | S | S | * | * | trans | -80.8 | 93.3 | 168.1 | 179.7 | 0 | 0 | 0 | 0 | 108.2 | K349 V353 | K349-V351 PolarHBondContact O-N 3.3Å; V351-V353 PolarHBondContact O-N 3.35Å | ||
| 352 | M | 34.4 | Very low | 32.3 | Very low | 157 Ų | 157 | 162.6 Ų | 162.6 | 77% | 0.773 | 83% | 0.825 | S | S | * | * | trans | -65.4 | 122.6 | 170.3 | -163.8 | 170.6 | 80.7 | 0 | 0 | 109.1 | S350 K354 | S350-M352 PolarHBondContact O-N 3.2Å; S350-M352 VanDerWaalsContact O-N 3.12Å; M352-K354 PolarHBondContact O-N 3.18Å | ||
| 353 | V | 31.1 | Very low | 32 | Very low | 136 Ų | 136 | 163.3 Ų | 163.3 | 82% | 0.824 | 82% | 0.821 | S | S | * | * | trans | -64.4 | 103 | 178.4 | 176.7 | 0 | 0 | 0 | 0 | 109.1 | V351 K355 | V351-V353 PolarHBondContact O-N 3.35Å; V353-K355 PolarHBondContact O-N 2.98Å; V353-K355 VanDerWaalsContact O-N 3.09Å | ||
| 354 | K | 29.4 | Very low | 31.5 | Very low | 190 Ų | 190 | 165.5 Ų | 165.5 | 83% | 0.826 | 83% | 0.826 | S | S | * | * | trans | -70.5 | 105.4 | 177 | -94.3 | -174.8 | 173.2 | 178.9 | 0 | 110.3 | M352 K356 | M352-K354 PolarHBondContact O-N 3.18Å; K354-K356 PolarHBondContact O-N 2.84Å | ||
| 355 | K | 31.3 | Very low | 31.1 | Very low | 205 Ų | 205 | 164.1 Ų | 164.1 | 89% | 0.891 | 83% | 0.829 | S | S | * | * | trans | -45.6 | 120.6 | 162.4 | -113.3 | 176.9 | 176.6 | 176.5 | 0 | 109.5 | V353 K357 | V353-K355 PolarHBondContact O-N 2.98Å; V353-K355 VanDerWaalsContact O-N 3.09Å; K355-K357 PolarHBondContact O-N 2.92Å; K355-K357 VanDerWaalsContact O-N 3.13Å | ||
| 356 | K | 26.9 | Very low | 30.4 | Very low | 203 Ų | 203 | 166.8 Ų | 166.8 | 88% | 0.883 | 83% | 0.833 | S | S | * | * | trans | -71.3 | 104.9 | 175.6 | -171.5 | 176.1 | -178.5 | -179.4 | 0 | 108.9 | K354 | K354-K356 PolarHBondContact O-N 2.84Š| ||
| 357 | K | 28.5 | Very low | 30 | Very low | 199 Ų | 199 | 162.1 Ų | 162.1 | 87% | 0.865 | 83% | 0.825 | S | S | * | * | trans | -84.2 | 124.6 | 176.2 | -155.9 | 177.5 | -174.2 | -176.1 | 0 | 108.6 | K355 | K355-K357 PolarHBondContact O-N 2.92Å; K355-K357 VanDerWaalsContact O-N 3.13Å | ||
| 358 | F | 27 | Very low | 30 | Very low | 198 Ų | 198 | 162.3 Ų | 162.3 | 87% | 0.868 | 83% | 0.826 | S | S | * | * | trans | -64.3 | 149.5 | 170.9 | -109 | -102.9 | 0 | 0 | 0 | 110.1 | ||||
| 359 | K | 25.1 | Very low | 29.5 | Very low | 202 Ų | 202 | 155.7 Ų | 155.7 | 88% | 0.878 | 82% | 0.818 | S | S | * | * | trans | -132.6 | 137 | 172 | -157.7 | -177.3 | -177 | -167.9 | 0 | 108.1 | ||||
| 360 | L | 27.7 | Very low | 29.3 | Very low | 143 Ų | 143 | 153.5 Ų | 153.5 | 75% | 0.749 | 81% | 0.811 | S | S | * | * | trans | -106.2 | 157 | -172.7 | -163 | 72.6 | 0 | 0 | 0 | 110.6 | ||||
