| 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 | 36.8 | Very low | 50.7 | Low | 238 Ų | 238 | 158.1 Ų | 158.1 | 100% | 1.172 | 81% | 0.81 | S | S | * | * | 0 | 109.8 | 0 | -81.8 | -80 | -172.5 | 0 | 0 | 105.8 | |||||
| 2 | D | 38.6 | Very low | 50 | Low | 147 Ų | 147 | 153.6 Ų | 153.6 | 79% | 0.786 | 80% | 0.799 | S | S | * | * | trans | -57.9 | 140.3 | -152.9 | -58.1 | -76.1 | 0 | 0 | 0 | 118.1 | ||||
| 3 | K | 47.6 | Very low | 50.1 | Low | 209 Ų | 209 | 152.6 Ų | 152.6 | 91% | 0.909 | 80% | 0.795 | S | S | * | * | trans | -134 | 115.6 | 141.5 | -77.4 | -167.8 | 178.2 | -174.7 | 0 | 108.8 | ||||
| 4 | P | 47.2 | Very low | 50.2 | Low | 92 Ų | 92 | 149 Ų | 149 | 60% | 0.597 | 79% | 0.79 | S | S | * | * | trans | -103.7 | 125 | -179.3 | 37.1 | -27.7 | 0 | 0 | 0 | 111.3 | ||||
| 5 | Y | 50.1 | Low | 50.8 | Low | 227 Ų | 227 | 148.5 Ų | 148.5 | 89% | 0.89 | 78% | 0.781 | S | S | * | * | trans | 66.1 | 110.8 | 158.4 | -44.6 | -72.8 | 0 | 0 | 0 | 119.3 | ||||
| 6 | D | 55.2 | Low | 51.3 | Low | 149 Ų | 149 | 148.6 Ų | 148.6 | 80% | 0.797 | 78% | 0.782 | S | S | * | * | -167 | 101.6 | 114.1 | -156.1 | 9.8 | 0 | 0 | 0 | 109.7 | |||||
| 7 | E | 56.4 | Low | 51.3 | Low | 185 Ų | 185 | 147.2 Ų | 147.2 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | trans | -103.8 | 109.1 | 169.7 | -73.3 | -174.6 | 175.6 | 0 | 0 | 107.7 | ||||
| 8 | T | 64.9 | Low | 51.1 | Low | 116 Ų | 116 | 144.3 Ų | 144.3 | 71% | 0.712 | 77% | 0.774 | S | S | * | * | trans | -86.9 | 127.3 | 167.1 | 48.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 9 | V | 52.2 | Low | 50.9 | Low | 121 Ų | 121 | 143.6 Ų | 143.6 | 73% | 0.733 | 78% | 0.776 | S | S | * | * | trans | -101.8 | 107.7 | 175.1 | 175.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 10 | D | 56.7 | Low | 50.7 | Low | 134 Ų | 134 | 142.7 Ų | 142.7 | 72% | 0.717 | 78% | 0.778 | S | S | * | * | trans | -74.4 | 120.8 | 169.8 | -77.6 | -38.5 | 0 | 0 | 0 | 110.2 | P12 | D10-P12 WeakPolarHBondContact O-CD 3.41Š| ||
| 11 | V | 52.5 | Low | 50.3 | Low | 121 Ų | 121 | 145.8 Ų | 145.8 | 73% | 0.733 | 78% | 0.778 | S | S | * | * | trans | -95 | 111.6 | 173.2 | -176.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 12 | P | 42.2 | Very low | 50.2 | Low | 104 Ų | 104 | 141.2 Ų | 141.2 | 68% | 0.675 | 76% | 0.758 | S | S | * | * | trans | -75.4 | 141.7 | 170.6 | 32.5 | -30.1 | 0 | 0 | 0 | 108.6 | D10 | D10-P12 WeakPolarHBondContact O-CD 3.41Š| ||
| 13 | D | 50.3 | Low | 50 | Low | 141 Ų | 141 | 143 Ų | 143 | 75% | 0.754 | 76% | 0.762 | S | S | * | * | trans | 104.1 | 34.3 | 174.3 | -52 | -20.4 | 0 | 0 | 0 | 118.3 | E15 | D13-E15 VanDerWaalsContact C-N 3.31Å; D13-E15 PolarHBondContact O-N 3.16Å | ||
| 14 | S | 52.6 | Low | 49.5 | Very low | 102 Ų | 102 | 139 Ų | 139 | 71% | 0.713 | 75% | 0.746 | S | S | * | * | trans | -76.8 | 80.8 | 159.2 | 60.3 | 0 | 0 | 0 | 0 | 111.2 | D16 | S14-D16 PolarHBondContact O-N 2.94Š| ||
| 15 | E | 58.3 | Low | 49 | Very low | 142 Ų | 142 | 137.8 Ų | 137.8 | 66% | 0.664 | 74% | 0.74 | S | S | * | * | trans | -70.6 | 123.5 | 166.3 | -66.5 | -174.8 | 162.6 | 0 | 0 | 111 | D13 K209 | D13-E15 VanDerWaalsContact C-N 3.31Å; D13-E15 PolarHBondContact O-N 3.16Å; E15-K209 PolarHBondContact O-NZ 2.91Å; E15-K209 VanDerWaalsContact O-NZ 3.14Å | ||
| 16 | D | 59.8 | Low | 48.5 | Very low | 149 Ų | 149 | 133.1 Ų | 133.1 | 80% | 0.797 | 73% | 0.73 | S | S | * | * | trans | -79.8 | 123.1 | 169.6 | -74.8 | -40.4 | 0 | 0 | 0 | 110.4 | S14 | S14-D16 PolarHBondContact O-N 2.94Š| ||
| 17 | I | 49.9 | Very low | 48 | Very low | 125 Ų | 125 | 129.6 Ų | 129.6 | 64% | 0.641 | 72% | 0.721 | S | S | * | * | trans | -107.3 | 113.9 | -179.8 | -56.7 | 167.5 | 0 | 0 | 0 | 109 | T19 | I17-T19 PolarHBondContact O-N 2.98Š| ||
| 18 | A | 48.6 | Very low | 47.3 | Very low | 95 Ų | 95 | 126.2 Ų | 126.2 | 79% | 0.785 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -71 | 121.3 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 19 | T | 47.6 | Very low | 46.4 | Very low | 132 Ų | 132 | 124.9 Ų | 124.9 | 81% | 0.81 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 133.4 | 177.8 | 6.3 | 0 | 0 | 0 | 0 | 111.1 | I17 R21 | I17-T19 PolarHBondContact O-N 2.98Å; T19-R21 PolarHBondContact O-N 3.23Å |
| 20 | P | 46.9 | Very low | 46.1 | Very low | 125 Ų | 125 | 126.2 Ų | 126.2 | 81% | 0.812 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 130 | 174.9 | -15.2 | 28.4 | 0 | 0 | 0 | 111.2 | L22 | P20-L22 PolarHBondContact O-N 3.47Š|
| 21 | R | 41 | Very low | 45.6 | Very low | 208 Ų | 208 | 125.4 Ų | 125.4 | 79% | 0.785 | 69% | 0.685 | S | S | * | * | trans | -72.9 | 110.6 | -178.7 | -168.4 | 177 | -174.3 | 170.8 | 1.9 | 110.8 | T19 Q23 | T19-R21 PolarHBondContact O-N 3.23Å; R21-Q23 PolarHBondContact O-N 3.22Å | ||
| 22 | L | 35.4 | Very low | 45.4 | Very low | 142 Ų | 142 | 126.4 Ų | 126.4 | 74% | 0.743 | 68% | 0.68 | S | S | * | * | trans | -70.5 | 113 | 157.9 | -147.2 | 90.9 | 0 | 0 | 0 | 107.4 | P20 Q24 | P20-L22 PolarHBondContact O-N 3.47Å; L22-Q24 HydrophobicContact CD2-CB 4.44Å; L22-Q24 PolarHBondContact O-N 3.21Å | ||
| 23 | Q | 35 | Very low | 45.4 | Very low | 185 Ų | 185 | 129.7 Ų | 129.7 | 86% | 0.864 | 68% | 0.684 | S | S | * | * | trans | -67.9 | 85.4 | 168.3 | -73.2 | 177.8 | -54.2 | 0 | 0 | 108.7 | R21 | R21-Q23 PolarHBondContact O-N 3.22Š| ||
| 24 | Q | 37.5 | Very low | 45.1 | Very low | 123 Ų | 123 | 132.6 Ų | 132.6 | 58% | 0.575 | 68% | 0.684 | S | S | * | * | trans | -132.5 | 126 | 163.3 | -121 | 169.1 | 1 | 0 | 0 | 108.4 | L22 L26 | L22-Q24 HydrophobicContact CD2-CB 4.44Å; L22-Q24 PolarHBondContact O-N 3.21Å; Q24-L26 PolarHBondContact O-N 3.42Å | ||
| 25 | S | 36.4 | Very low | 44.9 | Very low | 67 Ų | 67 | 130.6 Ų | 130.6 | 47% | 0.469 | 67% | 0.674 | S | S | . | * | trans | -51.2 | 123.4 | -173.3 | 39.2 | 0 | 0 | 0 | 0 | 112 | A27 E28 | S25-A27 PolarHBondContact O-N 3.44Å; S25-E28 PolarHBondContact O-N 2.77Å | ||
| 26 | L | 39.7 | Very low | 44.2 | Very low | 130 Ų | 130 | 129.9 Ų | 129.9 | 68% | 0.681 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -60.2 | -13.3 | -179.8 | -146.5 | 138.2 | 0 | 0 | 0 | 113.1 | Q24 E28 F30 | Q24-L26 PolarHBondContact O-N 3.42Å; L26-E28 VanDerWaalsContact C-N 3.35Å; L26-F30 HydrophobicContact CD2-CD2 3.88Å; L26-F30 HydrophobicContact CD2-CE2 3.7Å |
| 27 | A | 44.5 | Very low | 43.5 | Very low | 74 Ų | 74 | 132.6 Ų | 132.6 | 61% | 0.612 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -67.4 | -28.8 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | S25 | S25-A27 PolarHBondContact O-N 3.44Å |
| 28 | E | 41.7 | Very low | 43.3 | Very low | 114 Ų | 114 | 131 Ų | 131 | 53% | 0.533 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -86.9 | -20.3 | -176 | -65.2 | -176.4 | 153.4 | 0 | 0 | 113.4 | S25 L26 | S25-E28 PolarHBondContact O-N 2.77Å; L26-E28 VanDerWaalsContact C-N 3.35Å |
| 29 | N | 45.2 | Very low | 42.7 | Very low | 88 Ų | 88 | 131.1 Ų | 131.1 | 47% | 0.471 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -86.5 | -20.8 | 178.8 | -77.9 | -23 | 0 | 0 | 0 | 113.4 | F33 | N29-F33 PolarHBondContact O-N 3.2Å |
| 30 | F | 45.7 | Very low | 42.3 | Very low | 150 Ų | 150 | 134.2 Ų | 134.2 | 66% | 0.658 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -71.9 | -33.5 | 175.2 | -102 | -90.4 | 0 | 0 | 0 | 112.7 | L26 R34 | L26-F30 HydrophobicContact CD2-CD2 3.88Å; L26-F30 HydrophobicContact CD2-CE2 3.7Å; F30-R34 PolarHBondContact O-N 3.25Å |
| 31 | D | 47.5 | Very low | 42 | Very low | 116 Ų | 116 | 136 Ų | 136 | 62% | 0.62 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -72.9 | -32.4 | 176.9 | -77.5 | -29.8 | 0 | 0 | 0 | 112.7 | R34 A35 | D31-R34 PolarHBondContact O-N 3.42Å; D31-A35 WeakPolarHBondContact O-CB 3.33Å; D31-A35 PolarHBondContact O-N 3.46Å; D31-A35 VanDerWaalsContact O-N 3.11Å |
| 32 | K | 46.7 | Very low | 41.8 | Very low | 143 Ų | 143 | 132.1 Ų | 132.1 | 62% | 0.622 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -70.9 | -32.7 | 177 | -78.1 | -180 | 178.8 | 173.9 | 0 | 113.3 | ||
| 33 | F | 43.7 | Very low | 41.6 | Very low | 172 Ų | 172 | 134.9 Ų | 134.9 | 75% | 0.754 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -76 | -30 | 175.1 | -98.9 | -86.5 | 0 | 0 | 0 | 112.9 | N29 | N29-F33 PolarHBondContact O-N 3.2Å |
| 34 | R | 44.5 | Very low | 41.7 | Very low | 203 Ų | 203 | 131 Ų | 131 | 77% | 0.766 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -74 | -32.9 | 174.9 | -167.6 | 172.7 | 179.3 | 147.9 | -0.5 | 112.8 | F30 D31 | F30-R34 PolarHBondContact O-N 3.25Å; D31-R34 PolarHBondContact O-N 3.42Å |
| 35 | A | 46.4 | Very low | 41.4 | Very low | 59 Ų | 59 | 132.1 Ų | 132.1 | 49% | 0.488 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -69.1 | -31.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | D31 F37 | D31-A35 WeakPolarHBondContact O-CB 3.33Å; D31-A35 PolarHBondContact O-N 3.46Å; D31-A35 VanDerWaalsContact O-N 3.11Å; A35-F37 PolarHBondContact O-N 2.93Å |
| 36 | N | 43.9 | Very low | 41.4 | Very low | 128 Ų | 128 | 136.2 Ų | 136.2 | 68% | 0.684 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.9 | -12 | -176.7 | -76.6 | -8.3 | 0 | 0 | 0 | 114.8 | ||
| 37 | F | 46.4 | Very low | 40.9 | Very low | 205 Ų | 205 | 135.1 Ų | 135.1 | 90% | 0.899 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.7 | -3 | 174.9 | -117.9 | -94.4 | 0 | 0 | 0 | 113.7 | A35 | A35-F37 PolarHBondContact O-N 2.93Š|
| 38 | S | 44.6 | Very low | 40.5 | Very low | 93 Ų | 93 | 138.1 Ų | 138.1 | 65% | 0.65 | 73% | 0.732 | S | S | * | * | trans | -106.3 | -0.6 | -175.9 | -165.1 | 0 | 0 | 0 | 0 | 113.9 | K40 | S38-K40 VanDerWaalsContact C-N 3.28Å; S38-K40 PolarHBondContact O-N 3.42Å | ||
| 39 | S | 36.1 | Very low | 40.2 | Very low | 97 Ų | 97 | 139 Ų | 139 | 68% | 0.678 | 75% | 0.745 | S | S | * | * | trans | -83.6 | 56.4 | -178.1 | 67.4 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 40 | K | 39.9 | Very low | 39.6 | Very low | 196 Ų | 196 | 139.3 Ų | 139.3 | 85% | 0.852 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -151.5 | 49.6 | 164 | -80.7 | -162.2 | -178.7 | 176.7 | 0 | 112.1 | S38 | S38-K40 VanDerWaalsContact C-N 3.28Å; S38-K40 PolarHBondContact O-N 3.42Å |
| 41 | L | 40.5 | Very low | 39.2 | Very low | 163 Ų | 163 | 138.4 Ų | 138.4 | 85% | 0.853 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -151.8 | 142.5 | 159.1 | -87.7 | 114.4 | 0 | 0 | 0 | 110.7 | ||
| 42 | P | 36.5 | Very low | 38.3 | Very low | 126 Ų | 126 | 142.7 Ų | 142.7 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -76.6 | 149.7 | -173.4 | 30.2 | -32.2 | 0 | 0 | 0 | 113.4 | ||||
| 43 | K | 31.7 | Very low | 37.8 | Very low | 200 Ų | 200 | 141.7 Ų | 141.7 | 87% | 0.87 | 79% | 0.794 | S | S | * | * | trans | -70.6 | 142.3 | -170.2 | -61.3 | 170 | 177.7 | 175.1 | 0 | 113.8 | ||||
| 44 | A | 35.7 | Very low | 37.2 | Very low | 104 Ų | 104 | 140.8 Ų | 140.8 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | -132 | 130 | 149.1 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 45 | N | 32.5 | Very low | 36.9 | Very low | 146 Ų | 146 | 139.3 Ų | 139.3 | 78% | 0.781 | 80% | 0.802 | S | S | * | * | trans | -76 | 142 | -169.3 | -65.8 | -34.1 | 0 | 0 | 0 | 113.1 | ||||
| 46 | T | 35.2 | Very low | 36.3 | Very low | 154 Ų | 154 | 145.3 Ų | 145.3 | 95% | 0.945 | 82% | 0.82 | S | S | * | * | -176.2 | 142.2 | 124.4 | 17 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 47 | S | 30.1 | Very low | 35.5 | Very low | 106 Ų | 106 | 148.8 Ų | 148.8 | 74% | 0.741 | 83% | 0.829 | S | S | * | * | trans | -122.7 | 129.4 | -162.1 | 52.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 48 | V | 36.3 | Very low | 34.9 | Very low | 137 Ų | 137 | 149.3 Ų | 149.3 | 83% | 0.83 | 83% | 0.831 | S | S | * | * | trans | -160.2 | 91.9 | 152.8 | -169.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 49 | T | 34.3 | Very low | 34.1 | Very low | 132 Ų | 132 | 150.5 Ų | 150.5 | 81% | 0.81 | 84% | 0.839 | S | S | * | * | 42.6 | 114.7 | 106.8 | 53.9 | 0 | 0 | 0 | 0 | 118 | |||||
| 50 | A | 32.6 | Very low | 34.1 | Very low | 96 Ų | 96 | 152 Ų | 152 | 79% | 0.793 | 85% | 0.85 | S | S | * | * | trans | -102.2 | 170.3 | 166.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 51 | P | 37.5 | Very low | 33.6 | Very low | 131 Ų | 131 | 149.9 Ų | 149.9 | 85% | 0.851 | 85% | 0.848 | S | S | * | * | trans | -127.8 | 142.4 | 147.6 | 34.2 | -20.3 | 0 | 0 | 0 | 113.6 | ||||
| 52 | K | 29.2 | Very low | 33.4 | Very low | 206 Ų | 206 | 151.3 Ų | 151.3 | 90% | 0.896 | 85% | 0.85 | S | S | * | * | trans | -94 | 151.7 | 170.2 | -67.8 | 176.1 | 175.2 | 175.5 | 0 | 109.9 | ||||
| 53 | S | 37.3 | Very low | 33.4 | Very low | 121 Ų | 121 | 154.4 Ų | 154.4 | 85% | 0.846 | 85% | 0.851 | S | S | * | * | trans | -134.5 | 125.3 | 157.2 | 57.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 54 | N | 30 | Very low | 33.4 | Very low | 153 Ų | 153 | 153.1 Ų | 153.1 | 82% | 0.818 | 85% | 0.853 | S | S | * | * | trans | -74.7 | 145.1 | 173.4 | -73.9 | -28.6 | 0 | 0 | 0 | 111.6 | ||||
| 55 | I | 37.7 | Very low | 33.3 | Very low | 173 Ų | 173 | 152.1 Ų | 152.1 | 89% | 0.887 | 85% | 0.853 | S | S | * | * | trans | -139.9 | 140.3 | 145.9 | -64.9 | -173 | 0 | 0 | 0 | 109.7 | ||||
| 56 | E | 33.8 | Very low | 33.5 | Very low | 184 Ų | 184 | 153.1 Ų | 153.1 | 86% | 0.86 | 86% | 0.858 | S | S | * | * | trans | -75.8 | 157.5 | -162.4 | -63.7 | 167.7 | 128.2 | 0 | 0 | 116.1 | ||||
| 57 | K | 27.8 | Very low | 33.7 | Very low | 202 Ų | 202 | 149.3 Ų | 149.3 | 88% | 0.878 | 85% | 0.849 | S | S | * | * | trans | -81.1 | 147.7 | 167.9 | -70.4 | 178.2 | 174.5 | 179.7 | 0 | 111.2 | ||||
| 58 | K | 33.8 | Very low | 34 | Very low | 216 Ų | 216 | 151.7 Ų | 151.7 | 94% | 0.939 | 85% | 0.854 | S | S | * | * | trans | -127.8 | 130.5 | 145.7 | -87.3 | -172.5 | 177.5 | 177.7 | 0 | 110.8 | ||||
| 59 | S | 28.5 | Very low | 34.4 | Very low | 117 Ų | 117 | 149.3 Ų | 149.3 | 82% | 0.818 | 84% | 0.843 | S | S | * | * | trans | -95.5 | 149.1 | 177.6 | 50.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 60 | S | 35.1 | Very low | 34.9 | Very low | 130 Ų | 130 | 147.7 Ų | 147.7 | 91% | 0.909 | 84% | 0.837 | S | S | * | * | trans | -142.7 | 138.6 | 151.6 | 49.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 61 | N | 29.9 | Very low | 35.4 | Very low | 150 Ų | 150 | 150 Ų | 150 | 80% | 0.802 | 84% | 0.836 | S | S | * | * | trans | -130 | 123.8 | -163.8 | -179.6 | 55.3 | 0 | 0 | 0 | 107 | ||||
| 62 | E | 36.2 | Very low | 36 | Very low | 193 Ų | 193 | 151.3 Ų | 151.3 | 90% | 0.902 | 84% | 0.836 | S | S | * | * | trans | -142.8 | 102.8 | 163.9 | -69.2 | -168.2 | 148.6 | 0 | 0 | 105.9 | ||||
| 63 | K | 35.6 | Very low | 37 | Very low | 191 Ų | 191 | 149.2 Ų | 149.2 | 83% | 0.83 | 84% | 0.835 | S | S | * | * | 73.2 | 94 | 77.1 | -132.4 | -176.3 | -170.4 | -170.1 | 0 | 114.3 | |||||
| 64 | L | 32.2 | Very low | 37.8 | Very low | 174 Ų | 174 | 149.2 Ų | 149.2 | 91% | 0.911 | 83% | 0.825 | S | S | * | * | trans | -6.2 | 138.3 | 151.3 | -64.7 | 151.5 | 0 | 0 | 0 | 118.9 | ||||
| 65 | G | 34.6 | Very low | 38.7 | Very low | 83 Ų | 83 | 149.6 Ų | 149.6 | 86% | 0.856 | 83% | 0.827 | S | S | * | * | trans | -134 | 116.7 | 150 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 66 | D | 35.3 | Very low | 39.6 | Very low | 166 Ų | 166 | 150.8 Ų | 150.8 | 89% | 0.888 | 82% | 0.822 | S | S | * | * | trans | -95.5 | 142.1 | 174.2 | -164.8 | 16.6 | 0 | 0 | 0 | 107.8 | ||||
| 67 | G | 39.5 | Very low | 40.4 | Very low | 75 Ų | 75 | 149 Ų | 149 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | trans | -149.8 | 101.8 | -172.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 68 | D | 37.3 | Very low | 41.6 | Very low | 155 Ų | 155 | 148.6 Ų | 148.6 | 83% | 0.829 | 82% | 0.82 | S | S | * | * | trans | -82.7 | 155.5 | -174.4 | 176.2 | 36.7 | 0 | 0 | 0 | 113.5 | ||||
| 69 | S | 43.3 | Very low | 42.5 | Very low | 88 Ų | 88 | 145.3 Ų | 145.3 | 62% | 0.615 | 81% | 0.812 | S | S | * | * | trans | 69.1 | 119.9 | 152.4 | -170.9 | 0 | 0 | 0 | 0 | 121 | ||||
| 70 | S | 46.1 | Very low | 43.5 | Very low | 97 Ų | 97 | 147 Ų | 147 | 68% | 0.678 | 81% | 0.812 | S | S | * | * | 165.5 | 115.4 | 108.7 | 58.7 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 71 | D | 42.8 | Very low | 44.3 | Very low | 145 Ų | 145 | 147.6 Ų | 147.6 | 78% | 0.775 | 81% | 0.805 | S | S | * | * | 61.4 | 110.4 | 109 | -67.7 | -24.1 | 0 | 0 | 0 | 113 | |||||
| 72 | D | 50.8 | Low | 45.2 | Very low | 159 Ų | 159 | 147.9 Ų | 147.9 | 85% | 0.85 | 81% | 0.807 | S | S | * | * | trans | -163.4 | 110.2 | 141.3 | -94.9 | -28.5 | 0 | 0 | 0 | 109 | ||||
| 73 | D | 48.9 | Very low | 45.8 | Very low | 161 Ų | 161 | 146.7 Ų | 146.7 | 86% | 0.861 | 80% | 0.801 | S | S | * | * | trans | -71 | 121 | 162 | -77 | -49 | 0 | 0 | 0 | 107.7 | ||||
| 74 | D | 54.2 | Low | 46.3 | Very low | 122 Ų | 122 | 144.1 Ų | 144.1 | 65% | 0.652 | 80% | 0.797 | S | S | * | * | trans | -135.2 | 109.1 | 162.1 | -84.2 | -36.1 | 0 | 0 | 0 | 109.4 | Y76 | D74-Y76 HydrophobicContact CB-CE2 4.32Š| ||
| 75 | D | 50.1 | Low | 47 | Very low | 161 Ų | 161 | 143.9 Ų | 143.9 | 86% | 0.861 | 79% | 0.791 | S | S | * | * | trans | -64.6 | 123.7 | 169.7 | -128.3 | -15.4 | 0 | 0 | 0 | 108.7 | ||||
| 76 | Y | 54.9 | Low | 47.6 | Very low | 197 Ų | 197 | 146.2 Ų | 146.2 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | trans | -113.1 | 93.9 | 169.9 | -67.2 | -70.1 | 0 | 0 | 0 | 108.8 | D74 | D74-Y76 HydrophobicContact CB-CE2 4.32Š| ||
