| 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 | 42 | Very low | 46.3 | Very low | 248 Ų | 248 | 165.6 Ų | 165.6 | 100% | 1.222 | 86% | 0.862 | S | S | * | * | 0 | -172.2 | 0 | -81.3 | 178.1 | 166.4 | 0 | 0 | 109 | |||||
| 2 | M | 48.5 | Very low | 45.9 | Very low | 198 Ų | 198 | 159.8 Ų | 159.8 | 98% | 0.975 | 85% | 0.846 | S | S | * | * | trans | -56.8 | 157.8 | -173.1 | -53.1 | 169.2 | -163.8 | 0 | 0 | 113.2 | ||||
| 3 | G | 43 | Very low | 45.4 | Very low | 77 Ų | 77 | 156.7 Ų | 156.7 | 79% | 0.794 | 85% | 0.845 | S | S | * | * | cis | -168 | -176.3 | 5.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 4 | R | 41.7 | Very low | 45.2 | Very low | 238 Ų | 238 | 153.9 Ų | 153.9 | 90% | 0.898 | 84% | 0.844 | S | S | * | * | trans | -88.2 | 157.6 | -176.4 | -67.4 | 172.8 | 167.9 | 174.8 | -5.2 | 113 | ||||
| 5 | S | 57.1 | Low | 45 | Very low | 123 Ų | 123 | 150.7 Ų | 150.7 | 86% | 0.86 | 84% | 0.836 | S | S | * | * | trans | -158.5 | 142.2 | 132.9 | -85.1 | 0 | 0 | 0 | 0 | 112 | ||||
| 6 | H | 42.6 | Very low | 45.3 | Very low | 185 Ų | 185 | 150.3 Ų | 150.3 | 86% | 0.856 | 83% | 0.832 | S | S | * | * | trans | -121.1 | 153.3 | 167.4 | -75.1 | -69.9 | 0 | 0 | 0 | 108.6 | ||||
| 7 | S | 53.9 | Low | 45.2 | Very low | 113 Ų | 113 | 151.1 Ų | 151.1 | 79% | 0.79 | 83% | 0.828 | S | S | * | * | trans | -131.5 | 143.8 | 160.9 | -174.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 8 | R | 44.8 | Very low | 45.5 | Very low | 224 Ų | 224 | 152.3 Ų | 152.3 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | -143 | 135.8 | 172 | -65.8 | -175.4 | -174.2 | 174.5 | 1.8 | 108.8 | ||||
| 9 | Y | 49.5 | Very low | 45.4 | Very low | 217 Ų | 217 | 152.4 Ų | 152.4 | 85% | 0.851 | 82% | 0.819 | S | S | * | * | trans | -133.5 | 120.8 | 156.8 | -102.8 | -105.4 | 0 | 0 | 0 | 105.1 | ||||
| 10 | S | 43.4 | Very low | 45.3 | Very low | 84 Ų | 84 | 153.7 Ų | 153.7 | 59% | 0.587 | 81% | 0.811 | S | S | * | * | 67.3 | 99.4 | 56.9 | -54.4 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 11 | S | 43.2 | Very low | 45.3 | Very low | 115 Ų | 115 | 152.6 Ų | 152.6 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | 84 | 146.1 | 86.6 | -66.8 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 12 | S | 41.4 | Very low | 45.4 | Very low | 95 Ų | 95 | 148.1 Ų | 148.1 | 66% | 0.664 | 78% | 0.781 | S | S | * | * | cis | -177 | 150.7 | -16.1 | 50.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 13 | S | 38.9 | Very low | 45.4 | Very low | 120 Ų | 120 | 146.8 Ų | 146.8 | 84% | 0.839 | 77% | 0.772 | S | S | * | * | trans | 53.2 | 128.8 | 150.9 | -53.7 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 14 | S | 42.4 | Very low | 45.5 | Very low | 118 Ų | 118 | 149.3 Ų | 149.3 | 83% | 0.825 | 77% | 0.772 | S | S | * | * | -164.9 | 142.2 | 125.2 | -164 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 15 | S | 42.2 | Very low | 45.8 | Very low | 105 Ų | 105 | 147.2 Ų | 147.2 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | trans | -102.9 | 168.9 | 171 | 57.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 16 | N | 50.9 | Low | 45.5 | Very low | 144 Ų | 144 | 145.9 Ų | 145.9 | 77% | 0.77 | 76% | 0.758 | S | S | * | * | trans | -156.7 | 138.5 | 151.4 | -112.2 | -56.7 | 0 | 0 | 0 | 112.1 | ||||
| 17 | E | 42.7 | Very low | 45.9 | Very low | 164 Ų | 164 | 145.9 Ų | 145.9 | 77% | 0.766 | 76% | 0.758 | S | S | * | * | trans | -144.3 | 135.7 | -176.4 | -179 | -171.6 | 161.4 | 0 | 0 | 109.2 | ||||
| 18 | K | 50.3 | Low | 45.5 | Very low | 173 Ų | 173 | 143.6 Ų | 143.6 | 75% | 0.752 | 75% | 0.752 | S | S | * | * | trans | -162.8 | 117.6 | 163.9 | -96 | 123.4 | -163.7 | 170.7 | 0 | 109 | ||||