| 361 | D | 27.9 | Very low | 28.8 | Very low | 133 Ų | 133 | 156.1 Ų | 156.1 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | trans | 60.4 | 126.4 | 165.1 | -59.6 | -35.7 | 0 | 0 | 0 | 121.5 | ||||
| 362 | K | 27.2 | Very low | 28.6 | Very low | 202 Ų | 202 | 158.7 Ų | 158.7 | 88% | 0.878 | 81% | 0.812 | S | S | * | * | -166.4 | 151.8 | 95.2 | -168.1 | 159.1 | -177.7 | 171.5 | 0 | 112.8 | |||||
| 363 | D | 27.1 | Very low | 28.3 | Very low | 123 Ų | 123 | 160.1 Ų | 160.1 | 66% | 0.658 | 82% | 0.815 | S | S | * | * | trans | -74.9 | 155.5 | -166 | -46 | -87.4 | 0 | 0 | 0 | 118.3 | ||||
| 364 | N | 28.4 | Very low | 28 | Very low | 169 Ų | 169 | 160 Ų | 160 | 90% | 0.904 | 81% | 0.809 | S | S | * | * | 171 | 142.8 | 111.5 | -92.9 | -21 | 0 | 0 | 0 | 112.9 | |||||
| 365 | G | 26.4 | Very low | 28.2 | Very low | 77 Ų | 77 | 157.6 Ų | 157.6 | 79% | 0.794 | 81% | 0.811 | S | S | * | * | trans | 130.9 | 50.9 | 151.8 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 366 | M | 25 | Very low | 28 | Very low | 175 Ų | 175 | 153.1 Ų | 153.1 | 86% | 0.862 | 80% | 0.803 | S | S | * | * | trans | 43.9 | 108.3 | 140.7 | -136.2 | 66 | 177 | 0 | 0 | 123.8 | ||||
| 367 | S | 28.6 | Very low | 28 | Very low | 99 Ų | 99 | 152.1 Ų | 152.1 | 69% | 0.692 | 80% | 0.801 | S | S | * | * | trans | 49.5 | 163.8 | 132.1 | -62.8 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 368 | P | 38.8 | Very low | 27.9 | Very low | 127 Ų | 127 | 150.2 Ų | 150.2 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | cis | -134.8 | 165.6 | -40.7 | 37.9 | -22.4 | 0 | 0 | 0 | 113.7 | ||||
| 369 | G | 27 | Very low | 27.8 | Very low | 73 Ų | 73 | 146 Ų | 146 | 75% | 0.753 | 79% | 0.788 | S | S | * | * | trans | 179.3 | 81.4 | 175 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 370 | E | 28.2 | Very low | 27.8 | Very low | 155 Ų | 155 | 146.1 Ų | 146.1 | 72% | 0.724 | 79% | 0.785 | S | S | * | * | trans | 48 | 112.2 | 153.2 | -55.6 | -151.3 | 100.9 | 0 | 0 | 123.6 | ||||
| 371 | K | 28.4 | Very low | 27.7 | Very low | 174 Ų | 174 | 145.5 Ų | 145.5 | 76% | 0.757 | 78% | 0.782 | S | S | * | * | 53.6 | 102.4 | 128.9 | -60.7 | 167.2 | -176.4 | 151.3 | 0 | 120.7 | |||||
| 372 | M | 27.3 | Very low | 27.9 | Very low | 192 Ų | 192 | 144.3 Ų | 144.3 | 95% | 0.946 | 78% | 0.782 | S | S | * | * | -164.3 | 136.5 | 114.3 | -157.1 | 69.3 | 151.8 | 0 | 0 | 109.6 | |||||
| 373 | F | 26.4 | Very low | 28.1 | Very low | 187 Ų | 187 | 140 Ų | 140 | 82% | 0.82 | 78% | 0.775 | S | S | * | * | trans | -99.3 | 137.6 | -169.6 | -102.7 | -101.3 | 0 | 0 | 0 | 114.9 | ||||
| 374 | N | 25.5 | Very low | 28 | Very low | 133 Ų | 133 | 143.4 Ų | 143.4 | 71% | 0.711 | 79% | 0.787 | S | S | * | * | trans | 38.6 | 130.1 | 143 | -64.3 | 1.8 | 0 | 0 | 0 | 123 | ||||
