| 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 | 51.8 | Low | 57.1 | Low | 242 Ų | 242 | 135.8 Ų | 135.8 | 100% | 1.192 | 82% | 0.823 | S | S | * | * | 0 | 169.4 | 0 | -66.3 | 168 | 81.9 | 0 | 0 | 107.8 | |||||
| 2 | A | 54.5 | Low | 56.7 | Low | 100 Ų | 100 | 138.8 Ų | 138.8 | 83% | 0.826 | 82% | 0.821 | S | S | * | * | trans | -67.9 | 150.7 | -160.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 3 | L | 53.6 | Low | 55.9 | Low | 159 Ų | 159 | 134.8 Ų | 134.8 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | trans | -78.3 | 144.8 | 162.7 | -75 | 80.5 | 0 | 0 | 0 | 109.6 | ||||
| 4 | V | 69.9 | Low | 55.4 | Low | 115 Ų | 115 | 134.1 Ų | 134.1 | 70% | 0.697 | 80% | 0.795 | S | S | * | * | trans | -134.1 | 128.1 | 151.3 | 179 | 0 | 0 | 0 | 0 | 107.6 | Y6 | V4-Y6 HydrophobicContact CG1-CD2 3.65Å; V4-Y6 HydrophobicContact CG1-CE2 3.67Å | ||
| 5 | S | 65.2 | Low | 55.3 | Low | 114 Ų | 114 | 134.3 Ų | 134.3 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | trans | -153.3 | 114.9 | 170.4 | -58 | 0 | 0 | 0 | 0 | 107 | ||||
| 6 | Y | 69.4 | Low | 55.1 | Low | 216 Ų | 216 | 136.8 Ų | 136.8 | 85% | 0.847 | 79% | 0.792 | S | S | * | * | trans | -111.3 | 140.5 | 178.1 | -78.9 | -78.5 | 0 | 0 | 0 | 109.9 | V4 | V4-Y6 HydrophobicContact CG1-CD2 3.65Å; V4-Y6 HydrophobicContact CG1-CE2 3.67Å | ||
| 7 | G | 61.1 | Low | 55.4 | Low | 74 Ų | 74 | 139.5 Ų | 139.5 | 76% | 0.763 | 80% | 0.796 | S | S | * | * | trans | -74.7 | -162.8 | 161 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 8 | S | 48.3 | Very low | 55 | Low | 123 Ų | 123 | 139.4 Ų | 139.4 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | cis | -157.5 | -166.7 | 13.4 | -160.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 9 | S | 49.9 | Very low | 54.5 | Low | 105 Ų | 105 | 139.2 Ų | 139.2 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | trans | -16.8 | 149.5 | 166 | -121.3 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 10 | G | 50.4 | Low | 54.2 | Low | 63 Ų | 63 | 139.1 Ų | 139.1 | 65% | 0.649 | 79% | 0.79 | S | S | * | * | cis | 102.8 | 99.5 | 2.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 11 | E | 54.3 | Low | 53.7 | Low | 183 Ų | 183 | 136.1 Ų | 136.1 | 86% | 0.855 | 78% | 0.783 | S | S | * | * | trans | -175.1 | 169.9 | 175.8 | 57.8 | -165.1 | 111.2 | 0 | 0 | 108.8 | ||||
| 12 | E | 52.6 | Low | 53.4 | Low | 172 Ų | 172 | 129 Ų | 129 | 80% | 0.804 | 76% | 0.757 | S | S | * | * | -158.4 | 141.9 | -59.9 | -167.8 | 173.1 | 168.9 | 0 | 0 | 110.4 | |||||
| 13 | S | 46.1 | Very low | 52.9 | Low | 86 Ų | 86 | 131.1 Ų | 131.1 | 60% | 0.601 | 76% | 0.755 | S | S | * | * | trans | 66.3 | 165.9 | 156.5 | 64.7 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 14 | N | 48.1 | Very low | 52.6 | Low | 126 Ų | 126 | 131.6 Ų | 131.6 | 67% | 0.674 | 75% | 0.753 | S | S | * | * | trans | 80.5 | 135.2 | 163.4 | -43.2 | -38.4 | 0 | 0 | 0 | 118.1 | ||||
| 15 | D | 54.5 | Low | 51.3 | Low | 137 Ų | 137 | 130.6 Ų | 130.6 | 73% | 0.733 | 75% | 0.751 | S | S | * | * | cis | -161.3 | 173.6 | -11.5 | -103.8 | -25.1 | 0 | 0 | 0 | 111.6 | ||||
| 16 | E | 52.3 | Low | 50.2 | Low | 174 Ų | 174 | 131.3 Ų | 131.3 | 81% | 0.813 | 75% | 0.75 | S | S | * | * | trans | -54.7 | 172 | 173.7 | -33.3 | -73 | 127.7 | 0 | 0 | 115.2 | ||||
| 17 | E | 59.2 | Low | 48.8 | Very low | 183 Ų | 183 | 127.8 Ų | 127.8 | 86% | 0.855 | 75% | 0.752 | S | S | * | * | cis | -110.8 | -115.8 | 3.1 | -59.8 | -171.8 | -117.5 | 0 | 0 | 112.9 | ||||
| 18 | D | 48.6 | Very low | 47.9 | Very low | 137 Ų | 137 | 128.8 Ų | 128.8 | 73% | 0.733 | 75% | 0.753 | S | S | * | * | cis | -152.6 | 172.6 | 2.1 | -170.9 | 16.9 | 0 | 0 | 0 | 111.3 | ||||
| 19 | L | 46.5 | Very low | 47.7 | Very low | 136 Ų | 136 | 128.2 Ų | 128.2 | 71% | 0.712 | 76% | 0.755 | S | S | * | * | trans | -71.9 | 162.3 | 177.4 | -61 | 165.2 | 0 | 0 | 0 | 111.6 | ||||
| 20 | V | 47.9 | Very low | 47.2 | Very low | 136 Ų | 136 | 126.7 Ų | 126.7 | 82% | 0.824 | 76% | 0.756 | S | S | * | * | cis | -164.5 | 174.6 | 7.5 | -114.3 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 21 | A | 43.7 | Very low | 46.8 | Very low | 78 Ų | 78 | 129.7 Ų | 129.7 | 65% | 0.645 | 77% | 0.767 | S | S | * | * | cis | -162.4 | 170.1 | 2.8 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 22 | S | 45.1 | Very low | 46.6 | Very low | 92 Ų | 92 | 128 Ų | 128 | 64% | 0.643 | 76% | 0.762 | S | S | * | * | trans | 60.3 | 113.4 | 147.1 | 61.5 | 0 | 0 | 0 | 0 | 123 | ||||
| 23 | N | 45.3 | Very low | 46.4 | Very low | 145 Ų | 145 | 128.3 Ų | 128.3 | 78% | 0.775 | 77% | 0.769 | S | S | * | * | 64.8 | 144.6 | 125.1 | -49.1 | -0 | 0 | 0 | 0 | 119.6 | |||||
| 24 | E | 45.2 | Very low | 46.8 | Very low | 169 Ų | 169 | 133.5 Ų | 133.5 | 79% | 0.79 | 78% | 0.78 | S | S | * | * | cis | -159.6 | 160.7 | -0.6 | -132.7 | 173.7 | 131 | 0 | 0 | 111.5 | ||||
| 25 | S | 43.8 | Very low | 47.1 | Very low | 94 Ų | 94 | 134.3 Ų | 134.3 | 66% | 0.657 | 79% | 0.785 | S | S | * | * | trans | 42.7 | 105.4 | 164.6 | 62.7 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 26 | T | 41.3 | Very low | 47.3 | Very low | 128 Ų | 128 | 138.9 Ų | 138.9 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | 52.8 | 104.6 | 70.6 | 75 | 0 | 0 | 0 | 0 | 117.6 | |||||
| 27 | T | 41.5 | Very low | 47.5 | Very low | 143 Ų | 143 | 135.9 Ų | 135.9 | 88% | 0.877 | 79% | 0.785 | S | S | * | * | -166.4 | 123 | 117.8 | 18.4 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 28 | A | 41.9 | Very low | 47.4 | Very low | 95 Ų | 95 | 133.8 Ų | 133.8 | 79% | 0.785 | 78% | 0.775 | S | S | * | * | trans | 26.3 | 122.8 | 149.5 | 0 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 29 | A | 42.9 | Very low | 47.9 | Very low | 110 Ų | 110 | 132 Ų | 132 | 91% | 0.909 | 77% | 0.771 | S | S | * | * | trans | 64.2 | 125.2 | 132.1 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 30 | G | 40.1 | Very low | 48.6 | Very low | 74 Ų | 74 | 132.9 Ų | 132.9 | 76% | 0.763 | 77% | 0.772 | S | S | * | * | trans | 142.9 | 47.9 | 166.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | I32 | G30-I32 PolarHBondContact O-N 2.9Š| ||
| 31 | S | 42 | Very low | 49 | Very low | 125 Ų | 125 | 135.4 Ų | 135.4 | 87% | 0.874 | 77% | 0.772 | S | S | * | * | trans | -72.9 | 89.1 | -179.8 | 55.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 32 | I | 49.4 | Very low | 49.7 | Very low | 148 Ų | 148 | 139.4 Ų | 139.4 | 76% | 0.759 | 78% | 0.775 | S | S | * | * | trans | -120.8 | 127.6 | 159.4 | -62.1 | 178.7 | 0 | 0 | 0 | 106.7 | G30 K34 | G30-I32 PolarHBondContact O-N 2.9Å; I32-K34 PolarHBondContact O-N 3.24Å | ||
| 33 | L | 49.7 | Very low | 50.5 | Low | 179 Ų | 179 | 143.3 Ų | 143.3 | 94% | 0.937 | 79% | 0.785 | S | S | * | * | trans | -59.1 | 110.8 | -177.4 | -65.9 | 169.1 | 0 | 0 | 0 | 109.8 | ||||
| 34 | K | 53.4 | Low | 51.3 | Low | 194 Ų | 194 | 147.8 Ų | 147.8 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -94.3 | 103.8 | 168.6 | -71.8 | 175.8 | -177 | 170.6 | 0 | 107.2 | I32 R36 | I32-K34 PolarHBondContact O-N 3.24Å; K34-R36 PolarHBondContact O-N 3.04Å | ||
| 35 | D | 55.5 | Low | 52.4 | Low | 143 Ų | 143 | 144.7 Ų | 144.7 | 77% | 0.765 | 78% | 0.783 | S | S | * | * | trans | -52.1 | 123.2 | 165.9 | -177.5 | 12 | 0 | 0 | 0 | 108.9 | ||||
| 36 | R | 57.2 | Low | 53.5 | Low | 233 Ų | 233 | 144 Ų | 144 | 88% | 0.879 | 78% | 0.777 | S | S | * | * | trans | -112.8 | 56.6 | -170.5 | -168.9 | -178 | 160.7 | 141.1 | -4.5 | 109.4 | K34 E38 | K34-R36 PolarHBondContact O-N 3.04Å; R36-E38 PolarHBondContact O-N 3.05Å | ||
| 37 | V | 57.1 | Low | 54.8 | Low | 111 Ų | 111 | 148.5 Ų | 148.5 | 67% | 0.673 | 79% | 0.785 | S | S | * | * | trans | -53.5 | 130.1 | 168.4 | -178.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 38 | E | 57 | Low | 56 | Low | 140 Ų | 140 | 146.7 Ų | 146.7 | 65% | 0.654 | 78% | 0.778 | S | S | * | * | trans | -68.2 | 138.3 | -175.5 | -60.4 | -171.1 | 135.9 | 0 | 0 | 111.5 | R36 E40 | R36-E38 PolarHBondContact O-N 3.05Å; E38-E40 HydrophobicContact CB-CG 4.48Å; E38-E40 PolarHBondContact O-N 3.18Å | ||
| 39 | P | 58.7 | Low | 56.8 | Low | 98 Ų | 98 | 144.4 Ų | 144.4 | 64% | 0.636 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | 13.8 | -166.2 | 33.5 | -38.2 | 0 | 0 | 0 | 114.7 | ||
| 40 | E | 62.3 | Low | 57.4 | Low | 156 Ų | 156 | 148.8 Ų | 148.8 | 73% | 0.729 | 76% | 0.758 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.6 | -25.9 | -158.3 | -52.2 | -136.2 | 165.3 | 0 | 0 | 113.6 | E38 K42 | E38-E40 HydrophobicContact CB-CG 4.48Å; E38-E40 PolarHBondContact O-N 3.18Å; E40-K42 PolarHBondContact O-N 2.81Å |
| 41 | F | 55.3 | Low | 58.3 | Low | 189 Ų | 189 | 151.9 Ų | 151.9 | 83% | 0.829 | 76% | 0.757 | S | S | * | * | trans | -77.7 | 42.3 | 178.8 | -62.9 | -77 | 0 | 0 | 0 | 113.9 | M43 | F41-M43 PolarHBondContact O-N 2.89Š| ||
| 42 | K | 59.1 | Low | 59.1 | Low | 162 Ų | 162 | 150.5 Ų | 150.5 | 70% | 0.704 | 75% | 0.745 | S | S | * | * | trans | -72.9 | 92.7 | 169.7 | -77.3 | 179 | 179.7 | 170.5 | 0 | 110.2 | E40 R44 | E40-K42 PolarHBondContact O-N 2.81Å; K42-R44 PolarHBondContact O-N 2.94Å; K42-R44 VanDerWaalsContact O-N 3.11Å | ||
| 43 | M | 61.9 | Low | 59.4 | Low | 173 Ų | 173 | 151.4 Ų | 151.4 | 85% | 0.852 | 75% | 0.751 | S | S | * | * | trans | -44 | 117.4 | 165.5 | -78.8 | -69 | -82.5 | 0 | 0 | 110 | F41 V45 | F41-M43 PolarHBondContact O-N 2.89Å; M43-V45 VanDerWaalsContact C-N 3.3Å; M43-V45 PolarHBondContact O-N 3.02Å | ||
| 44 | R | 61.5 | Low | 59.8 | Low | 239 Ų | 239 | 149.9 Ų | 149.9 | 90% | 0.902 | 74% | 0.743 | S | S | * | * | trans | -76.6 | 77.7 | -172.4 | -74.7 | -179.9 | 169.2 | 81.5 | -5.6 | 111 | K42 | K42-R44 PolarHBondContact O-N 2.94Å; K42-R44 VanDerWaalsContact O-N 3.11Å | ||
| 45 | V | 68.2 | Low | 60.1 | Low | 105 Ų | 105 | 146.7 Ų | 146.7 | 64% | 0.636 | 74% | 0.74 | S | S | * | * | trans | -57.7 | 122.4 | 160.7 | -175.8 | 0 | 0 | 0 | 0 | 107.4 | M43 K47 A49 | M43-V45 VanDerWaalsContact C-N 3.3Å; M43-V45 PolarHBondContact O-N 3.02Å; V45-K47 PolarHBondContact O-N 3.15Å; V45-A49 HydrophobicContact CG1-CB 4.15Å | ||
| 46 | P | 67.4 | Low | 60.4 | Low | 80 Ų | 80 | 143.9 Ų | 143.9 | 52% | 0.519 | 73% | 0.729 | S | S | . | * | trans | -67 | 135.8 | -176.6 | 26.2 | -33.3 | 0 | 0 | 0 | 110.1 | S48 A49 | P46-S48 PolarHBondContact O-N 3.3Å; P46-A49 HydrophobicContact CG-CB 4.26Å; P46-A49 WeakPolarHBondContact O-CB 3.34Å; P46-A49 PolarHBondContact O-N 3.09Å | ||
| 47 | K | 69.5 | Low | 60.7 | Low | 222 Ų | 222 | 140.2 Ų | 140.2 | 97% | 0.965 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -8.3 | -177.1 | -66.5 | -175.6 | 177.9 | -179 | 0 | 114.6 | V45 | V45-K47 PolarHBondContact O-N 3.15Š|
| 48 | S | 66.9 | Low | 60.9 | Low | 104 Ų | 104 | 138.1 Ų | 138.1 | 73% | 0.727 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -13.8 | 172.4 | 47.8 | 0 | 0 | 0 | 0 | 114 | P46 K50 | P46-S48 PolarHBondContact O-N 3.3Å; S48-K50 PolarHBondContact O-N 3.25Å |
| 49 | A | 58.6 | Low | 61.4 | Low | 48 Ų | 48 | 135 Ų | 135 | 40% | 0.397 | 70% | 0.703 | S | S | . | * | trans | -73.5 | 85 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | V45 P46 L51 | V45-A49 HydrophobicContact CG1-CB 4.15Å; P46-A49 HydrophobicContact CG-CB 4.26Å; P46-A49 WeakPolarHBondContact O-CB 3.34Å; P46-A49 PolarHBondContact O-N 3.09Å; A49-L51 VanDerWaalsContact C-N 3.27Å; A49-L51 PolarHBondContact O-N 2.93Å | ||
| 50 | K | 54.3 | Low | 61.7 | Low | 202 Ų | 202 | 135.9 Ų | 135.9 | 88% | 0.878 | 70% | 0.701 | S | S | * | * | trans | -68 | 88 | 161.5 | -73.8 | -175.8 | 177.9 | -179.9 | 0 | 109 | S48 P52 | S48-K50 PolarHBondContact O-N 3.25Å; K50-P52 WeakPolarHBondContact O-CD 3.45Å | ||
| 51 | L | 60.4 | Low | 62.2 | Low | 139 Ų | 139 | 132.2 Ų | 132.2 | 73% | 0.728 | 69% | 0.69 | S | S | * | * | trans | -62.9 | 125.9 | 161.8 | -64 | 176.5 | 0 | 0 | 0 | 107.9 | A49 | A49-L51 VanDerWaalsContact C-N 3.27Å; A49-L51 PolarHBondContact O-N 2.93Å | ||
| 52 | P | 58.7 | Low | 62.9 | Low | 96 Ų | 96 | 130.5 Ų | 130.5 | 62% | 0.623 | 68% | 0.682 | S | S | * | * | trans | -62.9 | 151.8 | 169.5 | 24.7 | -30.9 | 0 | 0 | 0 | 110.3 | K50 L54 | K50-P52 WeakPolarHBondContact O-CD 3.45Å; P52-L54 HydrophobicContact CB-CD1 4.02Å; P52-L54 HydrophobicContact CG-CD1 4.02Å; P52-L54 PolarHBondContact O-N 2.84Å | ||
| 53 | N | 54.5 | Low | 63.6 | Low | 166 Ų | 166 | 124.9 Ų | 124.9 | 89% | 0.888 | 66% | 0.661 | S | S | * | * | trans | -72.8 | 66.8 | -174.4 | -70.1 | -16.6 | 0 | 0 | 0 | 112.6 | V55 | N53-V55 VanDerWaalsContact C-N 3.31Š| ||
| 54 | L | 57.7 | Low | 64.4 | Low | 147 Ų | 147 | 127.2 Ų | 127.2 | 77% | 0.77 | 67% | 0.667 | S | S | * | * | trans | -83.1 | -1.2 | 178.8 | -100.5 | 65.8 | 0 | 0 | 0 | 114.3 | P52 P56 | P52-L54 HydrophobicContact CB-CD1 4.02Å; P52-L54 HydrophobicContact CG-CD1 4.02Å; P52-L54 PolarHBondContact O-N 2.84Å; L54-P56 WeakPolarHBondContact O-CD 3.5Å | ||
| 55 | V | 60.4 | Low | 65.1 | Low | 128 Ų | 128 | 120.2 Ų | 120.2 | 78% | 0.776 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -89.5 | 111.7 | 169.3 | -177.3 | 0 | 0 | 0 | 0 | 108.2 | N53 N57 | N53-V55 VanDerWaalsContact C-N 3.31Å; V55-N57 PolarHBondContact O-N 3Å |
| 56 | P | 60.9 | Low | 65.5 | Low | 83 Ų | 83 | 118 Ų | 118 | 54% | 0.539 | 65% | 0.645 | S | S | . | * | trans | -62.7 | 132.3 | 173.9 | 26.1 | -33.3 | 0 | 0 | 0 | 109.6 | L54 I58 | L54-P56 WeakPolarHBondContact O-CD 3.5Å; P56-I58 VanDerWaalsContact C-N 3.28Å; P56-I58 PolarHBondContact O-N 3.39Å | ||
| 57 | N | 63.4 | Low | 66.1 | Low | 157 Ų | 157 | 120.6 Ų | 120.6 | 84% | 0.84 | 65% | 0.648 | S | S | * | * | trans | -77.2 | 78.3 | -178.2 | -172.2 | 0.8 | 0 | 0 | 0 | 110.5 | V55 P59 | V55-N57 PolarHBondContact O-N 3Å; N57-P59 WeakPolarHBondContact O-CD 3.16Å | ||
| 58 | I | 61.8 | Low | 66.4 | Low | 66 Ų | 66 | 113.6 Ų | 113.6 | 34% | 0.338 | 62% | 0.624 | S | S | . | * | trans | -71.6 | 118 | 178.4 | -60.2 | 171.9 | 0 | 0 | 0 | 108.8 | P56 I60 S71 | P56-I58 VanDerWaalsContact C-N 3.28Å; P56-I58 PolarHBondContact O-N 3.39Å; I58-I60 PolarHBondContact O-N 2.93Å; I58-I60 VanDerWaalsContact O-N 3.07Å; I58-S71 WeakPolarHBondContact CG2-O 3.37Å | ||
| 59 | P | 68.8 | Low | 66.8 | Low | 76 Ų | 76 | 113.1 Ų | 113.1 | 49% | 0.494 | 61% | 0.613 | S | S | . | * | trans | -71.2 | 106.5 | -179.8 | 28.4 | -33.8 | 0 | 0 | 0 | 110.8 | N57 V61 | N57-P59 WeakPolarHBondContact O-CD 3.16Å; P59-V61 PolarHBondContact O-N 3.47Å; P59-V61 VanDerWaalsContact O-N 3.09Å | ||
| 60 | I | 65 | Low | 67.4 | Low | 115 Ų | 115 | 116.6 Ų | 116.6 | 59% | 0.59 | 62% | 0.624 | S | S | * | * | trans | -72.5 | 99.5 | 176.3 | -62.2 | 177.8 | 0 | 0 | 0 | 109.3 | I58 V68 L70 | I58-I60 PolarHBondContact O-N 2.93Å; I58-I60 VanDerWaalsContact O-N 3.07Å; I60-V68 HydrophobicContact CG2-CG1 3.83Å; I60-V68 HydrophobicContact CG2-CG2 4.32Å; I60-L70 HydrophobicContact CG1-CD2 4.32Å | ||
| 61 | V | 71 | Confident | 68.4 | Low | 80 Ų | 80 | 109.8 Ų | 109.8 | 49% | 0.485 | 60% | 0.602 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -97.9 | 126.1 | 175.9 | -178.7 | 0 | 0 | 0 | 0 | 109.4 | P59 L69 | P59-V61 PolarHBondContact O-N 3.47Å; P59-V61 VanDerWaalsContact O-N 3.09Å; V61-L69 PolarHBondContact N-O 3.38Å; V61-L69 PolarHBondContact O-N 3Å |
| 62 | K | 71.6 | Confident | 68.9 | Low | 152 Ų | 152 | 109.2 Ų | 109.2 | 66% | 0.661 | 60% | 0.604 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -96 | 135.2 | 175.5 | -66.2 | -176.3 | -179.7 | -177.5 | 0 | 110.9 | K67 V68 | K62-K67 WeakPolarHBondContact CA-O 3.44Å; K62-V68 HydrophobicContact CG-CG2 4.2Å |
| 63 | T | 72.6 | Confident | 69.8 | Low | 45 Ų | 45 | 107.6 Ų | 107.6 | 28% | 0.276 | 59% | 0.594 | S | S | . | * | P | Polyproline II helix | trans | -81.3 | 164.3 | 171.7 | 54.4 | 0 | 0 | 0 | 0 | 111.5 | D65 G66 K67 L69 | T63-D65 WeakPolarHBondContact CB-OD1 3.27Å; T63-D65 PolarHBondContact O-N 2.92Å; T63-D65 VanDerWaalsContact O-N 3.13Å; T63-D65 PolarHBondContact OG1-OD1 3.48Å; T63-G66 PolarHBondContact O-N 3.01Å; T63-K67 PolarHBondContact N-O 3.17Å; T63-K67 PolarHBondContact OG1-N 3.08Å; T63-K67 PolarHBondContact OG1-O 3.06Å; T63-L69 HydrophobicContact CG2-CD1 3.6Å; T63-L69 HydrophobicContact CG2-CD2 4.37Å; T63-L69 HydrophobicContact CG2-CG 3.84Å |
| 64 | K | 78.4 | Confident | 70.8 | Confident | 222 Ų | 222 | 106.2 Ų | 106.2 | 97% | 0.965 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | -17.6 | 179 | 64.1 | 178.8 | -179.8 | 178.5 | 0 | 114.8 | ||
| 65 | D | 77.3 | Confident | 71.1 | Confident | 91 Ų | 91 | 105.9 Ų | 105.9 | 49% | 0.487 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98 | 19.7 | 173.3 | 63.6 | -35.7 | 0 | 0 | 0 | 112.8 | T63 K67 | T63-D65 WeakPolarHBondContact CB-OD1 3.27Å; T63-D65 PolarHBondContact O-N 2.92Å; T63-D65 VanDerWaalsContact O-N 3.13Å; T63-D65 PolarHBondContact OG1-OD1 3.48Å; D65-K67 VanDerWaalsContact C-N 3.26Å; D65-K67 PolarHBondContact O-N 2.69Å; D65-K67 WeakPolarHBondContact OD2-CD 3.4Å; D65-K67 VanDerWaalsContact OD2-CE 3.24Å; D65-K67 WeakPolarHBondContact OD2-CE 3.49Å; D65-K67 IonicContact OD2-NZ 2.67Å; D65-K67 PolarHBondContact OD2-NZ 3.37Å |
| 66 | G | 76.4 | Confident | 71.2 | Confident | 58 Ų | 58 | 108.6 Ų | 108.6 | 60% | 0.598 | 59% | 0.588 | S | S | * | * | S | Bend | trans | 80.2 | -7.1 | 169.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | T63 | T63-G66 PolarHBondContact O-N 3.01Š|
| 67 | K | 78.9 | Confident | 71.2 | Confident | 135 Ų | 135 | 108 Ų | 108 | 59% | 0.587 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 147.2 | 179.8 | -61.5 | 171.3 | -174.5 | 144.2 | 0 | 110.9 | K62 T63 D65 | K62-K67 WeakPolarHBondContact CA-O 3.44Å; T63-K67 PolarHBondContact N-O 3.17Å; T63-K67 PolarHBondContact OG1-N 3.08Å; T63-K67 PolarHBondContact OG1-O 3.06Å; D65-K67 VanDerWaalsContact C-N 3.26Å; D65-K67 PolarHBondContact O-N 2.69Å; D65-K67 WeakPolarHBondContact OD2-CD 3.4Å; D65-K67 VanDerWaalsContact OD2-CE 3.24Å; D65-K67 WeakPolarHBondContact OD2-CE 3.49Å; D65-K67 IonicContact OD2-NZ 2.67Å; D65-K67 PolarHBondContact OD2-NZ 3.37Å |
| 68 | V | 77.3 | Confident | 70.8 | Confident | 75 Ų | 75 | 106.9 Ų | 106.9 | 46% | 0.455 | 58% | 0.584 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.4 | 125.5 | 173 | 168.2 | 0 | 0 | 0 | 0 | 108.9 | I60 K62 L70 | I60-V68 HydrophobicContact CG2-CG1 3.83Å; I60-V68 HydrophobicContact CG2-CG2 4.32Å; K62-V68 HydrophobicContact CG-CG2 4.2Å; V68-L70 HydrophobicContact CG1-CD2 3.7Å; V68-L70 HydrophobicContact CG1-CG 4.08Å |
| 69 | L | 75 | Confident | 70.6 | Confident | 95 Ų | 95 | 110.7 Ų | 110.7 | 50% | 0.497 | 61% | 0.605 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.6 | 126.3 | 163.2 | -60.4 | 177.6 | 0 | 0 | 0 | 108.3 | V61 T63 | V61-L69 PolarHBondContact N-O 3.38Å; V61-L69 PolarHBondContact O-N 3Å; T63-L69 HydrophobicContact CG2-CD1 3.6Å; T63-L69 HydrophobicContact CG2-CD2 4.37Å; T63-L69 HydrophobicContact CG2-CG 3.84Å |
| 70 | L | 70.4 | Confident | 69.8 | Low | 120 Ų | 120 | 111.9 Ų | 111.9 | 63% | 0.628 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 120 | 168.8 | -60 | 178.3 | 0 | 0 | 0 | 107.8 | I60 V68 V72 | I60-L70 HydrophobicContact CG1-CD2 4.32Å; V68-L70 HydrophobicContact CG1-CD2 3.7Å; V68-L70 HydrophobicContact CG1-CG 4.08Å; L70-V72 PolarHBondContact O-N 2.87Å |