| 77 | D | 50.4 | Low | 48.4 | Very low | 148 Ų | 148 | 144.5 Ų | 144.5 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | trans | -71.5 | 116.6 | 154.5 | -98.4 | -32.9 | 0 | 0 | 0 | 107.6 | ||||
| 78 | E | 53.6 | Low | 48.8 | Very low | 192 Ų | 192 | 146.8 Ų | 146.8 | 90% | 0.897 | 77% | 0.769 | S | S | * | * | trans | -105.2 | 96.9 | 163.4 | -85.6 | -178.5 | 169.1 | 0 | 0 | 108.1 | ||||
| 79 | D | 52.6 | Low | 49.4 | Very low | 147 Ų | 147 | 147.2 Ų | 147.2 | 79% | 0.786 | 77% | 0.771 | S | S | * | * | trans | -71.8 | 121.3 | 160.1 | -84.2 | -42 | 0 | 0 | 0 | 108.7 | D81 | D79-D81 PolarHBondContact O-N 3.43Š| ||
| 80 | D | 49.2 | Very low | 49.5 | Very low | 152 Ų | 152 | 150.6 Ų | 150.6 | 81% | 0.813 | 78% | 0.782 | S | S | * | * | trans | -79.1 | 93.9 | 175 | -125.7 | -11.5 | 0 | 0 | 0 | 108.5 | ||||
| 81 | D | 52.2 | Low | 49.7 | Very low | 143 Ų | 143 | 153.9 Ų | 153.9 | 77% | 0.765 | 79% | 0.792 | S | S | * | * | trans | -118.1 | 93.1 | 169.6 | -86.2 | -29.3 | 0 | 0 | 0 | 109.4 | D79 E83 | D79-D81 PolarHBondContact O-N 3.43Å; D81-E83 PolarHBondContact O-N 3.38Å | ||
| 82 | D | 49.5 | Very low | 49.6 | Very low | 157 Ų | 157 | 155.2 Ų | 155.2 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | -70.8 | 104 | 165 | -83.7 | -41.7 | 0 | 0 | 0 | 109.4 | ||||
| 83 | E | 47.7 | Very low | 49.1 | Very low | 167 Ų | 167 | 154.3 Ų | 154.3 | 78% | 0.78 | 79% | 0.789 | S | S | * | * | trans | -129.2 | 105.3 | 165.2 | -74.6 | -169.4 | 173.9 | 0 | 0 | 110.9 | D81 | D81-E83 PolarHBondContact O-N 3.38Š| ||
| 84 | D | 47.2 | Very low | 48.4 | Very low | 137 Ų | 137 | 151.7 Ų | 151.7 | 73% | 0.733 | 78% | 0.783 | S | S | * | * | 64.4 | 145.4 | 117.9 | -71.5 | -27.5 | 0 | 0 | 0 | 123.7 | |||||
| 85 | E | 46.6 | Very low | 47.4 | Very low | 169 Ų | 169 | 152.3 Ų | 152.3 | 79% | 0.79 | 79% | 0.787 | S | S | * | * | trans | 77 | 140 | 148.1 | -76.2 | 170.6 | -155.2 | 0 | 0 | 118 | ||||
| 86 | D | 48.2 | Very low | 46.8 | Very low | 133 Ų | 133 | 151.5 Ų | 151.5 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | cis | -171.6 | -177.3 | -1.3 | -133 | -21.4 | 0 | 0 | 0 | 107.7 | ||||
| 87 | D | 51.6 | Low | 46.4 | Very low | 130 Ų | 130 | 147.6 Ų | 147.6 | 70% | 0.695 | 78% | 0.78 | S | S | * | * | trans | 105 | 87.9 | 155.3 | -76.3 | -28.9 | 0 | 0 | 0 | 120.8 | ||||
| 88 | N | 47.2 | Very low | 46.4 | Very low | 123 Ų | 123 | 147.7 Ų | 147.7 | 66% | 0.658 | 78% | 0.78 | S | S | * | * | 47.2 | 121.6 | 110.3 | -63.9 | -49.5 | 0 | 0 | 0 | 119.9 | |||||
| 89 | D | 49.3 | Very low | 46.4 | Very low | 163 Ų | 163 | 144.1 Ų | 144.1 | 87% | 0.872 | 77% | 0.771 | S | S | * | * | -168.5 | 120.1 | 107.3 | -93.5 | -24.1 | 0 | 0 | 0 | 111.1 | |||||
| 90 | D | 45.7 | Very low | 46.6 | Very low | 159 Ų | 159 | 142.3 Ų | 142.3 | 85% | 0.85 | 76% | 0.761 | S | S | * | * | trans | -61.3 | 132.8 | 161 | -93.7 | -37.3 | 0 | 0 | 0 | 109.4 | ||||
| 91 | D | 51.5 | Low | 46.9 | Very low | 166 Ų | 166 | 144.4 Ų | 144.4 | 89% | 0.888 | 77% | 0.766 | S | S | * | * | trans | -147.6 | 123.7 | 143.7 | -132.8 | -14.8 | 0 | 0 | 0 | 112.1 | ||||
| 92 | E | 40 | Very low | 47.4 | Very low | 173 Ų | 173 | 141.6 Ų | 141.6 | 81% | 0.808 | 77% | 0.77 | S | S | * | * | trans | -74.8 | 141.7 | -176.5 | -69.3 | -177.6 | 141.1 | 0 | 0 | 111.6 | ||||
| 93 | N | 39.8 | Very low | 48.4 | Very low | 141 Ų | 141 | 139.3 Ų | 139.3 | 75% | 0.754 | 76% | 0.757 | S | S | * | * | trans | 58.2 | 99.6 | 136.9 | -172.6 | 39.3 | 0 | 0 | 0 | 118.4 | ||||
| 94 | S | 34.8 | Very low | 49.7 | Very low | 105 Ų | 105 | 134.7 Ų | 134.7 | 73% | 0.734 | 73% | 0.732 | S | S | * | * | -172.3 | 116.3 | 121.9 | 17.7 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 95 | N | 33.6 | Very low | 51.2 | Low | 136 Ų | 136 | 130.8 Ų | 130.8 | 73% | 0.727 | 71% | 0.712 | S | S | * | * | trans | 58.9 | 112.4 | 136.9 | -68.6 | -57.3 | 0 | 0 | 0 | 121.3 | ||||
| 96 | I | 37.9 | Very low | 52.7 | Low | 144 Ų | 144 | 124.8 Ų | 124.8 | 74% | 0.738 | 69% | 0.688 | S | S | * | * | trans | 83 | 102.7 | 150 | -47.8 | 152 | 0 | 0 | 0 | 114.4 | D98 | I96-D98 PolarHBondContact O-N 3.04Š| ||
| 97 | P | 46.6 | Very low | 54.1 | Low | 114 Ų | 114 | 121.1 Ų | 121.1 | 74% | 0.74 | 68% | 0.676 | S | S | * | * | trans | -68 | 120.2 | 167.5 | 28.2 | -28.1 | 0 | 0 | 0 | 108 | V99 | P97-V99 PolarHBondContact O-N 3.42Š| ||
| 98 | D | 50.4 | Low | 55.3 | Low | 150 Ų | 150 | 119.2 Ų | 119.2 | 80% | 0.802 | 67% | 0.666 | S | S | * | * | trans | -42.2 | 135.6 | 162.6 | -78.8 | -45.1 | 0 | 0 | 0 | 109.6 | I96 I100 | I96-D98 PolarHBondContact O-N 3.04Å; D98-I100 PolarHBondContact O-N 2.9Å | ||
| 99 | V | 51.8 | Low | 56.7 | Low | 118 Ų | 118 | 118.4 Ų | 118.4 | 72% | 0.715 | 65% | 0.654 | S | S | * | * | trans | -45.2 | 105.6 | -178.2 | 178.7 | 0 | 0 | 0 | 0 | 109.8 | P97 E101 | P97-V99 PolarHBondContact O-N 3.42Å; V99-E101 PolarHBondContact O-N 3.34Å; V99-E101 VanDerWaalsContact O-N 3.07Å | ||
| 100 | I | 58.9 | Low | 58 | Low | 109 Ų | 109 | 118.3 Ų | 118.3 | 56% | 0.559 | 65% | 0.648 | S | S | * | * | trans | -61.9 | 114.1 | 173.1 | -61.6 | 166.7 | 0 | 0 | 0 | 106.7 | D98 G102 I103 | D98-I100 PolarHBondContact O-N 2.9Å; I100-G102 PolarHBondContact O-N 2.92Å; I100-G102 VanDerWaalsContact O-N 3.13Å; I100-I103 HydrophobicContact CB-CD1 3.67Å; I100-I103 HydrophobicContact CB-CG1 4.09Å; I100-I103 HydrophobicContact CD1-CD1 3.93Å; I100-I103 HydrophobicContact CG1-CD1 4.3Å; I100-I103 HydrophobicContact CG2-CD1 4.12Å; I100-I103 HydrophobicContact CG2-CG1 4.25Å; I100-I103 PolarHBondContact O-N 2.86Å; I100-I103 VanDerWaalsContact O-N 3.15Å | ||
| 101 | E | 53.8 | Low | 59.7 | Low | 196 Ų | 196 | 117.8 Ų | 117.8 | 92% | 0.916 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.1 | 116.4 | -179.4 | -164.1 | 174.1 | -168 | 0 | 0 | 109.6 | V99 | V99-E101 PolarHBondContact O-N 3.34Å; V99-E101 VanDerWaalsContact O-N 3.07Å |
| 102 | G | 63.9 | Low | 61 | Low | 83 Ų | 83 | 113.1 Ų | 113.1 | 86% | 0.856 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 111.3 | -5.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 116.2 | I100 | I100-G102 PolarHBondContact O-N 2.92Å; I100-G102 VanDerWaalsContact O-N 3.13Å |
| 103 | I | 69.5 | Low | 63 | Low | 110 Ų | 110 | 112.2 Ų | 112.2 | 56% | 0.564 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -82.2 | 135.8 | 171.3 | -60.8 | -176.9 | 0 | 0 | 0 | 110.2 | I100 N105 | I100-I103 HydrophobicContact CB-CD1 3.67Å; I100-I103 HydrophobicContact CB-CG1 4.09Å; I100-I103 HydrophobicContact CD1-CD1 3.93Å; I100-I103 HydrophobicContact CG1-CD1 4.3Å; I100-I103 HydrophobicContact CG2-CD1 4.12Å; I100-I103 HydrophobicContact CG2-CG1 4.25Å; I100-I103 PolarHBondContact O-N 2.86Å; I100-I103 VanDerWaalsContact O-N 3.15Å; I103-N105 PolarHBondContact O-N 3.37Å; I103-N105 VanDerWaalsContact O-N 3.13Å |
| 104 | Y | 74.6 | Confident | 64.9 | Low | 69 Ų | 69 | 107.8 Ų | 107.8 | 27% | 0.271 | 60% | 0.599 | S | S | . | * | trans | -61.5 | 113.2 | 176.9 | 173.5 | -102 | 0 | 0 | 0 | 111.2 | P106 Y109 F122 I125 Q126 | Y104-P106 HydrophobicContact CD1-CG 4.41Å; Y104-P106 HydrophobicContact CE1-CG 3.92Å; Y104-Y109 HydrophobicContact CD2-CD2 4.22Å; Y104-Y109 AromaticContact CD2-CE2 3.8Å; Y104-Y109 HydrophobicContact CD2-CE2 3.8Å; Y104-Y109 AromaticContact CE2-CD2 3.64Å; Y104-Y109 HydrophobicContact CE2-CD2 3.64Å; Y104-Y109 AromaticContact CE2-CE2 3.69Å; Y104-Y109 HydrophobicContact CE2-CE2 3.69Å; Y104-Y109 HydrophobicContact CE2-CG 4.49Å; Y104-F122 HydrophobicContact CE2-CD1 4.23Å; Y104-F122 HydrophobicContact CE2-CE1 4.44Å; Y104-F122 WeakPolarHBondContact OH-CD1 3.46Å; Y104-I125 HydrophobicContact CD1-CB 4.34Å; Y104-I125 HydrophobicContact CD1-CG2 3.47Å; Y104-I125 VanDerWaalsContact CD1-CG2 3.47Å; Y104-I125 HydrophobicContact CD2-CG2 4.46Å; Y104-I125 HydrophobicContact CE1-CB 4Å; Y104-I125 HydrophobicContact CE1-CD1 4.44Å; Y104-I125 HydrophobicContact CE1-CG2 3.64Å; Y104-I125 HydrophobicContact CE2-CD1 4.09Å; Y104-I125 HydrophobicContact CG-CG2 3.91Å; Y104-Q126 HydrophobicContact CE1-CG 4.4Å | ||
| 105 | N | 79.3 | Confident | 67.3 | Low | 55 Ų | 55 | 105.6 Ų | 105.6 | 29% | 0.294 | 58% | 0.584 | S | S | . | * | trans | -104.1 | 115.7 | 172.8 | -178.6 | 12.2 | 0 | 0 | 0 | 110.4 | I103 A107 D108 Y109 | I103-N105 PolarHBondContact O-N 3.37Å; I103-N105 VanDerWaalsContact O-N 3.13Å; N105-A107 PolarHBondContact O-N 3.06Å; N105-A107 PolarHBondContact OD1-N 2.65Å; N105-D108 WeakPolarHBondContact CB-OD2 3.19Å; N105-D108 PolarHBondContact ND2-OD1 2.79Å; N105-D108 VanDerWaalsContact ND2-OD1 3.16Å; N105-D108 PolarHBondContact O-N 3.31Å; N105-Y109 VanDerWaalsContact O-CD2 3.29Å; N105-Y109 WeakPolarHBondContact O-CD2 3.41Å | ||
| 106 | P | 77.6 | Confident | 69.5 | Low | 44 Ų | 44 | 103.6 Ų | 103.6 | 29% | 0.286 | 58% | 0.581 | S | S | . | * | G | 310 helix | trans | -57.2 | -30.6 | 179.2 | -25.9 | 34.1 | 0 | 0 | 0 | 114.8 | Y104 D108 Y109 Q126 | Y104-P106 HydrophobicContact CD1-CG 4.41Å; Y104-P106 HydrophobicContact CE1-CG 3.92Å; P106-D108 PolarHBondContact O-N 2.72Å; P106-Y109 PolarHBondContact O-N 2.82Å; P106-Q126 VanDerWaalsContact CB-NE2 3.33Å; P106-Q126 HydrophobicContact CG-CG 4.07Å |
| 107 | A | 77.5 | Confident | 71.8 | Confident | 56 Ų | 56 | 103.4 Ų | 103.4 | 46% | 0.463 | 58% | 0.577 | S | S | . | * | G | 310 helix | trans | -65 | -29.8 | -178 | 0 | 0 | 0 | 0 | 0 | 112.7 | N105 Y109 | N105-A107 PolarHBondContact O-N 3.06Å; N105-A107 PolarHBondContact OD1-N 2.65Å; A107-Y109 PolarHBondContact O-N 3.44Å |
| 108 | D | 78.8 | Confident | 73.5 | Confident | 90 Ų | 90 | 101.2 Ų | 101.2 | 48% | 0.481 | 56% | 0.558 | S | S | . | * | G | 310 helix | trans | -69.6 | -18.5 | -178 | -61.9 | -12.5 | 0 | 0 | 0 | 111.9 | N105 P106 H111 | N105-D108 WeakPolarHBondContact CB-OD2 3.19Å; N105-D108 PolarHBondContact ND2-OD1 2.79Å; N105-D108 VanDerWaalsContact ND2-OD1 3.16Å; N105-D108 PolarHBondContact O-N 3.31Å; P106-D108 PolarHBondContact O-N 2.72Å; D108-H111 PolarHBondContact O-CE1 3.41Å; D108-H111 PolarHBondContact O-ND1 3.25Å |
| 109 | Y | 76.2 | Confident | 75 | Confident | 106 Ų | 106 | 100.9 Ų | 100.9 | 42% | 0.416 | 55% | 0.55 | S | S | . | . | G | 310 helix | trans | -113.2 | 2.3 | -174 | -56 | -83.2 | 0 | 0 | 0 | 114.1 | Y104 N105 P106 A107 H111 L112 | Y104-Y109 HydrophobicContact CD2-CD2 4.22Å; Y104-Y109 AromaticContact CD2-CE2 3.8Å; Y104-Y109 HydrophobicContact CD2-CE2 3.8Å; Y104-Y109 AromaticContact CE2-CD2 3.64Å; Y104-Y109 HydrophobicContact CE2-CD2 3.64Å; Y104-Y109 AromaticContact CE2-CE2 3.69Å; Y104-Y109 HydrophobicContact CE2-CE2 3.69Å; Y104-Y109 HydrophobicContact CE2-CG 4.49Å; N105-Y109 VanDerWaalsContact O-CD2 3.29Å; N105-Y109 WeakPolarHBondContact O-CD2 3.41Å; P106-Y109 PolarHBondContact O-N 2.82Å; A107-Y109 PolarHBondContact O-N 3.44Å; Y109-H111 PolarHBondContact O-N 3.21Å; Y109-L112 HydrophobicContact CD1-CD1 4.11Å; Y109-L112 PolarHBondContact O-N 3.01Å |
| 110 | E | 76.6 | Confident | 76.5 | Confident | 161 Ų | 161 | 100.5 Ų | 100.5 | 75% | 0.752 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -26.7 | 179.9 | -72.9 | -170 | 167.4 | 0 | 0 | 113.6 | L112 | E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 2.91Å |
| 111 | H | 79.9 | Confident | 77.8 | Confident | 148 Ų | 148 | 100 Ų | 100 | 69% | 0.685 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.6 | -9 | -177.9 | 70.4 | -86.1 | 0 | 0 | 0 | 113.7 | D108 Y109 T113 | D108-H111 PolarHBondContact O-CE1 3.41Å; D108-H111 PolarHBondContact O-ND1 3.25Å; Y109-H111 PolarHBondContact O-N 3.21Å; H111-T113 PolarHBondContact O-N 2.93Å |
| 112 | L | 80.5 | Confident | 79.2 | Confident | 68 Ų | 68 | 93.1 Ų | 93.1 | 36% | 0.356 | 51% | 0.505 | S | S | . | . | trans | -74.3 | 126.4 | 179.9 | -83.7 | 86.4 | 0 | 0 | 0 | 111.3 | Y109 E110 V114 | Y109-L112 HydrophobicContact CD1-CD1 4.11Å; Y109-L112 PolarHBondContact O-N 3.01Å; E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 2.91Å; L112-V114 VanDerWaalsContact C-N 3.31Å; L112-V114 HydrophobicContact CB-CG1 4.15Å; L112-V114 HydrophobicContact CD2-CG1 4.45Å; L112-V114 PolarHBondContact O-N 3.42Å | ||
| 113 | T | 81 | Confident | 80 | Confident | 154 Ų | 154 | 93.5 Ų | 93.5 | 95% | 0.945 | 48% | 0.484 | S | S | * | . | trans | -82 | 75.8 | 174.5 | -29.2 | 0 | 0 | 0 | 0 | 110.3 | H111 | H111-T113 PolarHBondContact O-N 2.93Š| ||
| 114 | V | 80.6 | Confident | 80.7 | Confident | 47 Ų | 47 | 95.4 Ų | 95.4 | 29% | 0.285 | 49% | 0.485 | S | S | . | . | trans | -100.1 | 154.8 | -177.9 | -77.2 | 0 | 0 | 0 | 0 | 112.9 | L112 I118 K119 F122 | L112-V114 VanDerWaalsContact C-N 3.31Å; L112-V114 HydrophobicContact CB-CG1 4.15Å; L112-V114 HydrophobicContact CD2-CG1 4.45Å; L112-V114 PolarHBondContact O-N 3.42Å; V114-I118 HydrophobicContact CB-CB 3.93Å; V114-I118 HydrophobicContact CB-CD1 4.44Å; V114-I118 HydrophobicContact CB-CG2 3.74Å; V114-I118 HydrophobicContact CG1-CB 4.35Å; V114-I118 HydrophobicContact CG1-CD1 4.4Å; V114-I118 HydrophobicContact CG1-CG2 3.71Å; V114-I118 HydrophobicContact CG2-CG2 4.18Å; V114-K119 HydrophobicContact CG2-CG 4.15Å; V114-F122 HydrophobicContact CG2-CE2 4.42Å | ||
| 115 | S | 83.6 | Confident | 81.2 | Confident | 60 Ų | 60 | 95.8 Ų | 95.8 | 42% | 0.42 | 49% | 0.491 | S | S | . | . | trans | -62.6 | 158.7 | 172.6 | 62.2 | 0 | 0 | 0 | 0 | 111.1 | E117 I118 K119 | S115-E117 PolarHBondContact O-N 3.16Å; S115-I118 PolarHBondContact O-N 3.28Å; S115-I118 VanDerWaalsContact O-N 3.11Å; S115-I118 WeakPolarHBondContact OG-CD1 3.48Å; S115-I118 WeakPolarHBondContact OG-CG1 3.49Å; S115-K119 PolarHBondContact O-N 3.34Å; S115-K119 VanDerWaalsContact O-N 3.16Å | ||
| 116 | S | 81.6 | Confident | 81.3 | Confident | 94 Ų | 94 | 99 Ų | 99 | 66% | 0.657 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -56.4 | -38.1 | -179.8 | 49.9 | 0 | 0 | 0 | 0 | 112.9 | I118 K119 E120 | S116-I118 VanDerWaalsContact C-N 3.35Å; S116-I118 PolarHBondContact O-N 3.22Å; S116-K119 WeakPolarHBondContact O-CB 3.49Å; S116-K119 PolarHBondContact O-N 3.31Å; S116-E120 PolarHBondContact O-N 3.19Å; S116-E120 VanDerWaalsContact O-N 3.14Å |
| 117 | E | 84.7 | Confident | 81.5 | Confident | 139 Ų | 139 | 104 Ų | 104 | 65% | 0.65 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.3 | -40.4 | 177.4 | -174.3 | 176.7 | -166.2 | 0 | 0 | 112.5 | S115 K119 E120 I121 | S115-E117 PolarHBondContact O-N 3.16Å; E117-K119 VanDerWaalsContact C-N 3.34Å; E117-E120 PolarHBondContact O-N 3.26Å; E117-I121 PolarHBondContact O-N 3.27Å |
| 118 | I | 83.4 | Confident | 81.8 | Confident | 68 Ų | 68 | 109.3 Ų | 109.3 | 35% | 0.349 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -72.6 | -32 | 178.4 | -63.9 | 169 | 0 | 0 | 0 | 110.9 | V114 S115 S116 E120 I121 F122 | V114-I118 HydrophobicContact CB-CB 3.93Å; V114-I118 HydrophobicContact CB-CD1 4.44Å; V114-I118 HydrophobicContact CB-CG2 3.74Å; V114-I118 HydrophobicContact CG1-CB 4.35Å; V114-I118 HydrophobicContact CG1-CD1 4.4Å; V114-I118 HydrophobicContact CG1-CG2 3.71Å; V114-I118 HydrophobicContact CG2-CG2 4.18Å; S115-I118 PolarHBondContact O-N 3.28Å; S115-I118 VanDerWaalsContact O-N 3.11Å; S115-I118 WeakPolarHBondContact OG-CD1 3.48Å; S115-I118 WeakPolarHBondContact OG-CG1 3.49Å; S116-I118 VanDerWaalsContact C-N 3.35Å; S116-I118 PolarHBondContact O-N 3.22Å; I118-E120 VanDerWaalsContact C-N 3.33Å; I118-I121 WeakPolarHBondContact O-CB 3.33Å; I118-I121 PolarHBondContact O-N 2.96Å; I118-F122 HydrophobicContact CG2-CD2 4.16Å; I118-F122 HydrophobicContact CG2-CE2 3.7Å; I118-F122 VanDerWaalsContact O-CD2 3.23Å; I118-F122 WeakPolarHBondContact O-CD2 3.39Å; I118-F122 PolarHBondContact O-N 2.87Å |
| 119 | K | 81.4 | Confident | 81.8 | Confident | 143 Ų | 143 | 110.6 Ų | 110.6 | 62% | 0.622 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63 | -39.4 | 173 | -111.4 | 179.8 | 179.6 | -174.9 | 0 | 112.5 | V114 S115 S116 E117 I121 F122 E123 | V114-K119 HydrophobicContact CG2-CG 4.15Å; S115-K119 PolarHBondContact O-N 3.34Å; S115-K119 VanDerWaalsContact O-N 3.16Å; S116-K119 WeakPolarHBondContact O-CB 3.49Å; S116-K119 PolarHBondContact O-N 3.31Å; E117-K119 VanDerWaalsContact C-N 3.34Å; K119-I121 VanDerWaalsContact C-N 3.31Å; K119-I121 PolarHBondContact O-N 3.36Å; K119-F122 PolarHBondContact O-N 3.18Å; K119-E123 PolarHBondContact O-N 3.22Å |
| 120 | E | 82.5 | Confident | 82.1 | Confident | 111 Ų | 111 | 109.8 Ų | 109.8 | 52% | 0.519 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.7 | -36.9 | 174.9 | -69.8 | 173.4 | -164.6 | 0 | 0 | 111.6 | S116 E117 I118 F122 E123 Y124 | S116-E120 PolarHBondContact O-N 3.19Å; S116-E120 VanDerWaalsContact O-N 3.14Å; E117-E120 PolarHBondContact O-N 3.26Å; I118-E120 VanDerWaalsContact C-N 3.33Å; E120-F122 PolarHBondContact O-N 3.31Å; E120-E123 WeakPolarHBondContact O-CB 3.4Å; E120-E123 PolarHBondContact O-N 2.76Å; E120-Y124 WeakPolarHBondContact O-CD2 3.29Å; E120-Y124 PolarHBondContact O-N 3.13Å |
| 121 | I | 85.8 | Confident | 82.4 | Confident | 97 Ų | 97 | 110 Ų | 110 | 50% | 0.497 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.9 | -43.7 | 175.7 | -68 | 165.5 | 0 | 0 | 0 | 112 | E117 I118 K119 E123 Y124 I125 | E117-I121 PolarHBondContact O-N 3.27Å; I118-I121 WeakPolarHBondContact O-CB 3.33Å; I118-I121 PolarHBondContact O-N 2.96Å; K119-I121 VanDerWaalsContact C-N 3.31Å; K119-I121 PolarHBondContact O-N 3.36Å; I121-E123 PolarHBondContact O-N 3.04Å; I121-Y124 WeakPolarHBondContact O-CB 3.42Å; I121-Y124 PolarHBondContact O-N 3.15Å; I121-Y124 VanDerWaalsContact O-N 3.07Å; I121-I125 PolarHBondContact O-N 3.11Å |