| 19 | H | 43.8 | Very low | 45.6 | Very low | 155 Ų | 155 | 145.1 Ų | 145.1 | 72% | 0.718 | 76% | 0.758 | S | S | * | * | 69.6 | 145.2 | 87.9 | -88.1 | -112 | 0 | 0 | 0 | 115 | |||||
| 20 | R | 43.7 | Very low | 45.7 | Very low | 178 Ų | 178 | 139.6 Ų | 139.6 | 67% | 0.672 | 75% | 0.751 | S | S | * | * | cis | 147.2 | 116.9 | -20.9 | -109.3 | -159.6 | 180 | -175.1 | 8.7 | 107.7 | Y22 | R20-Y22 PolarHBondContact NH1-OH 3.47Š| ||
| 21 | T | 44.4 | Very low | 45.9 | Very low | 130 Ų | 130 | 144 Ų | 144 | 80% | 0.798 | 76% | 0.762 | S | S | * | * | trans | -167.2 | 119.5 | 156.4 | 26.6 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 22 | Y | 45 | Very low | 46.4 | Very low | 154 Ų | 154 | 150.2 Ų | 150.2 | 60% | 0.604 | 77% | 0.768 | S | S | * | * | 71.2 | 136.5 | 61.6 | -58.1 | -51.1 | 0 | 0 | 0 | 113.3 | R20 | R20-Y22 PolarHBondContact NH1-OH 3.47Š| |||
| 23 | H | 48 | Very low | 46.9 | Very low | 170 Ų | 170 | 154.5 Ų | 154.5 | 79% | 0.787 | 77% | 0.774 | S | S | * | * | cis | -114.7 | -128.6 | 5.1 | -59.9 | -100.7 | 0 | 0 | 0 | 112.2 | ||||
| 24 | T | 46.1 | Very low | 47.7 | Very low | 130 Ų | 130 | 158 Ų | 158 | 80% | 0.798 | 78% | 0.775 | S | S | * | * | cis | -159 | -178 | 0.6 | -23.6 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 25 | K | 46.4 | Very low | 48.3 | Very low | 194 Ų | 194 | 158.4 Ų | 158.4 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | trans | -152.9 | -161.8 | 173.8 | -48.5 | 179.3 | -176.9 | 173.9 | 0 | 108.9 | ||||
| 26 | P | 51.7 | Low | 48.7 | Very low | 96 Ų | 96 | 163.4 Ų | 163.4 | 62% | 0.623 | 78% | 0.78 | S | S | * | * | cis | -135.3 | -167.4 | -23.7 | 21.2 | 6.1 | 0 | 0 | 0 | 114.6 | ||||
| 27 | H | 50.2 | Low | 48.7 | Very low | 185 Ų | 185 | 166 Ų | 166 | 86% | 0.856 | 79% | 0.785 | S | S | * | * | trans | 74.6 | 149.3 | 163.4 | -53.2 | -72.8 | 0 | 0 | 0 | 119.8 | ||||
| 28 | G | 46.1 | Very low | 49.1 | Very low | 64 Ų | 64 | 168.3 Ų | 168.3 | 66% | 0.66 | 79% | 0.792 | S | S | * | * | cis | 162.5 | 135.1 | -14.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 29 | R | 47.6 | Very low | 49.2 | Very low | 257 Ų | 257 | 164.3 Ų | 164.3 | 97% | 0.97 | 79% | 0.786 | S | S | * | * | trans | 63.9 | 162.3 | 178.4 | -59 | 177 | 170.6 | 168.6 | -4.1 | 113.7 | ||||
| 30 | S | 50.7 | Low | 49.8 | Very low | 100 Ų | 100 | 163 Ų | 163 | 70% | 0.699 | 79% | 0.789 | S | S | * | * | cis | -144.6 | -178.2 | 2.4 | -155.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 31 | H | 48.6 | Very low | 50.3 | Low | 177 Ų | 177 | 161.1 Ų | 161.1 | 82% | 0.819 | 79% | 0.792 | S | S | * | * | trans | -53.7 | 142.4 | -174.1 | -40.7 | -89.9 | 0 | 0 | 0 | 116.4 | ||||
| 32 | R | 53.2 | Low | 50.8 | Low | 246 Ų | 246 | 161 Ų | 161 | 93% | 0.928 | 79% | 0.785 | S | S | * | * | -168.8 | 154 | 113.9 | -108.7 | 175.5 | 179.2 | -166.7 | 0.5 | 116.6 | |||||
| 33 | K | 52.9 | Low | 51.4 | Low | 184 Ų | 184 | 159.9 Ų | 159.9 | 80% | 0.8 | 79% | 0.79 | S | S | * | * | trans | -31 | 141.3 | 169 | -76.6 | 172.4 | 173.6 | 175 | 0 | 119.1 | ||||
| 34 | K | 54.5 | Low | 51.9 | Low | 195 Ų | 195 | 154.6 Ų | 154.6 | 85% | 0.848 | 78% | 0.776 | S | S | * | * | trans | 83.9 | 153.3 | 144.3 | -69.6 | 176.4 | 175.4 | -169 | 0 | 120.9 | ||||
| 35 | V | 55.9 | Low | 52.8 | Low | 125 Ų | 125 | 151.5 Ų | 151.5 | 76% | 0.758 | 76% | 0.759 | S | S | * | * | trans | 71.8 | 78.9 | 163.1 | -152.7 | 0 | 0 | 0 | 0 | 120.4 | K37 | V35-K37 PolarHBondContact O-N 2.94Š| ||
| 36 | K | 50.1 | Low | 53.9 | Low | 210 Ų | 210 | 146 Ų | 146 | 91% | 0.913 | 74% | 0.739 | S | S | * | * | 40.6 | 81.1 | 115.2 | -157.2 | 177.5 | -172.9 | -179.2 | 0 | 117.6 | |||||