| 71 | S | 76.4 | Confident | 69.1 | Low | 60 Ų | 60 | 111.1 Ų | 111.1 | 42% | 0.42 | 62% | 0.62 | S | S | . | * | P | Polyproline II helix | trans | -70.4 | 123.1 | 170.5 | -61.5 | 0 | 0 | 0 | 0 | 109.5 | I58 | I58-S71 WeakPolarHBondContact CG2-O 3.37Š|
| 72 | V | 70.7 | Confident | 68.2 | Low | 126 Ų | 126 | 114.7 Ų | 114.7 | 76% | 0.764 | 64% | 0.636 | S | S | * | * | P | Polyproline II helix | trans | -69 | 129.8 | 167.3 | -176.6 | 0 | 0 | 0 | 0 | 107.8 | L70 | L70-V72 PolarHBondContact O-N 2.87Š|
| 73 | P | 77.4 | Confident | 67.4 | Low | 63 Ų | 63 | 114.1 Ų | 114.1 | 41% | 0.409 | 64% | 0.641 | S | S | . | * | P | Polyproline II helix | trans | -63 | 142.3 | 174.2 | -22.2 | 33.9 | 0 | 0 | 0 | 111.9 | L75 | P73-L75 PolarHBondContact O-N 3.32Š|
| 74 | D | 74.5 | Confident | 66.2 | Low | 137 Ų | 137 | 116.7 Ų | 116.7 | 73% | 0.733 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 130.7 | 173.7 | -74.1 | -51.8 | 0 | 0 | 0 | 110.8 | E76 A77 | D74-E76 PolarHBondContact O-N 3.36Å; D74-E76 VanDerWaalsContact O-N 3.14Å; D74-A77 PolarHBondContact O-N 3.39Å; D74-A77 VanDerWaalsContact O-N 3.16Å |
| 75 | L | 63.9 | Low | 65.2 | Low | 139 Ų | 139 | 113.8 Ų | 113.8 | 73% | 0.728 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -64.8 | -20.6 | -171.7 | -61.7 | 175.6 | 0 | 0 | 0 | 113.5 | P73 A77 L78 | P73-L75 PolarHBondContact O-N 3.32Å; L75-A77 PolarHBondContact O-N 3.42Å; L75-L78 PolarHBondContact O-N 2.97Å; L75-L78 VanDerWaalsContact O-N 3.09Å |
| 76 | E | 63.6 | Low | 63.7 | Low | 185 Ų | 185 | 116.9 Ų | 116.9 | 86% | 0.864 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -62.1 | -21.9 | 176.7 | -59.2 | -175 | -178.7 | 0 | 0 | 112.7 | D74 L78 | D74-E76 PolarHBondContact O-N 3.36Å; D74-E76 VanDerWaalsContact O-N 3.14Å; E76-L78 VanDerWaalsContact C-N 3.32Å |
| 77 | A | 59.8 | Low | 62.6 | Low | 72 Ų | 72 | 122.8 Ų | 122.8 | 60% | 0.595 | 68% | 0.684 | S | S | * | * | G | 310 helix | trans | -83.9 | -0.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | D74 L75 | D74-A77 PolarHBondContact O-N 3.39Å; D74-A77 VanDerWaalsContact O-N 3.16Å; L75-A77 PolarHBondContact O-N 3.42Å |
| 78 | L | 56.6 | Low | 61 | Low | 132 Ų | 132 | 121.8 Ų | 121.8 | 69% | 0.691 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -114.3 | -3.1 | -176.1 | -60.5 | 178.9 | 0 | 0 | 0 | 114.1 | L75 E76 S80 | L75-L78 PolarHBondContact O-N 2.97Å; L75-L78 VanDerWaalsContact O-N 3.09Å; E76-L78 VanDerWaalsContact C-N 3.32Å; L78-S80 VanDerWaalsContact C-N 3.33Å |
| 79 | D | 56.5 | Low | 59.3 | Low | 146 Ų | 146 | 121.2 Ų | 121.2 | 78% | 0.781 | 70% | 0.703 | S | S | * | * | trans | -94.4 | 16.3 | 176.6 | -156.3 | 29.9 | 0 | 0 | 0 | 112.5 | S81 | D79-S81 PolarHBondContact O-N 3.33Š| ||
| 80 | S | 53.1 | Low | 57.9 | Low | 101 Ų | 101 | 128.1 Ų | 128.1 | 71% | 0.706 | 72% | 0.723 | S | S | * | * | trans | -77.2 | 66 | 174.8 | 66.5 | 0 | 0 | 0 | 0 | 111.3 | L78 D82 | L78-S80 VanDerWaalsContact C-N 3.33Å; S80-D82 PolarHBondContact O-N 3.48Å | ||
| 81 | S | 50.4 | Low | 56.3 | Low | 99 Ų | 99 | 130.4 Ų | 130.4 | 69% | 0.692 | 74% | 0.735 | S | S | * | * | trans | -71.2 | 90.4 | 170.1 | -173.6 | 0 | 0 | 0 | 0 | 109.6 | D79 D83 | D79-S81 PolarHBondContact O-N 3.33Å; S81-D83 PolarHBondContact O-N 2.97Å | ||
| 82 | D | 52.3 | Low | 54.7 | Low | 155 Ų | 155 | 131.7 Ų | 131.7 | 83% | 0.829 | 75% | 0.749 | S | S | * | * | trans | -69.3 | 87.7 | 176.2 | -167.3 | 29.7 | 0 | 0 | 0 | 110.4 | S80 | S80-D82 PolarHBondContact O-N 3.48Š| ||
| 83 | D | 54.2 | Low | 53.5 | Low | 140 Ų | 140 | 135.3 Ų | 135.3 | 75% | 0.749 | 76% | 0.755 | S | S | * | * | trans | -135.4 | 65.6 | -174.3 | -162.4 | 17.5 | 0 | 0 | 0 | 109.1 | S81 | S81-D83 PolarHBondContact O-N 2.97Š| ||
| 84 | S | 46.7 | Very low | 52.1 | Low | 100 Ų | 100 | 139.2 Ų | 139.2 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | trans | -111.3 | 78.8 | -174.1 | 71.9 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 85 | D | 57.7 | Low | 50.4 | Low | 161 Ų | 161 | 140.8 Ų | 140.8 | 86% | 0.861 | 78% | 0.78 | S | S | * | * | trans | -79.2 | 121.7 | 162.2 | -92.5 | -24.5 | 0 | 0 | 0 | 110.2 | E87 | D85-E87 PolarHBondContact O-N 3.26Š| ||
| 86 | D | 46.8 | Very low | 49.7 | Very low | 156 Ų | 156 | 143.2 Ų | 143.2 | 83% | 0.834 | 79% | 0.785 | S | S | * | * | trans | -71.2 | 119 | 177.8 | -98.7 | -44 | 0 | 0 | 0 | 111.7 | ||||
| 87 | E | 53.2 | Low | 48.4 | Very low | 182 Ų | 182 | 139 Ų | 139 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | trans | -135.1 | 132.1 | 155.4 | -101.7 | -58.9 | 174.2 | 0 | 0 | 112.5 | D85 | D85-E87 PolarHBondContact O-N 3.26Š| ||
| 88 | S | 45 | Very low | 47.8 | Very low | 113 Ų | 113 | 146.2 Ų | 146.2 | 79% | 0.79 | 79% | 0.79 | S | S | * | * | trans | -101.7 | 100 | -159.6 | -81.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 89 | G | 41.5 | Very low | 47 | Very low | 63 Ų | 63 | 150.3 Ų | 150.3 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | trans | -151.9 | 90.7 | -171.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 90 | R | 44.4 | Very low | 46.6 | Very low | 240 Ų | 240 | 150.1 Ų | 150.1 | 91% | 0.906 | 80% | 0.795 | S | S | * | * | trans | 63.7 | 93.3 | 143.5 | -56 | 174.3 | -170.7 | -112.5 | -2.7 | 119.3 | A92 | R90-A92 PolarHBondContact O-N 3.05Š| ||
| 91 | L | 38.2 | Very low | 46.5 | Very low | 169 Ų | 169 | 153.6 Ų | 153.6 | 89% | 0.885 | 80% | 0.798 | S | S | * | * | trans | 2.2 | 109.2 | 133.8 | -68.3 | 163.9 | 0 | 0 | 0 | 117.6 | ||||
| 92 | A | 43.4 | Very low | 46.5 | Very low | 87 Ų | 87 | 157.5 Ų | 157.5 | 72% | 0.719 | 80% | 0.802 | S | S | * | * | trans | -141.9 | 129.4 | 152.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | R90 | R90-A92 PolarHBondContact O-N 3.05Š| ||
| 93 | K | 43.9 | Very low | 46 | Very low | 202 Ų | 202 | 159.2 Ų | 159.2 | 88% | 0.878 | 81% | 0.805 | S | S | * | * | trans | -102.9 | 113.7 | -177.1 | -65.4 | 174 | -178.9 | 174.3 | 0 | 110.4 | ||||
| 94 | N | 47.7 | Very low | 45.8 | Very low | 144 Ų | 144 | 155.3 Ų | 155.3 | 77% | 0.77 | 80% | 0.797 | S | S | * | * | trans | -147.6 | 71.9 | 173.6 | 49.7 | 0.8 | 0 | 0 | 0 | 112.8 | K96 | N94-K96 PolarHBondContact O-N 3.15Š| ||
| 95 | N | 39.4 | Very low | 46.1 | Very low | 170 Ų | 170 | 157.7 Ų | 157.7 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | trans | -48.2 | 127.3 | 163.6 | -72.7 | -26.6 | 0 | 0 | 0 | 111.1 | ||||
| 96 | K | 49.8 | Very low | 45.9 | Very low | 190 Ų | 190 | 156.6 Ų | 156.6 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | trans | -139.6 | 111.6 | 157.5 | -107.8 | 166.7 | -176 | 174.9 | 0 | 110 | N94 Y98 | N94-K96 PolarHBondContact O-N 3.15Å; K96-Y98 PolarHBondContact O-N 3.11Å | ||
| 97 | S | 35.7 | Very low | 46.6 | Very low | 98 Ų | 98 | 159.2 Ų | 159.2 | 69% | 0.685 | 81% | 0.806 | S | S | * | * | trans | -67.3 | 128.6 | 179.2 | -177.3 | 0 | 0 | 0 | 0 | 110.5 | R99 | S97-R99 PolarHBondContact OG-N 3.17Š| ||
| 98 | Y | 47.2 | Very low | 47.2 | Very low | 222 Ų | 222 | 156 Ų | 156 | 87% | 0.871 | 80% | 0.798 | S | S | * | * | trans | -118.3 | 66.1 | 158 | -84.9 | -83.6 | 0 | 0 | 0 | 109.2 | K96 | K96-Y98 PolarHBondContact O-N 3.11Š| ||
| 99 | R | 40.7 | Very low | 48.7 | Very low | 218 Ų | 218 | 153.7 Ų | 153.7 | 82% | 0.823 | 78% | 0.783 | S | S | * | * | trans | -119.3 | 99.7 | 162.5 | -65.8 | -172.2 | -171.2 | -179.7 | 3.3 | 108.5 | S97 | S97-R99 PolarHBondContact OG-N 3.17Š| ||
| 100 | D | 47.1 | Very low | 50.6 | Low | 143 Ų | 143 | 157.7 Ų | 157.7 | 77% | 0.765 | 79% | 0.788 | S | S | * | * | trans | -165.1 | 49.7 | 164.9 | -109.6 | -24.8 | 0 | 0 | 0 | 111.8 | K102 | D100-K102 VanDerWaalsContact C-N 3.3Å; D100-K102 PolarHBondContact O-N 2.85Å | ||
| 101 | F | 50.5 | Low | 52 | Low | 173 Ų | 173 | 152.9 Ų | 152.9 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | trans | -73.5 | 84.2 | 170.8 | -81 | -73.4 | 0 | 0 | 0 | 110.5 | H103 | F101-H103 PolarHBondContact O-CE1 2.97Å; F101-H103 VanDerWaalsContact O-CE1 3.31Å; F101-H103 PolarHBondContact O-ND1 2.94Å | ||
| 102 | K | 52.3 | Low | 53.7 | Low | 182 Ų | 182 | 148.9 Ų | 148.9 | 79% | 0.791 | 77% | 0.766 | S | S | * | * | trans | -59.1 | 138.7 | 173.6 | -72.4 | -166.6 | 174.9 | -174.9 | 0 | 111.1 | D100 G104 | D100-K102 VanDerWaalsContact C-N 3.3Å; D100-K102 PolarHBondContact O-N 2.85Å; K102-G104 VanDerWaalsContact C-N 3.26Å; K102-G104 PolarHBondContact O-N 3.11Å | ||
| 103 | H | 41.1 | Very low | 55.4 | Low | 191 Ų | 191 | 149.4 Ų | 149.4 | 88% | 0.884 | 76% | 0.76 | S | S | * | * | trans | -81.8 | 67.6 | -170.9 | -40 | -37.9 | 0 | 0 | 0 | 111.2 | F101 | F101-H103 PolarHBondContact O-CE1 2.97Å; F101-H103 VanDerWaalsContact O-CE1 3.31Å; F101-H103 PolarHBondContact O-ND1 2.94Å | ||
| 104 | G | 49.4 | Very low | 57 | Low | 57 Ų | 57 | 145.2 Ų | 145.2 | 59% | 0.588 | 75% | 0.746 | S | S | * | * | trans | -89.4 | 139 | 168.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | K102 D106 | K102-G104 VanDerWaalsContact C-N 3.26Å; K102-G104 PolarHBondContact O-N 3.11Å; G104-D106 PolarHBondContact O-N 2.87Å | ||
| 105 | T | 53.2 | Low | 58.3 | Low | 150 Ų | 150 | 143.5 Ų | 143.5 | 92% | 0.92 | 74% | 0.743 | S | S | * | * | trans | -81.3 | 46.1 | -176.3 | 54.1 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 106 | D | 54.7 | Low | 60 | Low | 139 Ų | 139 | 141.6 Ų | 141.6 | 74% | 0.743 | 74% | 0.74 | S | S | * | * | trans | -107.1 | 143.1 | -179.9 | -81.6 | -54.6 | 0 | 0 | 0 | 112.2 | G104 V108 | G104-D106 PolarHBondContact O-N 2.87Å; D106-V108 VanDerWaalsContact C-N 3.32Å; D106-V108 PolarHBondContact O-N 2.9Å | ||
| 107 | K | 61.1 | Low | 60.9 | Low | 210 Ų | 210 | 137.9 Ų | 137.9 | 91% | 0.913 | 73% | 0.734 | S | S | * | * | trans | -81 | 75.7 | -170.2 | -59.9 | 177.5 | -173.2 | 176.5 | 0 | 110.8 | S109 | K107-S109 PolarHBondContact O-N 2.96Š| ||
| 108 | V | 64.4 | Low | 62.4 | Low | 114 Ų | 114 | 145.2 Ų | 145.2 | 69% | 0.691 | 75% | 0.746 | S | S | * | * | trans | -57.2 | 103.5 | 171.5 | -78.1 | 0 | 0 | 0 | 0 | 110.4 | D106 | D106-V108 VanDerWaalsContact C-N 3.32Å; D106-V108 PolarHBondContact O-N 2.9Å | ||
| 109 | S | 77.5 | Confident | 63.2 | Low | 66 Ų | 66 | 138 Ų | 138 | 46% | 0.462 | 73% | 0.733 | S | S | . | * | trans | -65.3 | 139.2 | 171.3 | -177.1 | 0 | 0 | 0 | 0 | 109 | K107 L111 S112 | K107-S109 PolarHBondContact O-N 2.96Å; S109-L111 PolarHBondContact O-N 2.9Å; S109-S112 PolarHBondContact O-N 3.07Å; S109-S112 PolarHBondContact O-OG 2.78Å | ||
| 110 | L | 81.2 | Confident | 64 | Low | 147 Ų | 147 | 135.3 Ų | 135.3 | 77% | 0.77 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -51.9 | -27.5 | 176.9 | -75.4 | 164.6 | 0 | 0 | 0 | 112.9 | S112 V113 | L110-S112 PolarHBondContact O-N 3.34Å; L110-V113 PolarHBondContact O-N 3.4Å |
| 111 | L | 74.2 | Confident | 64.7 | Low | 139 Ų | 139 | 133.7 Ų | 133.7 | 73% | 0.728 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -60.2 | -23.7 | 174.9 | -63.5 | 171.1 | 0 | 0 | 0 | 114.4 | S109 | S109-L111 PolarHBondContact O-N 2.9Š|
| 112 | S | 73 | Confident | 64.9 | Low | 84 Ų | 84 | 129.9 Ų | 129.9 | 59% | 0.587 | 72% | 0.715 | S | S | * | * | G | 310 helix | trans | -90.2 | -2.4 | 175.6 | 68.3 | 0 | 0 | 0 | 0 | 114.1 | S109 L110 | S109-S112 PolarHBondContact O-N 3.07Å; S109-S112 PolarHBondContact O-OG 2.78Å; L110-S112 PolarHBondContact O-N 3.34Å |
| 113 | V | 80.2 | Confident | 65 | Low | 99 Ų | 99 | 129.2 Ų | 129.2 | 60% | 0.6 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | -23.9 | 173.2 | -174 | 0 | 0 | 0 | 0 | 110.9 | L110 | L110-V113 PolarHBondContact O-N 3.4Š|
| 114 | L | 77.2 | Confident | 65.2 | Low | 113 Ų | 113 | 127.8 Ų | 127.8 | 59% | 0.592 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -76.2 | 144.4 | 177.3 | -62 | 177.2 | 0 | 0 | 0 | 111.6 | ||
| 115 | P | 75.5 | Confident | 65.8 | Low | 108 Ų | 108 | 127.3 Ų | 127.3 | 70% | 0.701 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -62 | 141.8 | 175.1 | 26.1 | -34.1 | 0 | 0 | 0 | 110.9 | T117 | P115-T117 PolarHBondContact O-N 3.03Š|
| 116 | P | 74.9 | Confident | 66.4 | Low | 130 Ų | 130 | 128.7 Ų | 128.7 | 84% | 0.844 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 125.6 | -176.4 | -29.7 | 35.8 | 0 | 0 | 0 | 113.1 | R118 | P116-R118 PolarHBondContact O-N 3.18Š|
| 117 | T | 67.8 | Low | 66.6 | Low | 113 Ų | 113 | 132 Ų | 132 | 69% | 0.693 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 119.9 | -173.2 | 50.9 | 0 | 0 | 0 | 0 | 111.1 | P115 A119 | P115-T117 PolarHBondContact O-N 3.03Å; T117-A119 PolarHBondContact O-N 3.26Å |
| 118 | R | 68.4 | Low | 66.9 | Low | 252 Ų | 252 | 126.2 Ų | 126.2 | 95% | 0.951 | 68% | 0.683 | S | S | * | * | trans | -65.2 | 1.6 | 176.6 | -91 | -177.9 | 161.8 | -171 | -5.1 | 115 | P116 L120 | P116-R118 PolarHBondContact O-N 3.18Å; R118-L120 PolarHBondContact O-N 2.94Å | ||
| 119 | A | 62.3 | Low | 67 | Low | 70 Ų | 70 | 127.3 Ų | 127.3 | 58% | 0.579 | 68% | 0.682 | S | S | * | * | trans | -68.6 | 120.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | T117 I121 | T117-A119 PolarHBondContact O-N 3.26Å; A119-I121 PolarHBondContact O-N 3.37Å | ||
| 120 | L | 57.3 | Low | 66.5 | Low | 162 Ų | 162 | 129.1 Ų | 129.1 | 85% | 0.848 | 69% | 0.686 | S | S | * | * | trans | -65.3 | 97.8 | 171.8 | -65.2 | 176.2 | 0 | 0 | 0 | 109.2 | R118 V122 | R118-L120 PolarHBondContact O-N 2.94Å; L120-V122 VanDerWaalsContact C-N 3.29Å; L120-V122 PolarHBondContact O-N 2.88Å | ||
| 121 | I | 61.8 | Low | 66 | Low | 109 Ų | 109 | 125.5 Ų | 125.5 | 56% | 0.559 | 67% | 0.671 | S | S | * | * | trans | -70.2 | 91 | 170.6 | -47.8 | 176.3 | 0 | 0 | 0 | 107.3 | A119 R123 | A119-I121 PolarHBondContact O-N 3.37Å; I121-R123 VanDerWaalsContact C-N 3.35Å; I121-R123 HydrophobicContact CG2-CG 3.96Å; I121-R123 PolarHBondContact O-N 2.98Å | ||
| 122 | V | 55.8 | Low | 65.6 | Low | 93 Ų | 93 | 126 Ų | 126 | 56% | 0.564 | 67% | 0.67 | S | S | * | * | trans | -65.1 | 94.5 | 177.3 | -178.2 | 0 | 0 | 0 | 0 | 108.9 | L120 M129 | L120-V122 VanDerWaalsContact C-N 3.29Å; L120-V122 PolarHBondContact O-N 2.88Å; V122-M129 HydrophobicContact CG1-SD 4.29Å | ||
| 123 | R | 54.3 | Low | 65.3 | Low | 168 Ų | 168 | 130 Ų | 130 | 63% | 0.634 | 68% | 0.679 | S | S | * | * | trans | -98.7 | 86.7 | 176.1 | -76.6 | -175.7 | 154.4 | 116.8 | -5 | 109.8 | I121 G125 | I121-R123 VanDerWaalsContact C-N 3.35Å; I121-R123 HydrophobicContact CG2-CG 3.96Å; I121-R123 PolarHBondContact O-N 2.98Å; R123-G125 VanDerWaalsContact C-N 3.26Å; R123-G125 PolarHBondContact O-N 2.78Å | ||
| 124 | E | 45.2 | Very low | 64.6 | Low | 161 Ų | 161 | 131.4 Ų | 131.4 | 75% | 0.752 | 68% | 0.682 | S | S | * | * | trans | -80.5 | 80.2 | 166.3 | -163 | 149.3 | -135.3 | 0 | 0 | 108.9 | ||||
| 125 | G | 62.6 | Low | 64.1 | Low | 46 Ų | 46 | 131.9 Ų | 131.9 | 47% | 0.474 | 68% | 0.683 | S | S | . | * | S | Bend | trans | 88.3 | -170.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | R123 R127 | R123-G125 VanDerWaalsContact C-N 3.26Å; R123-G125 PolarHBondContact O-N 2.78Å; G125-R127 PolarHBondContact O-N 2.76Å |
| 126 | N | 64.4 | Low | 63.4 | Low | 180 Ų | 180 | 131.5 Ų | 131.5 | 96% | 0.963 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -74.9 | 24.8 | -168.8 | -66.7 | 26.2 | 0 | 0 | 0 | 115 | ||
| 127 | R | 60.2 | Low | 62.6 | Low | 208 Ų | 208 | 134.4 Ų | 134.4 | 79% | 0.785 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -130.7 | 134.7 | 176.3 | -68.1 | -179 | -179.6 | -97.3 | -1.2 | 109.8 | G125 M129 | G125-R127 PolarHBondContact O-N 2.76Å; R127-M129 PolarHBondContact O-N 2.86Å |
| 128 | P | 66.4 | Low | 62 | Low | 88 Ų | 88 | 137.4 Ų | 137.4 | 57% | 0.571 | 69% | 0.686 | S | S | * | * | trans | -66 | 131.8 | 170.5 | 28.7 | -32.8 | 0 | 0 | 0 | 109.3 | I130 | P128-I130 PolarHBondContact O-N 3.04Š| ||
| 129 | M | 66.3 | Low | 60.9 | Low | 137 Ų | 137 | 132.4 Ų | 132.4 | 68% | 0.675 | 68% | 0.678 | S | S | * | * | trans | -66.6 | 105.9 | 168.4 | -96.9 | -175.5 | 62.9 | 0 | 0 | 109.3 | V122 R127 | V122-M129 HydrophobicContact CG1-SD 4.29Å; R127-M129 PolarHBondContact O-N 2.86Å | ||
| 130 | I | 68.2 | Low | 60.1 | Low | 104 Ų | 104 | 133.6 Ų | 133.6 | 53% | 0.533 | 68% | 0.679 | S | S | . | * | trans | -82.9 | 127.2 | 169.7 | -61.7 | 174.7 | 0 | 0 | 0 | 107.2 | P128 H132 L134 | P128-I130 PolarHBondContact O-N 3.04Å; I130-H132 PolarHBondContact O-N 3.26Å; I130-L134 HydrophobicContact CG2-CB 3.77Å | ||
| 131 | P | 69.5 | Low | 59.2 | Low | 72 Ų | 72 | 130.8 Ų | 130.8 | 47% | 0.468 | 67% | 0.672 | S | S | . | * | trans | -53.5 | 138.8 | 173.6 | -27 | 34.8 | 0 | 0 | 0 | 111.6 | Q133 L134 | P131-Q133 PolarHBondContact O-N 2.92Å; P131-L134 PolarHBondContact O-N 3.33Å | ||
| 132 | H | 66.7 | Low | 58.4 | Low | 149 Ų | 149 | 133.3 Ų | 133.3 | 69% | 0.69 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -57.2 | -24.9 | -177.1 | 53.9 | -97.6 | 0 | 0 | 0 | 113.6 | I130 L134 M135 | I130-H132 PolarHBondContact O-N 3.26Å; H132-L134 VanDerWaalsContact C-N 3.26Å; H132-L134 PolarHBondContact O-N 2.85Å; H132-M135 HydrophobicContact CB-SD 4.34Å; H132-M135 WeakPolarHBondContact O-CB 3.25Å; H132-M135 PolarHBondContact O-N 3.24Å |
| 133 | Q | 67 | Low | 57.4 | Low | 167 Ų | 167 | 134.2 Ų | 134.2 | 78% | 0.78 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -64.3 | -25.4 | 173.7 | -63.9 | 171 | -14.3 | 0 | 0 | 113.7 | P131 | P131-Q133 PolarHBondContact O-N 2.92Š|
| 134 | L | 65 | Low | 56.6 | Low | 129 Ų | 129 | 132 Ų | 132 | 68% | 0.675 | 69% | 0.692 | S | S | * | * | G | 310 helix | trans | -98.4 | 3.6 | 178.7 | -57.6 | -179 | 0 | 0 | 0 | 112.7 | I130 P131 H132 S136 | I130-L134 HydrophobicContact CG2-CB 3.77Å; P131-L134 PolarHBondContact O-N 3.33Å; H132-L134 VanDerWaalsContact C-N 3.26Å; H132-L134 PolarHBondContact O-N 2.85Å; L134-S136 PolarHBondContact O-N 3.33Å |
| 135 | M | 65.9 | Low | 56.3 | Low | 123 Ų | 123 | 132.9 Ų | 132.9 | 61% | 0.606 | 69% | 0.693 | S | S | * | * | trans | -83 | 97.8 | 177.7 | -64.5 | -178.4 | 71.9 | 0 | 0 | 110 | H132 K137 | H132-M135 HydrophobicContact CB-SD 4.34Å; H132-M135 WeakPolarHBondContact O-CB 3.25Å; H132-M135 PolarHBondContact O-N 3.24Å; M135-K137 PolarHBondContact O-N 3.46Å; M135-K137 VanDerWaalsContact O-N 3.1Å | ||
| 136 | S | 60.6 | Low | 55.4 | Low | 101 Ų | 101 | 138 Ų | 138 | 71% | 0.706 | 71% | 0.705 | S | S | * | * | trans | -61.1 | 115 | 175 | 52.3 | 0 | 0 | 0 | 0 | 110.9 | L134 K138 | L134-S136 PolarHBondContact O-N 3.33Å; S136-K138 PolarHBondContact O-N 2.87Å | ||
| 137 | K | 58.7 | Low | 53.9 | Low | 191 Ų | 191 | 135.3 Ų | 135.3 | 83% | 0.83 | 70% | 0.695 | S | S | * | * | trans | -65.8 | 100.8 | 175.1 | -76.2 | -178.1 | 177.1 | 176.2 | 0 | 109.2 | M135 N139 | M135-K137 PolarHBondContact O-N 3.46Å; M135-K137 VanDerWaalsContact O-N 3.1Å; K137-N139 PolarHBondContact O-N 3.23Å | ||
| 138 | K | 56 | Low | 53.2 | Low | 175 Ų | 175 | 132.3 Ų | 132.3 | 76% | 0.761 | 69% | 0.694 | S | S | * | * | trans | -70.4 | 98.5 | 170.2 | -62.5 | -177.9 | -176.4 | -177.8 | 0 | 108 | S136 T140 | S136-K138 PolarHBondContact O-N 2.87Å; K138-T140 PolarHBondContact O-N 2.88Å | ||
| 139 | N | 44.1 | Very low | 51.8 | Low | 148 Ų | 148 | 133.4 Ų | 133.4 | 79% | 0.791 | 70% | 0.699 | S | S | * | * | trans | -69 | 83.3 | 174 | -70.1 | -9 | 0 | 0 | 0 | 109.5 | K137 S141 | K137-N139 PolarHBondContact O-N 3.23Å; N139-S141 PolarHBondContact O-N 3.05Å | ||