| 122 | F | 83.6 | Confident | 82.3 | Confident | 53 Ų | 53 | 109.6 Ų | 109.6 | 23% | 0.232 | 56% | 0.555 | C | S | . | * | H | α-helix | trans | -63.1 | -29 | 177.2 | -74.6 | -63 | 0 | 0 | 0 | 113 | Y104 V114 I118 K119 E120 Y124 I125 | Y104-F122 HydrophobicContact CE2-CD1 4.23Å; Y104-F122 HydrophobicContact CE2-CE1 4.44Å; Y104-F122 WeakPolarHBondContact OH-CD1 3.46Å; V114-F122 HydrophobicContact CG2-CE2 4.42Å; I118-F122 HydrophobicContact CG2-CD2 4.16Å; I118-F122 HydrophobicContact CG2-CE2 3.7Å; I118-F122 VanDerWaalsContact O-CD2 3.23Å; I118-F122 WeakPolarHBondContact O-CD2 3.39Å; I118-F122 PolarHBondContact O-N 2.87Å; K119-F122 PolarHBondContact O-N 3.18Å; E120-F122 PolarHBondContact O-N 3.31Å; F122-Y124 VanDerWaalsContact C-N 3.33Å; F122-I125 HydrophobicContact CD1-CD1 3.91Å; F122-I125 PolarHBondContact O-N 3.26Å |
| 123 | E | 82.1 | Confident | 82.5 | Confident | 90 Ų | 90 | 112.2 Ų | 112.2 | 42% | 0.421 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -68.6 | -33.2 | 174.4 | -158.9 | -178.1 | 178.4 | 0 | 0 | 111.8 | K119 E120 I121 I125 Q126 R127 | K119-E123 PolarHBondContact O-N 3.22Å; E120-E123 WeakPolarHBondContact O-CB 3.4Å; E120-E123 PolarHBondContact O-N 2.76Å; I121-E123 PolarHBondContact O-N 3.04Å; E123-I125 VanDerWaalsContact C-N 3.29Å; E123-I125 PolarHBondContact O-N 3.45Å; E123-Q126 PolarHBondContact O-N 2.63Å; E123-R127 WeakPolarHBondContact O-CG 3.42Å; E123-R127 PolarHBondContact O-N 3.01Å; E123-R127 IonicContact OE1-CZ 2.86Å; E123-R127 IonicContact OE1-NE 2.64Å; E123-R127 IonicContact OE1-NH2 2.85Å; E123-R127 PolarHBondContact OE1-NH2 3.07Å; E123-R127 IonicContact OE2-CZ 3.86Å; E123-R127 IonicContact OE2-NH2 3.68Å; E123-R127 PolarHBondContact OE2-NH2 3.13Å |
| 124 | Y | 84.2 | Confident | 82.5 | Confident | 151 Ų | 151 | 113.5 Ų | 113.5 | 59% | 0.592 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -66.3 | -28.4 | 175.1 | -73.9 | -75.5 | 0 | 0 | 0 | 113.3 | E120 I121 F122 R127 Y128 | E120-Y124 WeakPolarHBondContact O-CD2 3.29Å; E120-Y124 PolarHBondContact O-N 3.13Å; I121-Y124 WeakPolarHBondContact O-CB 3.42Å; I121-Y124 PolarHBondContact O-N 3.15Å; I121-Y124 VanDerWaalsContact O-N 3.07Å; F122-Y124 VanDerWaalsContact C-N 3.33Å; Y124-R127 PolarHBondContact O-N 3.16Å; Y124-Y128 WeakPolarHBondContact O-CB 3.17Å; Y124-Y128 PolarHBondContact O-N 3.21Å |
| 125 | I | 84.2 | Confident | 82.6 | Confident | 76 Ų | 76 | 118.2 Ų | 118.2 | 39% | 0.39 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.4 | -43.7 | 176.3 | -56.8 | 178.1 | 0 | 0 | 0 | 110.3 | Y104 I121 F122 E123 R127 Y128 | Y104-I125 HydrophobicContact CD1-CB 4.34Å; Y104-I125 HydrophobicContact CD1-CG2 3.47Å; Y104-I125 VanDerWaalsContact CD1-CG2 3.47Å; Y104-I125 HydrophobicContact CD2-CG2 4.46Å; Y104-I125 HydrophobicContact CE1-CB 4Å; Y104-I125 HydrophobicContact CE1-CD1 4.44Å; Y104-I125 HydrophobicContact CE1-CG2 3.64Å; Y104-I125 HydrophobicContact CE2-CD1 4.09Å; Y104-I125 HydrophobicContact CG-CG2 3.91Å; I121-I125 PolarHBondContact O-N 3.11Å; F122-I125 HydrophobicContact CD1-CD1 3.91Å; F122-I125 PolarHBondContact O-N 3.26Å; E123-I125 VanDerWaalsContact C-N 3.29Å; E123-I125 PolarHBondContact O-N 3.45Å; I125-R127 VanDerWaalsContact C-N 3.32Å; I125-R127 PolarHBondContact O-N 3.14Å; I125-Y128 PolarHBondContact O-N 3.4Å |
| 126 | Q | 81.1 | Confident | 82.5 | Confident | 124 Ų | 124 | 123.6 Ų | 123.6 | 58% | 0.579 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -69.4 | -30.7 | 177.5 | -63.4 | -177.8 | 20.4 | 0 | 0 | 112.6 | Y104 P106 E123 Y128 | Y104-Q126 HydrophobicContact CE1-CG 4.4Å; P106-Q126 VanDerWaalsContact CB-NE2 3.33Å; P106-Q126 HydrophobicContact CG-CG 4.07Å; E123-Q126 PolarHBondContact O-N 2.63Å; Q126-Y128 VanDerWaalsContact C-N 3.34Å |
| 127 | R | 82.4 | Confident | 82.4 | Confident | 148 Ų | 148 | 125.2 Ų | 125.2 | 56% | 0.558 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -81 | -13.8 | 178.8 | -68.5 | 174.2 | -179.7 | -173.4 | 1.6 | 113.3 | E123 Y124 I125 T129 | E123-R127 WeakPolarHBondContact O-CG 3.42Å; E123-R127 PolarHBondContact O-N 3.01Å; E123-R127 IonicContact OE1-CZ 2.86Å; E123-R127 IonicContact OE1-NE 2.64Å; E123-R127 IonicContact OE1-NH2 2.85Å; E123-R127 PolarHBondContact OE1-NH2 3.07Å; E123-R127 IonicContact OE2-CZ 3.86Å; E123-R127 IonicContact OE2-NH2 3.68Å; E123-R127 PolarHBondContact OE2-NH2 3.13Å; Y124-R127 PolarHBondContact O-N 3.16Å; I125-R127 VanDerWaalsContact C-N 3.32Å; I125-R127 PolarHBondContact O-N 3.14Å; R127-T129 PolarHBondContact O-N 3.48Å |
| 128 | Y | 84.7 | Confident | 82.1 | Confident | 167 Ų | 167 | 127.4 Ų | 127.4 | 66% | 0.655 | 62% | 0.618 | S | S | * | * | trans | -75.7 | 110.7 | -177.9 | -179.7 | -102.6 | 0 | 0 | 0 | 110.7 | Y124 I125 Q126 P130 | Y124-Y128 WeakPolarHBondContact O-CB 3.17Å; Y124-Y128 PolarHBondContact O-N 3.21Å; I125-Y128 PolarHBondContact O-N 3.4Å; Q126-Y128 VanDerWaalsContact C-N 3.34Å; Y128-P130 HydrophobicContact CE1-CB 3.88Å | ||
| 129 | T | 78.7 | Confident | 82 | Confident | 117 Ų | 117 | 132.6 Ų | 132.6 | 72% | 0.718 | 65% | 0.646 | S | S | * | * | trans | -97.1 | 112.9 | 167.2 | 48.1 | 0 | 0 | 0 | 0 | 108.8 | R127 Q131 | R127-T129 PolarHBondContact O-N 3.48Å; T129-Q131 PolarHBondContact O-N 3.2Å | ||
| 130 | P | 81.9 | Confident | 81.9 | Confident | 90 Ų | 90 | 134.5 Ų | 134.5 | 58% | 0.584 | 65% | 0.654 | S | S | * | * | trans | -60.4 | 131.2 | 178.6 | 22.6 | -30.9 | 0 | 0 | 0 | 109.9 | Y128 T132 | Y128-P130 HydrophobicContact CE1-CB 3.88Å; P130-T132 PolarHBondContact O-N 3.19Å | ||
| 131 | Q | 82.1 | Confident | 81.9 | Confident | 166 Ų | 166 | 134.2 Ų | 134.2 | 78% | 0.776 | 66% | 0.662 | S | S | * | * | trans | -69.8 | 117.3 | 173.3 | -68.4 | -172.5 | -6.3 | 0 | 0 | 108.6 | T129 I133 | T129-Q131 PolarHBondContact O-N 3.2Å; Q131-I133 HydrophobicContact CB-CG1 4.37Å; Q131-I133 PolarHBondContact O-N 3.41Å; Q131-I133 VanDerWaalsContact O-N 3.1Å | ||
| 132 | T | 79.3 | Confident | 81.6 | Confident | 139 Ų | 139 | 138.2 Ų | 138.2 | 85% | 0.853 | 68% | 0.676 | S | S | * | * | trans | -77.6 | 96 | 170.7 | -55 | 0 | 0 | 0 | 0 | 107.5 | P130 E134 | P130-T132 PolarHBondContact O-N 3.19Å; T132-E134 PolarHBondContact O-N 3.47Å | ||
| 133 | I | 84.9 | Confident | 81.4 | Confident | 122 Ų | 122 | 142.3 Ų | 142.3 | 63% | 0.626 | 70% | 0.699 | S | S | * | * | trans | -87.6 | 102.2 | 173.3 | -57.8 | 172 | 0 | 0 | 0 | 106.7 | Q131 L135 | Q131-I133 HydrophobicContact CB-CG1 4.37Å; Q131-I133 PolarHBondContact O-N 3.41Å; Q131-I133 VanDerWaalsContact O-N 3.1Å; I133-L135 HydrophobicContact CG2-CD2 4.25Å; I133-L135 HydrophobicContact CG2-CG 4.5Å; I133-L135 PolarHBondContact O-N 3.19Å | ||
| 134 | E | 80.2 | Confident | 81.4 | Confident | 182 Ų | 182 | 140.3 Ų | 140.3 | 85% | 0.85 | 69% | 0.694 | S | S | * | * | trans | -74 | 104.9 | 171.1 | -162.3 | 170.9 | -168.3 | 0 | 0 | 108.2 | T132 E136 | T132-E134 PolarHBondContact O-N 3.47Å; E134-E136 PolarHBondContact O-N 3.4Å | ||
| 135 | L | 82.8 | Confident | 81.3 | Confident | 146 Ų | 146 | 140.3 Ų | 140.3 | 76% | 0.764 | 70% | 0.704 | S | S | * | * | trans | -76.3 | 118.4 | 178 | -69.1 | 165.6 | 0 | 0 | 0 | 108.8 | I133 T137 | I133-L135 HydrophobicContact CG2-CD2 4.25Å; I133-L135 HydrophobicContact CG2-CG 4.5Å; I133-L135 PolarHBondContact O-N 3.19Å; L135-T137 PolarHBondContact O-N 3.48Å; L135-T137 VanDerWaalsContact O-N 3.1Å | ||
| 136 | E | 80.7 | Confident | 81.1 | Confident | 173 Ų | 173 | 146.6 Ų | 146.6 | 81% | 0.808 | 72% | 0.724 | S | S | * | * | trans | -60.3 | 113.4 | 172.6 | -70.2 | -179.3 | 178.9 | 0 | 0 | 110.6 | E134 K138 | E134-E136 PolarHBondContact O-N 3.4Å; E136-K138 PolarHBondContact O-N 3.48Å | ||
| 137 | T | 79.2 | Confident | 81 | Confident | 128 Ų | 128 | 147 Ų | 147 | 79% | 0.785 | 73% | 0.729 | S | S | * | * | trans | -79.3 | 105.4 | 173.3 | 52.6 | 0 | 0 | 0 | 0 | 110 | L135 L139 | L135-T137 PolarHBondContact O-N 3.48Å; L135-T137 VanDerWaalsContact O-N 3.1Å; T137-L139 PolarHBondContact O-N 3.37Å | ||
| 138 | K | 80.1 | Confident | 80.8 | Confident | 185 Ų | 185 | 145.1 Ų | 145.1 | 80% | 0.804 | 74% | 0.736 | S | S | * | * | trans | -79.2 | 110.8 | 170.2 | -66.7 | -173.4 | -179.9 | 179.1 | 0 | 109.7 | E136 K140 | E136-K138 PolarHBondContact O-N 3.48Å; K138-K140 PolarHBondContact O-N 3.26Å; K138-K140 VanDerWaalsContact O-N 3.12Å | ||
| 139 | L | 80.4 | Confident | 80.3 | Confident | 176 Ų | 176 | 141.9 Ų | 141.9 | 92% | 0.921 | 74% | 0.743 | S | S | * | * | trans | -65.8 | 109 | 166.7 | -68.7 | 171.2 | 0 | 0 | 0 | 108.6 | T137 | T137-L139 PolarHBondContact O-N 3.37Š| ||
| 140 | K | 80.3 | Confident | 79.9 | Confident | 184 Ų | 184 | 142.6 Ų | 142.6 | 80% | 0.8 | 75% | 0.748 | S | S | * | * | trans | -104.4 | 128.8 | 168.3 | -173 | -179 | 177.8 | -174.4 | 0 | 107.7 | K138 F142 | K138-K140 PolarHBondContact O-N 3.26Å; K138-K140 VanDerWaalsContact O-N 3.12Å; K140-F142 PolarHBondContact O-N 3.25Å; K140-F142 VanDerWaalsContact O-N 3.13Å | ||
| 141 | P | 80.6 | Confident | 79.2 | Confident | 105 Ų | 105 | 141.2 Ų | 141.2 | 68% | 0.682 | 75% | 0.749 | S | S | * | * | trans | -54.5 | 121.7 | 171.1 | -22.9 | 32 | 0 | 0 | 0 | 109.9 | I143 | P141-I143 HydrophobicContact CB-CG1 4.46Å; P141-I143 PolarHBondContact O-N 3.3Å | ||
| 142 | F | 80.5 | Confident | 78.6 | Confident | 181 Ų | 181 | 141 Ų | 141 | 79% | 0.794 | 75% | 0.754 | S | S | * | * | trans | -80.7 | 109.9 | 169 | 175.5 | -109.3 | 0 | 0 | 0 | 107.5 | K140 P144 | K140-F142 PolarHBondContact O-N 3.25Å; K140-F142 VanDerWaalsContact O-N 3.13Å; F142-P144 HydrophobicContact CD1-CG 4.06Å; F142-P144 HydrophobicContact CE1-CB 4.13Å; F142-P144 HydrophobicContact CE1-CG 3.62Å; F142-P144 HydrophobicContact CZ-CB 4.28Å; F142-P144 HydrophobicContact CZ-CG 4.25Å | ||
| 143 | I | 79.4 | Confident | 78.2 | Confident | 138 Ų | 138 | 142.3 Ų | 142.3 | 71% | 0.708 | 75% | 0.754 | S | S | * | * | trans | -108.8 | 102.7 | 174.4 | -56.8 | 170.9 | 0 | 0 | 0 | 105.6 | P141 | P141-I143 HydrophobicContact CB-CG1 4.46Å; P141-I143 PolarHBondContact O-N 3.3Å | ||
| 144 | P | 82.6 | Confident | 77.7 | Confident | 49 Ų | 49 | 141.1 Ų | 141.1 | 32% | 0.318 | 75% | 0.749 | S | S | . | * | trans | -61.4 | 140.9 | 175.4 | -7.6 | 17.4 | 0 | 0 | 0 | 109.9 | F142 Y146 I147 | F142-P144 HydrophobicContact CD1-CG 4.06Å; F142-P144 HydrophobicContact CE1-CB 4.13Å; F142-P144 HydrophobicContact CE1-CG 3.62Å; F142-P144 HydrophobicContact CZ-CB 4.28Å; F142-P144 HydrophobicContact CZ-CG 4.25Å; P144-Y146 WeakPolarHBondContact CB-O 3.23Å; P144-Y146 PolarHBondContact O-N 3.48Å; P144-I147 HydrophobicContact CG-CG1 4.38Å | ||
| 145 | D | 81.7 | Confident | 77.3 | Confident | 151 Ų | 151 | 135.7 Ų | 135.7 | 81% | 0.807 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -62.1 | -22.7 | 173.4 | -67.9 | -30.1 | 0 | 0 | 0 | 112.1 | ||
| 146 | Y | 79.6 | Confident | 76.5 | Confident | 207 Ų | 207 | 136.7 Ų | 136.7 | 81% | 0.812 | 73% | 0.733 | S | S | * | * | trans | -138.5 | 123.5 | 178.4 | -56.5 | -78 | 0 | 0 | 0 | 109.9 | P144 | P144-Y146 WeakPolarHBondContact CB-O 3.23Å; P144-Y146 PolarHBondContact O-N 3.48Å | ||
| 147 | I | 78.4 | Confident | 76.2 | Confident | 132 Ų | 132 | 135.5 Ų | 135.5 | 68% | 0.677 | 73% | 0.732 | S | S | * | * | trans | -99.3 | 131.7 | 167.8 | -59.7 | 170 | 0 | 0 | 0 | 105.5 | P144 A149 | P144-I147 HydrophobicContact CG-CG1 4.38Å; I147-A149 PolarHBondContact O-N 3.37Å | ||
| 148 | P | 78.3 | Confident | 75.9 | Confident | 110 Ų | 110 | 133.4 Ų | 133.4 | 71% | 0.714 | 71% | 0.712 | S | S | * | * | trans | -55.3 | 120.1 | 173.6 | 23.6 | -32.3 | 0 | 0 | 0 | 108.1 | V150 | P148-V150 VanDerWaalsContact C-N 3.32Å; P148-V150 PolarHBondContact O-N 3.35Å | ||
| 149 | A | 74.3 | Confident | 75.7 | Confident | 98 Ų | 98 | 130.8 Ų | 130.8 | 81% | 0.81 | 71% | 0.711 | S | S | * | * | trans | -66.9 | 101.3 | 167.7 | 0 | 0 | 0 | 0 | 0 | 106.1 | I147 G151 | I147-A149 PolarHBondContact O-N 3.37Å; A149-G151 VanDerWaalsContact C-N 3.35Å; A149-G151 PolarHBondContact O-N 3.39Å | ||
| 150 | V | 70.7 | Confident | 75.5 | Confident | 133 Ų | 133 | 127.5 Ų | 127.5 | 81% | 0.806 | 70% | 0.7 | S | S | * | * | trans | -61.1 | 108.6 | 159.3 | -176.4 | 0 | 0 | 0 | 0 | 103.7 | P148 D152 | P148-V150 VanDerWaalsContact C-N 3.32Å; P148-V150 PolarHBondContact O-N 3.35Å; V150-D152 PolarHBondContact O-N 3.48Å | ||
| 151 | G | 67.5 | Low | 75.6 | Confident | 60 Ų | 60 | 122.6 Ų | 122.6 | 62% | 0.619 | 68% | 0.677 | S | S | * | * | trans | -55.4 | 137.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | A149 I153 | A149-G151 VanDerWaalsContact C-N 3.35Å; A149-G151 PolarHBondContact O-N 3.39Å; G151-I153 PolarHBondContact O-N 3.4Å | ||
| 152 | D | 68.8 | Low | 75.8 | Confident | 163 Ų | 163 | 124.6 Ų | 124.6 | 87% | 0.872 | 69% | 0.69 | S | S | * | * | trans | -52.1 | 141.1 | 172.6 | -75.9 | -33.2 | 0 | 0 | 0 | 108.9 | V150 D154 | V150-D152 PolarHBondContact O-N 3.48Å; D152-D154 PolarHBondContact O-N 3.36Å | ||
| 153 | I | 70.8 | Confident | 76.3 | Confident | 165 Ų | 165 | 119.6 Ų | 119.6 | 85% | 0.846 | 67% | 0.671 | S | S | * | * | trans | -57.5 | 112.4 | 172.2 | -58.1 | 169.9 | 0 | 0 | 0 | 106.1 | G151 A155 | G151-I153 PolarHBondContact O-N 3.4Å; I153-A155 PolarHBondContact O-N 3.03Å | ||
| 154 | D | 74.2 | Confident | 76.6 | Confident | 98 Ų | 98 | 116.3 Ų | 116.3 | 52% | 0.524 | 67% | 0.671 | S | S | . | * | trans | -60 | 116.2 | 174.3 | -176.9 | -2.6 | 0 | 0 | 0 | 107.4 | D152 F156 | D152-D154 PolarHBondContact O-N 3.36Å; D154-F156 VanDerWaalsContact O-CD2 3.29Å; D154-F156 WeakPolarHBondContact O-CD2 3.38Å; D154-F156 PolarHBondContact O-N 3.49Å; D154-F156 PolarHBondContact OD1-N 3.33Å | ||
| 155 | A | 72.6 | Confident | 76.7 | Confident | 68 Ų | 68 | 119.5 Ų | 119.5 | 56% | 0.562 | 68% | 0.68 | S | S | * | * | trans | -69.7 | 6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | I153 L157 | I153-A155 PolarHBondContact O-N 3.03Å; A155-L157 HydrophobicContact CB-CD1 3.82Å; A155-L157 HydrophobicContact CB-CG 3.88Å; A155-L157 PolarHBondContact O-N 3.34Å | ||
| 156 | F | 65.7 | Low | 76.8 | Confident | 167 Ų | 167 | 115.8 Ų | 115.8 | 73% | 0.732 | 66% | 0.664 | S | S | * | * | trans | 55.3 | 22 | -174 | -65.4 | -85.7 | 0 | 0 | 0 | 112.9 | D154 K158 | D154-F156 VanDerWaalsContact O-CD2 3.29Å; D154-F156 WeakPolarHBondContact O-CD2 3.38Å; D154-F156 PolarHBondContact O-N 3.49Å; D154-F156 PolarHBondContact OD1-N 3.33Å; F156-K158 VanDerWaalsContact C-N 3.31Å; F156-K158 PolarHBondContact O-N 3.07Å | ||
| 157 | L | 73.8 | Confident | 76.8 | Confident | 147 Ų | 147 | 109.4 Ų | 109.4 | 77% | 0.77 | 64% | 0.644 | S | S | * | * | trans | -79.5 | 79.1 | 178.2 | -70.5 | 172 | 0 | 0 | 0 | 109.5 | A155 V159 | A155-L157 HydrophobicContact CB-CD1 3.82Å; A155-L157 HydrophobicContact CB-CG 3.88Å; A155-L157 PolarHBondContact O-N 3.34Å; L157-V159 PolarHBondContact O-N 3.3Å | ||
| 158 | K | 72.9 | Confident | 76.9 | Confident | 84 Ų | 84 | 108.8 Ų | 108.8 | 37% | 0.365 | 63% | 0.634 | S | S | . | * | P | Polyproline II helix | trans | -77.2 | 118.4 | 174.3 | -60.1 | -161.6 | -174.2 | -167.2 | 0 | 110.1 | F156 P160 L169 D175 | F156-K158 VanDerWaalsContact C-N 3.31Å; F156-K158 PolarHBondContact O-N 3.07Å; K158-P160 WeakPolarHBondContact O-CD 3.34Å; K158-L169 PolarHBondContact NZ-O 2.92Å; K158-D175 WeakPolarHBondContact CE-OD2 3.45Å; K158-D175 IonicContact NZ-OD2 3.73Å; K158-D175 PolarHBondContact NZ-OD2 3.19Å |
| 159 | V | 76.3 | Confident | 76.8 | Confident | 131 Ų | 131 | 106.4 Ų | 106.4 | 79% | 0.794 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 120.8 | 170.5 | -178.1 | 0 | 0 | 0 | 0 | 107.4 | L157 | L157-V159 PolarHBondContact O-N 3.3Š|
| 160 | P | 76.8 | Confident | 76.9 | Confident | 106 Ų | 106 | 104 Ų | 104 | 69% | 0.688 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 149 | -179.3 | 26.2 | -34 | 0 | 0 | 0 | 109.6 | K158 | K158-P160 WeakPolarHBondContact O-CD 3.34Š|
| 161 | R | 82.8 | Confident | 77.3 | Confident | 82 Ų | 82 | 104.4 Ų | 104.4 | 31% | 0.309 | 60% | 0.597 | S | S | . | * | P | Polyproline II helix | trans | -53.4 | 137 | -179 | -61.9 | -165.3 | -73.5 | 173.3 | -20.8 | 110.4 | D163 G164 K165 P166 D167 | R161-D163 WeakPolarHBondContact CB-OD1 3.45Å; R161-D163 IonicContact NE-OD1 3.79Å; R161-D163 IonicContact NH1-OD2 2.74Å; R161-D163 PolarHBondContact O-N 3.18Å; R161-G164 PolarHBondContact O-N 3.48Å; R161-K165 PolarHBondContact NE-O 3.35Å; R161-K165 VanDerWaalsContact NH2-C 3.34Å; R161-P166 PolarHBondContact NH2-O 3.2Å; R161-D167 HydrophobicContact CG-CB 4.14Å |
| 162 | P | 84.7 | Confident | 77.9 | Confident | 147 Ų | 147 | 108.2 Ų | 108.2 | 96% | 0.955 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | -16 | -179.3 | 25 | -33.4 | 0 | 0 | 0 | 113 | G164 | P162-G164 VanDerWaalsContact C-N 3.34Š|
| 163 | D | 90.4 | Very high | 78.2 | Confident | 76 Ų | 76 | 103.4 Ų | 103.4 | 41% | 0.406 | 58% | 0.578 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.7 | -2.9 | 174.7 | 75.5 | -15.1 | 0 | 0 | 0 | 113.8 | R161 K165 | R161-D163 WeakPolarHBondContact CB-OD1 3.45Å; R161-D163 IonicContact NE-OD1 3.79Å; R161-D163 IonicContact NH1-OD2 2.74Å; R161-D163 PolarHBondContact O-N 3.18Å; D163-K165 PolarHBondContact O-N 2.82Å; D163-K165 PolarHBondContact OD1-N 2.83Å; D163-K165 VanDerWaalsContact OD2-CD 3.3Å; D163-K165 WeakPolarHBondContact OD2-CD 3.07Å; D163-K165 WeakPolarHBondContact OD2-CE 3.12Å; D163-K165 WeakPolarHBondContact OD2-CG 2.97Å; D163-K165 IonicContact OD2-NZ 3.27Å; D163-K165 PolarHBondContact OD2-NZ 3.47Å |
| 164 | G | 85.3 | Confident | 78.6 | Confident | 69 Ų | 69 | 101.5 Ų | 101.5 | 71% | 0.711 | 57% | 0.569 | S | S | * | * | trans | 72.3 | 5.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115 | R161 P162 | R161-G164 PolarHBondContact O-N 3.48Å; P162-G164 VanDerWaalsContact C-N 3.34Å | ||