| 375 | V | 33.4 | Very low | 28 | Very low | 141 Ų | 141 | 143.4 Ų | 143.4 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | trans | -98.2 | 138.4 | 143.1 | 175.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 376 | P | 28.1 | Very low | 28 | Very low | 111 Ų | 111 | 151.3 Ų | 151.3 | 72% | 0.721 | 79% | 0.793 | S | S | * | * | trans | -123.9 | 145.5 | 154.3 | 33.9 | -22 | 0 | 0 | 0 | 113.8 | ||||
| 377 | H | 26 | Very low | 28 | Very low | 182 Ų | 182 | 154.4 Ų | 154.4 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | trans | -66.7 | 161.6 | 161.9 | -113.7 | -97.8 | 0 | 0 | 0 | 110.9 | ||||
| 378 | I | 25.8 | Very low | 28.1 | Very low | 158 Ų | 158 | 154.9 Ų | 154.9 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | 178.2 | 143.9 | 123.3 | -95 | 159.9 | 0 | 0 | 0 | 112.9 | |||||
| 379 | T | 25.7 | Very low | 27.5 | Very low | 109 Ų | 109 | 156.5 Ų | 156.5 | 67% | 0.669 | 80% | 0.797 | S | S | * | * | trans | 28.2 | 141 | 155 | -52.8 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 380 | Y | 25.7 | Very low | 27.4 | Very low | 206 Ų | 206 | 160.9 Ų | 160.9 | 81% | 0.808 | 80% | 0.798 | S | S | * | * | trans | -121.4 | 119.4 | 162.1 | -157.9 | -81.8 | 0 | 0 | 0 | 109 | ||||
| 381 | D | 25 | Very low | 27.3 | Very low | 129 Ų | 129 | 163.9 Ų | 163.9 | 69% | 0.69 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -102 | 159.5 | 168.1 | -91.1 | -50.8 | 0 | 0 | 0 | 109.6 | ||
| 382 | P | 31.7 | Very low | 27 | Very low | 108 Ų | 108 | 160 Ų | 160 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 157.8 | -169.2 | 29.5 | -35.7 | 0 | 0 | 0 | 113.8 | ||
| 383 | P | 32.7 | Very low | 27 | Very low | 113 Ų | 113 | 158.3 Ų | 158.3 | 73% | 0.734 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 135.2 | -168.9 | 32.2 | -34.9 | 0 | 0 | 0 | 113.8 | ||
| 384 | E | 25.1 | Very low | 26.9 | Very low | 193 Ų | 193 | 156.3 Ų | 156.3 | 90% | 0.902 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -88.1 | 139.2 | 159.9 | -71.1 | -173.7 | 132.8 | 0 | 0 | 110.9 | ||
| 385 | D | 27.4 | Very low | 26.9 | Very low | 170 Ų | 170 | 153.4 Ų | 153.4 | 91% | 0.909 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 129.9 | 175.2 | -101.3 | -40.7 | 0 | 0 | 0 | 112.1 | ||
| 386 | R | 27.2 | Very low | 26.7 | Very low | 242 Ų | 242 | 158 Ų | 158 | 91% | 0.913 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -85.1 | 119.5 | 170.2 | -80.9 | -177 | 172.4 | 173.4 | -2.9 | 111 | ||
| 387 | R | 25 | Very low | 26.5 | Very low | 241 Ų | 241 | 159.6 Ų | 159.6 | 91% | 0.909 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 149.8 | 155.5 | -56.8 | -177.4 | -169.9 | -179.2 | 3.1 | 110.3 | ||