| 140 | T | 45.7 | Very low | 50.8 | Low | 95 Ų | 95 | 134.2 Ų | 134.2 | 58% | 0.583 | 70% | 0.703 | S | S | * | * | trans | -71.1 | 93 | 171.4 | 47 | 0 | 0 | 0 | 0 | 108.7 | K138 H142 | K138-T140 PolarHBondContact O-N 2.88Å; T140-H142 PolarHBondContact O-CD2 3.39Å; T140-H142 PolarHBondContact O-N 2.81Å; T140-H142 PolarHBondContact O-NE2 3.07Å; T140-H142 PolarHBondContact OG1-NE2 3.27Å | ||
| 141 | S | 39.5 | Very low | 49.5 | Very low | 103 Ų | 103 | 137.8 Ų | 137.8 | 72% | 0.72 | 72% | 0.715 | S | S | * | * | trans | -62.5 | 99.5 | 169.6 | 43.4 | 0 | 0 | 0 | 0 | 109.2 | N139 T143 | N139-S141 PolarHBondContact O-N 3.05Å; S141-T143 VanDerWaalsContact C-N 3.25Å; S141-T143 PolarHBondContact O-N 3.45Å | ||
| 142 | H | 43.7 | Very low | 47.9 | Very low | 161 Ų | 161 | 140.6 Ų | 140.6 | 75% | 0.745 | 73% | 0.731 | S | S | * | * | trans | -71.5 | 79.8 | 179.5 | -66.9 | -84.9 | 0 | 0 | 0 | 110.4 | T140 V144 | T140-H142 PolarHBondContact O-CD2 3.39Å; T140-H142 PolarHBondContact O-N 2.81Å; T140-H142 PolarHBondContact O-NE2 3.07Å; T140-H142 PolarHBondContact OG1-NE2 3.27Å; H142-V144 VanDerWaalsContact C-N 3.34Å; H142-V144 PolarHBondContact O-N 3.25Å | ||
| 143 | T | 34.8 | Very low | 46.6 | Very low | 113 Ų | 113 | 142.8 Ų | 142.8 | 69% | 0.693 | 74% | 0.739 | S | S | * | * | trans | -66.6 | 93.9 | 167.8 | 51.3 | 0 | 0 | 0 | 0 | 109.1 | S141 K145 | S141-T143 VanDerWaalsContact C-N 3.25Å; S141-T143 PolarHBondContact O-N 3.45Å; T143-K145 PolarHBondContact O-N 2.95Å; T143-K145 VanDerWaalsContact O-N 3.09Å | ||
| 144 | V | 38.8 | Very low | 45.1 | Very low | 121 Ų | 121 | 141.2 Ų | 141.2 | 73% | 0.733 | 74% | 0.743 | S | S | * | * | trans | -61.1 | 111.7 | 175.4 | 178.9 | 0 | 0 | 0 | 0 | 108.9 | H142 E146 | H142-V144 VanDerWaalsContact C-N 3.34Å; H142-V144 PolarHBondContact O-N 3.25Å; V144-E146 HydrophobicContact CG1-CB 4.01Å | ||
| 145 | K | 38.6 | Very low | 43.8 | Very low | 179 Ų | 179 | 138.9 Ų | 138.9 | 78% | 0.778 | 75% | 0.75 | S | S | * | * | trans | -115.6 | 59.1 | 167.4 | -71 | -169.6 | 177 | -177.1 | 0 | 109.5 | T143 T147 | T143-K145 PolarHBondContact O-N 2.95Å; T143-K145 VanDerWaalsContact O-N 3.09Å; K145-T147 PolarHBondContact O-N 2.98Å; K145-T147 VanDerWaalsContact O-N 3.1Å; K145-T147 PolarHBondContact O-OG1 2.97Å | ||
| 146 | E | 42.6 | Very low | 42.5 | Very low | 154 Ų | 154 | 140.6 Ų | 140.6 | 72% | 0.72 | 76% | 0.761 | S | S | * | * | trans | -64 | 112 | 174.1 | -175.4 | 161.6 | -150.6 | 0 | 0 | 109.3 | V144 L148 | V144-E146 HydrophobicContact CG1-CB 4.01Å; E146-L148 HydrophobicContact CG-CD1 4.33Å; E146-L148 HydrophobicContact CG-CG 4.22Å; E146-L148 PolarHBondContact O-N 3.02Å | ||
| 147 | T | 34 | Very low | 41.6 | Very low | 123 Ų | 123 | 140.4 Ų | 140.4 | 76% | 0.755 | 76% | 0.756 | S | S | * | * | trans | -102.1 | 75.9 | -170.3 | -55.2 | 0 | 0 | 0 | 0 | 109.3 | K145 | K145-T147 PolarHBondContact O-N 2.98Å; K145-T147 VanDerWaalsContact O-N 3.1Å; K145-T147 PolarHBondContact O-OG1 2.97Å | ||
| 148 | L | 46 | Very low | 40.7 | Very low | 146 Ų | 146 | 138.6 Ų | 138.6 | 76% | 0.764 | 75% | 0.75 | S | S | * | * | trans | -93.9 | 126.2 | 172.4 | -73.2 | 174.7 | 0 | 0 | 0 | 110.8 | E146 | E146-L148 HydrophobicContact CG-CD1 4.33Å; E146-L148 HydrophobicContact CG-CG 4.22Å; E146-L148 PolarHBondContact O-N 3.02Å | ||
| 149 | T | 36 | Very low | 40 | Very low | 110 Ų | 110 | 138.5 Ų | 138.5 | 68% | 0.675 | 75% | 0.752 | S | S | * | * | trans | -88.1 | 138.4 | -179.4 | 53 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 150 | M | 46.6 | Very low | 39.7 | Very low | 155 Ų | 155 | 140.9 Ų | 140.9 | 76% | 0.764 | 76% | 0.756 | S | S | * | * | 166.7 | 127.8 | 117.2 | -85.3 | -59.4 | 163.9 | 0 | 0 | 112.7 | |||||
| 151 | K | 40.9 | Very low | 39.5 | Very low | 179 Ų | 179 | 141.9 Ų | 141.9 | 78% | 0.778 | 76% | 0.764 | S | S | * | * | trans | 47.1 | 112.6 | 147.8 | -73.4 | -179 | 174.8 | 176.7 | 0 | 121 | ||||
| 152 | T | 34.1 | Very low | 39 | Very low | 131 Ų | 131 | 141 Ų | 141 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | 42.4 | 131.3 | 128.8 | 60.6 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 153 | K | 40.1 | Very low | 38.8 | Very low | 195 Ų | 195 | 143 Ų | 143 | 85% | 0.848 | 77% | 0.765 | S | S | * | * | cis | -170.1 | 144.8 | 49.7 | -160.4 | 176 | -176.3 | -177.4 | 0 | 109.8 | ||||
| 154 | P | 35.7 | Very low | 39.3 | Very low | 134 Ų | 134 | 145.2 Ų | 145.2 | 87% | 0.87 | 77% | 0.767 | S | S | * | * | trans | -85.1 | 152.5 | -177 | 33.6 | -35.4 | 0 | 0 | 0 | 113.9 | ||||
| 155 | G | 38.6 | Very low | 39.1 | Very low | 79 Ų | 79 | 146.4 Ų | 146.4 | 81% | 0.814 | 77% | 0.769 | S | S | * | * | trans | -156.3 | 129.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 156 | N | 36.9 | Very low | 39.3 | Very low | 159 Ų | 159 | 144.8 Ų | 144.8 | 85% | 0.85 | 77% | 0.769 | S | S | * | * | trans | -84.3 | 176.5 | -169.4 | -178.3 | 34.6 | 0 | 0 | 0 | 113.8 | ||||
| 157 | V | 42.9 | Very low | 39.1 | Very low | 97 Ų | 97 | 143.7 Ų | 143.7 | 59% | 0.588 | 77% | 0.768 | S | S | * | * | trans | 115.5 | 103.6 | 149.4 | -178 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 158 | E | 38.4 | Very low | 39.7 | Very low | 154 Ų | 154 | 144.6 Ų | 144.6 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | trans | 65.3 | 160.4 | 145.4 | -71.2 | 167.4 | -141.5 | 0 | 0 | 119.8 | ||||
| 159 | Q | 41.8 | Very low | 39.9 | Very low | 173 Ų | 173 | 145 Ų | 145 | 81% | 0.808 | 77% | 0.771 | S | S | * | * | cis | -147.1 | 177.6 | 10.3 | -136 | 159.8 | 61.7 | 0 | 0 | 112.1 | ||||
| 160 | K | 38.8 | Very low | 40.7 | Very low | 198 Ų | 198 | 147.1 Ų | 147.1 | 86% | 0.861 | 78% | 0.779 | S | S | * | * | trans | -88.3 | -178.4 | 177.5 | -84.1 | -173.8 | 179.1 | -178 | 0 | 111.3 | ||||
| 161 | P | 40.2 | Very low | 40.7 | Very low | 116 Ų | 116 | 147.7 Ų | 147.7 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | cis | -148.1 | -172.4 | 20.7 | 46.6 | -25.2 | 0 | 0 | 0 | 119.9 | ||||
| 162 | S | 30.8 | Very low | 41.1 | Very low | 85 Ų | 85 | 146.3 Ų | 146.3 | 59% | 0.594 | 79% | 0.785 | S | S | * | * | trans | -35.4 | 150.9 | 172.1 | 53.4 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 163 | F | 38.6 | Very low | 41.8 | Very low | 202 Ų | 202 | 151.4 Ų | 151.4 | 89% | 0.886 | 79% | 0.789 | S | S | * | * | -138.2 | 112.2 | 128.3 | -73.4 | -83.7 | 0 | 0 | 0 | 106.5 | |||||
| 164 | Q | 45.2 | Very low | 41.8 | Very low | 159 Ų | 159 | 150 Ų | 150 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | 66.4 | 110.9 | 81.8 | -81 | -171.3 | -98.1 | 0 | 0 | 115.4 | |||||
| 165 | N | 33.7 | Very low | 42.3 | Very low | 147 Ų | 147 | 149.5 Ų | 149.5 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | trans | -70 | 148.1 | 154.5 | -69.1 | 1.7 | 0 | 0 | 0 | 109 | ||||
| 166 | N | 43.9 | Very low | 42.3 | Very low | 144 Ų | 144 | 152.6 Ų | 152.6 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | trans | -122.3 | 148.5 | 141 | -73 | -20.2 | 0 | 0 | 0 | 107.2 | ||||
| 167 | N | 38.3 | Very low | 42.8 | Very low | 132 Ų | 132 | 153.5 Ų | 153.5 | 71% | 0.706 | 79% | 0.786 | S | S | * | * | trans | -89.2 | -157.7 | 158.5 | -67.7 | -24.2 | 0 | 0 | 0 | 107.6 | ||||
| 168 | D | 45.6 | Very low | 42.9 | Very low | 142 Ų | 142 | 154.1 Ų | 154.1 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | trans | 77.7 | 106.5 | 164.5 | -39.9 | -30.4 | 0 | 0 | 0 | 113.1 | ||||
| 169 | D | 51.2 | Low | 42.9 | Very low | 154 Ų | 154 | 151.9 Ų | 151.9 | 82% | 0.824 | 79% | 0.792 | S | S | * | * | -177.5 | 114.6 | 121.7 | -84.3 | -14.8 | 0 | 0 | 0 | 110.4 | |||||
| 170 | D | 52.6 | Low | 43.3 | Very low | 155 Ų | 155 | 152.1 Ų | 152.1 | 83% | 0.829 | 79% | 0.79 | S | S | * | * | trans | 55.8 | 110.2 | 152.2 | -56.6 | -19.2 | 0 | 0 | 0 | 123.4 | ||||
| 171 | D | 47.3 | Very low | 43.5 | Very low | 166 Ų | 166 | 150.1 Ų | 150.1 | 89% | 0.888 | 78% | 0.784 | S | S | * | * | trans | -71.2 | 127.6 | 154 | -61.1 | -69.7 | 0 | 0 | 0 | 111.4 | ||||
| 172 | I | 48 | Very low | 43.4 | Very low | 151 Ų | 151 | 152 Ų | 152 | 77% | 0.774 | 79% | 0.788 | S | S | * | * | trans | -164.6 | 173.1 | 160.5 | -119.6 | 158.8 | 0 | 0 | 0 | 109.9 | ||||
| 173 | W | 49.1 | Very low | 44 | Very low | 238 Ų | 238 | 153.2 Ų | 153.2 | 90% | 0.902 | 80% | 0.796 | S | S | * | * | trans | 84.6 | 50.1 | -174.2 | -55.9 | 79.9 | 0 | 0 | 0 | 117 | ||||
| 174 | D | 41.5 | Very low | 44.2 | Very low | 166 Ų | 166 | 150.3 Ų | 150.3 | 89% | 0.888 | 79% | 0.79 | S | S | * | * | trans | -128.7 | 89.7 | 151.7 | -113.2 | -28.1 | 0 | 0 | 0 | 109.2 | ||||
| 175 | T | 44.7 | Very low | 44.4 | Very low | 122 Ų | 122 | 152.6 Ų | 152.6 | 75% | 0.748 | 80% | 0.797 | S | S | * | * | trans | -154.1 | 116.8 | 169.1 | 53.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 176 | D | 39.9 | Very low | 44.8 | Very low | 144 Ų | 144 | 153 Ų | 153 | 77% | 0.77 | 80% | 0.799 | S | S | * | * | trans | 39.9 | 97.9 | 140.8 | -52.4 | -26.4 | 0 | 0 | 0 | 120.4 | ||||
| 177 | I | 46.1 | Very low | 44.5 | Very low | 178 Ų | 178 | 153.4 Ų | 153.4 | 91% | 0.913 | 80% | 0.802 | S | S | * | * | trans | -128.8 | 88.7 | 136.8 | -57.8 | -176.3 | 0 | 0 | 0 | 109 | ||||
| 178 | T | 44.8 | Very low | 44.6 | Very low | 111 Ų | 111 | 154.6 Ų | 154.6 | 68% | 0.681 | 81% | 0.807 | S | S | * | * | trans | -71 | 134 | 170.6 | 52 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 179 | S | 40 | Very low | 44.3 | Very low | 106 Ų | 106 | 155.7 Ų | 155.7 | 74% | 0.741 | 81% | 0.808 | S | S | * | * | trans | 36.9 | 123.1 | 149.7 | 64.8 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 180 | K | 48.7 | Very low | 43.6 | Very low | 179 Ų | 179 | 156.3 Ų | 156.3 | 78% | 0.778 | 81% | 0.81 | S | S | * | * | -164.6 | 129.6 | 124.6 | -113.2 | -180 | 178.7 | -169.6 | 0 | 116 | |||||
| 181 | Q | 43.3 | Very low | 43.1 | Very low | 155 Ų | 155 | 153.1 Ų | 153.1 | 72% | 0.724 | 81% | 0.805 | S | S | * | * | trans | 59.2 | 117 | 145 | -72.1 | 174.4 | -104.8 | 0 | 0 | 120.4 | ||||
| 182 | D | 38.4 | Very low | 42.6 | Very low | 156 Ų | 156 | 153 Ų | 153 | 83% | 0.834 | 81% | 0.805 | S | S | * | * | trans | -58.1 | 149.5 | 156.2 | -38.3 | -97.9 | 0 | 0 | 0 | 112.3 | ||||
| 183 | S | 43.1 | Very low | 42.6 | Very low | 110 Ų | 110 | 154.5 Ų | 154.5 | 77% | 0.769 | 81% | 0.808 | S | S | * | * | trans | -166.9 | 125 | 155.6 | -79.9 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 184 | D | 43.9 | Very low | 42.1 | Very low | 142 Ų | 142 | 147 Ų | 147 | 76% | 0.759 | 80% | 0.804 | S | S | * | * | trans | -66 | 144.6 | 177.6 | -47.7 | -97 | 0 | 0 | 0 | 113.1 | ||||
| 185 | K | 48.6 | Very low | 42.4 | Very low | 206 Ų | 206 | 145.5 Ų | 145.5 | 90% | 0.896 | 80% | 0.802 | S | S | * | * | -159.3 | 141.5 | 126.8 | -99.6 | 126.2 | -151.1 | 146.1 | 0 | 112.7 | |||||
| 186 | N | 42.3 | Very low | 42.6 | Very low | 155 Ų | 155 | 148 Ų | 148 | 83% | 0.829 | 81% | 0.805 | S | S | * | * | trans | -81.2 | 156.3 | 175.9 | -72.6 | -76.5 | 0 | 0 | 0 | 112 | ||||
| 187 | N | 36.7 | Very low | 43.2 | Very low | 154 Ų | 154 | 144.2 Ų | 144.2 | 82% | 0.824 | 80% | 0.8 | S | S | * | * | trans | 66.2 | 92.5 | 148.9 | -169.5 | 42 | 0 | 0 | 0 | 118.1 | ||||
| 188 | L | 41.2 | Very low | 43.5 | Very low | 156 Ų | 156 | 142.7 Ų | 142.7 | 82% | 0.817 | 80% | 0.799 | S | S | * | * | trans | -144.6 | 110.4 | 145.5 | -164.4 | 65.2 | 0 | 0 | 0 | 112.2 | ||||
| 189 | E | 40 | Very low | 44.4 | Very low | 166 Ų | 166 | 140.9 Ų | 140.9 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | 39.5 | 139.4 | 135 | -148.7 | 154.9 | -140.5 | 0 | 0 | 122.1 | A191 | E189-A191 PolarHBondContact O-N 2.98Š| ||
| 190 | L | 35.8 | Very low | 45.7 | Very low | 166 Ų | 166 | 144.2 Ų | 144.2 | 87% | 0.869 | 79% | 0.792 | S | S | * | * | trans | -71.2 | 109.3 | -179.6 | -76.4 | 71.6 | 0 | 0 | 0 | 112.2 | ||||
| 191 | A | 41.2 | Very low | 46.3 | Very low | 88 Ų | 88 | 143.9 Ų | 143.9 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -109.2 | 120.3 | 159.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | E189 E193 | E189-A191 PolarHBondContact O-N 2.98Å; A191-E193 PolarHBondContact O-N 3.38Å | ||
| 192 | N | 37.7 | Very low | 47.7 | Very low | 164 Ų | 164 | 140.1 Ų | 140.1 | 88% | 0.877 | 78% | 0.782 | S | S | * | * | trans | -84.6 | 96.2 | 174.4 | -71 | -58.9 | 0 | 0 | 0 | 109.9 | ||||
| 193 | E | 47.1 | Very low | 49.4 | Very low | 183 Ų | 183 | 142 Ų | 142 | 86% | 0.855 | 78% | 0.783 | S | S | * | * | trans | -110.9 | 142.6 | 163 | -71.2 | -158.6 | 127.3 | 0 | 0 | 111.5 | A191 T195 | A191-E193 PolarHBondContact O-N 3.38Å; E193-T195 PolarHBondContact O-N 2.88Å | ||
| 194 | G | 38.6 | Very low | 50.7 | Low | 79 Ų | 79 | 144.8 Ų | 144.8 | 81% | 0.814 | 78% | 0.778 | S | S | * | * | trans | -84.8 | 92.2 | -165.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | E196 | G194-E196 PolarHBondContact O-N 2.93Š| ||
| 195 | T | 48.1 | Very low | 52.1 | Low | 136 Ų | 136 | 146 Ų | 146 | 83% | 0.834 | 78% | 0.776 | S | S | * | * | trans | -80.7 | 102.7 | 161.7 | 49.5 | 0 | 0 | 0 | 0 | 109.6 | E193 G197 | E193-T195 PolarHBondContact O-N 2.88Å; T195-G197 PolarHBondContact O-N 3.13Å | ||
| 196 | E | 48.9 | Very low | 53.3 | Low | 173 Ų | 173 | 140.8 Ų | 140.8 | 81% | 0.808 | 76% | 0.763 | S | S | * | * | trans | -73.2 | 68 | 175.9 | -66.2 | -157.7 | 130.9 | 0 | 0 | 111.7 | G194 V198 | G194-E196 PolarHBondContact O-N 2.93Å; E196-V198 PolarHBondContact O-N 3.21Å; E196-V198 VanDerWaalsContact O-N 3.15Å | ||
| 197 | G | 53.7 | Low | 54.9 | Low | 65 Ų | 65 | 137 Ų | 137 | 67% | 0.67 | 75% | 0.746 | S | S | * | * | trans | -59.2 | 115.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | T195 S199 | T195-G197 PolarHBondContact O-N 3.13Å; G197-S199 PolarHBondContact O-N 3.09Å | ||
| 198 | V | 52.2 | Low | 56.7 | Low | 146 Ų | 146 | 134.9 Ų | 134.9 | 89% | 0.885 | 74% | 0.74 | S | S | * | * | trans | -73.9 | 70 | -167.6 | -141.6 | 0 | 0 | 0 | 0 | 112.2 | E196 F200 | E196-V198 PolarHBondContact O-N 3.21Å; E196-V198 VanDerWaalsContact O-N 3.15Å; V198-F200 PolarHBondContact O-N 3.16Å | ||
| 199 | S | 63.5 | Low | 58.4 | Low | 73 Ų | 73 | 133 Ų | 133 | 51% | 0.51 | 73% | 0.731 | S | S | . | * | trans | -68.4 | 121.6 | 178.9 | 180 | 0 | 0 | 0 | 0 | 110.9 | G197 F201 S202 | G197-S199 PolarHBondContact O-N 3.09Å; S199-F201 PolarHBondContact O-N 3.41Å; S199-S202 WeakPolarHBondContact O-CB 3.47Å; S199-S202 PolarHBondContact O-N 3.21Å; S199-S202 PolarHBondContact O-OG 2.78Å | ||
| 200 | F | 67.5 | Low | 60 | Low | 177 Ų | 177 | 127.6 Ų | 127.6 | 78% | 0.776 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.1 | -17 | 178.7 | -173.6 | -104.8 | 0 | 0 | 0 | 114.1 | V198 | V198-F200 PolarHBondContact O-N 3.16Š|
| 201 | F | 60.6 | Low | 61.6 | Low | 171 Ų | 171 | 126.9 Ų | 126.9 | 75% | 0.75 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.3 | 9.6 | 179.3 | -86 | -85.4 | 0 | 0 | 0 | 115.1 | S199 F203 | S199-F201 PolarHBondContact O-N 3.41Å; F201-F203 PolarHBondContact O-N 2.61Å |
| 202 | S | 73.3 | Confident | 63.1 | Low | 76 Ų | 76 | 129.3 Ų | 129.3 | 53% | 0.531 | 70% | 0.696 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -70.5 | 14.1 | -175.5 | 61.6 | 0 | 0 | 0 | 0 | 116.7 | S199 Y204 | S199-S202 WeakPolarHBondContact O-CB 3.47Å; S199-S202 PolarHBondContact O-N 3.21Å; S199-S202 PolarHBondContact O-OG 2.78Å; S202-Y204 PolarHBondContact O-N 2.67Å; S202-Y204 VanDerWaalsContact O-N 3.11Å |
| 203 | F | 74 | Confident | 64.8 | Low | 195 Ų | 195 | 124.2 Ų | 124.2 | 86% | 0.855 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | -11.4 | -177.7 | -84.8 | -82.1 | 0 | 0 | 0 | 115.6 | F201 | F201-F203 PolarHBondContact O-N 2.61Š|
| 204 | Y | 70.2 | Confident | 66.2 | Low | 170 Ų | 170 | 120.2 Ų | 120.2 | 67% | 0.667 | 66% | 0.664 | S | S | * | * | trans | -119.6 | 100.2 | 179.3 | -159 | -96 | 0 | 0 | 0 | 111.4 | S202 P206 N210 | S202-Y204 PolarHBondContact O-N 2.67Å; S202-Y204 VanDerWaalsContact O-N 3.11Å; Y204-P206 HydrophobicContact CD1-CG 4.16Å; Y204-P206 HydrophobicContact CE1-CB 4.47Å; Y204-P206 HydrophobicContact CE1-CG 4.3Å; Y204-P206 WeakPolarHBondContact O-CD 3.3Å; Y204-N210 PolarHBondContact OH-ND2 2.96Å | ||
| 205 | K | 73.3 | Confident | 68 | Low | 168 Ų | 168 | 119 Ų | 119 | 73% | 0.73 | 65% | 0.646 | S | S | * | * | trans | -92.7 | 110.3 | 166.6 | -66.6 | -168.3 | 177.1 | -171.5 | 0 | 108.5 | T207 | K205-T207 PolarHBondContact O-N 2.8Š| ||
| 206 | P | 73.6 | Confident | 69.4 | Low | 96 Ų | 96 | 116.2 Ų | 116.2 | 62% | 0.623 | 63% | 0.632 | S | S | * | * | trans | -63.6 | 126.3 | -178.8 | -21.4 | 33.4 | 0 | 0 | 0 | 111.4 | Y204 | Y204-P206 HydrophobicContact CD1-CG 4.16Å; Y204-P206 HydrophobicContact CE1-CB 4.47Å; Y204-P206 HydrophobicContact CE1-CG 4.3Å; Y204-P206 WeakPolarHBondContact O-CD 3.3Å | ||
| 207 | T | 76.4 | Confident | 70.6 | Confident | 75 Ų | 75 | 114.8 Ų | 114.8 | 46% | 0.46 | 63% | 0.626 | S | S | . | * | trans | -75.5 | 155.9 | 170.7 | 57.5 | 0 | 0 | 0 | 0 | 110.1 | K205 N209 N210 | K205-T207 PolarHBondContact O-N 2.8Å; T207-N209 PolarHBondContact O-N 3.26Å; T207-N210 WeakPolarHBondContact O-CB 3.36Å; T207-N210 PolarHBondContact O-N 3.4Å; T207-N210 PolarHBondContact OG1-ND2 2.82Å; T207-N210 PolarHBondContact OG1-OD1 2.82Å | ||
| 208 | P | 74.7 | Confident | 71.7 | Confident | 109 Ų | 109 | 121 Ų | 121 | 71% | 0.708 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -56.6 | -35.4 | -179.8 | 19.1 | -31.7 | 0 | 0 | 0 | 113.4 | N210 H211 E212 | P208-N210 PolarHBondContact O-N 3.44Å; P208-H211 PolarHBondContact O-N 2.93Å; P208-H211 VanDerWaalsContact O-N 3.08Å; P208-E212 PolarHBondContact O-N 2.96Å; P208-E212 VanDerWaalsContact O-N 3.16Å |
| 209 | N | 75.5 | Confident | 72.8 | Confident | 117 Ų | 117 | 116.3 Ų | 116.3 | 63% | 0.626 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -54.8 | -33.4 | 172.9 | -79.7 | 28.5 | 0 | 0 | 0 | 113.3 | T207 E212 A213 | T207-N209 PolarHBondContact O-N 3.26Å; N209-E212 PolarHBondContact O-N 3.44Å; N209-A213 VanDerWaalsContact O-CB 3.3Å; N209-A213 WeakPolarHBondContact O-CB 3.34Å; N209-A213 PolarHBondContact O-N 2.94Å |
| 210 | N | 73.7 | Confident | 73.4 | Confident | 52 Ų | 52 | 115.6 Ų | 115.6 | 28% | 0.278 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -70.8 | -35.2 | -179.6 | -62.3 | -10.7 | 0 | 0 | 0 | 111.2 | Y204 T207 P208 V214 | Y204-N210 PolarHBondContact OH-ND2 2.96Å; T207-N210 WeakPolarHBondContact O-CB 3.36Å; T207-N210 PolarHBondContact O-N 3.4Å; T207-N210 PolarHBondContact OG1-ND2 2.82Å; T207-N210 PolarHBondContact OG1-OD1 2.82Å; P208-N210 PolarHBondContact O-N 3.44Å; N210-V214 WeakPolarHBondContact O-CG2 3.48Å; N210-V214 PolarHBondContact O-N 2.94Å; N210-V214 VanDerWaalsContact O-N 3.1Å |
| 211 | H | 69.6 | Low | 73.7 | Confident | 151 Ų | 151 | 109.8 Ų | 109.8 | 70% | 0.699 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -69.3 | -40.4 | 175.6 | -170.3 | -88.6 | 0 | 0 | 0 | 111.2 | P208 A215 | P208-H211 PolarHBondContact O-N 2.93Å; P208-H211 VanDerWaalsContact O-N 3.08Å; H211-A215 WeakPolarHBondContact O-CB 3.27Å; H211-A215 PolarHBondContact O-N 3.29Å |