| 165 | K | 85.1 | Confident | 78.8 | Confident | 116 Ų | 116 | 100.2 Ų | 100.2 | 50% | 0.504 | 56% | 0.563 | S | S | . | * | P | Polyproline II helix | trans | -81.6 | 149 | 175.8 | -61.5 | -172.3 | -161.6 | 113.9 | 0 | 110.1 | R161 D163 D167 | R161-K165 PolarHBondContact NE-O 3.35Å; R161-K165 VanDerWaalsContact NH2-C 3.34Å; D163-K165 PolarHBondContact O-N 2.82Å; D163-K165 PolarHBondContact OD1-N 2.83Å; D163-K165 VanDerWaalsContact OD2-CD 3.3Å; D163-K165 WeakPolarHBondContact OD2-CD 3.07Å; D163-K165 WeakPolarHBondContact OD2-CE 3.12Å; D163-K165 WeakPolarHBondContact OD2-CG 2.97Å; D163-K165 IonicContact OD2-NZ 3.27Å; D163-K165 PolarHBondContact OD2-NZ 3.47Å; K165-D167 PolarHBondContact O-N 3.2Å |
| 166 | P | 82.9 | Confident | 79.2 | Confident | 73 Ų | 73 | 99 Ų | 99 | 47% | 0.474 | 55% | 0.545 | S | S | . | . | P | Polyproline II helix | trans | -65.6 | 128.9 | -176.9 | 25.2 | -34.4 | 0 | 0 | 0 | 111.9 | R161 Y168 | R161-P166 PolarHBondContact NH2-O 3.2Å; P166-Y168 HydrophobicContact CB-CE1 4.34Å; P166-Y168 HydrophobicContact CB-CE2 4.11Å; P166-Y168 HydrophobicContact CG-CE2 3.75Å; P166-Y168 VanDerWaalsContact CG-OH 3.3Å; P166-Y168 WeakPolarHBondContact CG-OH 3.43Å |
| 167 | D | 80.3 | Confident | 79.4 | Confident | 73 Ų | 73 | 97.8 Ų | 97.8 | 39% | 0.39 | 55% | 0.554 | S | S | . | * | P | Polyproline II helix | trans | -81.8 | 133.7 | 171.5 | -166.4 | -0.7 | 0 | 0 | 0 | 110 | R161 K165 L169 | R161-D167 HydrophobicContact CG-CB 4.14Å; K165-D167 PolarHBondContact O-N 3.2Å; D167-L169 WeakPolarHBondContact OD1-CB 3.45Å; D167-L169 PolarHBondContact OD1-N 3.29Å |
| 168 | Y | 80.7 | Confident | 79.2 | Confident | 119 Ų | 119 | 94.7 Ų | 94.7 | 47% | 0.467 | 54% | 0.544 | S | S | . | . | trans | -115.1 | 11.9 | 179 | -59.8 | -73.2 | 0 | 0 | 0 | 112.3 | P166 G170 L171 L172 | P166-Y168 HydrophobicContact CB-CE1 4.34Å; P166-Y168 HydrophobicContact CB-CE2 4.11Å; P166-Y168 HydrophobicContact CG-CE2 3.75Å; P166-Y168 VanDerWaalsContact CG-OH 3.3Å; P166-Y168 WeakPolarHBondContact CG-OH 3.43Å; Y168-G170 PolarHBondContact O-N 2.94Å; Y168-L171 HydrophobicContact CD1-CD1 4.37Å; Y168-L171 PolarHBondContact O-N 3.28Å; Y168-L172 HydrophobicContact CD1-CD1 4.36Å; Y168-L172 HydrophobicContact CD2-CD1 4.23Å; Y168-L172 HydrophobicContact CG-CD1 3.87Å; Y168-L172 HydrophobicContact CG-CG 4.4Å; Y168-L172 PolarHBondContact O-N 3.39Å | ||
| 169 | L | 76.9 | Confident | 79.1 | Confident | 59 Ų | 59 | 96 Ų | 96 | 31% | 0.309 | 57% | 0.57 | S | S | . | * | B | Isolated β-bridge | trans | -65.6 | 126.6 | 173.2 | -166.1 | 68.2 | 0 | 0 | 0 | 110.2 | K158 D167 L171 V173 D175 | K158-L169 PolarHBondContact NZ-O 2.92Å; D167-L169 WeakPolarHBondContact OD1-CB 3.45Å; D167-L169 PolarHBondContact OD1-N 3.29Å; L169-L171 VanDerWaalsContact C-N 3.34Å; L169-V173 HydrophobicContact CD1-CB 4.35Å; L169-V173 HydrophobicContact CD1-CG1 4.18Å; L169-D175 HydrophobicContact CD2-CB 4.34Å; L169-D175 WeakPolarHBondContact CD2-OD1 3.17Å; L169-D175 HydrophobicContact CG-CB 3.97Å |
| 170 | G | 76.2 | Confident | 79 | Confident | 47 Ų | 47 | 96.4 Ų | 96.4 | 49% | 0.485 | 57% | 0.568 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 90.7 | -18.8 | -168.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y168 V173 | Y168-G170 PolarHBondContact O-N 2.94Å; G170-V173 WeakPolarHBondContact CA-O 3.47Å; G170-V173 PolarHBondContact N-O 2.92Å |
| 171 | L | 78.3 | Confident | 78.9 | Confident | 143 Ų | 143 | 96.6 Ų | 96.6 | 75% | 0.749 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.3 | -52.7 | 178.7 | -63.2 | 176.3 | 0 | 0 | 0 | 112.4 | Y168 L169 | Y168-L171 HydrophobicContact CD1-CD1 4.37Å; Y168-L171 PolarHBondContact O-N 3.28Å; L169-L171 VanDerWaalsContact C-N 3.34Å |
| 172 | L | 80.5 | Confident | 78.8 | Confident | 139 Ų | 139 | 94.4 Ų | 94.4 | 73% | 0.728 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | -30.1 | 178.3 | -67.7 | 177.4 | 0 | 0 | 0 | 112.5 | Y168 | Y168-L172 HydrophobicContact CD1-CD1 4.36Å; Y168-L172 HydrophobicContact CD2-CD1 4.23Å; Y168-L172 HydrophobicContact CG-CD1 3.87Å; Y168-L172 HydrophobicContact CG-CG 4.4Å; Y168-L172 PolarHBondContact O-N 3.39Å |
| 173 | V | 75.7 | Confident | 78.6 | Confident | 62 Ų | 62 | 89.6 Ų | 89.6 | 38% | 0.376 | 52% | 0.523 | S | S | . | . | B | Isolated β-bridge | trans | -133.8 | 129.6 | -172.4 | 177.2 | 0 | 0 | 0 | 0 | 107.8 | L169 G170 D175 | L169-V173 HydrophobicContact CD1-CB 4.35Å; L169-V173 HydrophobicContact CD1-CG1 4.18Å; G170-V173 WeakPolarHBondContact CA-O 3.47Å; G170-V173 PolarHBondContact N-O 2.92Å; V173-D175 PolarHBondContact O-N 3.35Å |
| 174 | L | 78.7 | Confident | 78.1 | Confident | 125 Ų | 125 | 89.3 Ų | 89.3 | 65% | 0.654 | 53% | 0.525 | S | S | * | . | trans | -61.1 | 132.3 | -179.4 | -175.5 | 64.9 | 0 | 0 | 0 | 110.8 | E176 | L174-E176 PolarHBondContact O-N 3.42Š| ||
| 175 | D | 77.8 | Confident | 77.9 | Confident | 72 Ų | 72 | 86.8 Ų | 86.8 | 39% | 0.385 | 50% | 0.496 | S | S | . | . | trans | -83.8 | 108.8 | 174.3 | -158.4 | -5.5 | 0 | 0 | 0 | 109.1 | K158 L169 V173 | K158-D175 WeakPolarHBondContact CE-OD2 3.45Å; K158-D175 IonicContact NZ-OD2 3.73Å; K158-D175 PolarHBondContact NZ-OD2 3.19Å; L169-D175 HydrophobicContact CD2-CB 4.34Å; L169-D175 WeakPolarHBondContact CD2-OD1 3.17Å; L169-D175 HydrophobicContact CG-CB 3.97Å; V173-D175 PolarHBondContact O-N 3.35Å | ||
| 176 | E | 80.4 | Confident | 77.7 | Confident | 43 Ų | 43 | 81.7 Ų | 81.7 | 20% | 0.201 | 48% | 0.475 | C | S | . | . | trans | -94.6 | 139.6 | -178.7 | -69.2 | 178.7 | -165.5 | 0 | 0 | 109.6 | L174 C178 S182 | L174-E176 PolarHBondContact O-N 3.42Å; E176-C178 PolarHBondContact O-N 3.36Å; E176-S182 VanDerWaalsContact OE1-CB 3.25Å; E176-S182 WeakPolarHBondContact OE1-CB 3.45Å; E176-S182 PolarHBondContact OE1-OG 2.94Å; E176-S182 VanDerWaalsContact OE2-CB 3.27Å; E176-S182 WeakPolarHBondContact OE2-CB 3.49Å; E176-S182 PolarHBondContact OE2-N 2.89Å; E176-S182 PolarHBondContact OE2-OG 3.42Å | ||
| 177 | P | 71.3 | Confident | 77.7 | Confident | 140 Ų | 140 | 81 Ų | 81 | 91% | 0.909 | 47% | 0.467 | S | S | * | . | S | Bend | trans | -66.4 | -3.7 | -178.8 | 29 | -36.8 | 0 | 0 | 0 | 113.4 | ||
| 178 | C | 69.3 | Low | 77.7 | Confident | 83 Ų | 83 | 80.4 Ų | 80.4 | 56% | 0.561 | 46% | 0.464 | S | S | * | . | S | Bend | trans | -91.3 | 136.4 | 178.9 | -68.8 | 0 | 0 | 0 | 0 | 110.5 | E176 N180 | E176-C178 PolarHBondContact O-N 3.36Å; C178-N180 CarbonylContact O-C 3.59Å; C178-N180 PolarHBondContact O-N 3.11Å |
| 179 | A | 71.7 | Confident | 77.7 | Confident | 110 Ų | 110 | 77.3 Ų | 77.3 | 91% | 0.909 | 46% | 0.455 | S | S | * | . | S | Bend | trans | -55.7 | -20.5 | 172.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 180 | N | 73.2 | Confident | 77.9 | Confident | 140 Ų | 140 | 78.1 Ų | 78.1 | 75% | 0.749 | 46% | 0.457 | S | S | * | . | S | Bend | trans | -110.1 | 116 | 172.3 | -60.2 | -54.9 | 0 | 0 | 0 | 109.5 | C178 | C178-N180 CarbonylContact O-C 3.59Å; C178-N180 PolarHBondContact O-N 3.11Å |
| 181 | Q | 74.4 | Confident | 78.2 | Confident | 110 Ų | 110 | 80.4 Ų | 80.4 | 51% | 0.514 | 46% | 0.458 | S | S | . | . | P | Polyproline II helix | trans | -66.1 | 137.6 | 173.7 | -167.1 | -173.6 | -11.3 | 0 | 0 | 111.2 | ||
| 182 | S | 81.1 | Confident | 78.2 | Confident | 37 Ų | 37 | 77 Ų | 77 | 26% | 0.259 | 44% | 0.435 | S | S | . | . | P | Polyproline II helix | trans | -61.9 | 149.6 | 173.2 | 80.3 | 0 | 0 | 0 | 0 | 112.1 | E176 P184 | E176-S182 VanDerWaalsContact OE1-CB 3.25Å; E176-S182 WeakPolarHBondContact OE1-CB 3.45Å; E176-S182 PolarHBondContact OE1-OG 2.94Å; E176-S182 VanDerWaalsContact OE2-CB 3.27Å; E176-S182 WeakPolarHBondContact OE2-CB 3.49Å; E176-S182 PolarHBondContact OE2-N 2.89Å; E176-S182 PolarHBondContact OE2-OG 3.42Å; S182-P184 VanDerWaalsContact O-CD 3.28Å; S182-P184 WeakPolarHBondContact O-CD 3.42Å |
| 183 | D | 79.9 | Confident | 78.1 | Confident | 45 Ų | 45 | 72.6 Ų | 72.6 | 24% | 0.241 | 42% | 0.418 | C | S | . | . | P | Polyproline II helix | trans | -75.8 | 116.5 | 170.5 | -179.2 | 15.7 | 0 | 0 | 0 | 109.1 | T185 V186 L187 K206 | D183-T185 PolarHBondContact O-N 3.14Å; D183-T185 PolarHBondContact OD1-N 3.38Å; D183-T185 PolarHBondContact OD1-OG1 3.32Å; D183-V186 HydrophobicContact CB-CB 4.16Å; D183-V186 HydrophobicContact CB-CG2 3.99Å; D183-V186 PolarHBondContact O-N 3.13Å; D183-L187 PolarHBondContact O-N 3.45Å; D183-K206 WeakPolarHBondContact OD1-CE 3.35Å; D183-K206 IonicContact OD1-NZ 2.78Å; D183-K206 PolarHBondContact OD1-NZ 3.41Å |
| 184 | P | 80.1 | Confident | 78.2 | Confident | 70 Ų | 70 | 76.3 Ų | 76.3 | 46% | 0.455 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -54.2 | -30.5 | -178.9 | 20.3 | -35.6 | 0 | 0 | 0 | 113.1 | S182 N188 | S182-P184 VanDerWaalsContact O-CD 3.28Å; S182-P184 WeakPolarHBondContact O-CD 3.42Å; P184-N188 VanDerWaalsContact O-CB 3.24Å; P184-N188 WeakPolarHBondContact O-CB 3.33Å; P184-N188 PolarHBondContact O-N 3.5Å |
| 185 | T | 80.7 | Confident | 78.3 | Confident | 16 Ų | 16 | 73.1 Ų | 73.1 | 10% | 0.098 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -66.3 | -48 | 176.7 | -45 | 0 | 0 | 0 | 0 | 111.3 | D183 L189 V203 I204 V205 | D183-T185 PolarHBondContact O-N 3.14Å; D183-T185 PolarHBondContact OD1-N 3.38Å; D183-T185 PolarHBondContact OD1-OG1 3.32Å; T185-L189 WeakPolarHBondContact O-CB 3.13Å; T185-L189 PolarHBondContact O-N 3.34Å; T185-L189 VanDerWaalsContact O-N 3.07Å; T185-V203 HydrophobicContact CG2-CG1 4.05Å; T185-I204 WeakPolarHBondContact CG2-O 3.34Å; T185-I204 PolarHBondContact OG1-O 3.12Å; T185-V205 HydrophobicContact CG2-CG2 4.4Å |
| 186 | V | 81.7 | Confident | 77.9 | Confident | 10 Ų | 10 | 78.5 Ų | 78.5 | 6% | 0.061 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -66.7 | -45.5 | 179.2 | 172.9 | 0 | 0 | 0 | 0 | 109.7 | D183 N188 L189 Q190 | D183-V186 HydrophobicContact CB-CB 4.16Å; D183-V186 HydrophobicContact CB-CG2 3.99Å; D183-V186 PolarHBondContact O-N 3.13Å; V186-N188 VanDerWaalsContact C-N 3.35Å; V186-N188 PolarHBondContact O-N 2.88Å; V186-L189 CarbonylContact O-C 3.59Å; V186-L189 WeakPolarHBondContact O-CB 3.47Å; V186-L189 PolarHBondContact O-N 3.48Å; V186-L189 VanDerWaalsContact O-N 3.11Å; V186-Q190 HydrophobicContact CG1-CG 4.31Å; V186-Q190 WeakPolarHBondContact O-CG 3.44Å; V186-Q190 PolarHBondContact O-N 2.89Å |
| 187 | L | 81.8 | Confident | 77.2 | Confident | 58 Ų | 58 | 83.2 Ų | 83.2 | 30% | 0.304 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.9 | -46.4 | 177.3 | 180 | 63.8 | 0 | 0 | 0 | 110.9 | D183 L189 Q190 L191 | D183-L187 PolarHBondContact O-N 3.45Å; L187-L189 VanDerWaalsContact C-N 3.26Å; L187-L189 PolarHBondContact O-N 2.87Å; L187-Q190 PolarHBondContact O-N 3.35Å; L187-L191 HydrophobicContact CD1-CD1 4.36Å; L187-L191 HydrophobicContact CD1-CG 4.26Å; L187-L191 HydrophobicContact CG-CD1 4.08Å; L187-L191 HydrophobicContact CG-CG 4.39Å; L187-L191 WeakPolarHBondContact O-CB 3.34Å; L187-L191 VanDerWaalsContact O-CG 3.31Å; L187-L191 WeakPolarHBondContact O-CG 3.32Å; L187-L191 PolarHBondContact O-N 3.35Å |
| 188 | N | 81.7 | Confident | 76.7 | Confident | 61 Ų | 61 | 83 Ų | 83 | 33% | 0.326 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -58.8 | -40.5 | 176.1 | -166.5 | -84.5 | 0 | 0 | 0 | 111.8 | P184 V186 R192 | P184-N188 VanDerWaalsContact O-CB 3.24Å; P184-N188 WeakPolarHBondContact O-CB 3.33Å; P184-N188 PolarHBondContact O-N 3.5Å; V186-N188 VanDerWaalsContact C-N 3.35Å; V186-N188 PolarHBondContact O-N 2.88Å; N188-R192 WeakPolarHBondContact O-CB 3.23Å; N188-R192 PolarHBondContact O-N 3.27Å |
| 189 | L | 80.6 | Confident | 76.1 | Confident | 54 Ų | 54 | 82.7 Ų | 82.7 | 28% | 0.283 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -69.8 | -37.6 | 179.2 | -170.3 | 62.1 | 0 | 0 | 0 | 112.2 | T185 V186 L187 A193 I225 L228 | T185-L189 WeakPolarHBondContact O-CB 3.13Å; T185-L189 PolarHBondContact O-N 3.34Å; T185-L189 VanDerWaalsContact O-N 3.07Å; V186-L189 CarbonylContact O-C 3.59Å; V186-L189 WeakPolarHBondContact O-CB 3.47Å; V186-L189 PolarHBondContact O-N 3.48Å; V186-L189 VanDerWaalsContact O-N 3.11Å; L187-L189 VanDerWaalsContact C-N 3.26Å; L187-L189 PolarHBondContact O-N 2.87Å; L189-A193 WeakPolarHBondContact O-CB 3.5Å; L189-A193 PolarHBondContact O-N 2.84Å; L189-I225 HydrophobicContact CD2-CD1 3.56Å; L189-L228 HydrophobicContact CB-CD2 4.33Å; L189-L228 HydrophobicContact CD1-CD2 4.39Å; L189-L228 HydrophobicContact CD2-CD2 3.23Å; L189-L228 HydrophobicContact CG-CD2 3.36Å |
| 190 | Q | 81.5 | Confident | 75.4 | Confident | 75 Ų | 75 | 84 Ų | 84 | 35% | 0.35 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -64.4 | -49.5 | 171.8 | -73.7 | 175.3 | -16.6 | 0 | 0 | 111.4 | V186 L187 R192 A193 L194 L228 | V186-Q190 HydrophobicContact CG1-CG 4.31Å; V186-Q190 WeakPolarHBondContact O-CG 3.44Å; V186-Q190 PolarHBondContact O-N 2.89Å; L187-Q190 PolarHBondContact O-N 3.35Å; Q190-R192 VanDerWaalsContact C-N 3.27Å; Q190-R192 PolarHBondContact O-N 3.37Å; Q190-A193 WeakPolarHBondContact O-CB 3.44Å; Q190-A193 PolarHBondContact O-N 3.5Å; Q190-L194 WeakPolarHBondContact O-CG 3.26Å; Q190-L194 PolarHBondContact O-N 3.2Å; Q190-L228 HydrophobicContact CB-CD1 4.21Å; Q190-L228 HydrophobicContact CG-CD1 3.67Å |
| 191 | L | 81.6 | Confident | 74.9 | Confident | 96 Ų | 96 | 85.2 Ų | 85.2 | 50% | 0.503 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -58.8 | -39 | 176.2 | -71.4 | 174.8 | 0 | 0 | 0 | 111.8 | L187 L194 S195 | L187-L191 HydrophobicContact CD1-CD1 4.36Å; L187-L191 HydrophobicContact CD1-CG 4.26Å; L187-L191 HydrophobicContact CG-CD1 4.08Å; L187-L191 HydrophobicContact CG-CG 4.39Å; L187-L191 WeakPolarHBondContact O-CB 3.34Å; L187-L191 VanDerWaalsContact O-CG 3.31Å; L187-L191 WeakPolarHBondContact O-CG 3.32Å; L187-L191 PolarHBondContact O-N 3.35Å; L191-L194 PolarHBondContact O-N 2.98Å; L191-S195 VanDerWaalsContact O-CB 3.25Å; L191-S195 WeakPolarHBondContact O-CB 3.5Å; L191-S195 PolarHBondContact O-N 3.47Å; L191-S195 PolarHBondContact O-OG 3.07Å |
| 192 | R | 79.2 | Confident | 74.2 | Confident | 72 Ų | 72 | 87.6 Ų | 87.6 | 27% | 0.272 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -65.5 | -40.1 | 174.1 | -173.9 | 176.2 | -68.3 | 175.7 | -0.8 | 112.3 | N188 Q190 K196 Q197 K201 | N188-R192 WeakPolarHBondContact O-CB 3.23Å; N188-R192 PolarHBondContact O-N 3.27Å; Q190-R192 VanDerWaalsContact C-N 3.27Å; Q190-R192 PolarHBondContact O-N 3.37Å; R192-K196 PolarHBondContact O-N 3.02Å; R192-Q197 WeakPolarHBondContact CG-O 3.46Å; R192-K201 PolarHBondContact NH2-O 3.37Å |
| 193 | A | 76.9 | Confident | 73.4 | Confident | 45 Ų | 45 | 88.1 Ų | 88.1 | 37% | 0.372 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.6 | -41 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | L189 Q190 L228 | L189-A193 WeakPolarHBondContact O-CB 3.5Å; L189-A193 PolarHBondContact O-N 2.84Å; Q190-A193 WeakPolarHBondContact O-CB 3.44Å; Q190-A193 PolarHBondContact O-N 3.5Å; A193-L228 HydrophobicContact CB-CD1 3.91Å |
| 194 | L | 79.4 | Confident | 72.8 | Confident | 141 Ų | 141 | 92.6 Ų | 92.6 | 74% | 0.738 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -72.3 | -46.8 | 179.9 | -69.4 | 172.7 | 0 | 0 | 0 | 112.9 | Q190 L191 K196 | Q190-L194 WeakPolarHBondContact O-CG 3.26Å; Q190-L194 PolarHBondContact O-N 3.2Å; L191-L194 PolarHBondContact O-N 2.98Å; L194-K196 PolarHBondContact O-N 3.49Å |
| 195 | S | 79.9 | Confident | 72.2 | Confident | 58 Ų | 58 | 94 Ų | 94 | 41% | 0.406 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -70.5 | -10 | -177.2 | 60.6 | 0 | 0 | 0 | 0 | 113.8 | L191 Q197 | L191-S195 VanDerWaalsContact O-CB 3.25Å; L191-S195 WeakPolarHBondContact O-CB 3.5Å; L191-S195 PolarHBondContact O-N 3.47Å; L191-S195 PolarHBondContact O-OG 3.07Å; S195-Q197 PolarHBondContact O-N 3Å; S195-Q197 PolarHBondContact OG-N 3.37Å |
| 196 | K | 69.6 | Low | 71.6 | Confident | 184 Ų | 184 | 98.8 Ų | 98.8 | 80% | 0.8 | 52% | 0.522 | S | S | * | . | trans | 51.4 | 11.7 | -169.5 | -59.4 | 179.5 | -178.7 | 176.7 | 0 | 113.5 | R192 L194 T198 | R192-K196 PolarHBondContact O-N 3.02Å; L194-K196 PolarHBondContact O-N 3.49Å; K196-T198 PolarHBondContact O-N 2.88Å; K196-T198 VanDerWaalsContact O-N 3.15Å | ||
| 197 | Q | 66.5 | Low | 71.1 | Confident | 142 Ų | 142 | 102.1 Ų | 102.1 | 66% | 0.664 | 55% | 0.546 | S | S | * | . | trans | -75.5 | 109.6 | -177.9 | -72.6 | -175.7 | 1.3 | 0 | 0 | 109 | R192 S195 A199 | R192-Q197 WeakPolarHBondContact CG-O 3.46Å; S195-Q197 PolarHBondContact O-N 3Å; S195-Q197 PolarHBondContact OG-N 3.37Å; Q197-A199 PolarHBondContact O-N 2.99Å | ||
| 198 | T | 60.7 | Low | 70.8 | Confident | 135 Ų | 135 | 102.8 Ų | 102.8 | 83% | 0.828 | 55% | 0.55 | S | S | * | . | trans | -82 | 108.7 | 172.2 | 36 | 0 | 0 | 0 | 0 | 109.1 | K196 | K196-T198 PolarHBondContact O-N 2.88Å; K196-T198 VanDerWaalsContact O-N 3.15Å | ||
| 199 | A | 54.9 | Low | 70.4 | Confident | 77 Ų | 77 | 105.7 Ų | 105.7 | 64% | 0.636 | 56% | 0.559 | S | S | * | * | S | Bend | trans | 70.1 | 82.6 | 143.4 | 0 | 0 | 0 | 0 | 0 | 120.4 | Q197 | Q197-A199 PolarHBondContact O-N 2.99Š|
| 200 | T | 57.1 | Low | 69.9 | Low | 138 Ų | 138 | 108 Ų | 108 | 85% | 0.847 | 57% | 0.572 | S | S | * | * | trans | -133.4 | -36.4 | 148.9 | 53.2 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 201 | K | 62.9 | Low | 69.5 | Low | 166 Ų | 166 | 106.8 Ų | 106.8 | 72% | 0.722 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -88.1 | 130.3 | -178.2 | -64.1 | -175 | 179.9 | -178.9 | 0 | 112.7 | R192 V203 | R192-K201 PolarHBondContact NH2-O 3.37Å; K201-V203 PolarHBondContact O-N 3.32Å |