| 388 | P | 30.4 | Very low | 26.5 | Very low | 108 Ų | 108 | 156.6 Ų | 156.6 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -96.6 | 139.3 | 154.4 | 34.1 | -27.3 | 0 | 0 | 0 | 112 | ||
| 389 | D | 25.7 | Very low | 26.5 | Very low | 161 Ų | 161 | 154.5 Ų | 154.5 | 86% | 0.861 | 80% | 0.801 | S | S | * | * | trans | 56.4 | 136.1 | 143.9 | -53.9 | -31.9 | 0 | 0 | 0 | 124 | ||||
| 390 | H | 25.2 | Very low | 26.5 | Very low | 166 Ų | 166 | 156.1 Ų | 156.1 | 77% | 0.769 | 81% | 0.81 | S | S | * | * | trans | -51.1 | 136.2 | 172.8 | -90.5 | -103 | 0 | 0 | 0 | 114.8 | ||||
| 391 | F | 25.1 | Very low | 26.5 | Very low | 217 Ų | 217 | 157.3 Ų | 157.3 | 95% | 0.952 | 81% | 0.814 | S | S | * | * | -148.5 | 141.6 | 129 | -107.4 | -80.9 | 0 | 0 | 0 | 109.5 | |||||
| 392 | S | 23.1 | Very low | 26.5 | Very low | 93 Ų | 93 | 161.1 Ų | 161.1 | 65% | 0.65 | 82% | 0.824 | S | S | * | * | trans | -100.9 | 140.5 | -174.5 | -50.6 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 393 | I | 26.5 | Very low | 26.1 | Very low | 156 Ų | 156 | 161.2 Ų | 161.2 | 80% | 0.8 | 83% | 0.827 | S | S | * | * | trans | -175.2 | 135.9 | 134.4 | -102.7 | 163.4 | 0 | 0 | 0 | 112.5 | ||||
| 394 | D | 25.3 | Very low | 26.4 | Very low | 146 Ų | 146 | 161.2 Ų | 161.2 | 78% | 0.781 | 83% | 0.827 | S | S | * | * | trans | 25.2 | 114.7 | 157.2 | -51.2 | -29.4 | 0 | 0 | 0 | 123.4 | ||||
| 395 | G | 25.6 | Very low | 26.5 | Very low | 72 Ų | 72 | 158.5 Ų | 158.5 | 74% | 0.742 | 82% | 0.824 | S | S | * | * | 53 | 119.1 | 111.7 | 0 | 0 | 0 | 0 | 0 | 122 | |||||
| 396 | Y | 27.9 | Very low | 26.4 | Very low | 238 Ų | 238 | 158.4 Ų | 158.4 | 93% | 0.933 | 82% | 0.822 | S | S | * | * | -165.2 | 148.9 | 111.7 | -127.9 | -98.7 | 0 | 0 | 0 | 112.6 | |||||
| 397 | D | 24.6 | Very low | 26.4 | Very low | 143 Ų | 143 | 153.7 Ų | 153.7 | 77% | 0.765 | 82% | 0.815 | S | S | * | * | trans | -73.2 | 148.3 | 168.2 | -106.3 | -48.9 | 0 | 0 | 0 | 111.8 | ||||
| 398 | S | 26.8 | Very low | 26.4 | Very low | 120 Ų | 120 | 149.7 Ų | 149.7 | 84% | 0.839 | 81% | 0.806 | S | S | * | * | -178.4 | 127.2 | 125.3 | 37.9 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 399 | S | 24.5 | Very low | 26.1 | Very low | 113 Ų | 113 | 149.8 Ų | 149.8 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | trans | -82.5 | 137.2 | 168.8 | 58.2 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 400 | V | 26.2 | Very low | 26 | Very low | 143 Ų | 143 | 147 Ų | 147 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | trans | -140.8 | 122.9 | 152.1 | -179.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 401 | R | 24.6 | Very low | 26.3 | Very low | 232 Ų | 232 | 145.5 Ų | 145.5 | 88% | 0.875 | 80% | 0.801 | S | S | * | * | trans | -73.8 | 143.1 | 165.6 | -78.1 | 171.4 | 160.6 | 170.5 | -6.8 | 110.8 | ||||