| 212 | E | 73.6 | Confident | 74.2 | Confident | 139 Ų | 139 | 106.7 Ų | 106.7 | 65% | 0.65 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.5 | -41.5 | 174.5 | -171.1 | 172.6 | -176.3 | 0 | 0 | 112.3 | P208 N209 A215 S216 | P208-E212 PolarHBondContact O-N 2.96Å; P208-E212 VanDerWaalsContact O-N 3.16Å; N209-E212 PolarHBondContact O-N 3.44Å; E212-A215 PolarHBondContact O-N 3.22Å; E212-S216 VanDerWaalsContact O-CB 3.28Å; E212-S216 WeakPolarHBondContact O-CB 3.35Å; E212-S216 PolarHBondContact O-N 3.29Å |
| 213 | A | 72.9 | Confident | 74.1 | Confident | 57 Ų | 57 | 108.9 Ų | 108.9 | 47% | 0.471 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -59.6 | -48 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | N209 A215 S216 E217 | N209-A213 VanDerWaalsContact O-CB 3.3Å; N209-A213 WeakPolarHBondContact O-CB 3.34Å; N209-A213 PolarHBondContact O-N 2.94Å; A213-A215 PolarHBondContact O-N 2.83Å; A213-S216 PolarHBondContact O-N 2.56Å; A213-E217 PolarHBondContact O-N 3.14Å |
| 214 | V | 75.9 | Confident | 73.6 | Confident | 99 Ų | 99 | 102.5 Ų | 102.5 | 60% | 0.6 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.7 | -38.3 | 177.2 | 171 | 0 | 0 | 0 | 0 | 111.6 | N210 R218 | N210-V214 WeakPolarHBondContact O-CG2 3.48Å; N210-V214 PolarHBondContact O-N 2.94Å; N210-V214 VanDerWaalsContact O-N 3.1Å; V214-R218 VanDerWaalsContact O-CB 3.29Å; V214-R218 WeakPolarHBondContact O-CB 3.34Å; V214-R218 PolarHBondContact O-N 3.46Å |
| 215 | A | 76.7 | Confident | 73.1 | Confident | 53 Ų | 53 | 98.8 Ų | 98.8 | 44% | 0.438 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.3 | -41.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | H211 E212 A213 R218 A219 | H211-A215 WeakPolarHBondContact O-CB 3.27Å; H211-A215 PolarHBondContact O-N 3.29Å; E212-A215 PolarHBondContact O-N 3.22Å; A213-A215 PolarHBondContact O-N 2.83Å; A215-R218 PolarHBondContact O-N 3.44Å; A215-A219 WeakPolarHBondContact O-CB 3.27Å; A215-A219 PolarHBondContact O-N 3.09Å |
| 216 | S | 78.8 | Confident | 72.4 | Confident | 78 Ų | 78 | 99.6 Ų | 99.6 | 55% | 0.545 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65.9 | -45.4 | 178.6 | -171.3 | 0 | 0 | 0 | 0 | 112.1 | E212 A213 R218 A219 A220 | E212-S216 VanDerWaalsContact O-CB 3.28Å; E212-S216 WeakPolarHBondContact O-CB 3.35Å; E212-S216 PolarHBondContact O-N 3.29Å; A213-S216 PolarHBondContact O-N 2.56Å; S216-R218 PolarHBondContact O-N 2.83Å; S216-A219 PolarHBondContact O-N 2.88Å; S216-A220 WeakPolarHBondContact O-CB 3.5Å; S216-A220 PolarHBondContact O-N 3.42Å |
| 217 | E | 73.7 | Confident | 71.6 | Confident | 144 Ų | 144 | 101.9 Ų | 101.9 | 67% | 0.673 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -62.7 | -42.5 | 175.2 | -173.5 | 174.4 | -172.6 | 0 | 0 | 111.6 | A213 A219 A220 A221 | A213-E217 PolarHBondContact O-N 3.14Å; E217-A219 VanDerWaalsContact C-N 3.31Å; E217-A219 PolarHBondContact O-N 3.35Å; E217-A220 PolarHBondContact O-N 3.31Å; E217-A221 PolarHBondContact O-N 2.88Å |
| 218 | R | 75.2 | Confident | 70.6 | Confident | 194 Ų | 194 | 106.2 Ų | 106.2 | 73% | 0.732 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -63 | -36.9 | 175.6 | -163.3 | 178.4 | -167.3 | -166.3 | 5 | 112.2 | V214 A215 S216 L222 | V214-R218 VanDerWaalsContact O-CB 3.29Å; V214-R218 WeakPolarHBondContact O-CB 3.34Å; V214-R218 PolarHBondContact O-N 3.46Å; A215-R218 PolarHBondContact O-N 3.44Å; S216-R218 PolarHBondContact O-N 2.83Å; R218-L222 WeakPolarHBondContact O-CG 3.07Å; R218-L222 PolarHBondContact O-N 3.5Å |
| 219 | A | 76.9 | Confident | 69.5 | Low | 49 Ų | 49 | 104.4 Ų | 104.4 | 41% | 0.405 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -69.5 | -41.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | A215 S216 E217 L222 Q223 | A215-A219 WeakPolarHBondContact O-CB 3.27Å; A215-A219 PolarHBondContact O-N 3.09Å; S216-A219 PolarHBondContact O-N 2.88Å; E217-A219 VanDerWaalsContact C-N 3.31Å; E217-A219 PolarHBondContact O-N 3.35Å; A219-L222 PolarHBondContact O-N 2.76Å; A219-Q223 PolarHBondContact O-N 3.47Å |
| 220 | A | 75.6 | Confident | 68.3 | Low | 57 Ų | 57 | 106.2 Ų | 106.2 | 47% | 0.471 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -62 | -42.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | S216 E217 L222 Q223 A224 | S216-A220 WeakPolarHBondContact O-CB 3.5Å; S216-A220 PolarHBondContact O-N 3.42Å; E217-A220 PolarHBondContact O-N 3.31Å; A220-L222 VanDerWaalsContact C-N 3.33Å; A220-L222 PolarHBondContact O-N 3.21Å; A220-Q223 PolarHBondContact O-N 3.06Å; A220-A224 WeakPolarHBondContact O-CB 3.47Å; A220-A224 PolarHBondContact O-N 3.04Å |
| 221 | A | 73.2 | Confident | 67.1 | Low | 56 Ų | 56 | 111.3 Ų | 111.3 | 46% | 0.463 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -60.8 | -38.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | E217 A224 T225 | E217-A221 PolarHBondContact O-N 2.88Å; A221-A224 PolarHBondContact O-N 3.12Å; A221-T225 WeakPolarHBondContact O-CG2 3.43Å; A221-T225 PolarHBondContact O-N 3.41Å; A221-T225 PolarHBondContact O-OG1 2.88Å; A221-T225 VanDerWaalsContact O-OG1 3.08Å |
| 222 | L | 71 | Confident | 65.8 | Low | 105 Ų | 105 | 109.3 Ų | 109.3 | 55% | 0.55 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -70.4 | -30.5 | 175 | -73.5 | 168.8 | 0 | 0 | 0 | 113.1 | R218 A219 A220 T225 R226 | R218-L222 WeakPolarHBondContact O-CG 3.07Å; R218-L222 PolarHBondContact O-N 3.5Å; A219-L222 PolarHBondContact O-N 2.76Å; A220-L222 VanDerWaalsContact C-N 3.33Å; A220-L222 PolarHBondContact O-N 3.21Å; L222-T225 PolarHBondContact O-OG1 3.4Å; L222-R226 WeakPolarHBondContact O-CG 3.45Å; L222-R226 PolarHBondContact O-N 2.69Å |
| 223 | Q | 70.8 | Confident | 64.2 | Low | 122 Ų | 122 | 107.5 Ų | 107.5 | 57% | 0.57 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -75.2 | -37.6 | 171.2 | -68.8 | -165.6 | 25.1 | 0 | 0 | 112.4 | A219 A220 R226 K227 | A219-Q223 PolarHBondContact O-N 3.47Å; A220-Q223 PolarHBondContact O-N 3.06Å; Q223-R226 PolarHBondContact O-N 3.09Å; Q223-K227 PolarHBondContact O-N 3.29Å |
| 224 | A | 64.5 | Low | 62.8 | Low | 62 Ų | 62 | 114.3 Ų | 114.3 | 51% | 0.512 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -63.4 | -42.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A220 A221 K228 | A220-A224 WeakPolarHBondContact O-CB 3.47Å; A220-A224 PolarHBondContact O-N 3.04Å; A221-A224 PolarHBondContact O-N 3.12Å; A224-K228 PolarHBondContact O-N 2.92Å; A224-K228 VanDerWaalsContact O-N 3.16Å |
| 225 | T | 60.2 | Low | 61 | Low | 91 Ų | 91 | 115.3 Ų | 115.3 | 56% | 0.558 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -66.2 | -39.5 | 175.1 | 49.2 | 0 | 0 | 0 | 0 | 112.4 | A221 L222 K228 A229 | A221-T225 WeakPolarHBondContact O-CG2 3.43Å; A221-T225 PolarHBondContact O-N 3.41Å; A221-T225 PolarHBondContact O-OG1 2.88Å; A221-T225 VanDerWaalsContact O-OG1 3.08Å; L222-T225 PolarHBondContact O-OG1 3.4Å; T225-K228 PolarHBondContact O-N 3.23Å; T225-A229 PolarHBondContact O-N 3.42Å |
| 226 | R | 58.1 | Low | 59.3 | Low | 186 Ų | 186 | 118.7 Ų | 118.7 | 70% | 0.702 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -62.6 | -48.6 | 173.8 | -78.5 | 177.4 | 170.4 | 165.7 | -2 | 112.9 | L222 Q223 K228 A229 E230 | L222-R226 WeakPolarHBondContact O-CG 3.45Å; L222-R226 PolarHBondContact O-N 2.69Å; Q223-R226 PolarHBondContact O-N 3.09Å; R226-K228 PolarHBondContact O-N 3.16Å; R226-A229 WeakPolarHBondContact O-CB 3.37Å; R226-A229 PolarHBondContact O-N 3.45Å; R226-E230 PolarHBondContact O-N 3.45Å |
| 227 | K | 57.7 | Low | 57.2 | Low | 143 Ų | 143 | 121.2 Ų | 121.2 | 62% | 0.622 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -64.3 | -23.6 | 178 | -74.1 | -173.7 | 175.2 | -179.5 | 0 | 113.6 | Q223 A229 | Q223-K227 PolarHBondContact O-N 3.29Å; K227-A229 VanDerWaalsContact C-N 3.33Å |
| 228 | K | 54.9 | Low | 55.5 | Low | 166 Ų | 166 | 120.4 Ų | 120.4 | 72% | 0.722 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -78.1 | -14.7 | 172.6 | -129.4 | 171.3 | -175.5 | 177.1 | 0 | 113.3 | A224 T225 R226 | A224-K228 PolarHBondContact O-N 2.92Å; A224-K228 VanDerWaalsContact O-N 3.16Å; T225-K228 PolarHBondContact O-N 3.23Å; R226-K228 PolarHBondContact O-N 3.16Å |
| 229 | A | 51.6 | Low | 54 | Low | 71 Ų | 71 | 118.7 Ų | 118.7 | 59% | 0.587 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -87.8 | -36.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | T225 R226 K227 L231 | T225-A229 PolarHBondContact O-N 3.42Å; R226-A229 WeakPolarHBondContact O-CB 3.37Å; R226-A229 PolarHBondContact O-N 3.45Å; K227-A229 VanDerWaalsContact C-N 3.33Å; A229-L231 VanDerWaalsContact C-N 3.31Å; A229-L231 PolarHBondContact O-N 3.12Å |
| 230 | E | 50.9 | Low | 52 | Low | 156 Ų | 156 | 123.8 Ų | 123.8 | 73% | 0.729 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | -16.4 | -174.9 | -68.4 | -179.4 | 119 | 0 | 0 | 114.6 | R226 | R226-E230 PolarHBondContact O-N 3.45Š|
| 231 | L | 48.5 | Very low | 50.6 | Low | 158 Ų | 158 | 129.8 Ų | 129.8 | 83% | 0.827 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 1.1 | -177.2 | -74 | 166.6 | 0 | 0 | 0 | 114.5 | A229 S233 | A229-L231 VanDerWaalsContact C-N 3.31Å; A229-L231 PolarHBondContact O-N 3.12Å; L231-S233 PolarHBondContact O-N 3.1Å |
| 232 | S | 40.8 | Very low | 48.9 | Very low | 109 Ų | 109 | 133.9 Ų | 133.9 | 76% | 0.762 | 72% | 0.722 | S | S | * | * | trans | -103.3 | 61.2 | -173.5 | -155.8 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 233 | S | 40.5 | Very low | 47.7 | Very low | 102 Ų | 102 | 134.5 Ų | 134.5 | 71% | 0.713 | 74% | 0.736 | S | S | * | * | trans | -137.9 | 48 | -173.5 | 56.1 | 0 | 0 | 0 | 0 | 114.5 | L231 | L231-S233 PolarHBondContact O-N 3.1Š| ||
| 234 | K | 42.7 | Very low | 45.9 | Very low | 200 Ų | 200 | 136.2 Ų | 136.2 | 87% | 0.87 | 75% | 0.749 | S | S | * | * | trans | -150.4 | 128.7 | 168.7 | -104.3 | 161.8 | -174.9 | 173.4 | 0 | 111.6 | ||||
| 235 | P | 39.1 | Very low | 44.8 | Very low | 120 Ų | 120 | 138.3 Ų | 138.3 | 78% | 0.779 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 146.6 | 171.9 | 33.4 | -33.5 | 0 | 0 | 0 | 111.1 | ||
| 236 | P | 40.2 | Very low | 43.4 | Very low | 124 Ų | 124 | 143.2 Ų | 143.2 | 81% | 0.805 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 138.4 | 173.3 | 32.8 | -32.7 | 0 | 0 | 0 | 111.7 | ||
| 237 | T | 34.5 | Very low | 42.5 | Very low | 131 Ų | 131 | 141.6 Ų | 141.6 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 146 | 164 | -56 | 0 | 0 | 0 | 0 | 109.7 | ||
| 238 | V | 39.6 | Very low | 41.2 | Very low | 127 Ų | 127 | 138.9 Ų | 138.9 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 138.2 | 173.4 | -72.9 | 0 | 0 | 0 | 0 | 111.1 | ||
| 239 | D | 42.9 | Very low | 40.4 | Very low | 158 Ų | 158 | 136.4 Ų | 136.4 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | trans | -143.5 | 135.1 | 153.3 | -82.5 | -53.1 | 0 | 0 | 0 | 107.2 | ||||
| 240 | N | 35.6 | Very low | 39.5 | Very low | 155 Ų | 155 | 142.5 Ų | 142.5 | 83% | 0.829 | 79% | 0.793 | S | S | * | * | trans | -93.3 | 152.5 | 170.7 | -65 | -54.6 | 0 | 0 | 0 | 108.8 | ||||
| 241 | E | 45.7 | Very low | 38.9 | Very low | 183 Ų | 183 | 142.7 Ų | 142.7 | 86% | 0.855 | 80% | 0.798 | S | S | * | * | trans | -149.7 | 150 | 140 | -95.9 | -47.3 | 148 | 0 | 0 | 110.1 | ||||
| 242 | D | 36.3 | Very low | 38.5 | Very low | 142 Ų | 142 | 139.8 Ų | 139.8 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | trans | -83.1 | 143.3 | -172.7 | -81.2 | -56.3 | 0 | 0 | 0 | 113.3 | ||||
| 243 | S | 46.2 | Very low | 38.1 | Very low | 119 Ų | 119 | 143.1 Ų | 143.1 | 83% | 0.832 | 80% | 0.795 | S | S | * | * | trans | -169.9 | 98.2 | 150.4 | -87.6 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 244 | N | 33.4 | Very low | 38.1 | Very low | 157 Ų | 157 | 145.4 Ų | 145.4 | 84% | 0.84 | 80% | 0.799 | S | S | * | * | trans | -71.2 | 126.9 | 163.3 | -87.7 | -61.9 | 0 | 0 | 0 | 110.4 | ||||
| 245 | S | 41.9 | Very low | 37.9 | Very low | 107 Ų | 107 | 144.1 Ų | 144.1 | 75% | 0.748 | 80% | 0.796 | S | S | * | * | trans | -134.8 | 120.8 | 161.4 | 56.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 246 | F | 30.9 | Very low | 38.1 | Very low | 194 Ų | 194 | 146.4 Ų | 146.4 | 85% | 0.851 | 80% | 0.802 | S | S | * | * | trans | -77 | 127.6 | 178.5 | -91.3 | -121.7 | 0 | 0 | 0 | 110.4 | ||||
| 247 | I | 37.7 | Very low | 37.7 | Very low | 152 Ų | 152 | 145 Ų | 145 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | trans | -125.6 | 91.5 | 157.3 | -57.3 | -176.2 | 0 | 0 | 0 | 108.5 | V249 | I247-V249 HydrophobicContact CG2-CG2 4.2Å; I247-V249 PolarHBondContact O-N 3.42Å | ||
| 248 | A | 30.8 | Very low | 37.9 | Very low | 85 Ų | 85 | 144.4 Ų | 144.4 | 70% | 0.702 | 79% | 0.791 | S | S | * | * | trans | -81 | 96.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | K250 | A248-K250 PolarHBondContact O-N 2.71Š| ||
| 249 | V | 37.8 | Very low | 37.8 | Very low | 115 Ų | 115 | 144.1 Ų | 144.1 | 70% | 0.697 | 79% | 0.79 | S | S | * | * | trans | -73.7 | 98.5 | 174 | -178.1 | 0 | 0 | 0 | 0 | 109.4 | I247 L251 | I247-V249 HydrophobicContact CG2-CG2 4.2Å; I247-V249 PolarHBondContact O-N 3.42Å; V249-L251 HydrophobicContact CG1-CG 4.45Å; V249-L251 PolarHBondContact O-N 3.03Å | ||
| 250 | K | 32.8 | Very low | 37.9 | Very low | 199 Ų | 199 | 143.1 Ų | 143.1 | 87% | 0.865 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -66 | 122 | 163.8 | -67 | 177.9 | 178.2 | 178.6 | 0 | 108.6 | A248 | A248-K250 PolarHBondContact O-N 2.71Š|
| 251 | L | 39.1 | Very low | 37.9 | Very low | 159 Ų | 159 | 146.2 Ų | 146.2 | 83% | 0.832 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -103.8 | 128.2 | 158 | -74.3 | 169.9 | 0 | 0 | 0 | 107.5 | V249 | V249-L251 HydrophobicContact CG1-CG 4.45Å; V249-L251 PolarHBondContact O-N 3.03Å |
| 252 | S | 40.1 | Very low | 37.9 | Very low | 97 Ų | 97 | 145.2 Ų | 145.2 | 68% | 0.678 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -71 | 143 | -178.1 | 39.6 | 0 | 0 | 0 | 0 | 111.4 | ||
| 253 | H | 31.8 | Very low | 38.5 | Very low | 180 Ų | 180 | 142.8 Ų | 142.8 | 83% | 0.833 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 124.4 | 151.8 | -79.4 | -109.3 | 0 | 0 | 0 | 107.6 | ||
| 254 | D | 41.1 | Very low | 38.5 | Very low | 150 Ų | 150 | 142.1 Ų | 142.1 | 80% | 0.802 | 78% | 0.776 | S | S | * | * | trans | -110.8 | 124.9 | 155.6 | -80.2 | -59.9 | 0 | 0 | 0 | 107.3 | ||||
| 255 | E | 37.6 | Very low | 39.6 | Very low | 172 Ų | 172 | 142.2 Ų | 142.2 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | -86.7 | 137.6 | -176.5 | -58.9 | -165.9 | 159.7 | 0 | 0 | 111.1 | ||||
| 256 | N | 44 | Very low | 39.9 | Very low | 169 Ų | 169 | 139.6 Ų | 139.6 | 90% | 0.904 | 75% | 0.751 | S | S | * | * | trans | -141.3 | 104.1 | 155.5 | -106.6 | -52.2 | 0 | 0 | 0 | 109.5 | ||||
| 257 | S | 31.9 | Very low | 40.8 | Very low | 95 Ų | 95 | 140.3 Ų | 140.3 | 66% | 0.664 | 75% | 0.748 | S | S | * | * | trans | -78.3 | 119.9 | -176.6 | -177.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 258 | T | 38.7 | Very low | 41.7 | Very low | 117 Ų | 117 | 140 Ų | 140 | 72% | 0.718 | 74% | 0.743 | S | S | * | * | trans | -139.2 | 78.4 | 157.7 | -58.3 | 0 | 0 | 0 | 0 | 108.5 | N260 | T258-N260 VanDerWaalsContact C-N 3.26Å; T258-N260 PolarHBondContact O-N 3.39Å | ||
| 259 | T | 38 | Very low | 42.9 | Very low | 121 Ų | 121 | 142.5 Ų | 142.5 | 74% | 0.742 | 74% | 0.74 | S | S | * | * | trans | -76.4 | 71.4 | -178.9 | 50.7 | 0 | 0 | 0 | 0 | 112.1 | R261 | T259-R261 PolarHBondContact O-N 3.2Š| ||
| 260 | N | 43.6 | Very low | 43.3 | Very low | 137 Ų | 137 | 141.9 Ų | 141.9 | 73% | 0.733 | 74% | 0.74 | S | S | * | * | trans | -69.1 | 79.9 | 169.5 | -86.6 | -8.2 | 0 | 0 | 0 | 110.5 | T258 L262 | T258-N260 VanDerWaalsContact C-N 3.26Å; T258-N260 PolarHBondContact O-N 3.39Å; N260-L262 PolarHBondContact O-N 3.2Å | ||
| 261 | R | 35.6 | Very low | 44.3 | Very low | 221 Ų | 221 | 137 Ų | 137 | 83% | 0.834 | 72% | 0.723 | S | S | * | * | trans | -71 | 73 | 176.6 | -170.1 | -170.1 | -174.4 | -164.1 | 2.6 | 110.5 | T259 T263 | T259-R261 PolarHBondContact O-N 3.2Å; R261-T263 VanDerWaalsContact C-N 3.34Å; R261-T263 PolarHBondContact O-N 2.76Å | ||
| 262 | L | 46.8 | Very low | 45.2 | Very low | 162 Ų | 162 | 134.4 Ų | 134.4 | 85% | 0.848 | 72% | 0.716 | S | S | * | * | trans | -67.3 | 94.1 | 168.5 | -66.3 | 177.6 | 0 | 0 | 0 | 108.7 | N260 A264 | N260-L262 PolarHBondContact O-N 3.2Å; L262-A264 PolarHBondContact O-N 2.66Å | ||
| 263 | T | 49.4 | Very low | 46 | Very low | 91 Ų | 91 | 136.6 Ų | 136.6 | 56% | 0.558 | 71% | 0.713 | S | S | * | * | trans | -64.1 | 118.6 | 168.9 | 50.5 | 0 | 0 | 0 | 0 | 108.5 | R261 K265 | R261-T263 VanDerWaalsContact C-N 3.34Å; R261-T263 PolarHBondContact O-N 2.76Å; T263-K265 PolarHBondContact O-N 3.28Å | ||
| 264 | A | 46.1 | Very low | 46.9 | Very low | 105 Ų | 105 | 133.1 Ų | 133.1 | 87% | 0.868 | 70% | 0.704 | S | S | * | * | trans | -60.8 | 105.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | L262 | L262-A264 PolarHBondContact O-N 2.66Š| ||
| 265 | K | 55.4 | Low | 47.5 | Very low | 158 Ų | 158 | 130.6 Ų | 130.6 | 69% | 0.687 | 69% | 0.694 | S | S | * | * | trans | -73.2 | 139.3 | 163.6 | -60.4 | -174.7 | 179.1 | -173.6 | 0 | 107.3 | T263 W267 | T263-K265 PolarHBondContact O-N 3.28Å; K265-W267 PolarHBondContact O-N 3.35Å | ||
| 266 | S | 48 | Very low | 48.6 | Very low | 52 Ų | 52 | 128.2 Ų | 128.2 | 36% | 0.364 | 69% | 0.686 | S | S | . | * | trans | -63.5 | 139.4 | 177.1 | -173.3 | 0 | 0 | 0 | 0 | 110 | E268 E269 | S266-E268 WeakPolarHBondContact CB-OE2 3.31Å; S266-E268 PolarHBondContact O-N 2.94Å; S266-E268 VanDerWaalsContact O-N 3.12Å; S266-E268 VanDerWaalsContact OG-CD 3.25Å; S266-E268 WeakPolarHBondContact OG-CG 3.38Å; S266-E268 PolarHBondContact OG-N 3.26Å; S266-E268 PolarHBondContact OG-OE2 2.68Å; S266-E269 PolarHBondContact O-N 3.49Å | ||
| 267 | W | 49.6 | Very low | 49.4 | Very low | 210 Ų | 210 | 126.7 Ų | 126.7 | 80% | 0.795 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -56.5 | -26.8 | 173.6 | -168.9 | -82.2 | 0 | 0 | 0 | 111.6 | K265 E269 C270 | K265-W267 PolarHBondContact O-N 3.35Å; W267-E269 VanDerWaalsContact C-N 3.26Å; W267-E269 PolarHBondContact O-N 3.34Å; W267-C270 PolarHBondContact O-N 3.35Å; W267-C270 VanDerWaalsContact O-N 3.1Å |
| 268 | E | 56.8 | Low | 51.1 | Low | 144 Ų | 144 | 126 Ų | 126 | 67% | 0.673 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -61.6 | -25.7 | 176.3 | -58.6 | 159.5 | 140.1 | 0 | 0 | 113.6 | S266 K273 | S266-E268 WeakPolarHBondContact CB-OE2 3.31Å; S266-E268 PolarHBondContact O-N 2.94Å; S266-E268 VanDerWaalsContact O-N 3.12Å; S266-E268 VanDerWaalsContact OG-CD 3.25Å; S266-E268 WeakPolarHBondContact OG-CG 3.38Å; S266-E268 PolarHBondContact OG-N 3.26Å; S266-E268 PolarHBondContact OG-OE2 2.68Å; E268-K273 PolarHBondContact O-NZ 2.99Å |
| 269 | E | 55.8 | Low | 53 | Low | 138 Ų | 138 | 125 Ų | 125 | 65% | 0.645 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -75.3 | -33 | 173.9 | -72.8 | -164.3 | 129.5 | 0 | 0 | 112.1 | S266 W267 L271 K273 | S266-E269 PolarHBondContact O-N 3.49Å; W267-E269 VanDerWaalsContact C-N 3.26Å; W267-E269 PolarHBondContact O-N 3.34Å; E269-L271 VanDerWaalsContact C-N 3.35Å; E269-L271 PolarHBondContact O-N 3.35Å; E269-K273 PolarHBondContact O-NZ 3.48Å |