| 202 | Q | 60.4 | Low | 69.1 | Low | 159 Ų | 159 | 110.9 Ų | 110.9 | 74% | 0.743 | 59% | 0.591 | S | S | * | * | trans | -60.4 | 130.7 | 173.7 | -65.6 | -179.1 | 5.3 | 0 | 0 | 108.9 | I204 | Q202-I204 PolarHBondContact O-N 2.63Š| ||
| 203 | V | 64.6 | Low | 69 | Low | 48 Ų | 48 | 116 Ų | 116 | 29% | 0.291 | 62% | 0.615 | S | S | . | * | trans | -76.5 | 114.1 | 173.8 | -177.4 | 0 | 0 | 0 | 0 | 106.4 | T185 K201 V205 | T185-V203 HydrophobicContact CG2-CG1 4.05Å; K201-V203 PolarHBondContact O-N 3.32Å; V203-V205 HydrophobicContact CB-CG2 4.42Å; V203-V205 HydrophobicContact CG1-CG2 3.88Å; V203-V205 PolarHBondContact O-N 3.26Å | ||
| 204 | I | 66.2 | Low | 69 | Low | 140 Ų | 140 | 117.8 Ų | 117.8 | 72% | 0.718 | 62% | 0.616 | S | S | * | * | trans | -72.1 | 113.3 | 168 | -59.7 | 169.3 | 0 | 0 | 0 | 105.6 | T185 Q202 | T185-I204 WeakPolarHBondContact CG2-O 3.34Å; T185-I204 PolarHBondContact OG1-O 3.12Å; Q202-I204 PolarHBondContact O-N 2.63Å | ||
| 205 | V | 67.3 | Low | 69.2 | Low | 99 Ų | 99 | 114.7 Ų | 114.7 | 60% | 0.6 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -103.3 | 122.9 | 177.2 | -178.3 | 0 | 0 | 0 | 0 | 107.4 | T185 V203 S207 | T185-V205 HydrophobicContact CG2-CG2 4.4Å; V203-V205 HydrophobicContact CB-CG2 4.42Å; V203-V205 HydrophobicContact CG1-CG2 3.88Å; V203-V205 PolarHBondContact O-N 3.26Å; V205-S207 PolarHBondContact O-N 2.92Å |
| 206 | K | 68.4 | Low | 69.3 | Low | 117 Ų | 117 | 119.9 Ų | 119.9 | 51% | 0.509 | 62% | 0.618 | S | S | . | * | P | Polyproline II helix | trans | -62.2 | 124.7 | 174.7 | -72.1 | 176.5 | 176.2 | 164.7 | 0 | 110.4 | D183 | D183-K206 WeakPolarHBondContact OD1-CE 3.35Å; D183-K206 IonicContact OD1-NZ 2.78Å; D183-K206 PolarHBondContact OD1-NZ 3.41Å |
| 207 | S | 72.6 | Confident | 69.9 | Low | 79 Ų | 79 | 114.3 Ų | 114.3 | 55% | 0.552 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -91.5 | 127.8 | 170.9 | 65.1 | 0 | 0 | 0 | 0 | 110.5 | V205 | V205-S207 PolarHBondContact O-N 2.92Š|
| 208 | L | 73.9 | Confident | 70.7 | Confident | 73 Ų | 73 | 110.1 Ų | 110.1 | 38% | 0.382 | 58% | 0.581 | S | S | . | * | trans | -90.8 | 115 | 176.5 | -62.8 | 169.6 | 0 | 0 | 0 | 109.8 | N210 V217 I218 | L208-N210 VanDerWaalsContact C-N 3.29Å; L208-N210 PolarHBondContact O-N 3.39Å; L208-V217 HydrophobicContact CD1-CG1 4.18Å; L208-V217 HydrophobicContact CD2-CG1 3.96Å; L208-I218 HydrophobicContact CD1-CG1 4.01Å | ||
| 209 | K | 73 | Confident | 71.9 | Confident | 121 Ų | 121 | 109.3 Ų | 109.3 | 53% | 0.526 | 57% | 0.568 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.8 | -20.2 | -177.9 | -66.6 | -177.9 | -176.3 | 176.2 | 0 | 113.5 | E15 | E15-K209 PolarHBondContact O-NZ 2.91Å; E15-K209 VanDerWaalsContact O-NZ 3.14Å |
| 210 | N | 72 | Confident | 73.3 | Confident | 103 Ų | 103 | 110.6 Ų | 110.6 | 55% | 0.551 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -141.6 | 68.6 | 179.9 | -77.4 | -43.3 | 0 | 0 | 0 | 112.3 | L208 E212 K213 Q214 | L208-N210 VanDerWaalsContact C-N 3.29Å; L208-N210 PolarHBondContact O-N 3.39Å; N210-E212 PolarHBondContact O-N 3.32Å; N210-E212 VanDerWaalsContact O-N 3.16Å; N210-K213 PolarHBondContact O-N 2.81Å; N210-K213 VanDerWaalsContact O-N 3.15Å; N210-Q214 PolarHBondContact O-N 2.89Å |
| 211 | A | 72.2 | Confident | 74.5 | Confident | 49 Ų | 49 | 109.8 Ų | 109.8 | 41% | 0.405 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -34.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114 | K213 Q214 I218 | A211-K213 VanDerWaalsContact C-N 3.3Å; A211-K213 PolarHBondContact O-N 3.26Å; A211-Q214 PolarHBondContact O-N 3.33Å; A211-I218 HydrophobicContact CB-CD1 4.05Å; A211-I218 WeakPolarHBondContact O-CD1 3.19Å |
| 212 | E | 74.3 | Confident | 75.6 | Confident | 183 Ų | 183 | 106 Ų | 106 | 86% | 0.855 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | -30.9 | -178.7 | -171.8 | 178.6 | -174.3 | 0 | 0 | 113.5 | N210 | N210-E212 PolarHBondContact O-N 3.32Å; N210-E212 VanDerWaalsContact O-N 3.16Å |
| 213 | K | 76.4 | Confident | 76.8 | Confident | 178 Ų | 178 | 104.9 Ų | 104.9 | 77% | 0.774 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.9 | -16.8 | -179.6 | -67.4 | -175.6 | 179 | 179.9 | 0 | 113.2 | N210 A211 | N210-K213 PolarHBondContact O-N 2.81Å; N210-K213 VanDerWaalsContact O-N 3.15Å; A211-K213 VanDerWaalsContact C-N 3.3Å; A211-K213 PolarHBondContact O-N 3.26Å |
| 214 | Q | 77 | Confident | 77.7 | Confident | 84 Ų | 84 | 104.5 Ų | 104.5 | 39% | 0.393 | 52% | 0.524 | S | S | . | . | trans | -111.3 | 45.4 | -171.5 | -67.3 | -175.4 | -46.7 | 0 | 0 | 112.6 | N210 A211 K216 V217 I218 | N210-Q214 PolarHBondContact O-N 2.89Å; A211-Q214 PolarHBondContact O-N 3.33Å; Q214-K216 PolarHBondContact O-N 3.26Å; Q214-K216 VanDerWaalsContact O-N 3.17Å; Q214-V217 HydrophobicContact CB-CB 4.44Å; Q214-V217 HydrophobicContact CB-CG2 4.25Å; Q214-V217 PolarHBondContact O-N 2.69Å; Q214-V217 VanDerWaalsContact O-N 3.09Å; Q214-I218 PolarHBondContact O-N 2.89Å | ||
| 215 | T | 84 | Confident | 78.4 | Confident | 75 Ų | 75 | 98.9 Ų | 98.9 | 46% | 0.46 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -53.8 | -37.6 | -179.8 | -43.4 | 0 | 0 | 0 | 0 | 112.8 | V217 I218 E219 | T215-V217 PolarHBondContact O-N 3.48Å; T215-I218 WeakPolarHBondContact O-CB 3.42Å; T215-I218 PolarHBondContact O-N 3.27Å; T215-E219 HydrophobicContact CG2-CG 4.4Å; T215-E219 WeakPolarHBondContact O-CG 3.29Å; T215-E219 PolarHBondContact O-N 3.26Å |
| 216 | K | 82.1 | Confident | 79.2 | Confident | 168 Ų | 168 | 98 Ų | 98 | 73% | 0.73 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.1 | -39.6 | 178.6 | -66.5 | -174.2 | 179 | -178.6 | 0 | 113.5 | Q214 I218 E219 N220 | Q214-K216 PolarHBondContact O-N 3.26Å; Q214-K216 VanDerWaalsContact O-N 3.17Å; K216-I218 VanDerWaalsContact C-N 3.3Å; K216-E219 PolarHBondContact O-N 3.12Å; K216-N220 WeakPolarHBondContact O-CB 3.39Å; K216-N220 VanDerWaalsContact O-CG 3.27Å; K216-N220 PolarHBondContact O-N 2.81Å |
| 217 | V | 80.5 | Confident | 79.8 | Confident | 66 Ų | 66 | 95.9 Ų | 95.9 | 40% | 0.4 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -68.2 | -37.3 | 179.2 | -177.3 | 0 | 0 | 0 | 0 | 109.9 | L208 Q214 T215 W221 | L208-V217 HydrophobicContact CD1-CG1 4.18Å; L208-V217 HydrophobicContact CD2-CG1 3.96Å; Q214-V217 HydrophobicContact CB-CB 4.44Å; Q214-V217 HydrophobicContact CB-CG2 4.25Å; Q214-V217 PolarHBondContact O-N 2.69Å; Q214-V217 VanDerWaalsContact O-N 3.09Å; T215-V217 PolarHBondContact O-N 3.48Å; V217-W221 VanDerWaalsContact O-CB 3.32Å; V217-W221 WeakPolarHBondContact O-CB 3.34Å; V217-W221 PolarHBondContact O-N 3.39Å |
| 218 | I | 83.4 | Confident | 80.1 | Confident | 54 Ų | 54 | 92.5 Ų | 92.5 | 28% | 0.277 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -67.3 | -47.3 | 176.3 | -60.7 | 171.2 | 0 | 0 | 0 | 110.5 | L208 A211 Q214 T215 K216 N220 W221 I222 | L208-I218 HydrophobicContact CD1-CG1 4.01Å; A211-I218 HydrophobicContact CB-CD1 4.05Å; A211-I218 WeakPolarHBondContact O-CD1 3.19Å; Q214-I218 PolarHBondContact O-N 2.89Å; T215-I218 WeakPolarHBondContact O-CB 3.42Å; T215-I218 PolarHBondContact O-N 3.27Å; K216-I218 VanDerWaalsContact C-N 3.3Å; I218-N220 PolarHBondContact O-N 3.45Å; I218-W221 PolarHBondContact O-N 2.92Å; I218-I222 HydrophobicContact CG2-CD1 3.73Å; I218-I222 HydrophobicContact CG2-CG1 4.31Å; I218-I222 WeakPolarHBondContact O-CB 3.28Å; I218-I222 WeakPolarHBondContact O-CG1 3.2Å; I218-I222 PolarHBondContact O-N 2.83Å |
| 219 | E | 86 | Confident | 80.1 | Confident | 118 Ų | 118 | 95.8 Ų | 95.8 | 55% | 0.551 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -59.7 | -44.6 | 176.2 | -74.7 | 175.7 | -178.4 | 0 | 0 | 111.9 | T215 K216 I222 K223 | T215-E219 HydrophobicContact CG2-CG 4.4Å; T215-E219 WeakPolarHBondContact O-CG 3.29Å; T215-E219 PolarHBondContact O-N 3.26Å; K216-E219 PolarHBondContact O-N 3.12Å; E219-I222 PolarHBondContact O-N 3.48Å; E219-K223 WeakPolarHBondContact O-CB 3.4Å; E219-K223 PolarHBondContact O-N 2.9Å |
| 220 | N | 84 | Confident | 80.2 | Confident | 105 Ų | 105 | 100.3 Ų | 100.3 | 56% | 0.561 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -61.7 | -46.1 | 175.5 | -76.6 | -7.1 | 0 | 0 | 0 | 111.6 | K216 I218 K223 S224 | K216-N220 WeakPolarHBondContact O-CB 3.39Å; K216-N220 VanDerWaalsContact O-CG 3.27Å; K216-N220 PolarHBondContact O-N 2.81Å; I218-N220 PolarHBondContact O-N 3.45Å; N220-K223 WeakPolarHBondContact O-CB 3.45Å; N220-K223 PolarHBondContact O-N 3.44Å; N220-S224 PolarHBondContact O-N 3.27Å; N220-S224 PolarHBondContact O-OG 3.35Å; N220-S224 VanDerWaalsContact O-OG 3.14Å |
| 221 | W | 84 | Confident | 80.2 | Confident | 120 Ų | 120 | 99.3 Ų | 99.3 | 46% | 0.455 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.8 | -43.8 | 176.8 | 179 | 81 | 0 | 0 | 0 | 112 | V217 I218 K223 S224 I225 | V217-W221 VanDerWaalsContact O-CB 3.32Å; V217-W221 WeakPolarHBondContact O-CB 3.34Å; V217-W221 PolarHBondContact O-N 3.39Å; I218-W221 PolarHBondContact O-N 2.92Å; W221-K223 VanDerWaalsContact C-N 3.3Å; W221-K223 PolarHBondContact O-N 3.43Å; W221-S224 PolarHBondContact O-N 2.86Å; W221-I225 HydrophobicContact CD2-CG1 3.97Å; W221-I225 HydrophobicContact CG-CG1 4.33Å; W221-I225 HydrophobicContact CH2-CG1 4.45Å; W221-I225 HydrophobicContact CZ2-CD1 4.32Å; W221-I225 HydrophobicContact CZ2-CG1 3.83Å; W221-I225 WeakPolarHBondContact O-CB 3.5Å; W221-I225 VanDerWaalsContact O-CG1 3.28Å; W221-I225 WeakPolarHBondContact O-CG1 3.49Å; W221-I225 PolarHBondContact O-N 3.36Å |
| 222 | I | 84.9 | Confident | 80 | Confident | 86 Ų | 86 | 101.5 Ų | 101.5 | 44% | 0.441 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -58.1 | -45.6 | 175.3 | -71.4 | 167.4 | 0 | 0 | 0 | 110.2 | I218 E219 I225 T226 | I218-I222 HydrophobicContact CG2-CD1 3.73Å; I218-I222 HydrophobicContact CG2-CG1 4.31Å; I218-I222 WeakPolarHBondContact O-CB 3.28Å; I218-I222 WeakPolarHBondContact O-CG1 3.2Å; I218-I222 PolarHBondContact O-N 2.83Å; E219-I222 PolarHBondContact O-N 3.48Å; I222-I225 PolarHBondContact O-N 3.22Å; I222-T226 VanDerWaalsContact O-CB 3.28Å; I222-T226 WeakPolarHBondContact O-CB 3.39Å; I222-T226 PolarHBondContact O-N 2.88Å; I222-T226 PolarHBondContact O-OG1 3.04Å |
| 223 | K | 86.2 | Confident | 79.5 | Confident | 137 Ų | 137 | 98.5 Ų | 98.5 | 60% | 0.596 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -59.6 | -52.6 | 177.1 | -174.9 | -177.1 | 175.6 | -171.7 | 0 | 110.8 | E219 N220 W221 I225 T226 D227 | E219-K223 WeakPolarHBondContact O-CB 3.4Å; E219-K223 PolarHBondContact O-N 2.9Å; N220-K223 WeakPolarHBondContact O-CB 3.45Å; N220-K223 PolarHBondContact O-N 3.44Å; W221-K223 VanDerWaalsContact C-N 3.3Å; W221-K223 PolarHBondContact O-N 3.43Å; K223-I225 VanDerWaalsContact C-N 3.33Å; K223-I225 PolarHBondContact O-N 3.1Å; K223-T226 WeakPolarHBondContact O-CB 3.44Å; K223-T226 PolarHBondContact O-N 3.12Å; K223-T226 VanDerWaalsContact O-N 3.13Å; K223-D227 VanDerWaalsContact O-CG 3.28Å; K223-D227 PolarHBondContact O-N 2.74Å |
| 224 | S | 82.8 | Confident | 78.8 | Confident | 39 Ų | 39 | 93.4 Ų | 93.4 | 27% | 0.273 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -58.8 | -40 | 179.2 | -65.8 | 0 | 0 | 0 | 0 | 113.7 | N220 W221 L228 | N220-S224 PolarHBondContact O-N 3.27Å; N220-S224 PolarHBondContact O-OG 3.35Å; N220-S224 VanDerWaalsContact O-OG 3.14Å; W221-S224 PolarHBondContact O-N 2.86Å; S224-L228 PolarHBondContact O-N 2.87Å |
| 225 | I | 82.5 | Confident | 78.4 | Confident | 23 Ų | 23 | 95.8 Ų | 95.8 | 12% | 0.118 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -72 | -38.6 | 176.6 | -67.6 | -62.6 | 0 | 0 | 0 | 111.3 | L189 W221 I222 K223 D227 L228 Y229 | L189-I225 HydrophobicContact CD2-CD1 3.56Å; W221-I225 HydrophobicContact CD2-CG1 3.97Å; W221-I225 HydrophobicContact CG-CG1 4.33Å; W221-I225 HydrophobicContact CH2-CG1 4.45Å; W221-I225 HydrophobicContact CZ2-CD1 4.32Å; W221-I225 HydrophobicContact CZ2-CG1 3.83Å; W221-I225 WeakPolarHBondContact O-CB 3.5Å; W221-I225 VanDerWaalsContact O-CG1 3.28Å; W221-I225 WeakPolarHBondContact O-CG1 3.49Å; W221-I225 PolarHBondContact O-N 3.36Å; I222-I225 PolarHBondContact O-N 3.22Å; K223-I225 VanDerWaalsContact C-N 3.33Å; K223-I225 PolarHBondContact O-N 3.1Å; I225-D227 VanDerWaalsContact C-N 3.32Å; I225-D227 PolarHBondContact O-N 3.44Å; I225-L228 HydrophobicContact CD1-CD2 4.47Å; I225-L228 WeakPolarHBondContact O-CB 3.34Å; I225-L228 PolarHBondContact O-N 3.25Å; I225-Y229 HydrophobicContact CG2-CD2 3.59Å; I225-Y229 HydrophobicContact CG2-CE2 3.31Å; I225-Y229 WeakPolarHBondContact O-CD2 3.46Å; I225-Y229 PolarHBondContact O-N 2.78Å |
| 226 | T | 83.4 | Confident | 77.7 | Confident | 79 Ų | 79 | 96 Ų | 96 | 49% | 0.485 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.1 | -42.7 | 174.7 | -57.5 | 0 | 0 | 0 | 0 | 110.6 | I222 K223 Y229 R230 | I222-T226 VanDerWaalsContact O-CB 3.28Å; I222-T226 WeakPolarHBondContact O-CB 3.39Å; I222-T226 PolarHBondContact O-N 2.88Å; I222-T226 PolarHBondContact O-OG1 3.04Å; K223-T226 WeakPolarHBondContact O-CB 3.44Å; K223-T226 PolarHBondContact O-N 3.12Å; K223-T226 VanDerWaalsContact O-N 3.13Å; T226-Y229 PolarHBondContact O-N 3.38Å; T226-R230 WeakPolarHBondContact O-CB 3.5Å; T226-R230 PolarHBondContact O-N 2.98Å |
| 227 | D | 81.6 | Confident | 77.4 | Confident | 74 Ų | 74 | 91.1 Ų | 91.1 | 40% | 0.396 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -63.5 | -41.5 | 175.9 | -68.6 | -25.2 | 0 | 0 | 0 | 111.6 | K223 I225 Y229 R230 A231 | K223-D227 VanDerWaalsContact O-CG 3.28Å; K223-D227 PolarHBondContact O-N 2.74Å; I225-D227 VanDerWaalsContact C-N 3.32Å; I225-D227 PolarHBondContact O-N 3.44Å; D227-Y229 PolarHBondContact O-N 3.36Å; D227-R230 WeakPolarHBondContact O-CB 3.37Å; D227-R230 PolarHBondContact O-N 3.33Å; D227-A231 PolarHBondContact O-N 3.18Å |
| 228 | L | 78 | Confident | 77.3 | Confident | 7 Ų | 7 | 95.5 Ų | 95.5 | 4% | 0.037 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -59.6 | -44.9 | 172.1 | 175.2 | 82.6 | 0 | 0 | 0 | 112.2 | L189 Q190 A193 S224 I225 R230 A231 K232 | L189-L228 HydrophobicContact CB-CD2 4.33Å; L189-L228 HydrophobicContact CD1-CD2 4.39Å; L189-L228 HydrophobicContact CD2-CD2 3.23Å; L189-L228 HydrophobicContact CG-CD2 3.36Å; Q190-L228 HydrophobicContact CB-CD1 4.21Å; Q190-L228 HydrophobicContact CG-CD1 3.67Å; A193-L228 HydrophobicContact CB-CD1 3.91Å; S224-L228 PolarHBondContact O-N 2.87Å; I225-L228 HydrophobicContact CD1-CD2 4.47Å; I225-L228 WeakPolarHBondContact O-CB 3.34Å; I225-L228 PolarHBondContact O-N 3.25Å; L228-R230 VanDerWaalsContact C-N 3.29Å; L228-R230 PolarHBondContact O-N 3.23Å; L228-A231 PolarHBondContact O-N 3.44Å; L228-K232 PolarHBondContact O-N 3.39Å |
| 229 | Y | 74.8 | Confident | 77.2 | Confident | 143 Ų | 143 | 96.1 Ų | 96.1 | 56% | 0.561 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -67.2 | -32.5 | 177.4 | -78.7 | -67.4 | 0 | 0 | 0 | 112 | I225 T226 D227 A231 K232 | I225-Y229 HydrophobicContact CG2-CD2 3.59Å; I225-Y229 HydrophobicContact CG2-CE2 3.31Å; I225-Y229 WeakPolarHBondContact O-CD2 3.46Å; I225-Y229 PolarHBondContact O-N 2.78Å; T226-Y229 PolarHBondContact O-N 3.38Å; D227-Y229 PolarHBondContact O-N 3.36Å; Y229-A231 VanDerWaalsContact C-N 3.31Å; Y229-K232 HydrophobicContact CD1-CD 4.05Å; Y229-K232 HydrophobicContact CE1-CD 4.49Å; Y229-K232 PolarHBondContact O-N 3.15Å |
| 230 | R | 74.5 | Confident | 76.9 | Confident | 215 Ų | 215 | 95.9 Ų | 95.9 | 81% | 0.811 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -67.2 | -32.2 | 174.7 | -167.5 | 177 | -173.6 | 173.9 | 1.6 | 112.5 | T226 D227 L228 K232 | T226-R230 WeakPolarHBondContact O-CB 3.5Å; T226-R230 PolarHBondContact O-N 2.98Å; D227-R230 WeakPolarHBondContact O-CB 3.37Å; D227-R230 PolarHBondContact O-N 3.33Å; L228-R230 VanDerWaalsContact C-N 3.29Å; L228-R230 PolarHBondContact O-N 3.23Å; R230-K232 VanDerWaalsContact C-N 3.33Å |
| 231 | A | 72 | Confident | 76.7 | Confident | 83 Ų | 83 | 97.2 Ų | 97.2 | 69% | 0.686 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -75.7 | -18.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | D227 L228 Y229 | D227-A231 PolarHBondContact O-N 3.18Å; L228-A231 PolarHBondContact O-N 3.44Å; Y229-A231 VanDerWaalsContact C-N 3.31Å |
| 232 | K | 68 | Low | 76.6 | Confident | 95 Ų | 95 | 98.5 Ų | 98.5 | 41% | 0.413 | 52% | 0.52 | S | S | . | . | S | Bend | trans | -69.2 | 134.3 | 172.5 | -70.2 | 179.9 | -178.5 | 172.9 | 0 | 109 | L228 Y229 R230 A234 | L228-K232 PolarHBondContact O-N 3.39Å; Y229-K232 HydrophobicContact CD1-CD 4.05Å; Y229-K232 HydrophobicContact CE1-CD 4.49Å; Y229-K232 PolarHBondContact O-N 3.15Å; R230-K232 VanDerWaalsContact C-N 3.33Å; K232-A234 PolarHBondContact O-N 3.09Å |
| 233 | P | 63.4 | Low | 76.6 | Confident | 120 Ų | 120 | 95.7 Ų | 95.7 | 78% | 0.779 | 51% | 0.505 | S | S | * | . | P | Polyproline II helix | trans | -57 | 135.8 | 174.5 | 24.4 | -32.3 | 0 | 0 | 0 | 108.9 | ||
| 234 | A | 62.8 | Low | 76.6 | Confident | 71 Ų | 71 | 90.7 Ų | 90.7 | 59% | 0.587 | 49% | 0.486 | S | S | * | . | P | Polyproline II helix | trans | -55 | 132.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | K232 T236 | K232-A234 PolarHBondContact O-N 3.09Å; A234-T236 PolarHBondContact O-N 3.45Å; A234-T236 VanDerWaalsContact O-N 3.09Å |
| 235 | P | 67.3 | Low | 76.8 | Confident | 134 Ų | 134 | 95.3 Ų | 95.3 | 87% | 0.87 | 50% | 0.503 | S | S | * | . | S | Bend | trans | -65.7 | -15.5 | -176.5 | 26.9 | -34.7 | 0 | 0 | 0 | 112.6 | ||