| 402 | K | 25.4 | Very low | 26.5 | Very low | 209 Ų | 209 | 140.8 Ų | 140.8 | 91% | 0.909 | 79% | 0.791 | S | S | * | * | -168.8 | 126.7 | 127.5 | -105.1 | 161.8 | -173.1 | -179.3 | 0 | 112.6 | |||||
| 403 | S | 24.4 | Very low | 26.5 | Very low | 109 Ų | 109 | 145.3 Ų | 145.3 | 76% | 0.762 | 80% | 0.802 | S | S | * | * | trans | -105.2 | -176 | 169.6 | 54.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 404 | P | 38.8 | Very low | 26.5 | Very low | 113 Ų | 113 | 148 Ų | 148 | 73% | 0.734 | 81% | 0.809 | S | S | * | * | cis | -130.7 | 172.1 | -38.2 | 31.9 | -15.4 | 0 | 0 | 0 | 112.5 | ||||
| 405 | T | 26 | Very low | 26.6 | Very low | 137 Ų | 137 | 148.6 Ų | 148.6 | 84% | 0.84 | 81% | 0.811 | S | S | * | * | trans | -151.9 | 134.2 | 149.9 | 15.8 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 406 | L | 26.7 | Very low | 26.5 | Very low | 167 Ų | 167 | 156.4 Ų | 156.4 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | trans | 69.5 | 98.3 | 159.9 | -70.7 | 164 | 0 | 0 | 0 | 121.3 | ||||
| 407 | L | 26.2 | Very low | 26.4 | Very low | 144 Ų | 144 | 151.3 Ų | 151.3 | 75% | 0.754 | 81% | 0.811 | S | S | * | * | -28.6 | 158.6 | 127.6 | -57 | 164.6 | 0 | 0 | 0 | 113.2 | |||||
| 408 | E | 24.7 | Very low | 26.6 | Very low | 156 Ų | 156 | 151.8 Ų | 151.8 | 73% | 0.729 | 81% | 0.814 | S | S | * | * | cis | -173 | 174 | 6 | -121.6 | -179.3 | 105.7 | 0 | 0 | 108.3 | ||||
| 409 | V | 25.1 | Very low | 26.5 | Very low | 110 Ų | 110 | 150.9 Ų | 150.9 | 67% | 0.667 | 81% | 0.808 | S | S | * | * | cis | -155.8 | 165 | -4.4 | 75.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 410 | S | 24.1 | Very low | 26.6 | Very low | 103 Ų | 103 | 154.7 Ų | 154.7 | 72% | 0.72 | 81% | 0.811 | S | S | * | * | trans | 13.4 | 131.1 | 157.7 | -60.1 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 411 | T | 29.6 | Very low | 26.7 | Very low | 135 Ų | 135 | 151.7 Ų | 151.7 | 83% | 0.828 | 80% | 0.801 | S | S | * | * | trans | -68.4 | 157 | 148.4 | 44.8 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 412 | P | 29.3 | Very low | 27.1 | Very low | 117 Ų | 117 | 148.9 Ų | 148.9 | 76% | 0.76 | 80% | 0.798 | S | S | * | * | trans | -131.1 | 162.5 | 144.2 | 35.7 | -23.5 | 0 | 0 | 0 | 115.2 | ||||
| 413 | H | 24.9 | Very low | 27.4 | Very low | 188 Ų | 188 | 145.6 Ų | 145.6 | 87% | 0.87 | 79% | 0.79 | S | S | * | * | trans | -66.5 | 144 | -177.2 | -73.7 | -105.7 | 0 | 0 | 0 | 114.5 | ||||
| 414 | F | 26.1 | Very low | 27.7 | Very low | 214 Ų | 214 | 146.5 Ų | 146.5 | 94% | 0.939 | 79% | 0.786 | S | S | * | * | trans | -91.1 | 113.1 | 164.5 | -97.3 | -87.6 | 0 | 0 | 0 | 112.2 | ||||