| 270 | C | 48.2 | Very low | 54.8 | Low | 102 Ų | 102 | 124 Ų | 124 | 69% | 0.689 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -77.9 | -13.4 | -175.8 | -65.7 | 0 | 0 | 0 | 0 | 114.5 | W267 | W267-C270 PolarHBondContact O-N 3.35Å; W267-C270 VanDerWaalsContact O-N 3.1Å |
| 271 | L | 53 | Low | 56.3 | Low | 96 Ų | 96 | 120.7 Ų | 120.7 | 50% | 0.503 | 63% | 0.63 | S | S | . | * | S | Bend | trans | -77.9 | 133.7 | 176 | -61.1 | -179.9 | 0 | 0 | 0 | 111.1 | E269 K273 | E269-L271 VanDerWaalsContact C-N 3.35Å; E269-L271 PolarHBondContact O-N 3.35Å; L271-K273 VanDerWaalsContact O-CD 3.31Å; L271-K273 WeakPolarHBondContact O-CD 3.45Å; L271-K273 PolarHBondContact O-NZ 2.69Å |
| 272 | P | 58.1 | Low | 57.9 | Low | 106 Ų | 106 | 114.7 Ų | 114.7 | 69% | 0.688 | 61% | 0.614 | S | S | * | * | trans | -65.3 | 133.5 | 171.4 | 28.3 | -33.6 | 0 | 0 | 0 | 109.8 | V274 | P272-V274 HydrophobicContact CB-CG2 4.4Å; P272-V274 HydrophobicContact CG-CG2 4.43Å; P272-V274 PolarHBondContact O-N 2.74Å | ||
| 273 | K | 56.8 | Low | 59.5 | Low | 143 Ų | 143 | 113.4 Ų | 113.4 | 62% | 0.622 | 60% | 0.598 | S | S | * | * | trans | -81 | 73.6 | 180 | -80.4 | 62.4 | -176.9 | 168.3 | 0 | 108.7 | E268 E269 L271 T275 | E268-K273 PolarHBondContact O-NZ 2.99Å; E269-K273 PolarHBondContact O-NZ 3.48Å; L271-K273 VanDerWaalsContact O-CD 3.31Å; L271-K273 WeakPolarHBondContact O-CD 3.45Å; L271-K273 PolarHBondContact O-NZ 2.69Å; K273-T275 VanDerWaalsContact C-N 3.32Å; K273-T275 PolarHBondContact O-N 3.31Å | ||
| 274 | V | 51.3 | Low | 60.8 | Low | 107 Ų | 107 | 114.9 Ų | 114.9 | 65% | 0.648 | 60% | 0.599 | S | S | * | * | trans | -71.9 | 90.5 | 171.4 | -176.8 | 0 | 0 | 0 | 0 | 108 | P272 I276 | P272-V274 HydrophobicContact CB-CG2 4.4Å; P272-V274 HydrophobicContact CG-CG2 4.43Å; P272-V274 PolarHBondContact O-N 2.74Å; V274-I276 PolarHBondContact O-N 2.88Å | ||
| 275 | T | 53.9 | Low | 61.5 | Low | 97 Ų | 97 | 115.1 Ų | 115.1 | 60% | 0.595 | 58% | 0.583 | S | S | * | * | trans | -73.1 | 120.2 | 172.5 | 49.7 | 0 | 0 | 0 | 0 | 109.1 | K273 N277 | K273-T275 VanDerWaalsContact C-N 3.32Å; K273-T275 PolarHBondContact O-N 3.31Å; T275-N277 PolarHBondContact O-N 3.49Å | ||
| 276 | I | 59.7 | Low | 62.1 | Low | 121 Ų | 121 | 110.8 Ų | 110.8 | 62% | 0.621 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | 6.4 | -176.6 | -59.6 | 166.5 | 0 | 0 | 0 | 112.7 | V274 D278 | V274-I276 PolarHBondContact O-N 2.88Å; I276-D278 VanDerWaalsContact C-N 3.26Å; I276-D278 PolarHBondContact O-N 3.47Å |
| 277 | N | 61.4 | Low | 63.1 | Low | 138 Ų | 138 | 111.4 Ų | 111.4 | 74% | 0.738 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | 8.2 | -177.9 | -60.6 | 0.9 | 0 | 0 | 0 | 113.7 | T275 P279 | T275-N277 PolarHBondContact O-N 3.49Å; N277-P279 WeakPolarHBondContact O-CD 3.48Å |
| 278 | D | 68 | Low | 63.9 | Low | 81 Ų | 81 | 105 Ų | 105 | 43% | 0.433 | 56% | 0.561 | S | S | . | * | trans | -77.9 | 113 | -179.9 | -156.4 | -26.4 | 0 | 0 | 0 | 109.9 | I276 E280 I281 L282 | I276-D278 VanDerWaalsContact C-N 3.26Å; I276-D278 PolarHBondContact O-N 3.47Å; D278-E280 PolarHBondContact O-N 3.33Å; D278-E280 VanDerWaalsContact O-N 3.16Å; D278-I281 HydrophobicContact CB-CD1 3.96Å; D278-I281 HydrophobicContact CB-CG1 4.11Å; D278-I281 PolarHBondContact O-N 2.99Å; D278-I281 VanDerWaalsContact O-N 3.09Å; D278-L282 PolarHBondContact O-N 3.06Å | ||
| 279 | P | 76.8 | Confident | 63.9 | Low | 94 Ų | 94 | 105 Ų | 105 | 61% | 0.61 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -66.3 | -20.3 | -169.4 | 26.5 | -35.7 | 0 | 0 | 0 | 113.5 | N277 R283 | N277-P279 WeakPolarHBondContact O-CD 3.48Å; P279-R283 VanDerWaalsContact O-CB 3.25Å; P279-R283 WeakPolarHBondContact O-CB 3.48Å; P279-R283 PolarHBondContact O-N 3.25Å |
| 280 | E | 77.2 | Confident | 64.1 | Low | 102 Ų | 102 | 104 Ų | 104 | 48% | 0.477 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -68.5 | -42.1 | 173 | -66.5 | -114.8 | 103.4 | 0 | 0 | 111.8 | D278 R283 Q284 | D278-E280 PolarHBondContact O-N 3.33Å; D278-E280 VanDerWaalsContact O-N 3.16Å; E280-R283 PolarHBondContact O-N 3.09Å; E280-R283 IonicContact OE1-CZ 2.78Å; E280-R283 IonicContact OE1-NH1 2.76Å; E280-R283 PolarHBondContact OE1-NH1 2.85Å; E280-R283 IonicContact OE1-NH2 2.61Å; E280-R283 PolarHBondContact OE1-NH2 3.07Å; E280-Q284 WeakPolarHBondContact O-CG 3.42Å; E280-Q284 PolarHBondContact O-N 3.1Å |
| 281 | I | 73.7 | Confident | 64.6 | Low | 67 Ų | 67 | 105.3 Ų | 105.3 | 34% | 0.344 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68.2 | -44 | 179.7 | -58.2 | 178.5 | 0 | 0 | 0 | 109.9 | D278 R283 Q284 M285 | D278-I281 HydrophobicContact CB-CD1 3.96Å; D278-I281 HydrophobicContact CB-CG1 4.11Å; D278-I281 PolarHBondContact O-N 2.99Å; D278-I281 VanDerWaalsContact O-N 3.09Å; I281-R283 VanDerWaalsContact C-N 3.33Å; I281-R283 PolarHBondContact O-N 3.02Å; I281-Q284 PolarHBondContact O-N 2.87Å; I281-M285 WeakPolarHBondContact O-CG 3.42Å; I281-M285 PolarHBondContact O-N 2.94Å |
| 282 | L | 70.9 | Confident | 64.6 | Low | 95 Ų | 95 | 104.8 Ų | 104.8 | 50% | 0.497 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.4 | -42.1 | 173.8 | -100.3 | 161.3 | 0 | 0 | 0 | 111.9 | D278 S286 | D278-L282 PolarHBondContact O-N 3.06Å; L282-S286 WeakPolarHBondContact O-CB 3.44Å; L282-S286 PolarHBondContact O-N 3.16Å; L282-S286 PolarHBondContact O-OG 2.88Å |
| 283 | R | 79 | Confident | 64.2 | Low | 134 Ų | 134 | 103.4 Ų | 103.4 | 51% | 0.506 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62 | -48.2 | 174.8 | -167.2 | 177 | 76.6 | -116.4 | 1.4 | 111.2 | P279 E280 I281 M285 S286 S287 | P279-R283 VanDerWaalsContact O-CB 3.25Å; P279-R283 WeakPolarHBondContact O-CB 3.48Å; P279-R283 PolarHBondContact O-N 3.25Å; E280-R283 PolarHBondContact O-N 3.09Å; E280-R283 IonicContact OE1-CZ 2.78Å; E280-R283 IonicContact OE1-NH1 2.76Å; E280-R283 PolarHBondContact OE1-NH1 2.85Å; E280-R283 IonicContact OE1-NH2 2.61Å; E280-R283 PolarHBondContact OE1-NH2 3.07Å; I281-R283 VanDerWaalsContact C-N 3.33Å; I281-R283 PolarHBondContact O-N 3.02Å; R283-M285 PolarHBondContact O-N 2.94Å; R283-S286 PolarHBondContact O-N 3.42Å; R283-S286 PolarHBondContact O-OG 3.44Å; R283-S287 PolarHBondContact O-N 2.84Å; R283-S287 PolarHBondContact O-OG 3.43Å |
| 284 | Q | 76.2 | Confident | 64.1 | Low | 123 Ų | 123 | 101.7 Ų | 101.7 | 58% | 0.575 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -59.1 | -47.3 | 178 | -77.1 | 179.1 | -20.5 | 0 | 0 | 112.6 | E280 I281 S286 S287 V288 | E280-Q284 WeakPolarHBondContact O-CG 3.42Å; E280-Q284 PolarHBondContact O-N 3.1Å; I281-Q284 PolarHBondContact O-N 2.87Å; Q284-S286 VanDerWaalsContact C-N 3.3Å; Q284-S286 PolarHBondContact O-N 3.32Å; Q284-S287 PolarHBondContact O-N 2.94Å; Q284-V288 WeakPolarHBondContact O-CG2 3.38Å; Q284-V288 PolarHBondContact O-N 3.5Å |
| 285 | M | 61.3 | Low | 64.1 | Low | 109 Ų | 109 | 102.8 Ų | 102.8 | 54% | 0.537 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.4 | -36 | 176.8 | -65.7 | -159.2 | -53 | 0 | 0 | 112.4 | I281 R283 V288 Q289 | I281-M285 WeakPolarHBondContact O-CG 3.42Å; I281-M285 PolarHBondContact O-N 2.94Å; R283-M285 PolarHBondContact O-N 2.94Å; M285-V288 PolarHBondContact O-N 2.88Å; M285-Q289 PolarHBondContact O-N 3.27Å; M285-Q289 VanDerWaalsContact O-N 3.1Å |
| 286 | S | 68.9 | Low | 64.1 | Low | 67 Ų | 67 | 105.5 Ų | 105.5 | 47% | 0.469 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -68.1 | -36.1 | 175.3 | 74.8 | 0 | 0 | 0 | 0 | 113.1 | L282 R283 Q284 K290 | L282-S286 WeakPolarHBondContact O-CB 3.44Å; L282-S286 PolarHBondContact O-N 3.16Å; L282-S286 PolarHBondContact O-OG 2.88Å; R283-S286 PolarHBondContact O-N 3.42Å; R283-S286 PolarHBondContact O-OG 3.44Å; Q284-S286 VanDerWaalsContact C-N 3.3Å; Q284-S286 PolarHBondContact O-N 3.32Å; S286-K290 WeakPolarHBondContact O-CB 3.43Å; S286-K290 PolarHBondContact O-N 3.16Å; S286-K290 VanDerWaalsContact O-N 3.16Å |
| 287 | S | 68.7 | Low | 63.7 | Low | 65 Ų | 65 | 107.2 Ų | 107.2 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.4 | -46.3 | 173.3 | -70.2 | 0 | 0 | 0 | 0 | 111.5 | R283 Q284 Q289 K290 E291 | R283-S287 PolarHBondContact O-N 2.84Å; R283-S287 PolarHBondContact O-OG 3.43Å; Q284-S287 PolarHBondContact O-N 2.94Å; S287-Q289 PolarHBondContact O-N 2.87Å; S287-K290 PolarHBondContact O-N 3.42Å; S287-K290 VanDerWaalsContact O-N 3.12Å; S287-E291 WeakPolarHBondContact O-CB 3.27Å; S287-E291 PolarHBondContact O-N 2.85Å |
| 288 | V | 66.1 | Low | 63.4 | Low | 77 Ų | 77 | 107.3 Ų | 107.3 | 47% | 0.467 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.7 | -42.3 | 179.1 | 171 | 0 | 0 | 0 | 0 | 111.8 | Q284 M285 K290 E291 I292 | Q284-V288 WeakPolarHBondContact O-CG2 3.38Å; Q284-V288 PolarHBondContact O-N 3.5Å; M285-V288 PolarHBondContact O-N 2.88Å; V288-K290 VanDerWaalsContact C-N 3.33Å; V288-K290 PolarHBondContact O-N 2.84Å; V288-E291 PolarHBondContact O-N 2.89Å; V288-I292 HydrophobicContact CG1-CD1 3.79Å; V288-I292 WeakPolarHBondContact O-CD1 3.29Å; V288-I292 VanDerWaalsContact O-CG1 3.27Å; V288-I292 WeakPolarHBondContact O-CG1 3.39Å; V288-I292 PolarHBondContact O-N 3.31Å |
| 289 | Q | 58 | Low | 62.6 | Low | 144 Ų | 144 | 110.3 Ų | 110.3 | 67% | 0.673 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.2 | -36.9 | 174.5 | -76.4 | -163.9 | -29.6 | 0 | 0 | 112.8 | M285 S287 T293 | M285-Q289 PolarHBondContact O-N 3.27Å; M285-Q289 VanDerWaalsContact O-N 3.1Å; S287-Q289 PolarHBondContact O-N 2.87Å; Q289-T293 WeakPolarHBondContact O-CB 3.24Å; Q289-T293 PolarHBondContact O-N 2.92Å; Q289-T293 VanDerWaalsContact O-N 3.09Å; Q289-T293 PolarHBondContact O-OG1 2.87Å |
| 290 | K | 59 | Low | 61.2 | Low | 116 Ų | 116 | 111.5 Ų | 111.5 | 50% | 0.504 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -69.6 | -39.7 | 177.7 | -167.1 | 172.5 | -176.9 | -67.2 | 0 | 112.1 | S286 S287 V288 T293 E294 | S286-K290 WeakPolarHBondContact O-CB 3.43Å; S286-K290 PolarHBondContact O-N 3.16Å; S286-K290 VanDerWaalsContact O-N 3.16Å; S287-K290 PolarHBondContact O-N 3.42Å; S287-K290 VanDerWaalsContact O-N 3.12Å; V288-K290 VanDerWaalsContact C-N 3.33Å; V288-K290 PolarHBondContact O-N 2.84Å; K290-T293 PolarHBondContact O-N 2.9Å; K290-E294 WeakPolarHBondContact CE-OE1 3.15Å; K290-E294 IonicContact NZ-OE1 3.9Å; K290-E294 PolarHBondContact NZ-OE1 3.03Å; K290-E294 IonicContact NZ-OE2 3.67Å; K290-E294 PolarHBondContact NZ-OE2 2.81Å; K290-E294 WeakPolarHBondContact O-CB 3.44Å; K290-E294 WeakPolarHBondContact O-CG 3.33Å; K290-E294 PolarHBondContact O-N 3.21Å |
| 291 | E | 59.3 | Low | 60 | Low | 129 Ų | 129 | 114 Ų | 114 | 60% | 0.603 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -63.4 | -47.5 | 176.5 | -167.6 | 163.8 | -155.6 | 0 | 0 | 111.2 | S287 V288 T293 E294 Q295 | S287-E291 WeakPolarHBondContact O-CB 3.27Å; S287-E291 PolarHBondContact O-N 2.85Å; V288-E291 PolarHBondContact O-N 2.89Å; E291-T293 PolarHBondContact O-N 3.05Å; E291-E294 PolarHBondContact O-N 2.85Å; E291-Q295 WeakPolarHBondContact O-CB 3.42Å; E291-Q295 PolarHBondContact O-N 3.12Å |
| 292 | I | 53.1 | Low | 59 | Low | 85 Ų | 85 | 120 Ų | 120 | 44% | 0.436 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -58.7 | -45.6 | 174.6 | -65.4 | 164.1 | 0 | 0 | 0 | 111.5 | V288 E294 Q295 E296 | V288-I292 HydrophobicContact CG1-CD1 3.79Å; V288-I292 WeakPolarHBondContact O-CD1 3.29Å; V288-I292 VanDerWaalsContact O-CG1 3.27Å; V288-I292 WeakPolarHBondContact O-CG1 3.39Å; V288-I292 PolarHBondContact O-N 3.31Å; I292-E294 PolarHBondContact O-N 3.48Å; I292-Q295 PolarHBondContact O-N 2.57Å; I292-E296 PolarHBondContact O-N 3.17Å; I292-E296 VanDerWaalsContact O-N 3.12Å |
| 293 | T | 49.4 | Very low | 58 | Low | 77 Ų | 77 | 122.6 Ų | 122.6 | 47% | 0.472 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -72.1 | -15.7 | -177.8 | -46.7 | 0 | 0 | 0 | 0 | 113.5 | Q289 K290 E291 | Q289-T293 WeakPolarHBondContact O-CB 3.24Å; Q289-T293 PolarHBondContact O-N 2.92Å; Q289-T293 VanDerWaalsContact O-N 3.09Å; Q289-T293 PolarHBondContact O-OG1 2.87Å; K290-T293 PolarHBondContact O-N 2.9Å; E291-T293 PolarHBondContact O-N 3.05Å |
| 294 | E | 54 | Low | 56.5 | Low | 107 Ų | 107 | 123.5 Ų | 123.5 | 50% | 0.5 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -97.1 | -29.5 | 175.1 | -73.1 | 176.5 | 167.5 | 0 | 0 | 111.7 | K290 E291 I292 K297 | K290-E294 WeakPolarHBondContact CE-OE1 3.15Å; K290-E294 IonicContact NZ-OE1 3.9Å; K290-E294 PolarHBondContact NZ-OE1 3.03Å; K290-E294 IonicContact NZ-OE2 3.67Å; K290-E294 PolarHBondContact NZ-OE2 2.81Å; K290-E294 WeakPolarHBondContact O-CB 3.44Å; K290-E294 WeakPolarHBondContact O-CG 3.33Å; K290-E294 PolarHBondContact O-N 3.21Å; E291-E294 PolarHBondContact O-N 2.85Å; I292-E294 PolarHBondContact O-N 3.48Å; E294-K297 PolarHBondContact O-N 2.65Å |
| 295 | Q | 52.6 | Low | 55.4 | Low | 131 Ų | 131 | 125.4 Ų | 125.4 | 61% | 0.612 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -74.5 | -34.2 | 175.8 | -161.5 | 168.7 | 3 | 0 | 0 | 112.9 | E291 I292 K297 E298 | E291-Q295 WeakPolarHBondContact O-CB 3.42Å; E291-Q295 PolarHBondContact O-N 3.12Å; I292-Q295 PolarHBondContact O-N 2.57Å; Q295-K297 PolarHBondContact O-N 2.99Å; Q295-E298 PolarHBondContact O-N 2.91Å |
| 296 | E | 51.8 | Low | 55.2 | Low | 154 Ų | 154 | 128.9 Ų | 128.9 | 72% | 0.72 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.7 | 6.8 | 171.9 | -73.4 | -177.6 | 173.4 | 0 | 0 | 114.6 | I292 | I292-E296 PolarHBondContact O-N 3.17Å; I292-E296 VanDerWaalsContact O-N 3.12Å |
| 297 | K | 52.7 | Low | 54.9 | Low | 156 Ų | 156 | 131.5 Ų | 131.5 | 68% | 0.678 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.7 | -4.8 | -176.7 | -76.2 | 178.9 | 178.3 | 165.4 | 0 | 116.5 | E294 Q295 | E294-K297 PolarHBondContact O-N 2.65Å; Q295-K297 PolarHBondContact O-N 2.99Å |
| 298 | E | 54.4 | Low | 54.6 | Low | 141 Ų | 141 | 133.4 Ų | 133.4 | 66% | 0.659 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | -27.9 | 178.2 | -84.8 | -156.8 | 116.1 | 0 | 0 | 115.6 | Q295 | Q295-E298 PolarHBondContact O-N 2.91Š|
| 299 | D | 50.7 | Low | 54.2 | Low | 144 Ų | 144 | 137.3 Ų | 137.3 | 77% | 0.77 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -82.3 | -13.2 | -176.3 | -66.7 | -35.2 | 0 | 0 | 0 | 114.4 | K301 | D299-K301 PolarHBondContact O-N 3.1Š|
| 300 | D | 47.9 | Very low | 53.8 | Low | 119 Ų | 119 | 139.5 Ų | 139.5 | 64% | 0.636 | 67% | 0.671 | S | S | * | * | trans | -79.3 | 57.3 | -177.1 | -155.9 | 34.8 | 0 | 0 | 0 | 111.4 | K307 | D300-K307 IonicContact OD1-NZ 3.03Å; D300-K307 PolarHBondContact OD1-NZ 2.77Å; D300-K307 IonicContact OD2-NZ 2.65Å; D300-K307 PolarHBondContact OD2-NZ 3.15Å | ||
| 301 | K | 52.8 | Low | 54.1 | Low | 155 Ų | 155 | 137.1 Ų | 137.1 | 67% | 0.674 | 67% | 0.666 | S | S | * | * | trans | -135.2 | 7.5 | -161.3 | -115.5 | -178.3 | -160.8 | 155.7 | 0 | 117.6 | D299 | D299-K301 PolarHBondContact O-N 3.1Š| ||
| 302 | E | 51.8 | Low | 54.4 | Low | 192 Ų | 192 | 139.8 Ų | 139.8 | 90% | 0.897 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -145.3 | 47.7 | 175.7 | -136.9 | 162.3 | -112.5 | 0 | 0 | 114.7 | ||
| 303 | D | 50.5 | Low | 55.2 | Low | 149 Ų | 149 | 144.8 Ų | 144.8 | 80% | 0.797 | 70% | 0.7 | S | S | * | * | trans | -143.3 | 116.3 | 156.5 | -113.3 | -35 | 0 | 0 | 0 | 110.7 | E305 | D303-E305 PolarHBondContact O-N 3.06Š| ||
| 304 | V | 47.8 | Very low | 56.2 | Low | 153 Ų | 153 | 145 Ų | 145 | 93% | 0.927 | 70% | 0.698 | S | S | * | * | trans | -93.3 | 52.2 | -177.5 | -166.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 305 | E | 52.6 | Low | 56.6 | Low | 164 Ų | 164 | 145.3 Ų | 145.3 | 77% | 0.766 | 70% | 0.698 | S | S | * | * | trans | -82.6 | 131.3 | 157 | -68.9 | -152.2 | 146.1 | 0 | 0 | 109.1 | D303 K307 | D303-E305 PolarHBondContact O-N 3.06Å; E305-K307 VanDerWaalsContact C-N 3.34Å; E305-K307 PolarHBondContact O-N 3.28Å | ||
| 306 | E | 57.2 | Low | 57.1 | Low | 181 Ų | 181 | 141.6 Ų | 141.6 | 85% | 0.846 | 68% | 0.684 | S | S | * | * | trans | -69.4 | 87.2 | -174.3 | -168.6 | 170.3 | -140.7 | 0 | 0 | 110 | V308 | E306-V308 VanDerWaalsContact C-N 3.29Å; E306-V308 WeakPolarHBondContact O-CG2 3.5Å; E306-V308 PolarHBondContact O-N 3.49Å | ||
| 307 | K | 61.6 | Low | 57.7 | Low | 123 Ų | 123 | 137.9 Ų | 137.9 | 54% | 0.535 | 67% | 0.673 | S | S | . | * | trans | -58.7 | 88.6 | 175.2 | -86.2 | 169.9 | 175.4 | 157.6 | 0 | 109.5 | D300 E305 F309 | D300-K307 IonicContact OD1-NZ 3.03Å; D300-K307 PolarHBondContact OD1-NZ 2.77Å; D300-K307 IonicContact OD2-NZ 2.65Å; D300-K307 PolarHBondContact OD2-NZ 3.15Å; E305-K307 VanDerWaalsContact C-N 3.34Å; E305-K307 PolarHBondContact O-N 3.28Å; K307-F309 HydrophobicContact CB-CE2 4.18Å; K307-F309 HydrophobicContact CB-CZ 4.47Å; K307-F309 WeakPolarHBondContact O-CD2 3.46Å; K307-F309 WeakPolarHBondContact O-CE2 3.44Å; K307-F309 PolarHBondContact O-N 2.82Å | ||
| 308 | V | 63.2 | Low | 58.2 | Low | 105 Ų | 105 | 133.1 Ų | 133.1 | 64% | 0.636 | 67% | 0.668 | S | S | * | * | trans | -67.9 | 90.6 | -179.8 | -176.3 | 0 | 0 | 0 | 0 | 109.7 | E306 | E306-V308 VanDerWaalsContact C-N 3.29Å; E306-V308 WeakPolarHBondContact O-CG2 3.5Å; E306-V308 PolarHBondContact O-N 3.49Å | ||
| 309 | F | 58 | Low | 58.6 | Low | 158 Ų | 158 | 131.9 Ų | 131.9 | 69% | 0.693 | 67% | 0.673 | S | S | * | * | trans | -61.9 | 137.7 | 173 | -68.3 | -82.8 | 0 | 0 | 0 | 110.8 | K307 T311 | K307-F309 HydrophobicContact CB-CE2 4.18Å; K307-F309 HydrophobicContact CB-CZ 4.47Å; K307-F309 WeakPolarHBondContact O-CD2 3.46Å; K307-F309 WeakPolarHBondContact O-CE2 3.44Å; K307-F309 PolarHBondContact O-N 2.82Å; F309-T311 PolarHBondContact O-N 3.49Å | ||
| 310 | W | 48.9 | Very low | 59.1 | Low | 191 Ų | 191 | 130.2 Ų | 130.2 | 72% | 0.723 | 66% | 0.66 | S | S | * | * | trans | -75.5 | 73.3 | 170.1 | -68.3 | 90.7 | 0 | 0 | 0 | 109.9 | ||||
| 311 | T | 65.6 | Low | 59.8 | Low | 65 Ų | 65 | 129.3 Ų | 129.3 | 40% | 0.399 | 65% | 0.648 | S | S | . | * | trans | -63.9 | 155 | 167.7 | 59.2 | 0 | 0 | 0 | 0 | 110.3 | F309 E313 N314 F315 | F309-T311 PolarHBondContact O-N 3.49Å; T311-E313 PolarHBondContact O-N 3.45Å; T311-N314 CarbonylContact O-C 3.56Å; T311-N314 PolarHBondContact O-N 3.27Å; T311-N314 WeakPolarHBondContact OG1-CB 3.34Å; T311-N314 PolarHBondContact OG1-N 3.28Å; T311-N314 PolarHBondContact OG1-ND2 3.2Å; T311-N314 PolarHBondContact OG1-OD1 3.48Å; T311-F315 PolarHBondContact O-N 3.36Å | ||
| 312 | E | 65.9 | Low | 60.1 | Low | 186 Ų | 186 | 131.2 Ų | 131.2 | 87% | 0.869 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -63.5 | -30.7 | 177.9 | -166 | 163.7 | -150.5 | 0 | 0 | 111.9 | F315 | E312-F315 VanDerWaalsContact O-CB 3.3Å; E312-F315 WeakPolarHBondContact O-CB 3.21Å; E312-F315 PolarHBondContact O-N 2.78Å; E312-F315 VanDerWaalsContact O-N 3.11Å |
| 313 | E | 69.5 | Low | 60.5 | Low | 189 Ų | 189 | 131.6 Ų | 131.6 | 88% | 0.883 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | -32.6 | 172 | -169 | 167.3 | -151.3 | 0 | 0 | 112.9 | T311 F315 | T311-E313 PolarHBondContact O-N 3.45Å; E313-F315 VanDerWaalsContact C-N 3.29Å |
| 314 | N | 71.6 | Confident | 60.9 | Low | 82 Ų | 82 | 127 Ų | 127 | 44% | 0.439 | 63% | 0.632 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81.7 | -5.6 | 172.6 | -69.7 | -2.1 | 0 | 0 | 0 | 112.7 | T311 V316 | T311-N314 CarbonylContact O-C 3.56Å; T311-N314 PolarHBondContact O-N 3.27Å; T311-N314 WeakPolarHBondContact OG1-CB 3.34Å; T311-N314 PolarHBondContact OG1-N 3.28Å; T311-N314 PolarHBondContact OG1-ND2 3.2Å; T311-N314 PolarHBondContact OG1-OD1 3.48Å; N314-V316 PolarHBondContact O-N 2.88Å |