| 236 | T | 69.9 | Low | 77 | Confident | 80 Ų | 80 | 96.5 Ų | 96.5 | 49% | 0.491 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -125.5 | 128.6 | -177.6 | 54.5 | 0 | 0 | 0 | 0 | 109.8 | A234 | A234-T236 PolarHBondContact O-N 3.45Å; A234-T236 VanDerWaalsContact O-N 3.09Å |
| 237 | V | 75.9 | Confident | 77 | Confident | 65 Ų | 65 | 97.2 Ų | 97.2 | 39% | 0.394 | 52% | 0.518 | S | S | . | . | trans | -85.7 | 119.9 | 172.6 | 176.6 | 0 | 0 | 0 | 0 | 108.7 | Y239 H299 | V237-Y239 HydrophobicContact CG1-CD1 4.21Å; V237-Y239 HydrophobicContact CG1-CE1 4Å; V237-H299 WeakPolarHBondContact CG2-NE2 3.21Å | ||
| 238 | H | 77.7 | Confident | 77.3 | Confident | 157 Ų | 157 | 100.1 Ų | 100.1 | 73% | 0.727 | 53% | 0.529 | S | S | * | . | trans | -91.3 | 110.8 | 173.3 | -65.6 | -66.6 | 0 | 0 | 0 | 109.6 | ||||
| 239 | Y | 82.1 | Confident | 77.8 | Confident | 68 Ų | 68 | 101.1 Ų | 101.1 | 27% | 0.267 | 53% | 0.534 | S | S | . | . | trans | -72.4 | 137.2 | 174.2 | -57.6 | -66 | 0 | 0 | 0 | 110.7 | V237 R241 M243 H296 H299 | V237-Y239 HydrophobicContact CG1-CD1 4.21Å; V237-Y239 HydrophobicContact CG1-CE1 4Å; Y239-R241 VanDerWaalsContact C-N 3.25Å; Y239-R241 WeakPolarHBondContact CB-O 3.24Å; Y239-R241 PolarHBondContact O-N 3.43Å; Y239-M243 HydrophobicContact CD1-CG 3.9Å; Y239-M243 HydrophobicContact CD2-CB 3.96Å; Y239-M243 HydrophobicContact CD2-CG 3.93Å; Y239-M243 HydrophobicContact CE1-CG 4.35Å; Y239-M243 HydrophobicContact CE2-CB 4.31Å; Y239-M243 HydrophobicContact CE2-CG 4.4Å; Y239-M243 HydrophobicContact CG-CB 4.19Å; Y239-M243 HydrophobicContact CG-CG 3.63Å; Y239-H296 HydrophobicContact CD1-CB 3.87Å; Y239-H296 HydrophobicContact CE1-CB 4.24Å; Y239-H296 WeakPolarHBondContact CE1-O 3.3Å; Y239-H299 AromaticContact CE1-ND1 3.89Å; Y239-H299 AromaticContact CZ-ND1 3.64Å; Y239-H299 PolarHBondContact OH-ND1 3.04Å | ||
| 240 | T | 78.4 | Confident | 78.2 | Confident | 112 Ų | 112 | 97.4 Ų | 97.4 | 69% | 0.687 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -68.8 | -23 | 179.1 | 39.5 | 0 | 0 | 0 | 0 | 113.7 | H296 | T240-H296 PolarHBondContact OG1-ND1 3Š|
| 241 | R | 80.4 | Confident | 78.8 | Confident | 133 Ų | 133 | 90.2 Ų | 90.2 | 50% | 0.502 | 51% | 0.509 | S | S | . | . | S | Bend | trans | -135 | 160.6 | 178.1 | -71.1 | -171.6 | 178.4 | -178.4 | 1.5 | 109.2 | Y239 M243 Y291 | Y239-R241 VanDerWaalsContact C-N 3.25Å; Y239-R241 WeakPolarHBondContact CB-O 3.24Å; Y239-R241 PolarHBondContact O-N 3.43Å; R241-M243 PolarHBondContact O-N 2.72Å; R241-M243 VanDerWaalsContact O-N 3.12Å; R241-Y291 HydrophobicContact CB-CD2 3.8Å; R241-Y291 HydrophobicContact CB-CE1 4.41Å; R241-Y291 HydrophobicContact CB-CE2 3.47Å; R241-Y291 VanDerWaalsContact CB-CE2 3.47Å; R241-Y291 HydrophobicContact CB-CG 4.39Å; R241-Y291 HydrophobicContact CG-CD2 4.38Å; R241-Y291 HydrophobicContact CG-CE2 4.39Å |
| 242 | N | 82.6 | Confident | 79.4 | Confident | 148 Ų | 148 | 92.7 Ų | 92.7 | 79% | 0.791 | 52% | 0.515 | S | S | * | . | P | Polyproline II helix | trans | -55.3 | 116.2 | 176.9 | -61.9 | 63.3 | 0 | 0 | 0 | 109.8 | Y291 | N242-Y291 PolarHBondContact O-OH 3.17Å; N242-Y291 VanDerWaalsContact O-OH 3.04Å |
| 243 | M | 83.6 | Confident | 80.3 | Confident | 27 Ų | 27 | 92.4 Ų | 92.4 | 13% | 0.133 | 51% | 0.512 | C | S | . | . | P | Polyproline II helix | trans | -102.2 | 148.6 | 170.7 | -76.5 | -65.6 | -173.7 | 0 | 0 | 108.5 | Y239 R241 P289 Y291 H296 L300 | Y239-M243 HydrophobicContact CD1-CG 3.9Å; Y239-M243 HydrophobicContact CD2-CB 3.96Å; Y239-M243 HydrophobicContact CD2-CG 3.93Å; Y239-M243 HydrophobicContact CE1-CG 4.35Å; Y239-M243 HydrophobicContact CE2-CB 4.31Å; Y239-M243 HydrophobicContact CE2-CG 4.4Å; Y239-M243 HydrophobicContact CG-CB 4.19Å; Y239-M243 HydrophobicContact CG-CG 3.63Å; R241-M243 PolarHBondContact O-N 2.72Å; R241-M243 VanDerWaalsContact O-N 3.12Å; M243-P289 HydrophobicContact SD-CG 3.73Å; M243-Y291 HydrophobicContact CE-CD2 3.83Å; M243-Y291 HydrophobicContact CE-CE2 3.94Å; M243-Y291 HydrophobicContact SD-CE2 4.13Å; M243-H296 HydrophobicContact CE-CB 3.91Å; M243-L300 HydrophobicContact CB-CD2 4.12Å; M243-L300 HydrophobicContact CG-CD2 4.48Å; M243-L300 HydrophobicContact SD-CD2 4.2Å |
| 244 | P | 87.4 | Confident | 81.5 | Confident | 31 Ų | 31 | 90.6 Ų | 90.6 | 20% | 0.201 | 50% | 0.5 | C | S | . | . | P | Polyproline II helix | trans | -56.1 | 145.5 | 169.7 | -22.7 | 33.3 | 0 | 0 | 0 | 111.2 | L249 P289 | P244-L249 HydrophobicContact CB-CD1 4.23Å; P244-L249 HydrophobicContact CB-CD2 3.97Å; P244-L249 HydrophobicContact CB-CG 3.96Å; P244-L249 HydrophobicContact CG-CD2 4.35Å; P244-P289 HydrophobicContact CG-CG 4.42Å |
| 245 | E | 86.2 | Confident | 82.6 | Confident | 136 Ų | 136 | 92.1 Ų | 92.1 | 64% | 0.636 | 50% | 0.502 | S | S | * | . | P | Polyproline II helix | trans | -70.4 | 144.3 | 173.2 | -71.7 | -66.1 | 158.1 | 0 | 0 | 109.8 | S247 E248 L249 | E245-S247 PolarHBondContact O-N 3.45Å; E245-S247 VanDerWaalsContact O-N 3.12Å; E245-E248 WeakPolarHBondContact O-CB 3.46Å; E245-E248 PolarHBondContact O-N 3.36Å; E245-L249 PolarHBondContact O-N 3.28Å |
| 246 | I | 86.7 | Confident | 83.6 | Confident | 48 Ų | 48 | 89.5 Ų | 89.5 | 25% | 0.246 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -57.8 | -34.3 | -177 | -61.5 | 165.8 | 0 | 0 | 0 | 111.1 | E248 L249 M250 L300 L304 E307 | I246-E248 VanDerWaalsContact C-N 3.3Å; I246-E248 PolarHBondContact O-N 3.39Å; I246-L249 PolarHBondContact O-N 2.88Å; I246-M250 HydrophobicContact CG2-CG 4.45Å; I246-M250 HydrophobicContact CG2-SD 4.34Å; I246-M250 WeakPolarHBondContact O-CG 3.4Å; I246-M250 PolarHBondContact O-N 3.1Å; I246-M250 VanDerWaalsContact O-N 3.11Å; I246-L300 HydrophobicContact CG1-CD1 3.78Å; I246-L304 HydrophobicContact CG2-CD1 4.01Å; I246-E307 HydrophobicContact CG2-CB 4.08Å; I246-E307 HydrophobicContact CG2-CG 3.85Å |
| 247 | S | 84.6 | Confident | 84.4 | Confident | 94 Ų | 94 | 89 Ų | 89 | 66% | 0.657 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -64.5 | -30.2 | 176.5 | 54 | 0 | 0 | 0 | 0 | 114.2 | E245 | E245-S247 PolarHBondContact O-N 3.45Å; E245-S247 VanDerWaalsContact O-N 3.12Å |
| 248 | E | 87.5 | Confident | 84.8 | Confident | 135 Ų | 135 | 90.4 Ų | 90.4 | 63% | 0.631 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -74 | -39.7 | 178 | -168.1 | 171.7 | -160.8 | 0 | 0 | 110.3 | E245 I246 M250 A251 | E245-E248 WeakPolarHBondContact O-CB 3.46Å; E245-E248 PolarHBondContact O-N 3.36Å; I246-E248 VanDerWaalsContact C-N 3.3Å; I246-E248 PolarHBondContact O-N 3.39Å; E248-M250 VanDerWaalsContact C-N 3.25Å; E248-M250 PolarHBondContact O-N 3.44Å; E248-A251 VanDerWaalsContact O-CB 3.23Å; E248-A251 WeakPolarHBondContact O-CB 3.25Å; E248-A251 PolarHBondContact O-N 3.29Å |
| 249 | L | 87.6 | Confident | 85.3 | Confident | 29 Ų | 29 | 88.9 Ų | 88.9 | 15% | 0.152 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -70.9 | -16.8 | 174.8 | -62.4 | 178.4 | 0 | 0 | 0 | 113.9 | P244 E245 I246 A251 L286 D287 I288 L300 L304 | P244-L249 HydrophobicContact CB-CD1 4.23Å; P244-L249 HydrophobicContact CB-CD2 3.97Å; P244-L249 HydrophobicContact CB-CG 3.96Å; P244-L249 HydrophobicContact CG-CD2 4.35Å; E245-L249 PolarHBondContact O-N 3.28Å; I246-L249 PolarHBondContact O-N 2.88Å; L249-A251 VanDerWaalsContact C-N 3.29Å; L249-L286 WeakPolarHBondContact CD2-O 3.28Å; L249-D287 HydrophobicContact CD2-CB 4.34Å; L249-I288 HydrophobicContact CD1-CD1 4.37Å; L249-I288 HydrophobicContact CD1-CG1 3.87Å; L249-I288 HydrophobicContact CD2-CG1 4.46Å; L249-L300 HydrophobicContact CD1-CD1 4.45Å; L249-L300 HydrophobicContact CD1-CD2 3.68Å; L249-L300 HydrophobicContact CD1-CG 3.91Å; L249-L304 HydrophobicContact CB-CD1 3.78Å; L249-L304 HydrophobicContact CB-CD2 3.97Å; L249-L304 HydrophobicContact CB-CG 4.49Å; L249-L304 HydrophobicContact CD1-CD2 4.36Å |
| 250 | M | 84.3 | Confident | 85.4 | Confident | 65 Ų | 65 | 89.5 Ų | 89.5 | 32% | 0.32 | 49% | 0.485 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.8 | -1.3 | 173.2 | -73 | -177.5 | 76 | 0 | 0 | 113.5 | I246 E248 L304 E307 F308 | I246-M250 HydrophobicContact CG2-CG 4.45Å; I246-M250 HydrophobicContact CG2-SD 4.34Å; I246-M250 WeakPolarHBondContact O-CG 3.4Å; I246-M250 PolarHBondContact O-N 3.1Å; I246-M250 VanDerWaalsContact O-N 3.11Å; E248-M250 VanDerWaalsContact C-N 3.25Å; E248-M250 PolarHBondContact O-N 3.44Å; M250-L304 HydrophobicContact CG-CD1 3.7Å; M250-E307 HydrophobicContact SD-CB 4.15Å; M250-F308 HydrophobicContact CB-CZ 4.28Å; M250-F308 HydrophobicContact CE-CD1 4.18Å; M250-F308 HydrophobicContact CE-CE1 4.17Å; M250-F308 HydrophobicContact CG-CE1 4.35Å; M250-F308 HydrophobicContact CG-CE2 4.18Å; M250-F308 HydrophobicContact CG-CZ 4Å |
| 251 | A | 85.8 | Confident | 85.6 | Confident | 64 Ų | 64 | 86.4 Ų | 86.4 | 53% | 0.529 | 46% | 0.463 | S | S | . | . | S | Bend | trans | -62.1 | 151.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | E248 L249 | E248-A251 VanDerWaalsContact O-CB 3.23Å; E248-A251 WeakPolarHBondContact O-CB 3.25Å; E248-A251 PolarHBondContact O-N 3.29Å; L249-A251 VanDerWaalsContact C-N 3.29Å |
| 252 | V | 85.1 | Confident | 85.6 | Confident | 134 Ų | 134 | 85.4 Ų | 85.4 | 81% | 0.812 | 47% | 0.468 | S | S | * | . | P | Polyproline II helix | trans | -66.2 | 136.7 | 173.5 | -178.8 | 0 | 0 | 0 | 0 | 108.9 | ||
| 253 | W | 86.7 | Confident | 85.5 | Confident | 90 Ų | 90 | 84.9 Ų | 84.9 | 34% | 0.341 | 47% | 0.465 | S | S | . | . | P | Polyproline II helix | trans | -61.3 | 143.9 | 178.9 | -62.8 | 76.1 | 0 | 0 | 0 | 111 | F257 I261 L285 L286 | W253-F257 HydrophobicContact CB-CD1 4.47Å; W253-F257 AromaticContact CD2-CD1 3.96Å; W253-F257 HydrophobicContact CD2-CD1 3.96Å; W253-F257 HydrophobicContact CD2-CE1 4Å; W253-F257 AromaticContact CE3-CD1 3.08Å; W253-F257 HydrophobicContact CE3-CD1 3.08Å; W253-F257 AromaticContact CE3-CE1 2.98Å; W253-F257 HydrophobicContact CE3-CE1 2.98Å; W253-F257 HydrophobicContact CE3-CG 4.05Å; W253-F257 AromaticContact CE3-CZ 3.89Å; W253-F257 HydrophobicContact CE3-CZ 3.89Å; W253-F257 AromaticContact CH2-CE1 3.74Å; W253-F257 HydrophobicContact CH2-CE1 3.74Å; W253-F257 HydrophobicContact CH2-CZ 4.24Å; W253-F257 AromaticContact CZ3-CD1 3.53Å; W253-F257 HydrophobicContact CZ3-CD1 3.53Å; W253-F257 AromaticContact CZ3-CE1 2.85Å; W253-F257 HydrophobicContact CZ3-CE1 2.85Å; W253-F257 HydrophobicContact CZ3-CE2 4.4Å; W253-F257 HydrophobicContact CZ3-CG 4.5Å; W253-F257 AromaticContact CZ3-CZ 3.38Å; W253-F257 HydrophobicContact CZ3-CZ 3.38Å; W253-I261 HydrophobicContact CH2-CD1 4.37Å; W253-L285 HydrophobicContact CH2-CG 4.21Å; W253-L285 WeakPolarHBondContact CH2-O 3.32Å; W253-L285 WeakPolarHBondContact CZ3-O 3.48Å; W253-L286 HydrophobicContact CH2-CD2 3.89Å; W253-L286 HydrophobicContact CZ2-CD2 3.64Å |
| 254 | P | 88.4 | Confident | 84.8 | Confident | 81 Ų | 81 | 89.3 Ų | 89.3 | 53% | 0.526 | 49% | 0.487 | S | S | . | . | P | Polyproline II helix | trans | -57.9 | 140.4 | 172.4 | -23 | 33.2 | 0 | 0 | 0 | 111.3 | S256 F257 E258 | P254-S256 VanDerWaalsContact C-N 3.26Å; P254-S256 PolarHBondContact O-N 2.89Å; P254-F257 HydrophobicContact CB-CB 4.33Å; P254-F257 WeakPolarHBondContact O-CA 3.49Å; P254-F257 WeakPolarHBondContact O-CB 3.44Å; P254-F257 PolarHBondContact O-N 3.28Å; P254-E258 PolarHBondContact O-N 2.98Å |
| 255 | T | 86.7 | Confident | 83.7 | Confident | 103 Ų | 103 | 96.4 Ų | 96.4 | 63% | 0.632 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -57.3 | -37.9 | -175.1 | 56.4 | 0 | 0 | 0 | 0 | 113.1 | F257 E258 E259 | T255-F257 PolarHBondContact O-N 2.97Å; T255-E258 PolarHBondContact O-N 3.43Å; T255-E259 WeakPolarHBondContact O-CB 3.43Å; T255-E259 WeakPolarHBondContact O-CG 3.42Å; T255-E259 PolarHBondContact O-N 3.32Å |
| 256 | S | 88.4 | Confident | 82.6 | Confident | 79 Ų | 79 | 93 Ų | 93 | 55% | 0.552 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.8 | -34.3 | 175.4 | 56 | 0 | 0 | 0 | 0 | 112.7 | P254 T260 | P254-S256 VanDerWaalsContact C-N 3.26Å; P254-S256 PolarHBondContact O-N 2.89Å; S256-T260 PolarHBondContact O-N 2.91Å; S256-T260 PolarHBondContact O-OG1 2.9Å |
| 257 | F | 85.9 | Confident | 81.5 | Confident | 70 Ų | 70 | 93.5 Ų | 93.5 | 31% | 0.307 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -79.6 | -42.8 | 179.9 | -171.7 | -84.8 | 0 | 0 | 0 | 111 | W253 P254 T255 E259 T260 I261 L285 | W253-F257 HydrophobicContact CB-CD1 4.47Å; W253-F257 AromaticContact CD2-CD1 3.96Å; W253-F257 HydrophobicContact CD2-CD1 3.96Å; W253-F257 HydrophobicContact CD2-CE1 4Å; W253-F257 AromaticContact CE3-CD1 3.08Å; W253-F257 HydrophobicContact CE3-CD1 3.08Å; W253-F257 AromaticContact CE3-CE1 2.98Å; W253-F257 HydrophobicContact CE3-CE1 2.98Å; W253-F257 HydrophobicContact CE3-CG 4.05Å; W253-F257 AromaticContact CE3-CZ 3.89Å; W253-F257 HydrophobicContact CE3-CZ 3.89Å; W253-F257 AromaticContact CH2-CE1 3.74Å; W253-F257 HydrophobicContact CH2-CE1 3.74Å; W253-F257 HydrophobicContact CH2-CZ 4.24Å; W253-F257 AromaticContact CZ3-CD1 3.53Å; W253-F257 HydrophobicContact CZ3-CD1 3.53Å; W253-F257 AromaticContact CZ3-CE1 2.85Å; W253-F257 HydrophobicContact CZ3-CE1 2.85Å; W253-F257 HydrophobicContact CZ3-CE2 4.4Å; W253-F257 HydrophobicContact CZ3-CG 4.5Å; W253-F257 AromaticContact CZ3-CZ 3.38Å; W253-F257 HydrophobicContact CZ3-CZ 3.38Å; P254-F257 HydrophobicContact CB-CB 4.33Å; P254-F257 WeakPolarHBondContact O-CA 3.49Å; P254-F257 WeakPolarHBondContact O-CB 3.44Å; P254-F257 PolarHBondContact O-N 3.28Å; T255-F257 PolarHBondContact O-N 2.97Å; F257-E259 VanDerWaalsContact C-N 3.35Å; F257-E259 PolarHBondContact O-N 2.8Å; F257-T260 WeakPolarHBondContact O-CA 3.49Å; F257-T260 WeakPolarHBondContact O-CB 3.31Å; F257-T260 PolarHBondContact O-N 3Å; F257-I261 HydrophobicContact CD1-CD1 4.03Å; F257-I261 HydrophobicContact CD1-CG1 4.15Å; F257-I261 HydrophobicContact CE1-CD1 3.21Å; F257-I261 HydrophobicContact CE1-CG1 3.58Å; F257-I261 HydrophobicContact CZ-CD1 3.92Å; F257-I261 HydrophobicContact CZ-CG1 4.15Å; F257-I261 PolarHBondContact O-N 3.33Å; F257-L285 HydrophobicContact CZ-CD1 3.84Å |
| 258 | E | 85.7 | Confident | 80.6 | Confident | 95 Ų | 95 | 91.3 Ų | 91.3 | 44% | 0.444 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.9 | -44.3 | 174.5 | -175.1 | 177.7 | -178.5 | 0 | 0 | 111.8 | P254 T255 T260 I261 N262 | P254-E258 PolarHBondContact O-N 2.98Å; T255-E258 PolarHBondContact O-N 3.43Å; E258-T260 VanDerWaalsContact C-N 3.27Å; E258-T260 PolarHBondContact O-N 3.04Å; E258-I261 PolarHBondContact O-N 3.26Å; E258-N262 WeakPolarHBondContact O-CB 3.08Å; E258-N262 VanDerWaalsContact O-CG 3.3Å; E258-N262 PolarHBondContact O-N 3.12Å; E258-N262 PolarHBondContact O-ND2 3.11Å |
| 259 | E | 86.7 | Confident | 79.6 | Confident | 124 Ų | 124 | 90.8 Ų | 90.8 | 58% | 0.579 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.6 | -38.7 | 173.1 | -74.1 | 174.1 | -165.4 | 0 | 0 | 111.9 | T255 F257 N262 N263 | T255-E259 WeakPolarHBondContact O-CB 3.43Å; T255-E259 WeakPolarHBondContact O-CG 3.42Å; T255-E259 PolarHBondContact O-N 3.32Å; F257-E259 VanDerWaalsContact C-N 3.35Å; F257-E259 PolarHBondContact O-N 2.8Å; E259-N262 PolarHBondContact O-N 3.35Å; E259-N263 WeakPolarHBondContact O-CB 3.24Å; E259-N263 PolarHBondContact O-N 3.45Å; E259-N263 PolarHBondContact O-ND2 3.31Å |
| 260 | T | 84.3 | Confident | 78.8 | Confident | 82 Ų | 82 | 97 Ų | 97 | 50% | 0.503 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.3 | -44.9 | 178.6 | -57.2 | 0 | 0 | 0 | 0 | 111.4 | S256 F257 E258 N262 N263 M264 | S256-T260 PolarHBondContact O-N 2.91Å; S256-T260 PolarHBondContact O-OG1 2.9Å; F257-T260 WeakPolarHBondContact O-CA 3.49Å; F257-T260 WeakPolarHBondContact O-CB 3.31Å; F257-T260 PolarHBondContact O-N 3Å; E258-T260 VanDerWaalsContact C-N 3.27Å; E258-T260 PolarHBondContact O-N 3.04Å; T260-N262 VanDerWaalsContact C-N 3.35Å; T260-N263 PolarHBondContact O-N 3.27Å; T260-M264 WeakPolarHBondContact O-CB 3.48Å; T260-M264 PolarHBondContact O-N 3.32Å |
| 261 | I | 83.2 | Confident | 78.2 | Confident | 46 Ų | 46 | 97.7 Ų | 97.7 | 24% | 0.236 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -63.4 | -40.2 | 174.5 | -77.5 | -165.5 | 0 | 0 | 0 | 111.6 | W253 F257 E258 N263 M264 L266 L285 | W253-I261 HydrophobicContact CH2-CD1 4.37Å; F257-I261 HydrophobicContact CD1-CD1 4.03Å; F257-I261 HydrophobicContact CD1-CG1 4.15Å; F257-I261 HydrophobicContact CE1-CD1 3.21Å; F257-I261 HydrophobicContact CE1-CG1 3.58Å; F257-I261 HydrophobicContact CZ-CD1 3.92Å; F257-I261 HydrophobicContact CZ-CG1 4.15Å; F257-I261 PolarHBondContact O-N 3.33Å; E258-I261 PolarHBondContact O-N 3.26Å; I261-N263 VanDerWaalsContact C-N 3.3Å; I261-N263 PolarHBondContact O-N 3.31Å; I261-M264 CarbonylContact O-C 3.44Å; I261-M264 PolarHBondContact O-N 2.82Å; I261-L266 HydrophobicContact CD1-CD1 4.29Å; I261-L266 HydrophobicContact CG1-CD1 4.29Å; I261-L266 HydrophobicContact CG2-CD1 4.1Å; I261-L285 HydrophobicContact CD1-CD1 4.2Å |
| 262 | N | 81.3 | Confident | 77.9 | Confident | 113 Ų | 113 | 103 Ų | 103 | 60% | 0.604 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -67.5 | -33.5 | -179.8 | -75.5 | -32.4 | 0 | 0 | 0 | 112.2 | E258 E259 T260 | E258-N262 WeakPolarHBondContact O-CB 3.08Å; E258-N262 VanDerWaalsContact O-CG 3.3Å; E258-N262 PolarHBondContact O-N 3.12Å; E258-N262 PolarHBondContact O-ND2 3.11Å; E259-N262 PolarHBondContact O-N 3.35Å; T260-N262 VanDerWaalsContact C-N 3.35Å |
| 263 | N | 79.8 | Confident | 77.8 | Confident | 136 Ų | 136 | 98.8 Ų | 98.8 | 73% | 0.727 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -78.5 | -36.3 | 176.3 | -69.6 | -34.7 | 0 | 0 | 0 | 112.5 | E259 T260 I261 Q265 | E259-N263 WeakPolarHBondContact O-CB 3.24Å; E259-N263 PolarHBondContact O-N 3.45Å; E259-N263 PolarHBondContact O-ND2 3.31Å; T260-N263 PolarHBondContact O-N 3.27Å; I261-N263 VanDerWaalsContact C-N 3.3Å; I261-N263 PolarHBondContact O-N 3.31Å; N263-Q265 PolarHBondContact O-N 3.41Å; N263-Q265 VanDerWaalsContact O-N 3.16Å |