| 415 | L | 26.3 | Very low | 27.2 | Very low | 158 Ų | 158 | 149.2 Ų | 149.2 | 83% | 0.827 | 79% | 0.794 | S | S | * | * | trans | -82 | 149 | 155.8 | -98.5 | 95.2 | 0 | 0 | 0 | 110.1 | ||||
| 416 | R | 24.8 | Very low | 27.5 | Very low | 235 Ų | 235 | 150.1 Ų | 150.1 | 89% | 0.887 | 79% | 0.793 | S | S | * | * | trans | -106 | 113.2 | -179.7 | -170 | -178 | -164.8 | 160.4 | 7 | 110.7 | ||||
| 417 | T | 26 | Very low | 27.6 | Very low | 131 Ų | 131 | 151.7 Ų | 151.7 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -116.6 | 144.8 | 167.8 | 46.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 418 | N | 27.3 | Very low | 27.7 | Very low | 153 Ų | 153 | 148 Ų | 148 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -88.1 | 151.6 | 176.2 | -58.1 | -42.3 | 0 | 0 | 0 | 110.2 | ||||
| 419 | S | 24.8 | Very low | 28 | Very low | 101 Ų | 101 | 149.5 Ų | 149.5 | 71% | 0.706 | 80% | 0.8 | S | S | * | * | trans | 165.1 | 131.4 | 134.8 | -177.3 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 420 | F | 26.4 | Very low | 28.2 | Very low | 194 Ų | 194 | 150.4 Ų | 150.4 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | trans | 50.9 | 125.3 | 150.1 | -77.3 | -113.7 | 0 | 0 | 0 | 119.2 | ||||
| 421 | A | 29 | Very low | 28.5 | Very low | 80 Ų | 80 | 153.1 Ų | 153.1 | 66% | 0.661 | 81% | 0.811 | S | S | * | * | 64.4 | 134.8 | 82.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 422 | E | 32.1 | Very low | 28.6 | Very low | 173 Ų | 173 | 155 Ų | 155 | 81% | 0.808 | 82% | 0.815 | S | S | * | * | cis | -154.8 | 178.6 | 23.9 | -134.3 | 159.6 | -175.1 | 0 | 0 | 112.4 | ||||
| 423 | D | 31.9 | Very low | 28.9 | Very low | 139 Ų | 139 | 154.5 Ų | 154.5 | 74% | 0.743 | 81% | 0.81 | S | S | * | * | trans | 69.7 | 156 | 163.9 | -75.7 | -4.1 | 0 | 0 | 0 | 119.3 | ||||
| 424 | L | 30.6 | Very low | 29.3 | Very low | 129 Ų | 129 | 151.1 Ų | 151.1 | 68% | 0.675 | 81% | 0.805 | S | S | * | * | cis | -151.1 | 144 | -1.5 | -133.3 | 164.6 | 0 | 0 | 0 | 111.1 | ||||
| 425 | D | 28.6 | Very low | 29.6 | Very low | 169 Ų | 169 | 148.6 Ų | 148.6 | 90% | 0.904 | 80% | 0.799 | S | S | * | * | trans | -175.2 | 122.9 | 135.7 | -107.1 | -15.1 | 0 | 0 | 0 | 110.4 | ||||
| 426 | L | 31.9 | Very low | 30.2 | Very low | 156 Ų | 156 | 146.8 Ų | 146.8 | 82% | 0.817 | 80% | 0.795 | S | S | * | * | trans | -151.6 | 103.9 | -173.9 | -168.8 | 152.7 | 0 | 0 | 0 | 112 | ||||
| 427 | E | 29.7 | Very low | 30.5 | Very low | 200 Ų | 200 | 143.6 Ų | 143.6 | 94% | 0.935 | 79% | 0.79 | S | S | * | * | trans | -164 | 131 | 158.9 | -104.3 | 178.9 | -167.7 | 0 | 0 | 106.2 | ||||