| 37 | K | 51.1 | Low | 55 | Low | 199 Ų | 199 | 144.2 Ų | 144.2 | 87% | 0.865 | 73% | 0.729 | S | S | * | * | trans | -134.1 | 124.1 | 158.6 | -84 | -174.9 | 175.5 | 178 | 0 | 110.8 | V35 | V35-K37 PolarHBondContact O-N 2.94Š| ||
| 38 | K | 49.9 | Very low | 56.3 | Low | 213 Ų | 213 | 144.3 Ų | 144.3 | 93% | 0.926 | 72% | 0.722 | S | S | * | * | trans | -159 | 76.3 | 177 | -166.6 | 177.6 | -177.3 | -178.5 | 0 | 111.5 | ||||
| 39 | S | 53.7 | Low | 58 | Low | 88 Ų | 88 | 147.2 Ų | 147.2 | 62% | 0.615 | 72% | 0.718 | S | S | * | * | trans | -156 | -24.8 | -178.5 | 52.1 | 0 | 0 | 0 | 0 | 116.5 | N41 | S39-N41 PolarHBondContact O-N 3.42Š| ||
| 40 | V | 56.5 | Low | 59.7 | Low | 128 Ų | 128 | 141.2 Ų | 141.2 | 78% | 0.776 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | -25.2 | -163.3 | -176.4 | 0 | 0 | 0 | 0 | 115.1 | L42 | V40-L42 PolarHBondContact O-N 3.41Š|
| 41 | N | 54.5 | Low | 61.4 | Low | 138 Ų | 138 | 140.7 Ų | 140.7 | 74% | 0.738 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -6.2 | -166.9 | -149 | 4.9 | 0 | 0 | 0 | 115.3 | S39 | S39-N41 PolarHBondContact O-N 3.42Š|
| 42 | L | 55.1 | Low | 63.3 | Low | 127 Ų | 127 | 139.9 Ų | 139.9 | 67% | 0.665 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -75.9 | -23.6 | -174.2 | -73 | 168.6 | 0 | 0 | 0 | 114.2 | V40 S45 | V40-L42 PolarHBondContact O-N 3.41Å; L42-S45 PolarHBondContact O-OG 3.46Å |
| 43 | N | 57.5 | Low | 65 | Low | 132 Ų | 132 | 132.9 Ų | 132.9 | 71% | 0.706 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -76.8 | -31.4 | -176.3 | -66.9 | -4.1 | 0 | 0 | 0 | 112.4 | N46 S47 | N43-N46 PolarHBondContact O-N 3.17Å; N43-S47 PolarHBondContact O-N 3.27Å; N43-S47 VanDerWaalsContact O-N 3.15Å |
| 44 | A | 58.6 | Low | 66.7 | Low | 58 Ų | 58 | 129.7 Ų | 129.7 | 48% | 0.479 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -74.9 | -33 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | R48 | A44-R48 PolarHBondContact O-N 3.37Å |
| 45 | S | 63.4 | Low | 68.5 | Low | 65 Ų | 65 | 125.8 Ų | 125.8 | 46% | 0.455 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -70 | -40.6 | 171.5 | 55.2 | 0 | 0 | 0 | 0 | 111.3 | L42 S47 R48 Q49 | L42-S45 PolarHBondContact O-OG 3.46Å; S45-S47 PolarHBondContact O-N 3.45Å; S45-R48 PolarHBondContact O-N 3.39Å; S45-Q49 WeakPolarHBondContact O-CB 3.46Å; S45-Q49 PolarHBondContact O-N 2.88Å |
| 46 | N | 69.8 | Low | 70.2 | Confident | 80 Ų | 80 | 125.3 Ų | 125.3 | 43% | 0.428 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -64.1 | -38.9 | -178.8 | -159.3 | -34.5 | 0 | 0 | 0 | 112 | N43 Q49 K50 | N43-N46 PolarHBondContact O-N 3.17Å; N46-Q49 PolarHBondContact O-N 2.97Å; N46-K50 WeakPolarHBondContact O-CG 3.35Å; N46-K50 PolarHBondContact O-N 3.32Å; N46-K50 WeakPolarHBondContact OD1-CE 3.48Å |
| 47 | S | 75.7 | Confident | 72.1 | Confident | 58 Ų | 58 | 118.9 Ų | 118.9 | 41% | 0.406 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -58.5 | -55.6 | 170.2 | 119.5 | 0 | 0 | 0 | 0 | 111.1 | N43 S45 Q49 K50 D51 | N43-S47 PolarHBondContact O-N 3.27Å; N43-S47 VanDerWaalsContact O-N 3.15Å; S45-S47 PolarHBondContact O-N 3.45Å; S47-Q49 PolarHBondContact O-N 3.02Å; S47-K50 WeakPolarHBondContact O-CA 3.31Å; S47-K50 WeakPolarHBondContact O-CB 3.41Å; S47-K50 PolarHBondContact O-N 3.47Å; S47-D51 VanDerWaalsContact C-OD2 3.31Å; S47-D51 PolarHBondContact O-N 3.25Å; S47-D51 PolarHBondContact OG-OD2 2.94Å |
| 48 | R | 77.6 | Confident | 74.2 | Confident | 187 Ų | 187 | 115.6 Ų | 115.6 | 71% | 0.706 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -58.7 | -23.9 | -179.8 | -71.4 | -178.7 | 172.2 | -166.9 | -2.6 | 113.6 | A44 S45 K52 | A44-R48 PolarHBondContact O-N 3.37Å; S45-R48 PolarHBondContact O-N 3.39Å; R48-K52 VanDerWaalsContact O-CG 3.31Å; R48-K52 WeakPolarHBondContact O-CG 3.43Å; R48-K52 PolarHBondContact O-N 3Å |