| 264 | M | 69 | Low | 77.9 | Confident | 120 Ų | 120 | 97.2 Ų | 97.2 | 59% | 0.591 | 53% | 0.534 | S | S | * | . | S | Bend | trans | -80 | 94.1 | 175.1 | -163.6 | 172.6 | -165.2 | 0 | 0 | 107.1 | T260 I261 L266 | T260-M264 WeakPolarHBondContact O-CB 3.48Å; T260-M264 PolarHBondContact O-N 3.32Å; I261-M264 CarbonylContact O-C 3.44Å; I261-M264 PolarHBondContact O-N 2.82Å; M264-L266 HydrophobicContact CG-CD2 4.06Å; M264-L266 HydrophobicContact CG-CG 4.49Å; M264-L266 PolarHBondContact O-N 3.45Å; M264-L266 HydrophobicContact SD-CD2 3.9Å |
| 265 | Q | 63.5 | Low | 77.9 | Confident | 180 Ų | 180 | 99.9 Ų | 99.9 | 84% | 0.841 | 54% | 0.543 | S | S | * | . | trans | -55.7 | 93.9 | 163.3 | -72.5 | -178.9 | -13.3 | 0 | 0 | 106.8 | N263 S267 | N263-Q265 PolarHBondContact O-N 3.41Å; N263-Q265 VanDerWaalsContact O-N 3.16Å; Q265-S267 PolarHBondContact O-N 3.28Å | ||
| 266 | L | 62.9 | Low | 78 | Confident | 66 Ų | 66 | 101.4 Ų | 101.4 | 35% | 0.346 | 54% | 0.541 | S | S | . | . | trans | -67.9 | 86.3 | -176.5 | -77.3 | 170.3 | 0 | 0 | 0 | 106.2 | I261 M264 L268 L285 | I261-L266 HydrophobicContact CD1-CD1 4.29Å; I261-L266 HydrophobicContact CG1-CD1 4.29Å; I261-L266 HydrophobicContact CG2-CD1 4.1Å; M264-L266 HydrophobicContact CG-CD2 4.06Å; M264-L266 HydrophobicContact CG-CG 4.49Å; M264-L266 PolarHBondContact O-N 3.45Å; M264-L266 HydrophobicContact SD-CD2 3.9Å; L266-L268 HydrophobicContact CB-CD1 3.97Å; L266-L268 HydrophobicContact CB-CG 4.19Å; L266-L268 HydrophobicContact CD1-CD1 4.45Å; L266-L268 PolarHBondContact O-N 3.34Å; L266-L285 HydrophobicContact CD1-CD2 4.31Å | ||
| 267 | S | 63.3 | Low | 78.1 | Confident | 58 Ų | 58 | 101.2 Ų | 101.2 | 41% | 0.406 | 53% | 0.534 | S | S | . | . | trans | -73.5 | 56 | 170.5 | 56 | 0 | 0 | 0 | 0 | 108.6 | Q265 S269 Q270 L271 | Q265-S267 PolarHBondContact O-N 3.28Å; S267-S269 PolarHBondContact O-N 3.45Å; S267-Q270 VanDerWaalsContact CB-OE1 3.27Å; S267-Q270 PolarHBondContact O-N 3.07Å; S267-Q270 PolarHBondContact OG-OE1 2.93Å; S267-L271 WeakPolarHBondContact O-CD1 3.4Å | ||
| 268 | L | 65.9 | Low | 78.2 | Confident | 47 Ų | 47 | 101.6 Ų | 101.6 | 25% | 0.246 | 53% | 0.534 | C | S | . | . | G | 310 helix | trans | -52.5 | -27.4 | 177 | -82 | 150 | 0 | 0 | 0 | 111.4 | L266 Q270 Y278 | L266-L268 HydrophobicContact CB-CD1 3.97Å; L266-L268 HydrophobicContact CB-CG 4.19Å; L266-L268 HydrophobicContact CD1-CD1 4.45Å; L266-L268 PolarHBondContact O-N 3.34Å; L268-Q270 VanDerWaalsContact C-N 3.35Å; L268-Y278 HydrophobicContact CB-CE2 4.35Å; L268-Y278 HydrophobicContact CD2-CE2 3.95Å |
| 269 | S | 66.6 | Low | 78.5 | Confident | 125 Ų | 125 | 98 Ų | 98 | 87% | 0.874 | 52% | 0.519 | S | S | * | . | G | 310 helix | trans | -77.3 | -13.3 | 176.3 | -49.6 | 0 | 0 | 0 | 0 | 114.8 | S267 | S267-S269 PolarHBondContact O-N 3.45Š|
| 270 | Q | 71.1 | Confident | 78.7 | Confident | 158 Ų | 158 | 94 Ų | 94 | 74% | 0.738 | 50% | 0.501 | S | S | * | . | G | 310 helix | trans | -103.3 | -1.7 | -179.1 | -66.2 | -178.8 | -26.2 | 0 | 0 | 113 | S267 L268 D272 | S267-Q270 VanDerWaalsContact CB-OE1 3.27Å; S267-Q270 PolarHBondContact O-N 3.07Å; S267-Q270 PolarHBondContact OG-OE1 2.93Å; L268-Q270 VanDerWaalsContact C-N 3.35Å; Q270-D272 PolarHBondContact O-N 2.82Å |
| 271 | L | 73.1 | Confident | 78.9 | Confident | 80 Ų | 80 | 93.4 Ų | 93.4 | 42% | 0.419 | 49% | 0.494 | S | S | . | . | trans | -71 | 115.7 | 174.5 | -81.3 | 101 | 0 | 0 | 0 | 109.5 | S267 C273 I281 | S267-L271 WeakPolarHBondContact O-CD1 3.4Å; L271-C273 PolarHBondContact O-N 3.21Å; L271-I281 HydrophobicContact CD2-CD1 3.87Å | ||
| 272 | D | 78.9 | Confident | 79.2 | Confident | 176 Ų | 176 | 93.1 Ų | 93.1 | 94% | 0.941 | 49% | 0.492 | S | S | * | . | trans | -77.2 | 74.4 | 167.9 | -172.5 | 21.2 | 0 | 0 | 0 | 109.3 | Q270 | Q270-D272 PolarHBondContact O-N 2.82Š| ||
| 273 | C | 82.9 | Confident | 79.7 | Confident | 46 Ų | 46 | 87.7 Ų | 87.7 | 31% | 0.311 | 46% | 0.464 | S | S | . | . | trans | -133.3 | 156 | 178.8 | 70.9 | 0 | 0 | 0 | 0 | 112.4 | L271 D277 | L271-C273 PolarHBondContact O-N 3.21Å; C273-D277 HydrophobicContact CB-CB 4.07Å | ||
| 274 | S | 88.4 | Confident | 80.1 | Confident | 56 Ų | 56 | 84.4 Ų | 84.4 | 39% | 0.392 | 46% | 0.455 | S | S | . | . | trans | -67.5 | 155.5 | 177.4 | 81.3 | 0 | 0 | 0 | 0 | 110.7 | K276 D277 Y278 | S274-K276 PolarHBondContact O-N 3.31Å; S274-K276 VanDerWaalsContact O-N 3.07Å; S274-D277 WeakPolarHBondContact CB-OD2 3.46Å; S274-D277 PolarHBondContact O-N 3.3Å; S274-D277 PolarHBondContact OG-N 3.02Å; S274-D277 PolarHBondContact OG-OD2 3.3Å; S274-Y278 PolarHBondContact O-N 3Å | ||
| 275 | L | 89 | Confident | 81 | Confident | 137 Ų | 137 | 81 Ų | 81 | 72% | 0.717 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -53.5 | -33.8 | 176.9 | 177.7 | 62.6 | 0 | 0 | 0 | 112.6 | V279 | L275-V279 HydrophobicContact CD1-CG2 4.41Å; L275-V279 VanDerWaalsContact O-CG2 3.29Å; L275-V279 WeakPolarHBondContact O-CG2 3.39Å; L275-V279 PolarHBondContact O-N 3.11Å |
| 276 | K | 89.3 | Confident | 82.2 | Confident | 135 Ų | 135 | 74.8 Ų | 74.8 | 59% | 0.587 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -66.8 | -45.3 | 178.1 | -66.9 | 177.7 | -176.8 | 171.7 | 0 | 111 | S274 Y278 V279 D280 | S274-K276 PolarHBondContact O-N 3.31Å; S274-K276 VanDerWaalsContact O-N 3.07Å; K276-Y278 VanDerWaalsContact C-N 3.33Å; K276-V279 PolarHBondContact O-N 3.49Å; K276-D280 PolarHBondContact O-N 2.86Å |
| 277 | D | 89 | Confident | 83.5 | Confident | 76 Ų | 76 | 77.5 Ų | 77.5 | 41% | 0.406 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -68.4 | -37.4 | 179 | -53.5 | -40.3 | 0 | 0 | 0 | 110.5 | C273 S274 V279 D280 I281 | C273-D277 HydrophobicContact CB-CB 4.07Å; S274-D277 WeakPolarHBondContact CB-OD2 3.46Å; S274-D277 PolarHBondContact O-N 3.3Å; S274-D277 PolarHBondContact OG-N 3.02Å; S274-D277 PolarHBondContact OG-OD2 3.3Å; D277-V279 PolarHBondContact O-N 3.22Å; D277-D280 PolarHBondContact O-N 3.48Å; D277-I281 WeakPolarHBondContact O-CB 3.43Å; D277-I281 WeakPolarHBondContact O-CD1 3.41Å; D277-I281 WeakPolarHBondContact O-CG1 3.43Å; D277-I281 PolarHBondContact O-N 2.93Å |
| 278 | Y | 89.5 | Confident | 84.8 | Confident | 78 Ų | 78 | 74.9 Ų | 74.9 | 31% | 0.306 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -60.3 | -45.4 | 174.6 | -171.4 | -106.2 | 0 | 0 | 0 | 112.3 | L268 S274 K276 D280 I281 I282 | L268-Y278 HydrophobicContact CB-CE2 4.35Å; L268-Y278 HydrophobicContact CD2-CE2 3.95Å; S274-Y278 PolarHBondContact O-N 3Å; K276-Y278 VanDerWaalsContact C-N 3.33Å; Y278-D280 VanDerWaalsContact C-N 3.33Å; Y278-D280 PolarHBondContact O-N 3.23Å; Y278-I281 PolarHBondContact O-N 2.9Å; Y278-I282 HydrophobicContact CD1-CD1 3.74Å; Y278-I282 HydrophobicContact CE1-CD1 3.17Å; Y278-I282 HydrophobicContact CE1-CG1 4.23Å; Y278-I282 HydrophobicContact CE2-CD1 4.29Å; Y278-I282 VanDerWaalsContact CZ-CD1 3.49Å; Y278-I282 WeakPolarHBondContact O-CG1 3.29Å; Y278-I282 PolarHBondContact O-N 2.98Å |
| 279 | V | 90.7 | Very high | 86 | Confident | 20 Ų | 20 | 74.5 Ų | 74.5 | 12% | 0.121 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -61.4 | -43.5 | 174.1 | 169.5 | 0 | 0 | 0 | 0 | 110.8 | L275 K276 D277 I281 I282 C283 L298 | L275-V279 HydrophobicContact CD1-CG2 4.41Å; L275-V279 VanDerWaalsContact O-CG2 3.29Å; L275-V279 WeakPolarHBondContact O-CG2 3.39Å; L275-V279 PolarHBondContact O-N 3.11Å; K276-V279 PolarHBondContact O-N 3.49Å; D277-V279 PolarHBondContact O-N 3.22Å; V279-I281 VanDerWaalsContact C-N 3.33Å; V279-I281 PolarHBondContact O-N 2.93Å; V279-I282 PolarHBondContact O-N 3.04Å; V279-C283 WeakPolarHBondContact O-CB 3.44Å; V279-C283 PolarHBondContact O-N 3.44Å; V279-C283 PolarHBondContact O-SG 3.5Å; V279-L298 HydrophobicContact CG1-CD1 4.32Å; V279-L298 HydrophobicContact CG1-CD2 3.83Å; V279-L298 HydrophobicContact CG1-CG 3.98Å; V279-L298 HydrophobicContact CG2-CD2 4.25Å |
| 280 | D | 90.4 | Very high | 87.1 | Confident | 39 Ų | 39 | 70.8 Ų | 70.8 | 21% | 0.209 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -65.2 | -38.1 | -179.6 | -64 | -8.9 | 0 | 0 | 0 | 111.3 | K276 D277 Y278 A284 V290 R294 | K276-D280 PolarHBondContact O-N 2.86Å; D277-D280 PolarHBondContact O-N 3.48Å; Y278-D280 VanDerWaalsContact C-N 3.33Å; Y278-D280 PolarHBondContact O-N 3.23Å; D280-A284 WeakPolarHBondContact O-CB 3.41Å; D280-A284 PolarHBondContact O-N 2.97Å; D280-V290 WeakPolarHBondContact OD1-CG1 3.28Å; D280-R294 IonicContact OD1-CZ 2.63Å; D280-R294 IonicContact OD1-NE 3.43Å; D280-R294 PolarHBondContact OD1-NE 3.33Å; D280-R294 IonicContact OD1-NH2 3.98Å; D280-R294 IonicContact OD2-CZ 3.36Å; D280-R294 IonicContact OD2-NE 3.48Å; D280-R294 PolarHBondContact OD2-NE 3.45Å; D280-R294 IonicContact OD2-NH2 3.53Å; D280-R294 PolarHBondContact OD2-NH2 2.88Å |
| 281 | I | 88.4 | Confident | 87.8 | Confident | 69 Ų | 69 | 66.5 Ų | 66.5 | 35% | 0.354 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -65.1 | -47.1 | 174.7 | -68.1 | 162.6 | 0 | 0 | 0 | 111.1 | L271 D277 Y278 V279 A284 L285 | L271-I281 HydrophobicContact CD2-CD1 3.87Å; D277-I281 WeakPolarHBondContact O-CB 3.43Å; D277-I281 WeakPolarHBondContact O-CD1 3.41Å; D277-I281 WeakPolarHBondContact O-CG1 3.43Å; D277-I281 PolarHBondContact O-N 2.93Å; Y278-I281 PolarHBondContact O-N 2.9Å; V279-I281 VanDerWaalsContact C-N 3.33Å; V279-I281 PolarHBondContact O-N 2.93Å; I281-A284 PolarHBondContact O-N 3.43Å; I281-L285 WeakPolarHBondContact O-CB 3.38Å; I281-L285 PolarHBondContact O-N 3.33Å |
| 282 | I | 89.9 | Confident | 88.2 | Confident | 40 Ų | 40 | 69.9 Ų | 69.9 | 21% | 0.205 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -64.6 | -45.2 | 178.9 | -71.6 | 178.5 | 0 | 0 | 0 | 111 | Y278 V279 A284 L285 L286 L301 | Y278-I282 HydrophobicContact CD1-CD1 3.74Å; Y278-I282 HydrophobicContact CE1-CD1 3.17Å; Y278-I282 HydrophobicContact CE1-CG1 4.23Å; Y278-I282 HydrophobicContact CE2-CD1 4.29Å; Y278-I282 VanDerWaalsContact CZ-CD1 3.49Å; Y278-I282 WeakPolarHBondContact O-CG1 3.29Å; Y278-I282 PolarHBondContact O-N 2.98Å; V279-I282 PolarHBondContact O-N 3.04Å; I282-A284 VanDerWaalsContact C-N 3.32Å; I282-A284 PolarHBondContact O-N 3.43Å; I282-L285 PolarHBondContact O-N 2.94Å; I282-L286 HydrophobicContact CG2-CD1 4.08Å; I282-L286 PolarHBondContact O-N 2.96Å; I282-L286 VanDerWaalsContact O-N 3.13Å; I282-L301 HydrophobicContact CG2-CD1 4.25Å; I282-L301 HydrophobicContact CG2-CD2 4.18Å |
| 283 | C | 91.5 | Very high | 88.4 | Confident | 0 Ų | 0 | 64.7 Ų | 64.7 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -62.5 | -41.2 | 177.1 | -75.2 | 0 | 0 | 0 | 0 | 111 | V279 L285 L286 D287 I288 V290 | V279-C283 WeakPolarHBondContact O-CB 3.44Å; V279-C283 PolarHBondContact O-N 3.44Å; V279-C283 PolarHBondContact O-SG 3.5Å; C283-L285 PolarHBondContact O-N 3.13Å; C283-L286 PolarHBondContact O-N 3.47Å; C283-D287 PolarHBondContact O-N 2.85Å; C283-I288 CarbonylContact C-O 3.42Å; C283-I288 HydrophobicContact CB-CB 4.07Å; C283-I288 HydrophobicContact CB-CG2 4.3Å; C283-I288 WeakPolarHBondContact O-CA 3.28Å; C283-I288 PolarHBondContact O-N 3.13Å; C283-V290 HydrophobicContact CB-CG2 3.46Å; C283-V290 VanDerWaalsContact CB-CG2 3.46Å |
| 284 | A | 88.7 | Confident | 88.7 | Confident | 67 Ų | 67 | 66.6 Ų | 66.6 | 55% | 0.554 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -64.4 | -37.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | D280 I281 I282 L286 D287 | D280-A284 WeakPolarHBondContact O-CB 3.41Å; D280-A284 PolarHBondContact O-N 2.97Å; I281-A284 PolarHBondContact O-N 3.43Å; I282-A284 VanDerWaalsContact C-N 3.32Å; I282-A284 PolarHBondContact O-N 3.43Å; A284-L286 VanDerWaalsContact C-N 3.29Å; A284-L286 PolarHBondContact O-N 3.37Å; A284-D287 PolarHBondContact O-N 3.14Å |
| 285 | L | 88.1 | Confident | 88.7 | Confident | 49 Ų | 49 | 69.2 Ų | 69.2 | 26% | 0.257 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -62.2 | -40 | 176.8 | -171.7 | 72.6 | 0 | 0 | 0 | 111.2 | W253 F257 I261 L266 I281 I282 C283 D287 | W253-L285 HydrophobicContact CH2-CG 4.21Å; W253-L285 WeakPolarHBondContact CH2-O 3.32Å; W253-L285 WeakPolarHBondContact CZ3-O 3.48Å; F257-L285 HydrophobicContact CZ-CD1 3.84Å; I261-L285 HydrophobicContact CD1-CD1 4.2Å; L266-L285 HydrophobicContact CD1-CD2 4.31Å; I281-L285 WeakPolarHBondContact O-CB 3.38Å; I281-L285 PolarHBondContact O-N 3.33Å; I282-L285 PolarHBondContact O-N 2.94Å; C283-L285 PolarHBondContact O-N 3.13Å; L285-D287 VanDerWaalsContact C-N 3.32Å; L285-D287 PolarHBondContact O-N 2.69Å |
| 286 | L | 89.3 | Confident | 88.7 | Confident | 49 Ų | 49 | 64.2 Ų | 64.2 | 26% | 0.257 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | 16.8 | -177.2 | -67.4 | 169.7 | 0 | 0 | 0 | 113.7 | L249 W253 I282 C283 A284 I288 L301 | L249-L286 WeakPolarHBondContact CD2-O 3.28Å; W253-L286 HydrophobicContact CH2-CD2 3.89Å; W253-L286 HydrophobicContact CZ2-CD2 3.64Å; I282-L286 HydrophobicContact CG2-CD1 4.08Å; I282-L286 PolarHBondContact O-N 2.96Å; I282-L286 VanDerWaalsContact O-N 3.13Å; C283-L286 PolarHBondContact O-N 3.47Å; A284-L286 VanDerWaalsContact C-N 3.29Å; A284-L286 PolarHBondContact O-N 3.37Å; L286-I288 HydrophobicContact CB-CD1 4.17Å; L286-I288 HydrophobicContact CB-CG1 4.24Å; L286-I288 PolarHBondContact O-N 3.02Å; L286-I288 VanDerWaalsContact O-N 3.14Å; L286-L301 HydrophobicContact CD1-CD1 3.2Å |
| 287 | D | 88.9 | Confident | 88.8 | Confident | 122 Ų | 122 | 57.8 Ų | 57.8 | 65% | 0.652 | 30% | 0.302 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.4 | 27.1 | -176.6 | -73.2 | -41.9 | 0 | 0 | 0 | 114.5 | L249 C283 A284 L285 | L249-D287 HydrophobicContact CD2-CB 4.34Å; C283-D287 PolarHBondContact O-N 2.85Å; A284-D287 PolarHBondContact O-N 3.14Å; L285-D287 VanDerWaalsContact C-N 3.32Å; L285-D287 PolarHBondContact O-N 2.69Å |
| 288 | I | 91.5 | Very high | 88.9 | Confident | 4 Ų | 4 | 56 Ų | 56 | 2% | 0.021 | 29% | 0.292 | C | S | . | . | trans | -92.4 | 115.7 | 175.5 | -61 | 173.2 | 0 | 0 | 0 | 109.2 | L249 C283 L286 V290 L300 L301 | L249-I288 HydrophobicContact CD1-CD1 4.37Å; L249-I288 HydrophobicContact CD1-CG1 3.87Å; L249-I288 HydrophobicContact CD2-CG1 4.46Å; C283-I288 CarbonylContact C-O 3.42Å; C283-I288 HydrophobicContact CB-CB 4.07Å; C283-I288 HydrophobicContact CB-CG2 4.3Å; C283-I288 WeakPolarHBondContact O-CA 3.28Å; C283-I288 PolarHBondContact O-N 3.13Å; L286-I288 HydrophobicContact CB-CD1 4.17Å; L286-I288 HydrophobicContact CB-CG1 4.24Å; L286-I288 PolarHBondContact O-N 3.02Å; L286-I288 VanDerWaalsContact O-N 3.14Å; I288-V290 PolarHBondContact O-N 2.85Å; I288-L300 HydrophobicContact CG1-CD2 4.37Å; I288-L300 HydrophobicContact CG2-CD2 4.11Å; I288-L301 HydrophobicContact CD1-CB 3.97Å; I288-L301 HydrophobicContact CD1-CD1 3.98Å | ||
| 289 | P | 90.8 | Very high | 89 | Confident | 38 Ų | 38 | 55.7 Ų | 55.7 | 25% | 0.247 | 29% | 0.294 | C | S | . | . | trans | -69.3 | 134.5 | 179.8 | 27.5 | -32.6 | 0 | 0 | 0 | 111.2 | M243 P244 Y291 S297 | M243-P289 HydrophobicContact SD-CG 3.73Å; P244-P289 HydrophobicContact CG-CG 4.42Å; P289-Y291 HydrophobicContact CB-CE1 4.31Å; P289-Y291 HydrophobicContact CB-CE2 4.13Å; P289-Y291 HydrophobicContact CG-CE2 4.04Å; P289-S297 PolarHBondContact O-OG 3.43Å | ||
| 290 | V | 89.4 | Confident | 89 | Confident | 48 Ų | 48 | 54.9 Ų | 54.9 | 29% | 0.291 | 29% | 0.289 | S | S | . | . | trans | -101 | 118 | 171.3 | -174.8 | 0 | 0 | 0 | 0 | 109.4 | D280 C283 I288 R294 S297 | D280-V290 WeakPolarHBondContact OD1-CG1 3.28Å; C283-V290 HydrophobicContact CB-CG2 3.46Å; C283-V290 VanDerWaalsContact CB-CG2 3.46Å; I288-V290 PolarHBondContact O-N 2.85Å; V290-R294 HydrophobicContact CG1-CG 3.78Å; V290-S297 WeakPolarHBondContact CA-OG 3.4Å | ||
| 291 | Y | 86.1 | Confident | 89.1 | Confident | 67 Ų | 67 | 54.3 Ų | 54.3 | 26% | 0.263 | 29% | 0.286 | S | S | . | . | trans | -102.3 | -152.3 | 174.5 | -57.7 | -62.2 | 0 | 0 | 0 | 110.4 | R241 N242 M243 P289 N293 | R241-Y291 HydrophobicContact CB-CD2 3.8Å; R241-Y291 HydrophobicContact CB-CE1 4.41Å; R241-Y291 HydrophobicContact CB-CE2 3.47Å; R241-Y291 VanDerWaalsContact CB-CE2 3.47Å; R241-Y291 HydrophobicContact CB-CG 4.39Å; R241-Y291 HydrophobicContact CG-CD2 4.38Å; R241-Y291 HydrophobicContact CG-CE2 4.39Å; N242-Y291 PolarHBondContact O-OH 3.17Å; N242-Y291 VanDerWaalsContact O-OH 3.04Å; M243-Y291 HydrophobicContact CE-CD2 3.83Å; M243-Y291 HydrophobicContact CE-CE2 3.94Å; M243-Y291 HydrophobicContact SD-CE2 4.13Å; P289-Y291 HydrophobicContact CB-CE1 4.31Å; P289-Y291 HydrophobicContact CB-CE2 4.13Å; P289-Y291 HydrophobicContact CG-CE2 4.04Å; Y291-N293 PolarHBondContact O-N 3.5Å | ||
| 292 | N | 81.8 | Confident | 89.3 | Confident | 151 Ų | 151 | 57.3 Ų | 57.3 | 81% | 0.807 | 30% | 0.296 | S | S | * | . | S | Bend | trans | -63.4 | -25.4 | 178.8 | -61.3 | 4.1 | 0 | 0 | 0 | 113.3 | ||
| 293 | N | 83.3 | Confident | 89.2 | Confident | 67 Ų | 67 | 56.4 Ų | 56.4 | 36% | 0.358 | 29% | 0.294 | S | S | . | . | trans | -117 | 106.8 | -178.8 | -170.7 | -2.7 | 0 | 0 | 0 | 111.4 | Y291 I295 H296 | Y291-N293 PolarHBondContact O-N 3.5Å; N293-I295 PolarHBondContact O-N 2.87Å; N293-I295 VanDerWaalsContact OD1-CB 3.24Å; N293-I295 WeakPolarHBondContact OD1-CB 3.27Å; N293-I295 WeakPolarHBondContact OD1-CG1 3.25Å; N293-I295 PolarHBondContact OD1-N 3.49Å; N293-H296 PolarHBondContact O-N 2.53Å | ||