| 315 | F | 61.7 | Low | 61.4 | Low | 113 Ų | 113 | 130.7 Ų | 130.7 | 50% | 0.496 | 63% | 0.629 | S | S | . | * | trans | -83.5 | 76.5 | -172 | -158.5 | -85.4 | 0 | 0 | 0 | 112.2 | T311 E312 E313 P317 | T311-F315 PolarHBondContact O-N 3.36Å; E312-F315 VanDerWaalsContact O-CB 3.3Å; E312-F315 WeakPolarHBondContact O-CB 3.21Å; E312-F315 PolarHBondContact O-N 2.78Å; E312-F315 VanDerWaalsContact O-N 3.11Å; E313-F315 VanDerWaalsContact C-N 3.29Å; F315-P317 VanDerWaalsContact O-CD 3.27Å; F315-P317 WeakPolarHBondContact O-CD 3.35Å; F315-P317 VanDerWaalsContact O-N 3.12Å | ||
| 316 | V | 62.6 | Low | 61.7 | Low | 54 Ų | 54 | 130.1 Ų | 130.1 | 33% | 0.327 | 63% | 0.631 | S | S | . | * | trans | -52 | 119.1 | 172.6 | 179 | 0 | 0 | 0 | 0 | 110.2 | N314 E320 R321 | N314-V316 PolarHBondContact O-N 2.88Å; V316-E320 HydrophobicContact CG1-CB 3.63Å; V316-R321 HydrophobicContact CB-CG 4.29Å; V316-R321 HydrophobicContact CG1-CG 4.16Å; V316-R321 WeakPolarHBondContact O-CG 3.24Å; V316-R321 PolarHBondContact O-NE 2.89Å | ||
| 317 | P | 65 | Low | 61.8 | Low | 75 Ų | 75 | 126 Ų | 126 | 49% | 0.487 | 62% | 0.618 | S | S | . | * | trans | -58.5 | 149.3 | -178.2 | -28 | 36.9 | 0 | 0 | 0 | 112.8 | F315 P319 E320 | F315-P317 VanDerWaalsContact O-CD 3.27Å; F315-P317 WeakPolarHBondContact O-CD 3.35Å; F315-P317 VanDerWaalsContact O-N 3.12Å; P317-P319 VanDerWaalsContact C-N 3.35Å; P317-P319 WeakPolarHBondContact O-CD 3.39Å; P317-E320 PolarHBondContact O-N 3.21Å | ||
| 318 | G | 63.1 | Low | 61.5 | Low | 56 Ų | 56 | 126.4 Ų | 126.4 | 58% | 0.577 | 62% | 0.623 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -42.3 | -44.9 | -169 | 0 | 0 | 0 | 0 | 0 | 117.2 | E320 | G318-E320 VanDerWaalsContact C-N 3.33Å; G318-E320 PolarHBondContact O-N 2.78Å |
| 319 | P | 63 | Low | 61.2 | Low | 115 Ų | 115 | 127.5 Ų | 127.5 | 75% | 0.747 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | -33.5 | 179.2 | -24.4 | 35.4 | 0 | 0 | 0 | 114.6 | P317 | P317-P319 VanDerWaalsContact C-N 3.35Å; P317-P319 WeakPolarHBondContact O-CD 3.39Å |
| 320 | E | 61.9 | Low | 61.4 | Low | 110 Ų | 110 | 123.5 Ų | 123.5 | 51% | 0.514 | 64% | 0.636 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92 | -13.7 | -168.8 | -64.3 | -173.2 | 130.1 | 0 | 0 | 113.3 | V316 P317 G318 K322 R323 A324 | V316-E320 HydrophobicContact CG1-CB 3.63Å; P317-E320 PolarHBondContact O-N 3.21Å; G318-E320 VanDerWaalsContact C-N 3.33Å; G318-E320 PolarHBondContact O-N 2.78Å; E320-K322 PolarHBondContact O-N 3.25Å; E320-R323 PolarHBondContact O-N 2.92Å; E320-A324 PolarHBondContact O-N 2.95Å; E320-A324 VanDerWaalsContact O-N 3.15Å |
| 321 | R | 61.3 | Low | 61.9 | Low | 99 Ų | 99 | 117.2 Ų | 117.2 | 37% | 0.374 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -54.4 | -23.2 | 174.3 | -66.8 | -173.5 | 172 | -149.5 | -6.9 | 113.9 | V316 | V316-R321 HydrophobicContact CB-CG 4.29Å; V316-R321 HydrophobicContact CG1-CG 4.16Å; V316-R321 WeakPolarHBondContact O-CG 3.24Å; V316-R321 PolarHBondContact O-NE 2.89Å |
| 322 | K | 59 | Low | 61.5 | Low | 195 Ų | 195 | 124.2 Ų | 124.2 | 85% | 0.848 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -82.7 | -17.9 | 174.2 | -69 | -162 | 176 | -168.3 | 0 | 114.8 | E320 | E320-K322 PolarHBondContact O-N 3.25Å |
| 323 | R | 60.5 | Low | 60.9 | Low | 200 Ų | 200 | 118.2 Ų | 118.2 | 76% | 0.755 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -90.9 | -40.5 | 174.7 | -75.6 | -178.6 | 165.6 | 179.1 | -5.6 | 111.9 | E320 R325 L326 | E320-R323 PolarHBondContact O-N 2.92Å; R323-R325 VanDerWaalsContact C-N 3.31Å; R323-R325 PolarHBondContact O-N 3.42Å; R323-L326 PolarHBondContact O-N 2.55Å |
| 324 | A | 57.9 | Low | 60.4 | Low | 53 Ų | 53 | 116.7 Ų | 116.7 | 44% | 0.438 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -56 | -39.9 | -176 | 0 | 0 | 0 | 0 | 0 | 113.7 | E320 L326 V327 | E320-A324 PolarHBondContact O-N 2.95Å; E320-A324 VanDerWaalsContact O-N 3.15Å; A324-L326 PolarHBondContact O-N 3.24Å; A324-L326 VanDerWaalsContact O-N 3.15Å; A324-V327 PolarHBondContact O-N 3.07Å |
| 325 | R | 58.8 | Low | 60 | Low | 230 Ų | 230 | 121.1 Ų | 121.1 | 87% | 0.868 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | -2.8 | -174.4 | -56.6 | -171.5 | 86.4 | 111.5 | 0.7 | 115.6 | R323 | R323-R325 VanDerWaalsContact C-N 3.31Å; R323-R325 PolarHBondContact O-N 3.42Å |
| 326 | L | 60.1 | Low | 60.3 | Low | 153 Ų | 153 | 119.3 Ų | 119.3 | 80% | 0.801 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | -8.3 | 179.7 | -156 | 71.3 | 0 | 0 | 0 | 113.3 | R323 A324 M328 | R323-L326 PolarHBondContact O-N 2.55Å; A324-L326 PolarHBondContact O-N 3.24Å; A324-L326 VanDerWaalsContact O-N 3.15Å; L326-M328 PolarHBondContact O-N 3.24Å |
| 327 | V | 59.3 | Low | 60.9 | Low | 95 Ų | 95 | 118.9 Ų | 118.9 | 58% | 0.576 | 63% | 0.634 | S | S | * | * | trans | -92.7 | 96.1 | -178.7 | -175.6 | 0 | 0 | 0 | 0 | 109.3 | A324 | A324-V327 PolarHBondContact O-N 3.07Š| ||
| 328 | M | 54.3 | Low | 61.4 | Low | 130 Ų | 130 | 120.2 Ų | 120.2 | 64% | 0.64 | 64% | 0.641 | S | S | * | * | trans | -67.7 | 133.2 | 171 | -71.2 | -64.5 | -70.1 | 0 | 0 | 110 | L326 G330 T331 | L326-M328 PolarHBondContact O-N 3.24Å; M328-G330 PolarHBondContact O-N 2.97Å; M328-T331 HydrophobicContact CB-CG2 3.87Å; M328-T331 PolarHBondContact O-N 2.87Å; M328-T331 PolarHBondContact O-OG1 2.94Å; M328-T331 VanDerWaalsContact O-OG1 3.05Å | ||
| 329 | P | 57.3 | Low | 62.1 | Low | 129 Ų | 129 | 123 Ų | 123 | 84% | 0.838 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | 111.9 | 175.9 | 25.3 | -32.8 | 0 | 0 | 0 | 109.7 | ||
| 330 | G | 62.5 | Low | 62.8 | Low | 73 Ų | 73 | 122.8 Ų | 122.8 | 75% | 0.753 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 117.3 | -21.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | M328 K332 | M328-G330 PolarHBondContact O-N 2.97Å; G330-K332 PolarHBondContact O-N 3.21Å |
| 331 | T | 58.4 | Low | 63.4 | Low | 59 Ų | 59 | 121.8 Ų | 121.8 | 36% | 0.362 | 63% | 0.629 | S | S | . | * | trans | -79 | 93.2 | -178.1 | 54.3 | 0 | 0 | 0 | 0 | 112 | M328 S333 | M328-T331 HydrophobicContact CB-CG2 3.87Å; M328-T331 PolarHBondContact O-N 2.87Å; M328-T331 PolarHBondContact O-OG1 2.94Å; M328-T331 VanDerWaalsContact O-OG1 3.05Å; T331-S333 PolarHBondContact O-N 2.89Å | ||
| 332 | K | 56.9 | Low | 64.1 | Low | 213 Ų | 213 | 120 Ų | 120 | 93% | 0.926 | 63% | 0.627 | S | S | * | * | trans | -75.1 | 48.4 | 175.8 | -66.3 | -175.1 | 179.3 | 177.9 | 0 | 113.5 | G330 | G330-K332 PolarHBondContact O-N 3.21Š| ||
| 333 | S | 54.5 | Low | 64.9 | Low | 59 Ų | 59 | 117.8 Ų | 117.8 | 41% | 0.413 | 62% | 0.62 | S | S | . | * | trans | -152.9 | 94.8 | 178.5 | 41.2 | 0 | 0 | 0 | 0 | 111 | T331 H335 I336 | T331-S333 PolarHBondContact O-N 2.89Å; S333-H335 PolarHBondContact O-N 3.41Å; S333-I336 WeakPolarHBondContact OG-CG1 3.36Å | ||
| 334 | N | 58.4 | Low | 65.6 | Low | 157 Ų | 157 | 112.2 Ų | 112.2 | 84% | 0.84 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | 18.4 | 177.1 | -69.9 | -27 | 0 | 0 | 0 | 114.3 | ||
| 335 | H | 63.7 | Low | 66.4 | Low | 175 Ų | 175 | 112.9 Ų | 112.9 | 81% | 0.81 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -160.7 | 33.9 | -171.1 | -139.2 | -72.2 | 0 | 0 | 0 | 114.8 | S333 A337 | S333-H335 PolarHBondContact O-N 3.41Å; H335-A337 PolarHBondContact O-N 3.08Å |
| 336 | I | 67.9 | Low | 67.2 | Low | 76 Ų | 76 | 109.3 Ų | 109.3 | 39% | 0.39 | 61% | 0.608 | S | S | . | * | trans | -55.3 | 125.4 | 167.4 | -58.6 | 176.1 | 0 | 0 | 0 | 108 | S333 E340 L341 | S333-I336 WeakPolarHBondContact OG-CG1 3.36Å; I336-E340 HydrophobicContact CG2-CB 3.95Å; I336-L341 HydrophobicContact CG2-CB 4.2Å | ||
| 337 | A | 75.8 | Confident | 68.1 | Low | 44 Ų | 44 | 105.6 Ų | 105.6 | 36% | 0.364 | 59% | 0.592 | S | S | . | * | trans | -69.2 | 144.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110 | H335 N339 E340 L341 | H335-A337 PolarHBondContact O-N 3.08Å; A337-N339 PolarHBondContact O-N 3.27Å; A337-N339 VanDerWaalsContact O-N 3.09Å; A337-E340 HydrophobicContact CB-CB 4.46Å; A337-E340 HydrophobicContact CB-CG 4.11Å; A337-E340 PolarHBondContact N-OE2 3.37Å; A337-E340 WeakPolarHBondContact O-CA 3.27Å; A337-E340 WeakPolarHBondContact O-CB 3.42Å; A337-E340 PolarHBondContact O-N 3.4Å; A337-L341 PolarHBondContact O-N 3.46Å | ||
| 338 | V | 75.8 | Confident | 69.1 | Low | 104 Ų | 104 | 109.6 Ų | 109.6 | 63% | 0.63 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -53.5 | -37 | 178.3 | 178.9 | 0 | 0 | 0 | 0 | 111.1 | L341 L342 | V338-L341 PolarHBondContact O-N 2.94Å; V338-L342 HydrophobicContact CG1-CD1 3.93Å; V338-L342 HydrophobicContact CG1-CG 4.35Å; V338-L342 WeakPolarHBondContact O-CB 3.25Å; V338-L342 VanDerWaalsContact O-CG 3.25Å; V338-L342 WeakPolarHBondContact O-CG 3.47Å; V338-L342 PolarHBondContact O-N 2.81Å |
| 339 | N | 77.6 | Confident | 70.3 | Confident | 113 Ų | 113 | 108.6 Ų | 108.6 | 60% | 0.604 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -66.5 | -36.5 | 176.3 | -63 | -2 | 0 | 0 | 0 | 113.3 | A337 Q343 | A337-N339 PolarHBondContact O-N 3.27Å; A337-N339 VanDerWaalsContact O-N 3.09Å; N339-Q343 WeakPolarHBondContact O-CB 3.39Å; N339-Q343 WeakPolarHBondContact O-CG 3.44Å; N339-Q343 PolarHBondContact O-N 2.95Å |
| 340 | E | 77.7 | Confident | 71.5 | Confident | 111 Ų | 111 | 108.9 Ų | 108.9 | 52% | 0.519 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -69.7 | -40.9 | 175.1 | -68.2 | 174.6 | 134.6 | 0 | 0 | 110.9 | I336 A337 Q343 S344 | I336-E340 HydrophobicContact CG2-CB 3.95Å; A337-E340 HydrophobicContact CB-CB 4.46Å; A337-E340 HydrophobicContact CB-CG 4.11Å; A337-E340 PolarHBondContact N-OE2 3.37Å; A337-E340 WeakPolarHBondContact O-CA 3.27Å; A337-E340 WeakPolarHBondContact O-CB 3.42Å; A337-E340 PolarHBondContact O-N 3.4Å; E340-Q343 PolarHBondContact O-N 3.45Å; E340-S344 WeakPolarHBondContact O-CB 3.4Å; E340-S344 PolarHBondContact O-N 3.03Å; E340-S344 PolarHBondContact O-OG 2.9Å |
| 341 | L | 73.9 | Confident | 72.6 | Confident | 89 Ų | 89 | 110.1 Ų | 110.1 | 47% | 0.466 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -60 | -50.8 | 175.9 | -177 | 62.3 | 0 | 0 | 0 | 110.4 | I336 A337 V338 Q343 S344 T345 | I336-L341 HydrophobicContact CG2-CB 4.2Å; A337-L341 PolarHBondContact O-N 3.46Å; V338-L341 PolarHBondContact O-N 2.94Å; L341-Q343 VanDerWaalsContact C-N 3.31Å; L341-Q343 PolarHBondContact O-N 3.31Å; L341-S344 PolarHBondContact O-N 3.27Å; L341-S344 PolarHBondContact O-OG 2.84Å; L341-T345 HydrophobicContact CD1-CG2 4.33Å; L341-T345 WeakPolarHBondContact O-CG2 3.47Å; L341-T345 PolarHBondContact O-N 2.87Å; L341-T345 VanDerWaalsContact O-N 3.08Å; L341-T345 PolarHBondContact O-OG1 3.03Å |
| 342 | L | 75.1 | Confident | 73.9 | Confident | 63 Ų | 63 | 112.7 Ų | 112.7 | 33% | 0.33 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -62.5 | -33.7 | 178 | -68.3 | 172.8 | 0 | 0 | 0 | 113.4 | V338 T345 V349 | V338-L342 HydrophobicContact CG1-CD1 3.93Å; V338-L342 HydrophobicContact CG1-CG 4.35Å; V338-L342 WeakPolarHBondContact O-CB 3.25Å; V338-L342 VanDerWaalsContact O-CG 3.25Å; V338-L342 WeakPolarHBondContact O-CG 3.47Å; V338-L342 PolarHBondContact O-N 2.81Å; L342-T345 PolarHBondContact O-OG1 3.26Å; L342-V349 HydrophobicContact CD1-CG2 3.98Å; L342-V349 HydrophobicContact CD2-CG2 4.06Å; L342-V349 HydrophobicContact CG-CG2 4.44Å |
| 343 | Q | 75.7 | Confident | 75.3 | Confident | 148 Ų | 148 | 107 Ų | 107 | 69% | 0.692 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -70.7 | -35.3 | 172.3 | -75 | 168.6 | 16.7 | 0 | 0 | 112.1 | N339 E340 L341 | N339-Q343 WeakPolarHBondContact O-CB 3.39Å; N339-Q343 WeakPolarHBondContact O-CG 3.44Å; N339-Q343 PolarHBondContact O-N 2.95Å; E340-Q343 PolarHBondContact O-N 3.45Å; L341-Q343 VanDerWaalsContact C-N 3.31Å; L341-Q343 PolarHBondContact O-N 3.31Å |
| 344 | S | 77 | Confident | 76.8 | Confident | 82 Ų | 82 | 112 Ų | 112 | 57% | 0.573 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72.6 | -29 | 179.7 | 74.5 | 0 | 0 | 0 | 0 | 113.7 | E340 L341 | E340-S344 WeakPolarHBondContact O-CB 3.4Å; E340-S344 PolarHBondContact O-N 3.03Å; E340-S344 PolarHBondContact O-OG 2.9Å; L341-S344 PolarHBondContact O-N 3.27Å; L341-S344 PolarHBondContact O-OG 2.84Å |
| 345 | T | 74.1 | Confident | 78 | Confident | 67 Ų | 67 | 107.7 Ų | 107.7 | 41% | 0.411 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -88.9 | -12.6 | -174.1 | 51.2 | 0 | 0 | 0 | 0 | 114.6 | L341 L342 T347 | L341-T345 HydrophobicContact CD1-CG2 4.33Å; L341-T345 WeakPolarHBondContact O-CG2 3.47Å; L341-T345 PolarHBondContact O-N 2.87Å; L341-T345 VanDerWaalsContact O-N 3.08Å; L341-T345 PolarHBondContact O-OG1 3.03Å; L342-T345 PolarHBondContact O-OG1 3.26Å; T345-T347 PolarHBondContact O-N 3.36Å; T345-T347 VanDerWaalsContact O-N 3.07Å; T345-T347 PolarHBondContact OG1-OG1 2.88Å |
| 346 | N | 74.8 | Confident | 79 | Confident | 155 Ų | 155 | 103.3 Ų | 103.3 | 83% | 0.829 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 50.7 | 25.5 | -172.2 | -80 | -62.9 | 0 | 0 | 0 | 114.2 | ||
| 347 | T | 78.9 | Confident | 79.4 | Confident | 76 Ų | 76 | 106 Ų | 106 | 47% | 0.466 | 58% | 0.581 | S | S | . | * | trans | -85.5 | 127.5 | 179.5 | 45.8 | 0 | 0 | 0 | 0 | 110.7 | T345 V349 | T345-T347 PolarHBondContact O-N 3.36Å; T345-T347 VanDerWaalsContact O-N 3.07Å; T345-T347 PolarHBondContact OG1-OG1 2.88Å; T347-V349 PolarHBondContact O-N 3.46Å | ||
| 348 | E | 81.3 | Confident | 79.7 | Confident | 179 Ų | 179 | 107.4 Ų | 107.4 | 84% | 0.836 | 59% | 0.586 | S | S | * | * | trans | -59.3 | 128.8 | 169.3 | -70.9 | -168.7 | 122.3 | 0 | 0 | 110.7 | I350 | E348-I350 PolarHBondContact O-N 3.3Š| ||
| 349 | V | 79.2 | Confident | 79.6 | Confident | 109 Ų | 109 | 106.2 Ų | 106.2 | 66% | 0.661 | 59% | 0.586 | S | S | * | * | trans | -82.2 | 83.8 | 179.7 | -175.1 | 0 | 0 | 0 | 0 | 109 | L342 T347 S351 | L342-V349 HydrophobicContact CD1-CG2 3.98Å; L342-V349 HydrophobicContact CD2-CG2 4.06Å; L342-V349 HydrophobicContact CG-CG2 4.44Å; T347-V349 PolarHBondContact O-N 3.46Å; V349-S351 PolarHBondContact O-N 3.1Å | ||
| 350 | I | 82.8 | Confident | 79.7 | Confident | 134 Ų | 134 | 102.4 Ų | 102.4 | 69% | 0.687 | 57% | 0.574 | S | S | * | * | trans | -67.9 | 116.2 | 174.8 | -56.8 | 175.5 | 0 | 0 | 0 | 108.9 | E348 I352 | E348-I350 PolarHBondContact O-N 3.3Å; I350-I352 HydrophobicContact CG2-CG1 4.16Å; I350-I352 PolarHBondContact O-N 3.04Å | ||
| 351 | S | 85.3 | Confident | 80.1 | Confident | 99 Ų | 99 | 99.4 Ų | 99.4 | 69% | 0.692 | 57% | 0.568 | S | S | * | * | trans | -76.4 | 100 | 173 | 59.2 | 0 | 0 | 0 | 0 | 110.4 | V349 | V349-S351 PolarHBondContact O-N 3.1Š| ||
| 352 | I | 84.6 | Confident | 80.5 | Confident | 114 Ų | 114 | 102 Ų | 102 | 59% | 0.585 | 58% | 0.578 | S | S | * | * | trans | -87.7 | 120.9 | 176.6 | -57.2 | 172.4 | 0 | 0 | 0 | 109.1 | I350 L357 | I350-I352 HydrophobicContact CG2-CG1 4.16Å; I350-I352 PolarHBondContact O-N 3.04Å; I352-L357 HydrophobicContact CG2-CD1 4.32Å; I352-L357 HydrophobicContact CG2-CD2 3.93Å; I352-L357 HydrophobicContact CG2-CG 3.86Å | ||
| 353 | N | 86.4 | Confident | 80.9 | Confident | 93 Ų | 93 | 104.9 Ų | 104.9 | 50% | 0.497 | 59% | 0.593 | S | S | . | * | trans | -87 | 156.4 | 171.4 | -52.8 | -83.8 | 0 | 0 | 0 | 110.4 | S355 D356 | N353-S355 VanDerWaalsContact CB-OG 3.27Å; N353-S355 WeakPolarHBondContact CB-OG 3.4Å; N353-S355 PolarHBondContact O-N 3.37Å; N353-D356 WeakPolarHBondContact CA-OD2 3.27Å; N353-D356 VanDerWaalsContact CB-OD2 3.27Å; N353-D356 WeakPolarHBondContact CB-OD2 3.38Å; N353-D356 PolarHBondContact N-OD2 3.12Å; N353-D356 PolarHBondContact ND2-OD2 2.98Å; N353-D356 WeakPolarHBondContact O-CB 3.29Å; N353-D356 PolarHBondContact O-N 3.47Å | ||
| 354 | Q | 86 | Confident | 81.3 | Confident | 164 Ų | 164 | 104.2 Ų | 104.2 | 77% | 0.766 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | -31.1 | 175.4 | -173.9 | 177.9 | -0.6 | 0 | 0 | 112.4 | D356 T358 | Q354-D356 PolarHBondContact O-N 2.95Å; Q354-T358 PolarHBondContact O-OG1 3.26Å |
| 355 | S | 83.4 | Confident | 81.7 | Confident | 66 Ų | 66 | 105.5 Ų | 105.5 | 46% | 0.462 | 59% | 0.59 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -53.3 | -42.8 | 172.2 | 42.4 | 0 | 0 | 0 | 0 | 112 | N353 L357 T358 A359 | N353-S355 VanDerWaalsContact CB-OG 3.27Å; N353-S355 WeakPolarHBondContact CB-OG 3.4Å; N353-S355 PolarHBondContact O-N 3.37Å; S355-L357 PolarHBondContact O-N 2.91Å; S355-T358 CarbonylContact O-C 3.58Å; S355-T358 WeakPolarHBondContact O-CA 3.25Å; S355-T358 PolarHBondContact O-N 3.33Å; S355-T358 PolarHBondContact O-OG1 3.36Å; S355-A359 PolarHBondContact O-N 3.22Å |
| 356 | D | 84.6 | Confident | 82.2 | Confident | 84 Ų | 84 | 106.3 Ų | 106.3 | 45% | 0.449 | 59% | 0.591 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.4 | -34.7 | -165 | -44.8 | -18.9 | 0 | 0 | 0 | 109.9 | N353 Q354 T358 | N353-D356 WeakPolarHBondContact CA-OD2 3.27Å; N353-D356 VanDerWaalsContact CB-OD2 3.27Å; N353-D356 WeakPolarHBondContact CB-OD2 3.38Å; N353-D356 PolarHBondContact N-OD2 3.12Å; N353-D356 PolarHBondContact ND2-OD2 2.98Å; N353-D356 WeakPolarHBondContact O-CB 3.29Å; N353-D356 PolarHBondContact O-N 3.47Å; Q354-D356 PolarHBondContact O-N 2.95Å; D356-T358 PolarHBondContact O-N 2.76Å |
| 357 | L | 77.6 | Confident | 82.7 | Confident | 132 Ų | 132 | 104.6 Ų | 104.6 | 69% | 0.691 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | -17.3 | 169.3 | -61 | 175.5 | 0 | 0 | 0 | 113.7 | I352 S355 | I352-L357 HydrophobicContact CG2-CD1 4.32Å; I352-L357 HydrophobicContact CG2-CD2 3.93Å; I352-L357 HydrophobicContact CG2-CG 3.86Å; S355-L357 PolarHBondContact O-N 2.91Å |
| 358 | T | 81.1 | Confident | 82.7 | Confident | 74 Ų | 74 | 104.4 Ų | 104.4 | 45% | 0.454 | 58% | 0.578 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -113.8 | -7 | -176.6 | 59.9 | 0 | 0 | 0 | 0 | 114.3 | Q354 S355 D356 G360 A361 | Q354-T358 PolarHBondContact O-OG1 3.26Å; S355-T358 CarbonylContact O-C 3.58Å; S355-T358 WeakPolarHBondContact O-CA 3.25Å; S355-T358 PolarHBondContact O-N 3.33Å; S355-T358 PolarHBondContact O-OG1 3.36Å; D356-T358 PolarHBondContact O-N 2.76Å; T358-G360 VanDerWaalsContact C-N 3.26Å; T358-G360 PolarHBondContact O-N 3.04Å; T358-A361 WeakPolarHBondContact O-CB 3.5Å; T358-A361 PolarHBondContact O-N 2.86Å |
| 359 | A | 74.3 | Confident | 82.7 | Confident | 78 Ų | 78 | 101.3 Ų | 101.3 | 65% | 0.645 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.2 | -34.1 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | S355 | S355-A359 PolarHBondContact O-N 3.22Š|
| 360 | G | 80.7 | Confident | 82.6 | Confident | 34 Ų | 34 | 101.1 Ų | 101.1 | 35% | 0.351 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.1 | -33.7 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | T358 Q362 L363 E364 | T358-G360 VanDerWaalsContact C-N 3.26Å; T358-G360 PolarHBondContact O-N 3.04Å; G360-Q362 PolarHBondContact O-N 2.91Å; G360-L363 CarbonylContact O-C 3.6Å; G360-L363 WeakPolarHBondContact O-CA 3.48Å; G360-L363 WeakPolarHBondContact O-CB 3.21Å; G360-L363 PolarHBondContact O-N 3.37Å; G360-E364 WeakPolarHBondContact O-CG 3.42Å; G360-E364 PolarHBondContact O-N 2.94Å |