| 49 | Q | 80.6 | Confident | 76.3 | Confident | 125 Ų | 125 | 112.6 Ų | 112.6 | 58% | 0.584 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -79.8 | -42.3 | 175 | -144 | 166.4 | -9.8 | 0 | 0 | 111.3 | S45 N46 S47 K52 I53 | S45-Q49 WeakPolarHBondContact O-CB 3.46Å; S45-Q49 PolarHBondContact O-N 2.88Å; N46-Q49 PolarHBondContact O-N 2.97Å; S47-Q49 PolarHBondContact O-N 3.02Å; Q49-K52 PolarHBondContact O-N 3.47Å; Q49-I53 VanDerWaalsContact O-CG1 3.3Å; Q49-I53 WeakPolarHBondContact O-CG1 3.4Å; Q49-I53 PolarHBondContact O-N 2.92Å |
| 50 | K | 83.4 | Confident | 78.2 | Confident | 130 Ų | 130 | 111.6 Ų | 111.6 | 57% | 0.565 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61 | -43.9 | 171.4 | -70.6 | 176.4 | 179.2 | -174.2 | 0 | 112.3 | N46 S47 K52 I53 L54 | N46-K50 WeakPolarHBondContact O-CG 3.35Å; N46-K50 PolarHBondContact O-N 3.32Å; N46-K50 WeakPolarHBondContact OD1-CE 3.48Å; S47-K50 WeakPolarHBondContact O-CA 3.31Å; S47-K50 WeakPolarHBondContact O-CB 3.41Å; S47-K50 PolarHBondContact O-N 3.47Å; K50-K52 VanDerWaalsContact C-N 3.3Å; K50-K52 PolarHBondContact O-N 3.15Å; K50-I53 PolarHBondContact O-N 3.45Å; K50-I53 VanDerWaalsContact O-N 3.12Å; K50-L54 WeakPolarHBondContact O-CG 3.44Å; K50-L54 PolarHBondContact O-N 3.49Å |
| 51 | D | 87.5 | Confident | 79.9 | Confident | 89 Ų | 89 | 108.6 Ų | 108.6 | 48% | 0.476 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -59.6 | -41.7 | 178.9 | -56.5 | -34.9 | 0 | 0 | 0 | 111.3 | S47 N55 | S47-D51 VanDerWaalsContact C-OD2 3.31Å; S47-D51 PolarHBondContact O-N 3.25Å; S47-D51 PolarHBondContact OG-OD2 2.94Å; D51-N55 WeakPolarHBondContact O-CB 3.43Å; D51-N55 PolarHBondContact O-N 3Å; D51-N55 VanDerWaalsContact O-N 3.09Å |
| 52 | K | 88.5 | Confident | 81.8 | Confident | 161 Ų | 161 | 106.9 Ų | 106.9 | 70% | 0.7 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -65.7 | -41 | 174.1 | -75.7 | 177 | 177.7 | -170.7 | 0 | 112.9 | R48 Q49 K50 L56 | R48-K52 VanDerWaalsContact O-CG 3.31Å; R48-K52 WeakPolarHBondContact O-CG 3.43Å; R48-K52 PolarHBondContact O-N 3Å; Q49-K52 PolarHBondContact O-N 3.47Å; K50-K52 VanDerWaalsContact C-N 3.3Å; K50-K52 PolarHBondContact O-N 3.15Å; K52-L56 WeakPolarHBondContact O-CB 3.41Å; K52-L56 PolarHBondContact O-N 3.09Å |
| 53 | I | 88.2 | Confident | 83.5 | Confident | 99 Ų | 99 | 106.8 Ų | 106.8 | 51% | 0.508 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -65.1 | -46.7 | 178 | -69.6 | 163.6 | 0 | 0 | 0 | 110.1 | Q49 K50 N55 L56 T57 | Q49-I53 VanDerWaalsContact O-CG1 3.3Å; Q49-I53 WeakPolarHBondContact O-CG1 3.4Å; Q49-I53 PolarHBondContact O-N 2.92Å; K50-I53 PolarHBondContact O-N 3.45Å; K50-I53 VanDerWaalsContact O-N 3.12Å; I53-N55 VanDerWaalsContact C-N 3.35Å; I53-N55 PolarHBondContact O-N 3.42Å; I53-L56 PolarHBondContact O-N 3.34Å; I53-T57 PolarHBondContact O-N 3.12Å; I53-T57 PolarHBondContact O-OG1 2.88Å; I53-T57 VanDerWaalsContact O-OG1 3.08Å |
| 54 | L | 89.3 | Confident | 85.2 | Confident | 117 Ų | 117 | 104.4 Ų | 104.4 | 61% | 0.613 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.2 | -44.4 | 177 | -71.8 | 171.1 | 0 | 0 | 0 | 112.1 | K50 L56 T57 Q58 | K50-L54 WeakPolarHBondContact O-CG 3.44Å; K50-L54 PolarHBondContact O-N 3.49Å; L54-L56 PolarHBondContact O-N 3.04Å; L54-T57 PolarHBondContact O-N 3.23Å; L54-Q58 WeakPolarHBondContact O-CB 3.35Å; L54-Q58 PolarHBondContact O-N 2.98Å |