| 294 | R | 88.2 | Confident | 89.2 | Confident | 87 Ų | 87 | 56.8 Ų | 56.8 | 33% | 0.328 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -65.5 | -23.2 | 176.9 | -69.2 | 175.6 | 175.7 | 85.8 | -1.2 | 113.3 | D280 V290 H296 S297 L298 | D280-R294 IonicContact OD1-CZ 2.63Å; D280-R294 IonicContact OD1-NE 3.43Å; D280-R294 PolarHBondContact OD1-NE 3.33Å; D280-R294 IonicContact OD1-NH2 3.98Å; D280-R294 IonicContact OD2-CZ 3.36Å; D280-R294 IonicContact OD2-NE 3.48Å; D280-R294 PolarHBondContact OD2-NE 3.45Å; D280-R294 IonicContact OD2-NH2 3.53Å; D280-R294 PolarHBondContact OD2-NH2 2.88Å; V290-R294 HydrophobicContact CG1-CG 3.78Å; R294-H296 VanDerWaalsContact C-N 3.28Å; R294-H296 PolarHBondContact O-N 3.43Å; R294-S297 PolarHBondContact O-N 2.73Å; R294-L298 WeakPolarHBondContact O-CB 3.39Å; R294-L298 WeakPolarHBondContact O-CG 3.34Å; R294-L298 PolarHBondContact O-N 2.99Å |
| 295 | I | 89.3 | Confident | 89.2 | Confident | 110 Ų | 110 | 60.3 Ų | 60.3 | 56% | 0.564 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -64.6 | -34.4 | 178.8 | -57.1 | -59.4 | 0 | 0 | 0 | 111.3 | N293 L298 H299 | N293-I295 PolarHBondContact O-N 2.87Å; N293-I295 VanDerWaalsContact OD1-CB 3.24Å; N293-I295 WeakPolarHBondContact OD1-CB 3.27Å; N293-I295 WeakPolarHBondContact OD1-CG1 3.25Å; N293-I295 PolarHBondContact OD1-N 3.49Å; I295-L298 PolarHBondContact O-N 3.48Å; I295-H299 WeakPolarHBondContact O-CB 3.32Å; I295-H299 PolarHBondContact O-N 2.64Å |
| 296 | H | 88.8 | Confident | 89.2 | Confident | 32 Ų | 32 | 62.7 Ų | 62.7 | 15% | 0.148 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -66.3 | -42.7 | 176.6 | -71.1 | -178.1 | 0 | 0 | 0 | 111.5 | Y239 T240 M243 N293 R294 H299 L300 | Y239-H296 HydrophobicContact CD1-CB 3.87Å; Y239-H296 HydrophobicContact CE1-CB 4.24Å; Y239-H296 WeakPolarHBondContact CE1-O 3.3Å; T240-H296 PolarHBondContact OG1-ND1 3Å; M243-H296 HydrophobicContact CE-CB 3.91Å; N293-H296 PolarHBondContact O-N 2.53Å; R294-H296 VanDerWaalsContact C-N 3.28Å; R294-H296 PolarHBondContact O-N 3.43Å; H296-H299 PolarHBondContact O-N 2.9Å; H296-L300 PolarHBondContact O-N 2.97Å; H296-L300 VanDerWaalsContact O-N 3.12Å |
| 297 | S | 91 | Very high | 89.1 | Confident | 0 Ų | 0 | 64.5 Ų | 64.5 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -66.2 | -42 | 176.7 | -51.3 | 0 | 0 | 0 | 0 | 111.3 | P289 V290 R294 L300 L301 | P289-S297 PolarHBondContact O-OG 3.43Å; V290-S297 WeakPolarHBondContact CA-OG 3.4Å; R294-S297 PolarHBondContact O-N 2.73Å; S297-L300 PolarHBondContact O-N 3.06Å; S297-L301 PolarHBondContact O-N 3.42Å |
| 298 | L | 92.2 | Very high | 89 | Confident | 38 Ų | 38 | 61.4 Ų | 61.4 | 20% | 0.199 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -65.1 | -38.3 | 174.1 | -75 | 172.3 | 0 | 0 | 0 | 112.9 | V279 R294 I295 L300 L301 F302 | V279-L298 HydrophobicContact CG1-CD1 4.32Å; V279-L298 HydrophobicContact CG1-CD2 3.83Å; V279-L298 HydrophobicContact CG1-CG 3.98Å; V279-L298 HydrophobicContact CG2-CD2 4.25Å; R294-L298 WeakPolarHBondContact O-CB 3.39Å; R294-L298 WeakPolarHBondContact O-CG 3.34Å; R294-L298 PolarHBondContact O-N 2.99Å; I295-L298 PolarHBondContact O-N 3.48Å; L298-L300 VanDerWaalsContact C-N 3.3Å; L298-L300 PolarHBondContact O-N 2.8Å; L298-L301 HydrophobicContact CD2-CD2 3.97Å; L298-L301 WeakPolarHBondContact O-CB 3.41Å; L298-L301 PolarHBondContact O-N 2.85Å; L298-F302 HydrophobicContact CB-CE2 4.27Å; L298-F302 WeakPolarHBondContact O-CD2 3.39Å; L298-F302 WeakPolarHBondContact O-CG 3.47Å; L298-F302 PolarHBondContact O-N 3.18Å |
| 299 | H | 90.6 | Very high | 88.7 | Confident | 72 Ų | 72 | 66 Ų | 66 | 33% | 0.333 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.9 | -43.3 | 173.9 | 179.1 | -93.2 | 0 | 0 | 0 | 110.9 | V237 Y239 I295 H296 S303 | V237-H299 WeakPolarHBondContact CG2-NE2 3.21Å; Y239-H299 AromaticContact CE1-ND1 3.89Å; Y239-H299 AromaticContact CZ-ND1 3.64Å; Y239-H299 PolarHBondContact OH-ND1 3.04Å; I295-H299 WeakPolarHBondContact O-CB 3.32Å; I295-H299 PolarHBondContact O-N 2.64Å; H296-H299 PolarHBondContact O-N 2.9Å; H299-S303 PolarHBondContact CE1-OG 2.91Å; H299-S303 VanDerWaalsContact O-CB 3.28Å; H299-S303 WeakPolarHBondContact O-CB 3.49Å; H299-S303 PolarHBondContact O-N 3.49Å; H299-S303 PolarHBondContact O-OG 2.96Å |
| 300 | L | 90.7 | Very high | 88.3 | Confident | 3 Ų | 3 | 69 Ų | 69 | 2% | 0.016 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -65.9 | -42 | 175.9 | -169.1 | 63.4 | 0 | 0 | 0 | 111.7 | M243 I246 L249 I288 H296 S297 L298 F302 S303 L304 | M243-L300 HydrophobicContact CB-CD2 4.12Å; M243-L300 HydrophobicContact CG-CD2 4.48Å; M243-L300 HydrophobicContact SD-CD2 4.2Å; I246-L300 HydrophobicContact CG1-CD1 3.78Å; L249-L300 HydrophobicContact CD1-CD1 4.45Å; L249-L300 HydrophobicContact CD1-CD2 3.68Å; L249-L300 HydrophobicContact CD1-CG 3.91Å; I288-L300 HydrophobicContact CG1-CD2 4.37Å; I288-L300 HydrophobicContact CG2-CD2 4.11Å; H296-L300 PolarHBondContact O-N 2.97Å; H296-L300 VanDerWaalsContact O-N 3.12Å; S297-L300 PolarHBondContact O-N 3.06Å; L298-L300 VanDerWaalsContact C-N 3.3Å; L298-L300 PolarHBondContact O-N 2.8Å; L300-F302 PolarHBondContact O-N 2.96Å; L300-S303 PolarHBondContact O-N 3.38Å; L300-L304 VanDerWaalsContact O-CB 3.32Å; L300-L304 WeakPolarHBondContact O-CB 3.48Å; L300-L304 PolarHBondContact O-N 3.29Å |
| 301 | L | 92.5 | Very high | 87.8 | Confident | 28 Ų | 28 | 67.8 Ų | 67.8 | 15% | 0.147 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -57.1 | -49 | 175.1 | 179.9 | 70.4 | 0 | 0 | 0 | 112 | I282 L286 I288 S297 L298 L304 Y305 | I282-L301 HydrophobicContact CG2-CD1 4.25Å; I282-L301 HydrophobicContact CG2-CD2 4.18Å; L286-L301 HydrophobicContact CD1-CD1 3.2Å; I288-L301 HydrophobicContact CD1-CB 3.97Å; I288-L301 HydrophobicContact CD1-CD1 3.98Å; S297-L301 PolarHBondContact O-N 3.42Å; L298-L301 HydrophobicContact CD2-CD2 3.97Å; L298-L301 WeakPolarHBondContact O-CB 3.41Å; L298-L301 PolarHBondContact O-N 2.85Å; L301-L304 WeakPolarHBondContact O-CB 3.43Å; L301-L304 PolarHBondContact O-N 3.05Å; L301-Y305 PolarHBondContact O-N 3.28Å |
| 302 | F | 92.3 | Very high | 86.6 | Confident | 131 Ų | 131 | 71.5 Ų | 71.5 | 58% | 0.575 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -70.5 | -33.2 | 178.3 | -64.4 | -41.4 | 0 | 0 | 0 | 112.6 | L298 L300 Y305 L306 | L298-F302 HydrophobicContact CB-CE2 4.27Å; L298-F302 WeakPolarHBondContact O-CD2 3.39Å; L298-F302 WeakPolarHBondContact O-CG 3.47Å; L298-F302 PolarHBondContact O-N 3.18Å; L300-F302 PolarHBondContact O-N 2.96Å; F302-Y305 PolarHBondContact O-N 2.9Å; F302-L306 WeakPolarHBondContact O-CB 3.35Å; F302-L306 PolarHBondContact O-N 2.66Å |
| 303 | S | 89.1 | Confident | 85.6 | Confident | 22 Ų | 22 | 71.2 Ų | 71.2 | 15% | 0.154 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.7 | -44.1 | 173.2 | -59.7 | 0 | 0 | 0 | 0 | 111 | H299 L300 L306 E307 | H299-S303 PolarHBondContact CE1-OG 2.91Å; H299-S303 VanDerWaalsContact O-CB 3.28Å; H299-S303 WeakPolarHBondContact O-CB 3.49Å; H299-S303 PolarHBondContact O-N 3.49Å; H299-S303 PolarHBondContact O-OG 2.96Å; L300-S303 PolarHBondContact O-N 3.38Å; S303-L306 PolarHBondContact O-N 2.82Å; S303-E307 PolarHBondContact O-N 3.41Å |
| 304 | L | 90 | Very high | 84.3 | Confident | 7 Ų | 7 | 72.9 Ų | 72.9 | 4% | 0.037 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -59.5 | -47 | 173.8 | -179.1 | 64.1 | 0 | 0 | 0 | 111 | I246 L249 M250 L300 L301 L306 E307 F308 | I246-L304 HydrophobicContact CG2-CD1 4.01Å; L249-L304 HydrophobicContact CB-CD1 3.78Å; L249-L304 HydrophobicContact CB-CD2 3.97Å; L249-L304 HydrophobicContact CB-CG 4.49Å; L249-L304 HydrophobicContact CD1-CD2 4.36Å; M250-L304 HydrophobicContact CG-CD1 3.7Å; L300-L304 VanDerWaalsContact O-CB 3.32Å; L300-L304 WeakPolarHBondContact O-CB 3.48Å; L300-L304 PolarHBondContact O-N 3.29Å; L301-L304 WeakPolarHBondContact O-CB 3.43Å; L301-L304 PolarHBondContact O-N 3.05Å; L304-L306 VanDerWaalsContact C-N 3.33Å; L304-L306 PolarHBondContact O-N 2.91Å; L304-E307 PolarHBondContact O-N 3.41Å; L304-F308 HydrophobicContact CD1-CD2 3.9Å; L304-F308 HydrophobicContact CD1-CE2 3.54Å; L304-F308 HydrophobicContact CD1-CZ 4.48Å; L304-F308 HydrophobicContact CD2-CE2 4.31Å; L304-F308 HydrophobicContact CG-CD2 3.85Å; L304-F308 HydrophobicContact CG-CE2 3.74Å; L304-F308 VanDerWaalsContact O-CD2 3.26Å; L304-F308 WeakPolarHBondContact O-CD2 3.46Å; L304-F308 PolarHBondContact O-N 3.04Å |
| 305 | Y | 90.1 | Very high | 82.8 | Confident | 142 Ų | 142 | 77.6 Ų | 77.6 | 56% | 0.557 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -60 | -41.6 | 175.8 | -179.8 | -100.3 | 0 | 0 | 0 | 112.7 | L301 F302 F308 K309 | L301-Y305 PolarHBondContact O-N 3.28Å; F302-Y305 PolarHBondContact O-N 2.9Å; Y305-F308 PolarHBondContact O-N 2.87Å; Y305-K309 HydrophobicContact CD1-CG 4.27Å; Y305-K309 HydrophobicContact CE1-CG 3.84Å; Y305-K309 VanDerWaalsContact CZ-CE 3.48Å; Y305-K309 WeakPolarHBondContact O-CB 3.39Å; Y305-K309 WeakPolarHBondContact O-CG 3.3Å; Y305-K309 PolarHBondContact O-N 3.29Å; Y305-K309 WeakPolarHBondContact OH-CE 3.37Å |
| 306 | L | 88.3 | Confident | 81 | Confident | 99 Ų | 99 | 78.1 Ų | 78.1 | 52% | 0.518 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.9 | -42.4 | 178.3 | -177.3 | 62.5 | 0 | 0 | 0 | 111.9 | F302 S303 L304 F308 K309 N310 | F302-L306 WeakPolarHBondContact O-CB 3.35Å; F302-L306 PolarHBondContact O-N 2.66Å; S303-L306 PolarHBondContact O-N 2.82Å; L304-L306 VanDerWaalsContact C-N 3.33Å; L304-L306 PolarHBondContact O-N 2.91Å; L306-F308 VanDerWaalsContact C-N 3.34Å; L306-K309 PolarHBondContact O-N 2.95Å; L306-N310 WeakPolarHBondContact O-CB 3.08Å; L306-N310 VanDerWaalsContact O-CG 3.26Å; L306-N310 PolarHBondContact O-N 3.47Å; L306-N310 PolarHBondContact O-ND2 3.39Å |
| 307 | E | 87 | Confident | 79.3 | Confident | 87 Ų | 87 | 81.6 Ų | 81.6 | 41% | 0.407 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -62.6 | -41.4 | 173.8 | -76.2 | -59.5 | 150.6 | 0 | 0 | 111.4 | I246 M250 S303 L304 K309 N310 S311 | I246-E307 HydrophobicContact CG2-CB 4.08Å; I246-E307 HydrophobicContact CG2-CG 3.85Å; M250-E307 HydrophobicContact SD-CB 4.15Å; S303-E307 PolarHBondContact O-N 3.41Å; L304-E307 PolarHBondContact O-N 3.41Å; E307-K309 PolarHBondContact O-N 3.14Å; E307-N310 PolarHBondContact O-N 3.37Å; E307-S311 WeakPolarHBondContact O-CB 3.37Å; E307-S311 PolarHBondContact O-N 3.19Å |
| 308 | F | 85.8 | Confident | 77.4 | Confident | 56 Ų | 56 | 88.3 Ų | 88.3 | 25% | 0.246 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -60.6 | -44.4 | 173 | -87.4 | -59.4 | 0 | 0 | 0 | 112.6 | M250 L304 Y305 L306 N310 S311 F314 | M250-F308 HydrophobicContact CB-CZ 4.28Å; M250-F308 HydrophobicContact CE-CD1 4.18Å; M250-F308 HydrophobicContact CE-CE1 4.17Å; M250-F308 HydrophobicContact CG-CE1 4.35Å; M250-F308 HydrophobicContact CG-CE2 4.18Å; M250-F308 HydrophobicContact CG-CZ 4Å; L304-F308 HydrophobicContact CD1-CD2 3.9Å; L304-F308 HydrophobicContact CD1-CE2 3.54Å; L304-F308 HydrophobicContact CD1-CZ 4.48Å; L304-F308 HydrophobicContact CD2-CE2 4.31Å; L304-F308 HydrophobicContact CG-CD2 3.85Å; L304-F308 HydrophobicContact CG-CE2 3.74Å; L304-F308 VanDerWaalsContact O-CD2 3.26Å; L304-F308 WeakPolarHBondContact O-CD2 3.46Å; L304-F308 PolarHBondContact O-N 3.04Å; Y305-F308 PolarHBondContact O-N 2.87Å; L306-F308 VanDerWaalsContact C-N 3.34Å; F308-N310 VanDerWaalsContact C-N 3.3Å; F308-N310 PolarHBondContact O-N 3.47Å; F308-S311 PolarHBondContact O-N 3.38Å; F308-S311 PolarHBondContact O-OG 2.94Å; F308-F314 AromaticContact CD1-CD2 3.67Å; F308-F314 HydrophobicContact CD1-CD2 3.67Å; F308-F314 AromaticContact CD1-CE2 3.16Å; F308-F314 HydrophobicContact CD1-CE2 3.16Å; F308-F314 AromaticContact CD1-CZ 3.68Å; F308-F314 HydrophobicContact CD1-CZ 3.68Å; F308-F314 HydrophobicContact CE1-CD2 4.31Å; F308-F314 AromaticContact CE1-CE2 3.35Å; F308-F314 HydrophobicContact CE1-CE2 3.35Å; F308-F314 AromaticContact CE1-CZ 3.57Å; F308-F314 HydrophobicContact CE1-CZ 3.57Å; F308-F314 HydrophobicContact CG-CE2 4.4Å |
| 309 | K | 84.9 | Confident | 75.1 | Confident | 100 Ų | 100 | 91.1 Ų | 91.1 | 44% | 0.435 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -61.3 | -35.2 | 174.6 | -82.3 | -81.6 | -178.3 | -174 | 0 | 112.9 | Y305 L306 E307 | Y305-K309 HydrophobicContact CD1-CG 4.27Å; Y305-K309 HydrophobicContact CE1-CG 3.84Å; Y305-K309 VanDerWaalsContact CZ-CE 3.48Å; Y305-K309 WeakPolarHBondContact O-CB 3.39Å; Y305-K309 WeakPolarHBondContact O-CG 3.3Å; Y305-K309 PolarHBondContact O-N 3.29Å; Y305-K309 WeakPolarHBondContact OH-CE 3.37Å; L306-K309 PolarHBondContact O-N 2.95Å; E307-K309 PolarHBondContact O-N 3.14Å |
| 310 | N | 83.4 | Confident | 73 | Confident | 101 Ų | 101 | 93 Ų | 93 | 54% | 0.54 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -80.9 | -30 | 179.5 | -71.3 | -25.9 | 0 | 0 | 0 | 112.7 | L306 E307 F308 Q312 | L306-N310 WeakPolarHBondContact O-CB 3.08Å; L306-N310 VanDerWaalsContact O-CG 3.26Å; L306-N310 PolarHBondContact O-N 3.47Å; L306-N310 PolarHBondContact O-ND2 3.39Å; E307-N310 PolarHBondContact O-N 3.37Å; F308-N310 VanDerWaalsContact C-N 3.3Å; F308-N310 PolarHBondContact O-N 3.47Å; N310-Q312 PolarHBondContact O-N 2.81Å |
| 311 | S | 78.3 | Confident | 70.8 | Confident | 23 Ų | 23 | 100 Ų | 100 | 16% | 0.161 | 49% | 0.485 | C | S | . | . | S | Bend | trans | -66.7 | 129.5 | -179.6 | 73.9 | 0 | 0 | 0 | 0 | 111.5 | E307 F308 H313 F314 | E307-S311 WeakPolarHBondContact O-CB 3.37Å; E307-S311 PolarHBondContact O-N 3.19Å; F308-S311 PolarHBondContact O-N 3.38Å; F308-S311 PolarHBondContact O-OG 2.94Å; S311-H313 PolarHBondContact O-N 2.93Å; S311-F314 PolarHBondContact O-N 3.4Å; S311-F314 WeakPolarHBondContact OG-CD2 3.44Å |
| 312 | Q | 61.6 | Low | 68.3 | Low | 145 Ų | 145 | 108.2 Ų | 108.2 | 68% | 0.678 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.7 | -25.3 | -174.1 | -67.7 | -172 | 1.6 | 0 | 0 | 113.6 | N310 F314 R315 Q316 | N310-Q312 PolarHBondContact O-N 2.81Å; Q312-F314 PolarHBondContact O-N 3.28Å; Q312-R315 PolarHBondContact O-N 3.06Å; Q312-Q316 PolarHBondContact O-N 3.07Å |
| 313 | H | 59.4 | Low | 67.1 | Low | 146 Ų | 146 | 107.1 Ų | 107.1 | 68% | 0.676 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -57.3 | -32 | -177.5 | -76.4 | -73.9 | 0 | 0 | 0 | 113.5 | S311 | S311-H313 PolarHBondContact O-N 2.93Å |
| 314 | F | 56.9 | Low | 65.9 | Low | 102 Ų | 102 | 111.6 Ų | 111.6 | 45% | 0.447 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -91.7 | -25.8 | 179.7 | -67.7 | -85.6 | 0 | 0 | 0 | 113.6 | F308 S311 Q312 Q316 N317 E318 | F308-F314 AromaticContact CD1-CD2 3.67Å; F308-F314 HydrophobicContact CD1-CD2 3.67Å; F308-F314 AromaticContact CD1-CE2 3.16Å; F308-F314 HydrophobicContact CD1-CE2 3.16Å; F308-F314 AromaticContact CD1-CZ 3.68Å; F308-F314 HydrophobicContact CD1-CZ 3.68Å; F308-F314 HydrophobicContact CE1-CD2 4.31Å; F308-F314 AromaticContact CE1-CE2 3.35Å; F308-F314 HydrophobicContact CE1-CE2 3.35Å; F308-F314 AromaticContact CE1-CZ 3.57Å; F308-F314 HydrophobicContact CE1-CZ 3.57Å; F308-F314 HydrophobicContact CG-CE2 4.4Å; S311-F314 PolarHBondContact O-N 3.4Å; S311-F314 WeakPolarHBondContact OG-CD2 3.44Å; Q312-F314 PolarHBondContact O-N 3.28Å; F314-Q316 PolarHBondContact O-N 3.16Å; F314-N317 PolarHBondContact O-N 3.32Å; F314-E318 PolarHBondContact O-N 3.34Å |
| 315 | R | 56.2 | Low | 64.6 | Low | 185 Ų | 185 | 117.4 Ų | 117.4 | 70% | 0.698 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -65.2 | -24.6 | 174.4 | -57.3 | -169.7 | 93.3 | -170.6 | 8.5 | 112.2 | Q312 | Q312-R315 PolarHBondContact O-N 3.06Å |
| 316 | Q | 52.7 | Low | 63.1 | Low | 122 Ų | 122 | 115.9 Ų | 115.9 | 57% | 0.57 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -80.6 | -32.6 | 175.6 | -80.9 | 158.6 | -7.9 | 0 | 0 | 112.8 | Q312 F314 S319 | Q312-Q316 PolarHBondContact O-N 3.07Å; F314-Q316 PolarHBondContact O-N 3.16Å; Q316-S319 PolarHBondContact O-N 3.45Å; Q316-S319 PolarHBondContact O-OG 3.17Å |
| 317 | N | 53 | Low | 61.5 | Low | 105 Ų | 105 | 117 Ų | 117 | 56% | 0.561 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -78.9 | -23.4 | -178.9 | -72.1 | -3.6 | 0 | 0 | 0 | 114 | F314 S319 V320 | F314-N317 PolarHBondContact O-N 3.32Å; N317-S319 PolarHBondContact O-N 3.15Å; N317-V320 PolarHBondContact O-N 3.09Å |
| 318 | E | 50.7 | Low | 59.8 | Low | 140 Ų | 140 | 119 Ų | 119 | 65% | 0.654 | 60% | 0.602 | S | S | * | * | G | 310 helix | trans | -64.5 | -19.3 | 171.5 | -89.1 | 178 | 164.2 | 0 | 0 | 112.9 | F314 V320 | F314-E318 PolarHBondContact O-N 3.34Å; E318-V320 VanDerWaalsContact C-N 3.33Å; E318-V320 PolarHBondContact O-N 2.78Å |
| 319 | S | 44.5 | Very low | 57.9 | Low | 97 Ų | 97 | 123.5 Ų | 123.5 | 68% | 0.678 | 63% | 0.627 | S | S | * | * | G | 310 helix | trans | -82.3 | -2.7 | -179.3 | 70 | 0 | 0 | 0 | 0 | 115.4 | Q316 N317 | Q316-S319 PolarHBondContact O-N 3.45Å; Q316-S319 PolarHBondContact O-OG 3.17Å; N317-S319 PolarHBondContact O-N 3.15Å |
| 320 | V | 45.9 | Very low | 55.9 | Low | 112 Ų | 112 | 125.3 Ų | 125.3 | 68% | 0.679 | 64% | 0.642 | S | S | * | * | G | 310 helix | trans | -112.1 | -0.9 | -173.2 | -169.3 | 0 | 0 | 0 | 0 | 112.8 | N317 E318 | N317-V320 PolarHBondContact O-N 3.09Å; E318-V320 VanDerWaalsContact C-N 3.33Å; E318-V320 PolarHBondContact O-N 2.78Å |
| 321 | I | 43.6 | Very low | 53.6 | Low | 151 Ų | 151 | 127.3 Ų | 127.3 | 77% | 0.774 | 65% | 0.65 | S | S | * | * | trans | -122 | 47.5 | -175.7 | -43.4 | -178.5 | 0 | 0 | 0 | 112 | ||||
| 322 | T | 40.2 | Very low | 51.3 | Low | 200 Ų | 200 | 136.8 Ų | 136.8 | 100% | 1.227 | 70% | 0.695 | S | S | * | * | trans | -129.2 | 0 | 157.9 | -49.8 | 0 | 0 | 0 | 0 | 108.4 |
Retrieved 322 of 322 residues in 324.4 ms
(Link to these results)