| 361 | A | 84.6 | Confident | 82 | Confident | 47 Ų | 47 | 95.7 Ų | 95.7 | 39% | 0.388 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.4 | -35.6 | -168.2 | 0 | 0 | 0 | 0 | 0 | 114 | T358 L365 | T358-A361 WeakPolarHBondContact O-CB 3.5Å; T358-A361 PolarHBondContact O-N 2.86Å; A361-L365 VanDerWaalsContact O-CB 3.31Å; A361-L365 WeakPolarHBondContact O-CB 3.43Å; A361-L365 PolarHBondContact O-N 3.2Å |
| 362 | Q | 83.1 | Confident | 81 | Confident | 145 Ų | 145 | 93.7 Ų | 93.7 | 68% | 0.678 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68.9 | -37.7 | 173 | -177.3 | 177.2 | -10.7 | 0 | 0 | 111.7 | G360 I366 | G360-Q362 PolarHBondContact O-N 2.91Å; Q362-I366 HydrophobicContact CG-CD1 3.97Å; Q362-I366 WeakPolarHBondContact O-CB 3.22Å; Q362-I366 VanDerWaalsContact O-CG1 3.24Å; Q362-I366 WeakPolarHBondContact O-CG1 3.42Å; Q362-I366 PolarHBondContact O-N 2.68Å |
| 363 | L | 83.3 | Confident | 80.1 | Confident | 123 Ų | 123 | 94.4 Ų | 94.4 | 64% | 0.644 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -69.7 | -39.4 | 177.7 | -177.9 | 63.4 | 0 | 0 | 0 | 111.3 | G360 I366 K367 | G360-L363 CarbonylContact O-C 3.6Å; G360-L363 WeakPolarHBondContact O-CA 3.48Å; G360-L363 WeakPolarHBondContact O-CB 3.21Å; G360-L363 PolarHBondContact O-N 3.37Å; L363-I366 PolarHBondContact O-N 3.25Å; L363-K367 VanDerWaalsContact O-CB 3.29Å; L363-K367 WeakPolarHBondContact O-CB 3.45Å; L363-K367 PolarHBondContact O-N 2.9Å |
| 364 | E | 83.1 | Confident | 79 | Confident | 134 Ų | 134 | 91.3 Ų | 91.3 | 63% | 0.626 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.2 | -42.4 | 173.9 | -72.3 | 174.3 | 175.5 | 0 | 0 | 111.9 | G360 K367 S368 | G360-E364 WeakPolarHBondContact O-CG 3.42Å; G360-E364 PolarHBondContact O-N 2.94Å; E364-K367 CarbonylContact O-C 3.41Å; E364-K367 WeakPolarHBondContact O-CB 3.46Å; E364-K367 PolarHBondContact O-N 2.84Å; E364-S368 PolarHBondContact O-N 3.48Å; E364-S368 PolarHBondContact O-OG 3.34Å |
| 365 | L | 85.8 | Confident | 77.6 | Confident | 109 Ų | 109 | 89.1 Ų | 89.1 | 57% | 0.571 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.5 | -45 | 173.7 | -178.8 | 64.5 | 0 | 0 | 0 | 111.5 | A361 K367 S368 V369 | A361-L365 VanDerWaalsContact O-CB 3.31Å; A361-L365 WeakPolarHBondContact O-CB 3.43Å; A361-L365 PolarHBondContact O-N 3.2Å; L365-K367 VanDerWaalsContact C-N 3.3Å; L365-K367 PolarHBondContact O-N 3.17Å; L365-S368 PolarHBondContact O-N 2.82Å; L365-S368 PolarHBondContact O-OG 3.34Å; L365-V369 HydrophobicContact CD1-CG2 4.23Å; L365-V369 WeakPolarHBondContact O-CB 3.16Å; L365-V369 VanDerWaalsContact O-CG2 3.27Å; L365-V369 WeakPolarHBondContact O-CG2 3.49Å; L365-V369 PolarHBondContact O-N 3.48Å |
| 366 | I | 85.3 | Confident | 76.1 | Confident | 83 Ų | 83 | 92.2 Ų | 92.2 | 43% | 0.426 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.3 | -42 | 174.8 | -71.3 | 166.5 | 0 | 0 | 0 | 110.1 | Q362 L363 V369 T370 | Q362-I366 HydrophobicContact CG-CD1 3.97Å; Q362-I366 WeakPolarHBondContact O-CB 3.22Å; Q362-I366 VanDerWaalsContact O-CG1 3.24Å; Q362-I366 WeakPolarHBondContact O-CG1 3.42Å; Q362-I366 PolarHBondContact O-N 2.68Å; L363-I366 PolarHBondContact O-N 3.25Å; I366-V369 PolarHBondContact O-N 2.98Å; I366-T370 HydrophobicContact CG2-CG2 4.36Å; I366-T370 WeakPolarHBondContact O-CB 3.14Å; I366-T370 WeakPolarHBondContact O-CG2 3.19Å; I366-T370 PolarHBondContact O-N 2.9Å; I366-T370 PolarHBondContact O-OG1 2.94Å |
| 367 | K | 84.6 | Confident | 74.6 | Confident | 119 Ų | 119 | 95.1 Ų | 95.1 | 52% | 0.517 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.6 | -47.7 | 175 | -172.9 | -169.6 | 177.7 | -160.9 | 0 | 110.9 | L363 E364 L365 V369 T370 S371 Y376 | L363-K367 VanDerWaalsContact O-CB 3.29Å; L363-K367 WeakPolarHBondContact O-CB 3.45Å; L363-K367 PolarHBondContact O-N 2.9Å; E364-K367 CarbonylContact O-C 3.41Å; E364-K367 WeakPolarHBondContact O-CB 3.46Å; E364-K367 PolarHBondContact O-N 2.84Å; L365-K367 VanDerWaalsContact C-N 3.3Å; L365-K367 PolarHBondContact O-N 3.17Å; K367-V369 VanDerWaalsContact C-N 3.29Å; K367-V369 PolarHBondContact O-N 3.27Å; K367-T370 PolarHBondContact O-N 3.33Å; K367-S371 WeakPolarHBondContact O-CB 3.46Å; K367-S371 PolarHBondContact O-N 2.91Å; K367-S371 PolarHBondContact O-OG 2.66Å; K367-Y376 WeakPolarHBondContact CE-OH 3.35Å |
| 368 | S | 79.3 | Confident | 73.1 | Confident | 72 Ų | 72 | 92.5 Ų | 92.5 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67 | -27 | 179.2 | 65.8 | 0 | 0 | 0 | 0 | 113.7 | E364 L365 | E364-S368 PolarHBondContact O-N 3.48Å; E364-S368 PolarHBondContact O-OG 3.34Å; L365-S368 PolarHBondContact O-N 2.82Å; L365-S368 PolarHBondContact O-OG 3.34Å |
| 369 | V | 82.2 | Confident | 71.7 | Confident | 114 Ų | 114 | 98.1 Ų | 98.1 | 69% | 0.691 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -87.7 | -16.9 | 177.8 | 173.4 | 0 | 0 | 0 | 0 | 112.7 | L365 I366 K367 | L365-V369 HydrophobicContact CD1-CG2 4.23Å; L365-V369 WeakPolarHBondContact O-CB 3.16Å; L365-V369 VanDerWaalsContact O-CG2 3.27Å; L365-V369 WeakPolarHBondContact O-CG2 3.49Å; L365-V369 PolarHBondContact O-N 3.48Å; I366-V369 PolarHBondContact O-N 2.98Å; K367-V369 VanDerWaalsContact C-N 3.29Å; K367-V369 PolarHBondContact O-N 3.27Å |
| 370 | T | 76.9 | Confident | 70.4 | Confident | 105 Ų | 105 | 96 Ų | 96 | 64% | 0.644 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -116.9 | -13.8 | -178.2 | 61 | 0 | 0 | 0 | 0 | 114.9 | I366 K367 D372 | I366-T370 HydrophobicContact CG2-CG2 4.36Å; I366-T370 WeakPolarHBondContact O-CB 3.14Å; I366-T370 WeakPolarHBondContact O-CG2 3.19Å; I366-T370 PolarHBondContact O-N 2.9Å; I366-T370 PolarHBondContact O-OG1 2.94Å; K367-T370 PolarHBondContact O-N 3.33Å; T370-D372 PolarHBondContact O-N 3.2Å |
| 371 | S | 70.6 | Confident | 69.2 | Low | 20 Ų | 20 | 100 Ų | 100 | 14% | 0.14 | 52% | 0.522 | C | S | . | . | S | Bend | trans | -65.9 | 122.5 | 159.7 | -82 | 0 | 0 | 0 | 0 | 108.9 | K367 Y376 | K367-S371 WeakPolarHBondContact O-CB 3.46Å; K367-S371 PolarHBondContact O-N 2.91Å; K367-S371 PolarHBondContact O-OG 2.66Å; S371-Y376 PolarHBondContact OG-OH 3.39Å |
| 372 | D | 64.1 | Low | 67.9 | Low | 57 Ų | 57 | 104.7 Ų | 104.7 | 31% | 0.305 | 54% | 0.541 | S | S | . | . | trans | -66 | 129.9 | 162.7 | 156.3 | 21.9 | 0 | 0 | 0 | 108.9 | T370 S374 Q375 K411 | T370-D372 PolarHBondContact O-N 3.2Å; D372-S374 PolarHBondContact O-N 2.79Å; D372-S374 WeakPolarHBondContact OD1-CB 3.49Å; D372-S374 PolarHBondContact OD1-N 3.11Å; D372-S374 PolarHBondContact OD1-OG 2.97Å; D372-S374 PolarHBondContact OD2-OG 3.05Å; D372-Q375 VanDerWaalsContact O-CB 3.27Å; D372-Q375 WeakPolarHBondContact O-CB 3.45Å; D372-Q375 WeakPolarHBondContact O-CG 3.31Å; D372-Q375 PolarHBondContact O-N 3.37Å; D372-K411 WeakPolarHBondContact OD2-CE 3.34Å; D372-K411 IonicContact OD2-NZ 3.17Å | ||
| 373 | D | 65.1 | Low | 67 | Low | 129 Ų | 129 | 101.1 Ų | 101.1 | 69% | 0.69 | 53% | 0.526 | S | S | * | . | G | 310 helix | trans | -57.5 | -21.5 | 180 | -76.9 | -36.5 | 0 | 0 | 0 | 112.7 | Q375 Y376 R377 | D373-Q375 PolarHBondContact O-N 2.73Å; D373-Q375 VanDerWaalsContact O-N 3.1Å; D373-Y376 CarbonylContact O-C 3.5Å; D373-Y376 PolarHBondContact O-N 2.79Å; D373-R377 PolarHBondContact O-N 3.17Å |
| 374 | S | 62.4 | Low | 66.4 | Low | 28 Ų | 28 | 99.1 Ų | 99.1 | 20% | 0.196 | 52% | 0.516 | C | S | . | . | G | 310 helix | trans | -63.1 | -11.6 | 171 | 91.1 | 0 | 0 | 0 | 0 | 113.9 | D372 K411 | D372-S374 PolarHBondContact O-N 2.79Å; D372-S374 WeakPolarHBondContact OD1-CB 3.49Å; D372-S374 PolarHBondContact OD1-N 3.11Å; D372-S374 PolarHBondContact OD1-OG 2.97Å; D372-S374 PolarHBondContact OD2-OG 3.05Å; S374-K411 WeakPolarHBondContact OG-CE 3.4Å; S374-K411 PolarHBondContact OG-NZ 2.94Å |
| 375 | Q | 57.4 | Low | 65.8 | Low | 119 Ų | 119 | 93.7 Ų | 93.7 | 56% | 0.556 | 49% | 0.493 | S | S | * | . | G | 310 helix | trans | -88.1 | -19.5 | 171.3 | -56.7 | -178.4 | 6.9 | 0 | 0 | 113.1 | D372 D373 | D372-Q375 VanDerWaalsContact O-CB 3.27Å; D372-Q375 WeakPolarHBondContact O-CB 3.45Å; D372-Q375 WeakPolarHBondContact O-CG 3.31Å; D372-Q375 PolarHBondContact O-N 3.37Å; D373-Q375 PolarHBondContact O-N 2.73Å; D373-Q375 VanDerWaalsContact O-N 3.1Å |
| 376 | Y | 52.8 | Low | 65.3 | Low | 130 Ų | 130 | 90.7 Ų | 90.7 | 51% | 0.51 | 49% | 0.488 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -105.9 | -6.3 | 177.8 | -64.8 | -58.5 | 0 | 0 | 0 | 113.9 | K367 S371 D373 S378 | K367-Y376 WeakPolarHBondContact CE-OH 3.35Å; S371-Y376 PolarHBondContact OG-OH 3.39Å; D373-Y376 CarbonylContact O-C 3.5Å; D373-Y376 PolarHBondContact O-N 2.79Å; Y376-S378 PolarHBondContact O-N 3.48Å |
| 377 | R | 52.8 | Low | 64.8 | Low | 145 Ų | 145 | 96.1 Ų | 96.1 | 55% | 0.547 | 51% | 0.508 | S | S | . | . | S | Bend | trans | -57.1 | 112.9 | 144.5 | -91.6 | -142.7 | 179.1 | -140.5 | 0.3 | 107.4 | D373 K379 D383 | D373-R377 PolarHBondContact O-N 3.17Å; R377-K379 PolarHBondContact O-N 2.89Å; R377-D383 IonicContact CZ-OD2 3.26Å; R377-D383 IonicContact NH1-OD1 2.68Å; R377-D383 PolarHBondContact NH1-OD1 3.36Å; R377-D383 IonicContact NH1-OD2 3.47Å; R377-D383 PolarHBondContact NH1-OD2 3.37Å |
| 378 | S | 44.8 | Very low | 64.5 | Low | 77 Ų | 77 | 95.9 Ų | 95.9 | 54% | 0.538 | 51% | 0.512 | S | S | . | . | trans | -49.9 | 140.5 | 165.1 | 41.6 | 0 | 0 | 0 | 0 | 109.2 | Y376 S380 | Y376-S378 PolarHBondContact O-N 3.48Å; S378-S380 PolarHBondContact O-N 3.02Å; S378-S380 PolarHBondContact O-OG 2.86Å; S378-S380 WeakPolarHBondContact OG-CB 3.26Å; S378-S380 PolarHBondContact OG-OG 3.35Å | ||
| 379 | K | 53.1 | Low | 64.5 | Low | 192 Ų | 192 | 93.1 Ų | 93.1 | 84% | 0.835 | 49% | 0.494 | S | S | * | . | trans | -73.3 | 57.4 | 152.6 | -67.7 | -161.7 | 174 | -154.8 | 0 | 108.9 | R377 T381 | R377-K379 PolarHBondContact O-N 2.89Å; K379-T381 PolarHBondContact O-N 2.84Å | ||
| 380 | S | 47.5 | Very low | 64.3 | Low | 35 Ų | 35 | 92.5 Ų | 92.5 | 25% | 0.245 | 48% | 0.483 | C | S | . | . | trans | -62.8 | 124 | 167.2 | 28.4 | 0 | 0 | 0 | 0 | 106.5 | S378 D382 D383 | S378-S380 PolarHBondContact O-N 3.02Å; S378-S380 PolarHBondContact O-OG 2.86Å; S378-S380 WeakPolarHBondContact OG-CB 3.26Å; S378-S380 PolarHBondContact OG-OG 3.35Å; S380-D382 PolarHBondContact O-N 2.81Å; S380-D383 PolarHBondContact O-N 2.85Å; S380-D383 VanDerWaalsContact O-N 3.08Å | ||
| 381 | T | 55.1 | Low | 64.6 | Low | 116 Ų | 116 | 97.2 Ų | 97.2 | 71% | 0.712 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -4.8 | -177.5 | 42.9 | 0 | 0 | 0 | 0 | 114 | K379 | K379-T381 PolarHBondContact O-N 2.84Š|
| 382 | D | 56.9 | Low | 65.5 | Low | 147 Ų | 147 | 103.7 Ų | 103.7 | 79% | 0.786 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.3 | -30.4 | 176 | -47.9 | -46.4 | 0 | 0 | 0 | 113.4 | S380 | S380-D382 PolarHBondContact O-N 2.81Š|
| 383 | D | 64 | Low | 66.7 | Low | 69 Ų | 69 | 106 Ų | 106 | 37% | 0.369 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.3 | -30.5 | 175 | -95.1 | -27.3 | 0 | 0 | 0 | 111 | R377 S380 P385 H400 | R377-D383 IonicContact CZ-OD2 3.26Å; R377-D383 IonicContact NH1-OD1 2.68Å; R377-D383 PolarHBondContact NH1-OD1 3.36Å; R377-D383 IonicContact NH1-OD2 3.47Å; R377-D383 PolarHBondContact NH1-OD2 3.37Å; S380-D383 PolarHBondContact O-N 2.85Å; S380-D383 VanDerWaalsContact O-N 3.08Å; D383-P385 WeakPolarHBondContact O-CD 3.32Å; D383-H400 PolarHBondContact O-CD2 3.49Å; D383-H400 VanDerWaalsContact O-CD2 3.27Å |
| 384 | D | 70.9 | Confident | 67.8 | Low | 82 Ų | 82 | 106.4 Ų | 106.4 | 44% | 0.439 | 52% | 0.521 | S | S | . | . | S | Bend | trans | -66.7 | 112.9 | 174.3 | -98.3 | -52.4 | 0 | 0 | 0 | 109.7 | G386 H400 | D384-G386 VanDerWaalsContact C-N 3.26Å; D384-G386 PolarHBondContact O-N 3.15Å; D384-H400 IonicContact OD1-CE1 2.68Å; D384-H400 PolarHBondContact OD1-CE1 3.32Å; D384-H400 VanDerWaalsContact OD1-CE1 3.26Å; D384-H400 IonicContact OD1-NE2 3.48Å |
| 385 | P | 69.4 | Low | 69.1 | Low | 20 Ų | 20 | 111.9 Ų | 111.9 | 13% | 0.13 | 55% | 0.547 | C | S | . | . | trans | -73.2 | 86.7 | 175.5 | 31.4 | -34.4 | 0 | 0 | 0 | 108.9 | D383 A389 T396 W397 H400 | D383-P385 WeakPolarHBondContact O-CD 3.32Å; P385-A389 HydrophobicContact CB-CB 3.66Å; P385-T396 HydrophobicContact CB-CG2 4.06Å; P385-W397 HydrophobicContact CG-CB 4.5Å; P385-H400 VanDerWaalsContact CD-CD2 3.46Å; P385-H400 WeakPolarHBondContact CD-CD2 3.43Å; P385-H400 HydrophobicContact CG-CB 3.44Å; P385-H400 VanDerWaalsContact CG-CB 3.44Å | ||
| 386 | G | 75.2 | Confident | 70.8 | Confident | 45 Ų | 45 | 110 Ų | 110 | 46% | 0.464 | 54% | 0.543 | S | S | . | . | trans | -56.3 | 177.6 | -169.7 | 0 | 0 | 0 | 0 | 0 | 115 | D384 L388 A389 H390 | D384-G386 VanDerWaalsContact C-N 3.26Å; D384-G386 PolarHBondContact O-N 3.15Å; G386-L388 CarbonylContact O-C 3.12Å; G386-L388 PolarHBondContact O-N 2.75Å; G386-A389 WeakPolarHBondContact O-CA 3.31Å; G386-A389 WeakPolarHBondContact O-CB 3.39Å; G386-A389 PolarHBondContact O-N 3.08Å; G386-H390 PolarHBondContact O-N 3.26Å | ||
| 387 | K | 76.5 | Confident | 72.6 | Confident | 197 Ų | 197 | 107.2 Ų | 107.2 | 86% | 0.857 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.5 | -22.9 | -168.2 | -61.1 | 174.1 | -175.1 | 169.9 | 0 | 115.3 | ||
| 388 | L | 76.9 | Confident | 74.5 | Confident | 114 Ų | 114 | 104 Ų | 104 | 60% | 0.597 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | -42.6 | 170.4 | -75.2 | 169.6 | 0 | 0 | 0 | 113.7 | G386 R391 K392 | G386-L388 CarbonylContact O-C 3.12Å; G386-L388 PolarHBondContact O-N 2.75Å; L388-R391 CarbonylContact O-C 3.59Å; L388-R391 PolarHBondContact O-N 2.8Å; L388-R391 VanDerWaalsContact O-N 3.08Å; L388-K392 WeakPolarHBondContact O-CB 3.4Å; L388-K392 PolarHBondContact O-N 2.84Å |
| 389 | A | 80.2 | Confident | 76.7 | Confident | 14 Ų | 14 | 103 Ų | 103 | 12% | 0.116 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -68.5 | -37.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | P385 G386 R391 K392 H393 | P385-A389 HydrophobicContact CB-CB 3.66Å; G386-A389 WeakPolarHBondContact O-CA 3.31Å; G386-A389 WeakPolarHBondContact O-CB 3.39Å; G386-A389 PolarHBondContact O-N 3.08Å; A389-R391 PolarHBondContact O-N 3.24Å; A389-R391 VanDerWaalsContact O-N 3.1Å; A389-K392 PolarHBondContact O-N 3.1Å; A389-H393 HydrophobicContact CB-CB 4.08Å; A389-H393 CarbonylContact O-C 3.59Å; A389-H393 VanDerWaalsContact O-CA 3.31Å; A389-H393 WeakPolarHBondContact O-CA 3.38Å; A389-H393 PolarHBondContact O-N 3.42Å |
| 390 | H | 78.3 | Confident | 78.4 | Confident | 101 Ų | 101 | 95.8 Ų | 95.8 | 47% | 0.468 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -54.1 | -29.5 | 168.4 | -171.1 | 88.9 | 0 | 0 | 0 | 113 | G386 W397 | G386-H390 PolarHBondContact O-N 3.26Å; H390-W397 HydrophobicContact CB-CG 4.27Å; H390-W397 AromaticContact CE1-CD2 3.92Å; H390-W397 AromaticContact CE1-CE2 3.56Å; H390-W397 AromaticContact CE1-CH2 3.91Å; H390-W397 AromaticContact CE1-CZ2 3.57Å; H390-W397 AromaticContact ND1-CD1 3.49Å; H390-W397 AromaticContact ND1-CD2 3.34Å; H390-W397 VanDerWaalsContact ND1-CD2 3.34Å; H390-W397 AromaticContact ND1-CE2 3.09Å; H390-W397 AromaticContact ND1-CG 3.62Å; H390-W397 AromaticContact ND1-CZ2 3.62Å; H390-W397 AromaticContact ND1-NE1 3.17Å; H390-W397 PolarHBondContact ND1-NE1 3.34Å; H390-W397 VanDerWaalsContact ND1-NE1 3.17Å |
| 391 | R | 83.6 | Confident | 80.4 | Confident | 204 Ų | 204 | 98.3 Ų | 98.3 | 77% | 0.77 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -96.4 | -32.5 | -178.9 | -66.9 | 175 | 62.3 | -157.6 | -0.2 | 114.9 | L388 A389 | L388-R391 CarbonylContact O-C 3.59Å; L388-R391 PolarHBondContact O-N 2.8Å; L388-R391 VanDerWaalsContact O-N 3.08Å; A389-R391 PolarHBondContact O-N 3.24Å; A389-R391 VanDerWaalsContact O-N 3.1Å |
| 392 | K | 88.9 | Confident | 82.1 | Confident | 157 Ų | 157 | 95.4 Ų | 95.4 | 68% | 0.683 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -112.3 | -29.6 | -173.5 | -70.1 | -174.1 | 176.8 | -178 | 0 | 114.3 | L388 A389 | L388-K392 WeakPolarHBondContact O-CB 3.4Å; L388-K392 PolarHBondContact O-N 2.84Å; A389-K392 PolarHBondContact O-N 3.1Å |
| 393 | H | 89.2 | Confident | 83.7 | Confident | 105 Ų | 105 | 92.6 Ų | 92.6 | 49% | 0.486 | 47% | 0.468 | S | S | . | . | trans | -125.2 | 60 | -169.3 | -57.2 | -73.7 | 0 | 0 | 0 | 110.1 | A389 I395 T396 W397 | A389-H393 HydrophobicContact CB-CB 4.08Å; A389-H393 CarbonylContact O-C 3.59Å; A389-H393 VanDerWaalsContact O-CA 3.31Å; A389-H393 WeakPolarHBondContact O-CA 3.38Å; A389-H393 PolarHBondContact O-N 3.42Å; H393-I395 PolarHBondContact O-N 3.41Å; H393-I395 VanDerWaalsContact O-N 3.11Å; H393-T396 WeakPolarHBondContact O-CB 3.21Å; H393-T396 PolarHBondContact O-N 3.23Å; H393-W397 PolarHBondContact O-N 3.1Å | ||
| 394 | Q | 88.3 | Confident | 84.8 | Confident | 137 Ų | 137 | 94.8 Ų | 94.8 | 64% | 0.64 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -51.5 | -36.8 | -176.8 | -172.8 | -175.6 | 7.3 | 0 | 0 | 112.9 | W397 L398 | Q394-W397 PolarHBondContact O-N 3.34Å; Q394-L398 HydrophobicContact CG-CD1 3.96Å; Q394-L398 HydrophobicContact CG-CG 4.35Å; Q394-L398 WeakPolarHBondContact O-CB 3.42Å; Q394-L398 VanDerWaalsContact O-CG 3.26Å; Q394-L398 WeakPolarHBondContact O-CG 3.47Å; Q394-L398 PolarHBondContact O-N 3.16Å |
| 395 | I | 90.1 | Very high | 85.7 | Confident | 144 Ų | 144 | 95 Ų | 95 | 74% | 0.738 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -64.2 | -46 | 177.5 | -63.2 | 165.6 | 0 | 0 | 0 | 110.9 | H393 L398 A399 | H393-I395 PolarHBondContact O-N 3.41Å; H393-I395 VanDerWaalsContact O-N 3.11Å; I395-L398 PolarHBondContact O-N 3.08Å; I395-A399 WeakPolarHBondContact O-CB 3.31Å; I395-A399 PolarHBondContact O-N 3.07Å |
| 396 | T | 91.7 | Very high | 86.6 | Confident | 78 Ų | 78 | 100.7 Ų | 100.7 | 48% | 0.479 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.9 | -42.1 | 177.9 | -43.2 | 0 | 0 | 0 | 0 | 111.4 | P385 H393 A399 H400 | P385-T396 HydrophobicContact CB-CG2 4.06Å; H393-T396 WeakPolarHBondContact O-CB 3.21Å; H393-T396 PolarHBondContact O-N 3.23Å; T396-A399 PolarHBondContact O-N 3.27Å; T396-H400 PolarHBondContact O-N 3.39Å |
| 397 | W | 91.6 | Very high | 87.1 | Confident | 72 Ų | 72 | 101.4 Ų | 101.4 | 27% | 0.273 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.2 | -42.4 | 175.8 | -180 | 74.9 | 0 | 0 | 0 | 112.6 | P385 H390 H393 Q394 A399 H400 Q401 | P385-W397 HydrophobicContact CG-CB 4.5Å; H390-W397 HydrophobicContact CB-CG 4.27Å; H390-W397 AromaticContact CE1-CD2 3.92Å; H390-W397 AromaticContact CE1-CE2 3.56Å; H390-W397 AromaticContact CE1-CH2 3.91Å; H390-W397 AromaticContact CE1-CZ2 3.57Å; H390-W397 AromaticContact ND1-CD1 3.49Å; H390-W397 AromaticContact ND1-CD2 3.34Å; H390-W397 VanDerWaalsContact ND1-CD2 3.34Å; H390-W397 AromaticContact ND1-CE2 3.09Å; H390-W397 AromaticContact ND1-CG 3.62Å; H390-W397 AromaticContact ND1-CZ2 3.62Å; H390-W397 AromaticContact ND1-NE1 3.17Å; H390-W397 PolarHBondContact ND1-NE1 3.34Å; H390-W397 VanDerWaalsContact ND1-NE1 3.17Å; H393-W397 PolarHBondContact O-N 3.1Å; Q394-W397 PolarHBondContact O-N 3.34Å; W397-A399 VanDerWaalsContact C-N 3.35Å; W397-H400 PolarHBondContact O-N 2.94Å; W397-Q401 WeakPolarHBondContact O-CB 3.31Å; W397-Q401 PolarHBondContact O-N 3.43Å |