| 55 | N | 91.9 | Very high | 86.6 | Confident | 112 Ų | 112 | 105.5 Ų | 105.5 | 60% | 0.599 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.8 | -40.5 | 177.7 | -159.1 | -63.1 | 0 | 0 | 0 | 111.8 | D51 I53 K59 | D51-N55 WeakPolarHBondContact O-CB 3.43Å; D51-N55 PolarHBondContact O-N 3Å; D51-N55 VanDerWaalsContact O-N 3.09Å; I53-N55 VanDerWaalsContact C-N 3.35Å; I53-N55 PolarHBondContact O-N 3.42Å; N55-K59 WeakPolarHBondContact O-CB 3.3Å; N55-K59 PolarHBondContact O-N 2.89Å |
| 56 | L | 91.5 | Very high | 87.8 | Confident | 115 Ų | 115 | 105.1 Ų | 105.1 | 60% | 0.602 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.7 | -47.4 | 173.6 | -177.6 | 63.5 | 0 | 0 | 0 | 111.8 | K52 I53 L54 Q58 K59 V60 | K52-L56 WeakPolarHBondContact O-CB 3.41Å; K52-L56 PolarHBondContact O-N 3.09Å; I53-L56 PolarHBondContact O-N 3.34Å; L54-L56 PolarHBondContact O-N 3.04Å; L56-Q58 PolarHBondContact O-N 3.48Å; L56-K59 PolarHBondContact O-N 3.23Å; L56-V60 WeakPolarHBondContact O-CG2 3.49Å; L56-V60 PolarHBondContact O-N 2.99Å |
| 57 | T | 90.7 | Very high | 88.5 | Confident | 76 Ų | 76 | 105.7 Ų | 105.7 | 47% | 0.466 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -57.8 | -47.4 | 177 | -60.7 | 0 | 0 | 0 | 0 | 111.2 | I53 L54 K59 V60 C61 | I53-T57 PolarHBondContact O-N 3.12Å; I53-T57 PolarHBondContact O-OG1 2.88Å; I53-T57 VanDerWaalsContact O-OG1 3.08Å; L54-T57 PolarHBondContact O-N 3.23Å; T57-K59 VanDerWaalsContact C-N 3.31Å; T57-K59 PolarHBondContact O-N 3.28Å; T57-V60 PolarHBondContact O-N 3.47Å; T57-C61 PolarHBondContact O-N 3.45Å; T57-C61 PolarHBondContact O-SG 3.33Å; T57-C61 VanDerWaalsContact O-SG 3.33Å |
| 58 | Q | 93.6 | Very high | 89 | Confident | 130 Ų | 130 | 108.6 Ų | 108.6 | 61% | 0.607 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63 | -37.4 | 178 | -169.1 | 172 | 11.3 | 0 | 0 | 112 | L54 L56 C61 N62 | L54-Q58 WeakPolarHBondContact O-CB 3.35Å; L54-Q58 PolarHBondContact O-N 2.98Å; L56-Q58 PolarHBondContact O-N 3.48Å; Q58-C61 PolarHBondContact O-N 2.88Å; Q58-N62 WeakPolarHBondContact O-CB 3.38Å; Q58-N62 PolarHBondContact O-N 3.17Å; Q58-N62 PolarHBondContact O-OD1 3.08Å |
| 59 | K | 93.9 | Very high | 89.2 | Confident | 150 Ų | 150 | 106.9 Ų | 106.9 | 65% | 0.652 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67 | -37.2 | 174.6 | -165.1 | 172.7 | -176 | 178.4 | 0 | 112.5 | N55 L56 T57 M63 | N55-K59 WeakPolarHBondContact O-CB 3.3Å; N55-K59 PolarHBondContact O-N 2.89Å; L56-K59 PolarHBondContact O-N 3.23Å; T57-K59 VanDerWaalsContact C-N 3.31Å; T57-K59 PolarHBondContact O-N 3.28Å; K59-M63 WeakPolarHBondContact O-CB 3.46Å; K59-M63 PolarHBondContact O-N 3.07Å; K59-M63 VanDerWaalsContact O-N 3.07Å |
| 60 | V | 93.5 | Very high | 89 | Confident | 66 Ų | 66 | 107.6 Ų | 107.6 | 40% | 0.4 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -67.1 | -44.9 | 173.6 | 171.4 | 0 | 0 | 0 | 0 | 111.1 | L56 T57 N62 M63 V64 | L56-V60 WeakPolarHBondContact O-CG2 3.49Å; L56-V60 PolarHBondContact O-N 2.99Å; T57-V60 PolarHBondContact O-N 3.47Å; V60-N62 PolarHBondContact O-N 2.89Å; V60-M63 PolarHBondContact O-N 2.95Å; V60-V64 HydrophobicContact CG1-CG2 4.39Å; V60-V64 WeakPolarHBondContact O-CG2 3.43Å; V60-V64 PolarHBondContact O-N 3.17Å |
| 61 | C | 93.7 | Very high | 88.3 | Confident | 66 Ų | 66 | 106.2 Ų | 106.2 | 45% | 0.446 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -57.3 | -49.4 | 174.4 | -67.3 | 0 | 0 | 0 | 0 | 111.7 | T57 Q58 M63 V64 D65 | T57-C61 PolarHBondContact O-N 3.45Å; T57-C61 PolarHBondContact O-SG 3.33Å; T57-C61 VanDerWaalsContact O-SG 3.33Å; Q58-C61 PolarHBondContact O-N 2.88Å; C61-M63 VanDerWaalsContact C-N 3.26Å; C61-M63 PolarHBondContact O-N 3.39Å; C61-V64 PolarHBondContact O-N 3.18Å; C61-D65 PolarHBondContact O-N 3.01Å |