| 428 | G | 29 | Very low | 30.9 | Very low | 67 Ų | 67 | 144.3 Ų | 144.3 | 69% | 0.691 | 79% | 0.794 | S | S | * | * | cis | 166.7 | 121.5 | -13.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 429 | E | 29.4 | Very low | 31.2 | Very low | 188 Ų | 188 | 141.7 Ų | 141.7 | 88% | 0.879 | 79% | 0.787 | S | S | * | * | trans | -166.3 | 118.3 | 154.6 | -116.9 | 173.1 | -170.6 | 0 | 0 | 113.9 | ||||
| 430 | T | 30.6 | Very low | 31.6 | Very low | 128 Ų | 128 | 149.8 Ų | 149.8 | 79% | 0.785 | 81% | 0.814 | S | S | * | * | trans | 41.5 | 110.3 | 150.3 | 58 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 431 | L | 31.1 | Very low | 31.9 | Very low | 161 Ų | 161 | 147.6 Ų | 147.6 | 84% | 0.843 | 81% | 0.812 | S | S | * | * | trans | -53.8 | 130.6 | 157.6 | -101.4 | 144.1 | 0 | 0 | 0 | 113.4 | T433 | L431-T433 HydrophobicContact CD2-CG2 4.3Š| ||
| 432 | L | 30.8 | Very low | 32.1 | Very low | 175 Ų | 175 | 151.1 Ų | 151.1 | 92% | 0.916 | 82% | 0.82 | S | S | * | * | trans | -108.8 | 109.9 | 157.3 | -83.5 | 168 | 0 | 0 | 0 | 110.1 | ||||
| 433 | T | 36 | Very low | 32.1 | Very low | 105 Ų | 105 | 149.9 Ų | 149.9 | 64% | 0.644 | 82% | 0.821 | S | S | * | * | trans | -83.3 | 155 | 170.4 | 45.8 | 0 | 0 | 0 | 0 | 111.1 | L431 I435 | L431-T433 HydrophobicContact CD2-CG2 4.3Å; T433-I435 PolarHBondContact O-N 3.27Å | ||
| 434 | P | 32.3 | Very low | 32.1 | Very low | 118 Ų | 118 | 150.5 Ų | 150.5 | 77% | 0.766 | 83% | 0.825 | S | S | * | * | trans | -76.2 | 118.8 | -176 | 29.7 | -33.8 | 0 | 0 | 0 | 111.5 | T436 | P434-T436 PolarHBondContact O-N 3.42Š| ||
| 435 | I | 32.8 | Very low | 32.2 | Very low | 160 Ų | 160 | 151.9 Ų | 151.9 | 82% | 0.821 | 84% | 0.835 | S | S | * | * | trans | -75.7 | 107.2 | 173.3 | -61.9 | 175.1 | 0 | 0 | 0 | 109.4 | T433 | T433-I435 PolarHBondContact O-N 3.27Š| ||
| 436 | T | 40 | Very low | 32.4 | Very low | 121 Ų | 121 | 150.7 Ų | 150.7 | 74% | 0.742 | 83% | 0.83 | S | S | * | * | trans | -99 | 101.3 | 163.5 | 51.5 | 0 | 0 | 0 | 0 | 109.7 | P434 | P434-T436 PolarHBondContact O-N 3.42Š| ||
| 437 | H | 30.3 | Very low | 32.4 | Very low | 167 Ų | 167 | 150.4 Ų | 150.4 | 77% | 0.773 | 83% | 0.831 | S | S | * | * | trans | -145 | 130.3 | 161.5 | -98.7 | -80.3 | 0 | 0 | 0 | 111.6 | ||||
| 438 | V | 35.3 | Very low | 32.6 | Very low | 147 Ų | 147 | 146.5 Ų | 146.5 | 89% | 0.891 | 82% | 0.823 | S | S | * | * | trans | -124.4 | 118.3 | 169.4 | 170.5 | 0 | 0 | 0 | 0 | 107 | ||||
| 439 | S | 33 | Very low | 32.9 | Very low | 98 Ų | 98 | 153.2 Ų | 153.2 | 69% | 0.685 | 83% | 0.834 | S | S | * | * | trans | 178.6 | 131.6 | 173.2 | 50.6 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 440 | Q | 33.8 | Very low | 33.3 | Very low | 270 Ų | 270 | 150 Ų | 150 | 100% | 1.262 | 83% | 0.83 | S | S | * | * | cis | -128.5 | 0 | 2 | -82.1 | 173.7 | -42.7 | 0 | 0 | 110.2 |
Retrieved 440 of 440 residues in 398.4 ms
(Link to these results)