| 398 | L | 93 | Very high | 87.7 | Confident | 79 Ų | 79 | 96.3 Ų | 96.3 | 41% | 0.414 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -66.2 | -34.6 | 174.8 | -74.5 | 172.4 | 0 | 0 | 0 | 112.6 | Q394 I395 A402 | Q394-L398 HydrophobicContact CG-CD1 3.96Å; Q394-L398 HydrophobicContact CG-CG 4.35Å; Q394-L398 WeakPolarHBondContact O-CB 3.42Å; Q394-L398 VanDerWaalsContact O-CG 3.26Å; Q394-L398 WeakPolarHBondContact O-CG 3.47Å; Q394-L398 PolarHBondContact O-N 3.16Å; I395-L398 PolarHBondContact O-N 3.08Å; L398-A402 VanDerWaalsContact O-CB 3.3Å; L398-A402 WeakPolarHBondContact O-CB 3.37Å; L398-A402 PolarHBondContact O-N 3.25Å |
| 399 | A | 91 | Very high | 88.3 | Confident | 55 Ų | 55 | 94.4 Ų | 94.4 | 46% | 0.455 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.2 | -47.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | I395 T396 W397 A402 Q403 | I395-A399 WeakPolarHBondContact O-CB 3.31Å; I395-A399 PolarHBondContact O-N 3.07Å; T396-A399 PolarHBondContact O-N 3.27Å; W397-A399 VanDerWaalsContact C-N 3.35Å; A399-A402 PolarHBondContact O-N 3.47Å; A399-Q403 WeakPolarHBondContact O-CB 3.42Å; A399-Q403 PolarHBondContact O-N 3.23Å |
| 400 | H | 88.2 | Confident | 88.8 | Confident | 40 Ų | 40 | 99.3 Ų | 99.3 | 19% | 0.185 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -62.4 | -43.5 | 174.6 | -173.5 | -95.8 | 0 | 0 | 0 | 112.2 | D383 D384 P385 T396 W397 A402 Q403 E404 | D383-H400 PolarHBondContact O-CD2 3.49Å; D383-H400 VanDerWaalsContact O-CD2 3.27Å; D384-H400 IonicContact OD1-CE1 2.68Å; D384-H400 PolarHBondContact OD1-CE1 3.32Å; D384-H400 VanDerWaalsContact OD1-CE1 3.26Å; D384-H400 IonicContact OD1-NE2 3.48Å; P385-H400 VanDerWaalsContact CD-CD2 3.46Å; P385-H400 WeakPolarHBondContact CD-CD2 3.43Å; P385-H400 HydrophobicContact CG-CB 3.44Å; P385-H400 VanDerWaalsContact CG-CB 3.44Å; T396-H400 PolarHBondContact O-N 3.39Å; W397-H400 PolarHBondContact O-N 2.94Å; H400-A402 VanDerWaalsContact C-N 3.28Å; H400-A402 PolarHBondContact O-N 3.37Å; H400-Q403 PolarHBondContact O-N 3.39Å; H400-E404 WeakPolarHBondContact O-CB 3.24Å; H400-E404 PolarHBondContact O-N 3.18Å |
| 401 | Q | 89.9 | Confident | 89.3 | Confident | 89 Ų | 89 | 97.6 Ų | 97.6 | 42% | 0.416 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.3 | -35.7 | 176.3 | -168.8 | -176.9 | 34 | 0 | 0 | 112.2 | W397 N405 | W397-Q401 WeakPolarHBondContact O-CB 3.31Å; W397-Q401 PolarHBondContact O-N 3.43Å; Q401-N405 VanDerWaalsContact O-CB 3.3Å; Q401-N405 WeakPolarHBondContact O-CB 3.14Å; Q401-N405 PolarHBondContact O-N 2.95Å |
| 402 | A | 91.3 | Very high | 89.6 | Confident | 54 Ų | 54 | 93.7 Ų | 93.7 | 45% | 0.446 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -68.1 | -44 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L398 A399 H400 N405 E406 | L398-A402 VanDerWaalsContact O-CB 3.3Å; L398-A402 WeakPolarHBondContact O-CB 3.37Å; L398-A402 PolarHBondContact O-N 3.25Å; A399-A402 PolarHBondContact O-N 3.47Å; H400-A402 VanDerWaalsContact C-N 3.28Å; H400-A402 PolarHBondContact O-N 3.37Å; A402-N405 PolarHBondContact O-N 3.06Å; A402-E406 WeakPolarHBondContact O-CB 3.41Å; A402-E406 PolarHBondContact O-N 3.16Å |
| 403 | Q | 89.6 | Confident | 89.7 | Confident | 88 Ų | 88 | 93.8 Ų | 93.8 | 41% | 0.411 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.8 | -40.5 | 177.6 | -177.5 | 179.7 | -33.6 | 0 | 0 | 112.6 | A399 H400 E406 M407 | A399-Q403 WeakPolarHBondContact O-CB 3.42Å; A399-Q403 PolarHBondContact O-N 3.23Å; H400-Q403 PolarHBondContact O-N 3.39Å; Q403-E406 PolarHBondContact O-N 3.48Å; Q403-M407 WeakPolarHBondContact O-CB 3.48Å; Q403-M407 PolarHBondContact O-N 3.44Å |
| 404 | E | 86.3 | Confident | 89.7 | Confident | 115 Ų | 115 | 91.5 Ų | 91.5 | 54% | 0.537 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -64.1 | -43.7 | 174.5 | -176.1 | 176.7 | -149 | 0 | 0 | 111.5 | H400 M407 E408 | H400-E404 WeakPolarHBondContact O-CB 3.24Å; H400-E404 PolarHBondContact O-N 3.18Å; E404-M407 PolarHBondContact O-N 2.9Å; E404-E408 PolarHBondContact O-N 2.9Å |
| 405 | N | 90.4 | Very high | 89.8 | Confident | 88 Ų | 88 | 90.5 Ų | 90.5 | 47% | 0.471 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -67.6 | -38 | 176.3 | -178.9 | 30.7 | 0 | 0 | 0 | 112.3 | Q401 A402 E408 L409 | Q401-N405 VanDerWaalsContact O-CB 3.3Å; Q401-N405 WeakPolarHBondContact O-CB 3.14Å; Q401-N405 PolarHBondContact O-N 2.95Å; A402-N405 PolarHBondContact O-N 3.06Å; N405-E408 PolarHBondContact O-N 3.06Å; N405-L409 WeakPolarHBondContact O-CB 3.35Å; N405-L409 VanDerWaalsContact O-CG 3.27Å; N405-L409 WeakPolarHBondContact O-CG 3.3Å; N405-L409 PolarHBondContact O-N 2.92Å |
| 406 | E | 89.3 | Confident | 89.9 | Confident | 138 Ų | 138 | 87.3 Ų | 87.3 | 65% | 0.645 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -62.9 | -44.9 | 173.3 | -176.4 | 161.1 | -142.5 | 0 | 0 | 111.1 | A402 Q403 E408 L409 E410 | A402-E406 WeakPolarHBondContact O-CB 3.41Å; A402-E406 PolarHBondContact O-N 3.16Å; Q403-E406 PolarHBondContact O-N 3.48Å; E406-E408 PolarHBondContact O-N 2.94Å; E406-L409 PolarHBondContact O-N 3.1Å; E406-E410 WeakPolarHBondContact O-CB 3.36Å; E406-E410 PolarHBondContact O-N 2.84Å |
| 407 | M | 85.5 | Confident | 89.9 | Confident | 60 Ų | 60 | 91.5 Ų | 91.5 | 30% | 0.296 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -62.7 | -38.8 | 174.5 | -169.7 | -162.9 | -63.3 | 0 | 0 | 112.6 | Q403 E404 K411 | Q403-M407 WeakPolarHBondContact O-CB 3.48Å; Q403-M407 PolarHBondContact O-N 3.44Å; E404-M407 PolarHBondContact O-N 2.9Å; M407-K411 HydrophobicContact CG-CD 4.17Å; M407-K411 WeakPolarHBondContact O-CB 3.46Å; M407-K411 WeakPolarHBondContact O-CD 3.26Å; M407-K411 VanDerWaalsContact O-CG 3.31Å; M407-K411 WeakPolarHBondContact O-CG 3.31Å; M407-K411 PolarHBondContact O-N 3Å; M407-K411 PolarHBondContact SD-NZ 3.48Å |
| 408 | E | 87.5 | Confident | 89.8 | Confident | 91 Ų | 91 | 97.2 Ų | 97.2 | 43% | 0.425 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -68.5 | -38.8 | 175.4 | -158.6 | -162.3 | -164.2 | 0 | 0 | 111.8 | E404 N405 E406 R412 | E404-E408 PolarHBondContact O-N 2.9Å; N405-E408 PolarHBondContact O-N 3.06Å; E406-E408 PolarHBondContact O-N 2.94Å; E408-R412 VanDerWaalsContact CD-CZ 3.42Å; E408-R412 WeakPolarHBondContact O-CG 3.46Å; E408-R412 PolarHBondContact O-N 3.02Å; E408-R412 IonicContact OE1-CZ 2.69Å; E408-R412 VanDerWaalsContact OE1-CZ 3.29Å; E408-R412 IonicContact OE1-NH1 3.78Å; E408-R412 PolarHBondContact OE1-NH1 3.47Å; E408-R412 IonicContact OE1-NH2 2.74Å; E408-R412 PolarHBondContact OE1-NH2 3.22Å; E408-R412 IonicContact OE2-CZ 3.29Å; E408-R412 IonicContact OE2-NH1 3.34Å; E408-R412 PolarHBondContact OE2-NH1 2.96Å; E408-R412 IonicContact OE2-NH2 2.66Å; E408-R412 PolarHBondContact OE2-NH2 3.11Å |
| 409 | L | 91.2 | Very high | 89.7 | Confident | 74 Ų | 74 | 98 Ų | 98 | 39% | 0.387 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.7 | -43.1 | 174.8 | -76.2 | 168.4 | 0 | 0 | 0 | 111.9 | N405 E406 R412 W413 | N405-L409 WeakPolarHBondContact O-CB 3.35Å; N405-L409 VanDerWaalsContact O-CG 3.27Å; N405-L409 WeakPolarHBondContact O-CG 3.3Å; N405-L409 PolarHBondContact O-N 2.92Å; E406-L409 PolarHBondContact O-N 3.1Å; L409-R412 PolarHBondContact O-N 3.06Å; L409-W413 VanDerWaalsContact O-CB 3.24Å; L409-W413 WeakPolarHBondContact O-CB 3.3Å; L409-W413 PolarHBondContact O-N 2.85Å |
| 410 | E | 90.1 | Very high | 89.8 | Confident | 116 Ų | 116 | 102.6 Ų | 102.6 | 54% | 0.542 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61 | -45.1 | 175.5 | 179.4 | 156.1 | -134.7 | 0 | 0 | 111.2 | E406 R412 W413 A414 | E406-E410 WeakPolarHBondContact O-CB 3.36Å; E406-E410 PolarHBondContact O-N 2.84Å; E410-R412 PolarHBondContact O-N 3.3Å; E410-W413 CarbonylContact O-C 3.52Å; E410-W413 WeakPolarHBondContact O-CA 3.27Å; E410-W413 WeakPolarHBondContact O-CB 3.37Å; E410-W413 PolarHBondContact O-N 3.46Å; E410-A414 WeakPolarHBondContact O-CB 3.29Å; E410-A414 PolarHBondContact O-N 2.86Å |
| 411 | K | 88.8 | Confident | 90 | Very high | 65 Ų | 65 | 103.5 Ų | 103.5 | 28% | 0.283 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -46.8 | 175.8 | -74.9 | 165.6 | -175.4 | 171.8 | 0 | 111.6 | D372 S374 M407 W413 A414 E415 | D372-K411 WeakPolarHBondContact OD2-CE 3.34Å; D372-K411 IonicContact OD2-NZ 3.17Å; S374-K411 WeakPolarHBondContact OG-CE 3.4Å; S374-K411 PolarHBondContact OG-NZ 2.94Å; M407-K411 HydrophobicContact CG-CD 4.17Å; M407-K411 WeakPolarHBondContact O-CB 3.46Å; M407-K411 WeakPolarHBondContact O-CD 3.26Å; M407-K411 VanDerWaalsContact O-CG 3.31Å; M407-K411 WeakPolarHBondContact O-CG 3.31Å; M407-K411 PolarHBondContact O-N 3Å; M407-K411 PolarHBondContact SD-NZ 3.48Å; K411-W413 VanDerWaalsContact C-N 3.27Å; K411-W413 PolarHBondContact O-N 2.92Å; K411-A414 PolarHBondContact O-N 3.27Å; K411-E415 WeakPolarHBondContact O-CB 3.49Å; K411-E415 VanDerWaalsContact O-CG 3.31Å; K411-E415 WeakPolarHBondContact O-CG 3.5Å; K411-E415 PolarHBondContact O-N 3.45Å |
| 412 | R | 90.5 | Very high | 90.1 | Very high | 123 Ų | 123 | 102.5 Ų | 102.5 | 46% | 0.464 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.4 | -34 | 171.7 | -74.2 | -175.8 | 179.7 | 114.5 | 9.9 | 113.3 | E408 L409 E410 S416 | E408-R412 VanDerWaalsContact CD-CZ 3.42Å; E408-R412 WeakPolarHBondContact O-CG 3.46Å; E408-R412 PolarHBondContact O-N 3.02Å; E408-R412 IonicContact OE1-CZ 2.69Å; E408-R412 VanDerWaalsContact OE1-CZ 3.29Å; E408-R412 IonicContact OE1-NH1 3.78Å; E408-R412 PolarHBondContact OE1-NH1 3.47Å; E408-R412 IonicContact OE1-NH2 2.74Å; E408-R412 PolarHBondContact OE1-NH2 3.22Å; E408-R412 IonicContact OE2-CZ 3.29Å; E408-R412 IonicContact OE2-NH1 3.34Å; E408-R412 PolarHBondContact OE2-NH1 2.96Å; E408-R412 IonicContact OE2-NH2 2.66Å; E408-R412 PolarHBondContact OE2-NH2 3.11Å; L409-R412 PolarHBondContact O-N 3.06Å; E410-R412 PolarHBondContact O-N 3.3Å; R412-S416 WeakPolarHBondContact O-CB 3.38Å; R412-S416 PolarHBondContact O-N 2.92Å |
| 413 | W | 90.6 | Very high | 90.2 | Very high | 159 Ų | 159 | 103.7 Ų | 103.7 | 60% | 0.602 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -75.5 | -33.3 | 178.4 | -88.5 | 11.1 | 0 | 0 | 0 | 113.2 | L409 E410 K411 R417 | L409-W413 VanDerWaalsContact O-CB 3.24Å; L409-W413 WeakPolarHBondContact O-CB 3.3Å; L409-W413 PolarHBondContact O-N 2.85Å; E410-W413 CarbonylContact O-C 3.52Å; E410-W413 WeakPolarHBondContact O-CA 3.27Å; E410-W413 WeakPolarHBondContact O-CB 3.37Å; E410-W413 PolarHBondContact O-N 3.46Å; K411-W413 VanDerWaalsContact C-N 3.27Å; K411-W413 PolarHBondContact O-N 2.92Å; W413-R417 WeakPolarHBondContact O-CB 3.38Å; W413-R417 VanDerWaalsContact O-CG 3.31Å; W413-R417 WeakPolarHBondContact O-CG 3.49Å; W413-R417 PolarHBondContact O-N 2.99Å; W413-R417 VanDerWaalsContact O-N 3.1Å; W413-R417 PolarHBondContact O-NH1 3.06Å; W413-R417 VanDerWaalsContact O-NH1 3.15Å |
| 414 | A | 88.4 | Confident | 90.5 | Very high | 56 Ų | 56 | 107.8 Ų | 107.8 | 46% | 0.463 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -71.2 | -46.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | E410 K411 S416 R417 R418 | E410-A414 WeakPolarHBondContact O-CB 3.29Å; E410-A414 PolarHBondContact O-N 2.86Å; K411-A414 PolarHBondContact O-N 3.27Å; A414-S416 PolarHBondContact O-N 2.96Å; A414-R417 PolarHBondContact O-N 3.4Å; A414-R418 WeakPolarHBondContact O-CB 3.5Å; A414-R418 PolarHBondContact O-N 2.92Å |
| 415 | E | 91 | Very high | 90.8 | Very high | 116 Ų | 116 | 106.6 Ų | 106.6 | 54% | 0.542 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -56.9 | -46 | 171.7 | -74.9 | 175.5 | 177.9 | 0 | 0 | 112.1 | K411 R417 R418 N419 | K411-E415 WeakPolarHBondContact O-CB 3.49Å; K411-E415 VanDerWaalsContact O-CG 3.31Å; K411-E415 WeakPolarHBondContact O-CG 3.5Å; K411-E415 PolarHBondContact O-N 3.45Å; E415-R417 PolarHBondContact O-N 3.06Å; E415-R418 PolarHBondContact O-N 3.21Å; E415-N419 VanDerWaalsContact O-CB 3.26Å; E415-N419 WeakPolarHBondContact O-CB 3.42Å; E415-N419 PolarHBondContact O-N 3.25Å; E415-N419 PolarHBondContact O-ND2 3.33Å |
| 416 | S | 91.3 | Very high | 91 | Very high | 77 Ų | 77 | 109.2 Ų | 109.2 | 54% | 0.538 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.5 | -41.9 | 177.9 | -176.6 | 0 | 0 | 0 | 0 | 112 | R412 A414 K420 | R412-S416 WeakPolarHBondContact O-CB 3.38Å; R412-S416 PolarHBondContact O-N 2.92Å; A414-S416 PolarHBondContact O-N 2.96Å; S416-K420 WeakPolarHBondContact O-CB 3.48Å; S416-K420 PolarHBondContact O-N 3.3Å |
| 417 | R | 92.2 | Very high | 91.3 | Very high | 167 Ų | 167 | 108.5 Ų | 108.5 | 63% | 0.63 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63 | -46.7 | 172.1 | -76.8 | 175.2 | 178.9 | 84.5 | -12.2 | 111.9 | W413 A414 E415 N419 K420 A421 | W413-R417 WeakPolarHBondContact O-CB 3.38Å; W413-R417 VanDerWaalsContact O-CG 3.31Å; W413-R417 WeakPolarHBondContact O-CG 3.49Å; W413-R417 PolarHBondContact O-N 2.99Å; W413-R417 VanDerWaalsContact O-N 3.1Å; W413-R417 PolarHBondContact O-NH1 3.06Å; W413-R417 VanDerWaalsContact O-NH1 3.15Å; A414-R417 PolarHBondContact O-N 3.4Å; E415-R417 PolarHBondContact O-N 3.06Å; R417-N419 PolarHBondContact O-N 3.18Å; R417-K420 PolarHBondContact O-N 3.44Å; R417-A421 WeakPolarHBondContact O-CB 3.35Å; R417-A421 PolarHBondContact O-N 2.83Å |
| 418 | R | 89.4 | Confident | 91.5 | Very high | 192 Ų | 192 | 108.8 Ų | 108.8 | 73% | 0.725 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.2 | -44 | 177.3 | -177.6 | -179.1 | 176 | 110.3 | 0 | 111.7 | A414 E415 A421 S422 | A414-R418 WeakPolarHBondContact O-CB 3.5Å; A414-R418 PolarHBondContact O-N 2.92Å; E415-R418 PolarHBondContact O-N 3.21Å; R418-A421 PolarHBondContact O-N 3.16Å; R418-S422 VanDerWaalsContact O-CB 3.29Å; R418-S422 WeakPolarHBondContact O-CB 3.33Å; R418-S422 PolarHBondContact O-N 3.43Å |
| 419 | N | 91.5 | Very high | 91 | Very high | 95 Ų | 95 | 113.5 Ų | 113.5 | 51% | 0.508 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.9 | -38.7 | 176.8 | -72.9 | -28.1 | 0 | 0 | 0 | 111.7 | E415 R417 N423 | E415-N419 VanDerWaalsContact O-CB 3.26Å; E415-N419 WeakPolarHBondContact O-CB 3.42Å; E415-N419 PolarHBondContact O-N 3.25Å; E415-N419 PolarHBondContact O-ND2 3.33Å; R417-N419 PolarHBondContact O-N 3.18Å; N419-N423 WeakPolarHBondContact O-CB 3.41Å; N419-N423 VanDerWaalsContact O-CG 3.24Å; N419-N423 PolarHBondContact O-N 3.08Å; N419-N423 PolarHBondContact O-ND2 3.01Å |
| 420 | K | 93.2 | Very high | 90.9 | Very high | 152 Ų | 152 | 115.5 Ų | 115.5 | 66% | 0.661 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64.2 | -43.7 | 172.4 | -170.9 | -179.5 | 179.9 | -174.5 | 0 | 111.9 | S416 R417 N423 R424 | S416-K420 WeakPolarHBondContact O-CB 3.48Å; S416-K420 PolarHBondContact O-N 3.3Å; R417-K420 PolarHBondContact O-N 3.44Å; K420-N423 PolarHBondContact O-N 2.88Å; K420-R424 WeakPolarHBondContact O-CB 3.45Å; K420-R424 PolarHBondContact O-N 2.92Å |
| 421 | A | 92.2 | Very high | 91 | Very high | 58 Ų | 58 | 115.4 Ų | 115.4 | 48% | 0.479 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -63.7 | -44.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | R417 R418 N423 R424 A425 | R417-A421 WeakPolarHBondContact O-CB 3.35Å; R417-A421 PolarHBondContact O-N 2.83Å; R418-A421 PolarHBondContact O-N 3.16Å; A421-N423 PolarHBondContact O-N 2.99Å; A421-R424 PolarHBondContact O-N 2.94Å; A421-A425 WeakPolarHBondContact O-CB 3.45Å; A421-A425 PolarHBondContact O-N 2.81Å |
| 422 | S | 91.8 | Very high | 91.1 | Very high | 68 Ų | 68 | 118.2 Ų | 118.2 | 48% | 0.476 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -62.2 | -40.8 | 175.7 | -174.3 | 0 | 0 | 0 | 0 | 112.3 | R418 A425 K426 | R418-S422 VanDerWaalsContact O-CB 3.29Å; R418-S422 WeakPolarHBondContact O-CB 3.33Å; R418-S422 PolarHBondContact O-N 3.43Å; S422-A425 PolarHBondContact O-N 2.97Å; S422-K426 VanDerWaalsContact O-CB 3.25Å; S422-K426 WeakPolarHBondContact O-CB 3.35Å; S422-K426 PolarHBondContact O-N 3.22Å |
| 423 | N | 93.9 | Very high | 91.1 | Very high | 79 Ų | 79 | 117.9 Ų | 117.9 | 42% | 0.422 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -66.4 | -43.2 | 173.7 | -74.9 | -24.8 | 0 | 0 | 0 | 111.9 | N419 K420 A421 A425 K426 Y427 | N419-N423 WeakPolarHBondContact O-CB 3.41Å; N419-N423 VanDerWaalsContact O-CG 3.24Å; N419-N423 PolarHBondContact O-N 3.08Å; N419-N423 PolarHBondContact O-ND2 3.01Å; K420-N423 PolarHBondContact O-N 2.88Å; A421-N423 PolarHBondContact O-N 2.99Å; N423-A425 VanDerWaalsContact C-N 3.32Å; N423-A425 PolarHBondContact O-N 3.03Å; N423-K426 PolarHBondContact O-N 3.42Å; N423-K426 VanDerWaalsContact O-N 3.16Å; N423-Y427 HydrophobicContact CB-CD2 4.4Å; N423-Y427 WeakPolarHBondContact O-CB 3.28Å; N423-Y427 WeakPolarHBondContact O-CD2 3.42Å; N423-Y427 PolarHBondContact O-N 3.09Å |
| 424 | R | 94.6 | Very high | 91.2 | Very high | 174 Ų | 174 | 115.4 Ų | 115.4 | 66% | 0.657 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -61.4 | -40.4 | 175.3 | -165.3 | 178.2 | 82.7 | 160.1 | 4.6 | 111.5 | K420 A421 G428 | K420-R424 WeakPolarHBondContact O-CB 3.45Å; K420-R424 PolarHBondContact O-N 2.92Å; A421-R424 PolarHBondContact O-N 2.94Å; R424-G428 WeakPolarHBondContact O-CA 3.43Å; R424-G428 PolarHBondContact O-N 3.1Å |
| 425 | A | 92.7 | Very high | 91.4 | Very high | 91 Ų | 91 | 119.3 Ų | 119.3 | 75% | 0.752 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -66.8 | -34.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113 | A421 S422 N423 | A421-A425 WeakPolarHBondContact O-CB 3.45Å; A421-A425 PolarHBondContact O-N 2.81Å; S422-A425 PolarHBondContact O-N 2.97Å; N423-A425 VanDerWaalsContact C-N 3.32Å; N423-A425 PolarHBondContact O-N 3.03Å |
| 426 | K | 96 | Very high | 91.4 | Very high | 143 Ų | 143 | 119.6 Ų | 119.6 | 62% | 0.622 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -84 | -28.7 | -178.2 | -172.6 | 177.3 | 178.1 | -162.3 | 0 | 114.4 | S422 N423 | S422-K426 VanDerWaalsContact O-CB 3.25Å; S422-K426 WeakPolarHBondContact O-CB 3.35Å; S422-K426 PolarHBondContact O-N 3.22Å; N423-K426 PolarHBondContact O-N 3.42Å; N423-K426 VanDerWaalsContact O-N 3.16Å |
| 427 | Y | 96 | Very high | 91.4 | Very high | 123 Ų | 123 | 122.8 Ų | 122.8 | 48% | 0.482 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -127.9 | -12 | -170.3 | -60.6 | -68.5 | 0 | 0 | 0 | 114.9 | N423 F429 | N423-Y427 HydrophobicContact CB-CD2 4.4Å; N423-Y427 WeakPolarHBondContact O-CB 3.28Å; N423-Y427 WeakPolarHBondContact O-CD2 3.42Å; N423-Y427 PolarHBondContact O-N 3.09Å; Y427-F429 VanDerWaalsContact C-N 3.34Å; Y427-F429 HydrophobicContact CG-CZ 4.4Å; Y427-F429 WeakPolarHBondContact O-CD1 3.35Å; Y427-F429 WeakPolarHBondContact O-CE1 3.3Å |
| 428 | G | 88.5 | Confident | 91.3 | Very high | 65 Ų | 65 | 119.2 Ų | 119.2 | 67% | 0.67 | 61% | 0.607 | S | S | * | * | trans | 81.3 | 1.7 | 180 | 0 | 0 | 0 | 0 | 0 | 115.8 | R424 | R424-G428 WeakPolarHBondContact O-CA 3.43Å; R424-G428 PolarHBondContact O-N 3.1Å | ||
| 429 | F | 76.3 | Confident | 91.5 | Very high | 190 Ų | 190 | 112.5 Ų | 112.5 | 83% | 0.833 | 60% | 0.597 | S | S | * | * | trans | -136.1 | 0 | -179.2 | 53.7 | -99.2 | 0 | 0 | 0 | 113 | Y427 | Y427-F429 VanDerWaalsContact C-N 3.34Å; Y427-F429 HydrophobicContact CG-CZ 4.4Å; Y427-F429 WeakPolarHBondContact O-CD1 3.35Å; Y427-F429 WeakPolarHBondContact O-CE1 3.3Å |
Retrieved 429 of 429 residues in 56.9 ms
(Link to these results)