| 62 | N | 93.9 | Very high | 87.4 | Confident | 102 Ų | 102 | 110.1 Ų | 110.1 | 55% | 0.545 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -58.9 | -36.4 | 177.3 | -70.7 | -9.9 | 0 | 0 | 0 | 112.6 | Q58 V60 A66 | Q58-N62 WeakPolarHBondContact O-CB 3.38Å; Q58-N62 PolarHBondContact O-N 3.17Å; Q58-N62 PolarHBondContact O-OD1 3.08Å; V60-N62 PolarHBondContact O-N 2.89Å; N62-A66 WeakPolarHBondContact O-CB 3.4Å; N62-A66 PolarHBondContact O-N 2.86Å |
| 63 | M | 91.4 | Very high | 86.1 | Confident | 125 Ų | 125 | 106.9 Ų | 106.9 | 62% | 0.616 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -71.2 | -43.6 | 177.6 | -174.4 | 168.9 | 65.3 | 0 | 0 | 111.9 | K59 V60 C61 A66 D67 | K59-M63 WeakPolarHBondContact O-CB 3.46Å; K59-M63 PolarHBondContact O-N 3.07Å; K59-M63 VanDerWaalsContact O-N 3.07Å; V60-M63 PolarHBondContact O-N 2.95Å; C61-M63 VanDerWaalsContact C-N 3.26Å; C61-M63 PolarHBondContact O-N 3.39Å; M63-A66 PolarHBondContact O-N 3.42Å; M63-D67 PolarHBondContact O-N 3.29Å |
| 64 | V | 91.7 | Very high | 84.7 | Confident | 82 Ų | 82 | 107.5 Ų | 107.5 | 50% | 0.497 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.7 | -41.3 | 174.4 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | V60 C61 D67 K68 | V60-V64 HydrophobicContact CG1-CG2 4.39Å; V60-V64 WeakPolarHBondContact O-CG2 3.43Å; V60-V64 PolarHBondContact O-N 3.17Å; C61-V64 PolarHBondContact O-N 3.18Å; V64-D67 PolarHBondContact O-N 2.88Å; V64-K68 WeakPolarHBondContact O-CB 3.21Å; V64-K68 PolarHBondContact O-N 2.97Å |
| 65 | D | 89.4 | Confident | 83 | Confident | 81 Ų | 81 | 110.9 Ų | 110.9 | 43% | 0.433 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -70.8 | -30.8 | 176.4 | -81.6 | -32.8 | 0 | 0 | 0 | 113.1 | C61 K69 | C61-D65 PolarHBondContact O-N 3.01Å; D65-K69 WeakPolarHBondContact O-CB 3.37Å; D65-K69 WeakPolarHBondContact O-CG 3.4Å; D65-K69 PolarHBondContact O-N 2.9Å |
| 66 | A | 87.1 | Confident | 81.1 | Confident | 56 Ų | 56 | 112.5 Ų | 112.5 | 46% | 0.463 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.8 | -46.7 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | N62 M63 K68 K69 R70 | N62-A66 WeakPolarHBondContact O-CB 3.4Å; N62-A66 PolarHBondContact O-N 2.86Å; M63-A66 PolarHBondContact O-N 3.42Å; A66-K68 VanDerWaalsContact C-N 3.34Å; A66-K68 PolarHBondContact O-N 3.47Å; A66-K69 WeakPolarHBondContact O-CB 3.12Å; A66-K69 PolarHBondContact O-N 3.13Å; A66-R70 PolarHBondContact O-N 3.14Å |
| 67 | D | 84.8 | Confident | 79.5 | Confident | 93 Ų | 93 | 116.9 Ų | 116.9 | 50% | 0.497 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -68.8 | -33.7 | 179.9 | -157.7 | 51.6 | 0 | 0 | 0 | 112.2 | M63 V64 R70 N71 | M63-D67 PolarHBondContact O-N 3.29Å; V64-D67 PolarHBondContact O-N 2.88Å; D67-R70 WeakPolarHBondContact O-CB 3.46Å; D67-R70 PolarHBondContact O-N 2.97Å; D67-N71 WeakPolarHBondContact O-CB 3.42Å; D67-N71 PolarHBondContact O-N 2.92Å; D67-N71 PolarHBondContact O-ND2 3.18Å |
| 68 | K | 85.8 | Confident | 77.9 | Confident | 119 Ų | 119 | 119.6 Ų | 119.6 | 52% | 0.517 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -72.4 | -25.7 | 172.1 | -167.2 | 174.2 | -173 | 176.2 | 0 | 113.4 | V64 A66 R72 | V64-K68 WeakPolarHBondContact O-CB 3.21Å; V64-K68 PolarHBondContact O-N 2.97Å; A66-K68 VanDerWaalsContact C-N 3.34Å; A66-K68 PolarHBondContact O-N 3.47Å; K68-R72 VanDerWaalsContact O-CG 3.31Å; K68-R72 WeakPolarHBondContact O-CG 3.42Å |
| 69 | K | 82.6 | Confident | 76.2 | Confident | 150 Ų | 150 | 123 Ų | 123 | 65% | 0.652 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -74.3 | -42.7 | 167.5 | -79.3 | 169 | -178.4 | 176 | 0 | 111 | D65 A66 R72 S73 | D65-K69 WeakPolarHBondContact O-CB 3.37Å; D65-K69 WeakPolarHBondContact O-CG 3.4Å; D65-K69 PolarHBondContact O-N 2.9Å; A66-K69 WeakPolarHBondContact O-CB 3.12Å; A66-K69 PolarHBondContact O-N 3.13Å; K69-R72 WeakPolarHBondContact O-CA 3.45Å; K69-R72 WeakPolarHBondContact O-CB 3.12Å; K69-R72 PolarHBondContact O-N 3.22Å; K69-S73 PolarHBondContact O-N 3.35Å; K69-S73 PolarHBondContact O-OG 2.97Å |
| 70 | R | 75.6 | Confident | 74.3 | Confident | 141 Ų | 141 | 123.4 Ų | 123.4 | 53% | 0.532 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -56.7 | -52.3 | 173.7 | -176.1 | 174.2 | -178.8 | 172.1 | 5.3 | 111.1 | A66 D67 R72 S73 E74 | A66-R70 PolarHBondContact O-N 3.14Å; D67-R70 WeakPolarHBondContact O-CB 3.46Å; D67-R70 PolarHBondContact O-N 2.97Å; R70-R72 PolarHBondContact O-N 2.9Å; R70-S73 PolarHBondContact O-N 2.88Å; R70-S73 VanDerWaalsContact O-N 3.14Å; R70-S73 PolarHBondContact O-OG 2.89Å; R70-S73 VanDerWaalsContact O-OG 3.13Å; R70-E74 WeakPolarHBondContact CG-OE2 3.31Å; R70-E74 IonicContact CZ-OE1 3.42Å; R70-E74 IonicContact CZ-OE2 2.65Å; R70-E74 IonicContact NE-OE1 3.21Å; R70-E74 IonicContact NE-OE2 3.59Å; R70-E74 PolarHBondContact NE-OE2 2.88Å; R70-E74 IonicContact NH2-OE1 3.49Å; R70-E74 PolarHBondContact NH2-OE1 3.05Å; R70-E74 IonicContact NH2-OE2 2.75Å; R70-E74 PolarHBondContact NH2-OE2 3.36Å; R70-E74 VanDerWaalsContact O-CB 3.3Å; R70-E74 WeakPolarHBondContact O-CB 3.45Å; R70-E74 PolarHBondContact O-N 2.91Å |
| 71 | N | 69.6 | Low | 72.5 | Confident | 101 Ų | 101 | 121 Ų | 121 | 54% | 0.54 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.3 | -0.1 | 172.3 | -81.3 | -83.6 | 0 | 0 | 0 | 115.6 | D67 R75 | D67-N71 WeakPolarHBondContact O-CB 3.42Å; D67-N71 PolarHBondContact O-N 2.92Å; D67-N71 PolarHBondContact O-ND2 3.18Å; N71-R75 WeakPolarHBondContact O-CG 3.4Å; N71-R75 PolarHBondContact O-NE 2.71Å |
| 72 | R | 67.8 | Low | 71.2 | Confident | 170 Ų | 170 | 122.4 Ų | 122.4 | 64% | 0.642 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -108.7 | -36.4 | 171.4 | -78.6 | 175.6 | 171.4 | -160 | -3.2 | 112.8 | K68 K69 R70 R75 | K68-R72 VanDerWaalsContact O-CG 3.31Å; K68-R72 WeakPolarHBondContact O-CG 3.42Å; K69-R72 WeakPolarHBondContact O-CA 3.45Å; K69-R72 WeakPolarHBondContact O-CB 3.12Å; K69-R72 PolarHBondContact O-N 3.22Å; R70-R72 PolarHBondContact O-N 2.9Å; R72-R75 WeakPolarHBondContact O-CB 3.3Å; R72-R75 WeakPolarHBondContact O-CG 3.49Å |
| 73 | S | 61.2 | Low | 70.3 | Confident | 93 Ų | 93 | 119.4 Ų | 119.4 | 65% | 0.65 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -76.8 | -37 | 174.3 | 49.5 | 0 | 0 | 0 | 0 | 112.5 | K69 R70 R75 | K69-S73 PolarHBondContact O-N 3.35Å; K69-S73 PolarHBondContact O-OG 2.97Å; R70-S73 PolarHBondContact O-N 2.88Å; R70-S73 VanDerWaalsContact O-N 3.14Å; R70-S73 PolarHBondContact O-OG 2.89Å; R70-S73 VanDerWaalsContact O-OG 3.13Å; S73-R75 PolarHBondContact O-N 3.44Å |
| 74 | E | 59 | Low | 69.3 | Low | 112 Ų | 112 | 116.6 Ų | 116.6 | 52% | 0.523 | 59% | 0.59 | S | S | . | * | S | Bend | trans | -77.7 | 14.4 | 179.5 | -138.7 | 154.9 | -162 | 0 | 0 | 112.1 | R70 H76 | R70-E74 WeakPolarHBondContact CG-OE2 3.31Å; R70-E74 IonicContact CZ-OE1 3.42Å; R70-E74 IonicContact CZ-OE2 2.65Å; R70-E74 IonicContact NE-OE1 3.21Å; R70-E74 IonicContact NE-OE2 3.59Å; R70-E74 PolarHBondContact NE-OE2 2.88Å; R70-E74 IonicContact NH2-OE1 3.49Å; R70-E74 PolarHBondContact NH2-OE1 3.05Å; R70-E74 IonicContact NH2-OE2 2.75Å; R70-E74 PolarHBondContact NH2-OE2 3.36Å; R70-E74 VanDerWaalsContact O-CB 3.3Å; R70-E74 WeakPolarHBondContact O-CB 3.45Å; R70-E74 PolarHBondContact O-N 2.91Å; E74-H76 PolarHBondContact O-N 2.93Å |
| 75 | R | 53 | Low | 68.4 | Low | 188 Ų | 188 | 114.2 Ų | 114.2 | 71% | 0.709 | 58% | 0.577 | S | S | * | * | trans | -75.6 | 48.7 | 173.3 | -71.3 | -176 | 167.3 | -150 | -10.9 | 112.9 | N71 R72 S73 | N71-R75 WeakPolarHBondContact O-CG 3.4Å; N71-R75 PolarHBondContact O-NE 2.71Å; R72-R75 WeakPolarHBondContact O-CB 3.3Å; R72-R75 WeakPolarHBondContact O-CG 3.49Å; S73-R75 PolarHBondContact O-N 3.44Å | ||
| 76 | H | 53.5 | Low | 67.6 | Low | 147 Ų | 147 | 116 Ų | 116 | 68% | 0.681 | 59% | 0.593 | S | S | * | * | trans | -60.3 | 140.2 | 151.8 | -75.8 | -98.1 | 0 | 0 | 0 | 108 | E74 N78 | E74-H76 PolarHBondContact O-N 2.93Å; H76-N78 PolarHBondContact O-N 2.97Å | ||
| 77 | K | 56.8 | Low | 66.8 | Low | 207 Ų | 207 | 123.5 Ų | 123.5 | 90% | 0.9 | 61% | 0.611 | S | S | * | * | trans | -78.3 | 51.1 | -175 | -66.1 | 179.4 | -178.3 | 173.5 | 0 | 111.5 | K79 | K77-K79 PolarHBondContact O-N 2.81Š| ||
| 78 | N | 57.9 | Low | 66.1 | Low | 132 Ų | 132 | 123.5 Ų | 123.5 | 71% | 0.706 | 61% | 0.611 | S | S | * | * | trans | -67.5 | 101 | 171.8 | -61.6 | 10.8 | 0 | 0 | 0 | 105.8 | H76 L80 | H76-N78 PolarHBondContact O-N 2.97Å; N78-L80 PolarHBondContact O-N 3.14Å | ||
| 79 | K | 58.1 | Low | 66 | Low | 201 Ų | 201 | 119.4 Ų | 119.4 | 87% | 0.874 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 124.3 | 165.4 | -71.2 | 179.5 | 177.4 | 178.5 | 0 | 106.1 | K77 A81 | K77-K79 PolarHBondContact O-N 2.81Å; K79-A81 PolarHBondContact O-N 3.17Å; K79-A81 VanDerWaalsContact O-N 3.14Å |
| 80 | L | 54.3 | Low | 66.1 | Low | 159 Ų | 159 | 114.1 Ų | 114.1 | 83% | 0.832 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 120.9 | 164.1 | -77.8 | 82.1 | 0 | 0 | 0 | 106.1 | N78 | N78-L80 PolarHBondContact O-N 3.14Š|
| 81 | A | 54.2 | Low | 66.5 | Low | 16 Ų | 16 | 112.8 Ų | 112.8 | 13% | 0.132 | 58% | 0.578 | C | S | . | * | P | Polyproline II helix | trans | -57.7 | 142.4 | 169.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | K79 C83 G84 N88 | K79-A81 PolarHBondContact O-N 3.17Å; K79-A81 VanDerWaalsContact O-N 3.14Å; A81-C83 WeakPolarHBondContact CB-SG 3.13Å; A81-C83 PolarHBondContact O-N 3.3Å; A81-G84 PolarHBondContact O-N 3.26Å; A81-N88 HydrophobicContact CB-CB 4.38Å; A81-N88 WeakPolarHBondContact CB-OD1 3.27Å |
| 82 | S | 67.8 | Low | 67.3 | Low | 95 Ų | 95 | 114.3 Ų | 114.3 | 66% | 0.664 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | -20.5 | -169 | 94.5 | 0 | 0 | 0 | 0 | 112.5 | G84 E90 | S82-G84 PolarHBondContact O-N 3.31Å; S82-G84 VanDerWaalsContact O-N 3.09Å; S82-E90 VanDerWaalsContact CA-OE2 3.27Å; S82-E90 WeakPolarHBondContact CA-OE2 3.38Å; S82-E90 WeakPolarHBondContact CB-OE2 3.49Å; S82-E90 PolarHBondContact N-OE2 2.05Å; S82-E90 PolarHBondContact OG-OE1 3.09Å; S82-E90 PolarHBondContact OG-OE2 3.16Å |
| 83 | C | 75.1 | Confident | 68.2 | Low | 40 Ų | 40 | 108.5 Ų | 108.5 | 27% | 0.27 | 56% | 0.563 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -51.4 | -19.6 | 162.9 | 66.1 | 0 | 0 | 0 | 0 | 115.4 | A81 C85 E90 I93 | A81-C83 WeakPolarHBondContact CB-SG 3.13Å; A81-C83 PolarHBondContact O-N 3.3Å; C83-C85 HydrophobicContact CB-CB 3.86Å; C83-C85 WeakPolarHBondContact CB-SG 3.13Å; C83-C85 PolarHBondContact O-N 3.15Å; C83-C85 WeakPolarHBondContact SG-CB 3.4Å; C83-C85 PolarHBondContact SG-N 3.48Å; C83-C85 CovalentContact SG-SG 2.05Å; C83-C85 PolarHBondContact SG-SG 3.09Å; C83-E90 PolarHBondContact N-OE2 2.99Å; C83-E90 VanDerWaalsContact N-OE2 3.09Å; C83-I93 HydrophobicContact CB-CD1 3.68Å |
| 84 | G | 69 | Low | 69.5 | Low | 65 Ų | 65 | 108.1 Ų | 108.1 | 67% | 0.67 | 55% | 0.553 | S | S | * | * | trans | 67.5 | 10.9 | -171 | 0 | 0 | 0 | 0 | 0 | 114.2 | A81 S82 | A81-G84 PolarHBondContact O-N 3.26Å; S82-G84 PolarHBondContact O-N 3.31Å; S82-G84 VanDerWaalsContact O-N 3.09Å | ||
| 85 | C | 73.6 | Confident | 71 | Confident | 33 Ų | 33 | 105.7 Ų | 105.7 | 22% | 0.223 | 55% | 0.552 | C | S | . | * | trans | -101.4 | 144.2 | -168.8 | 71 | 0 | 0 | 0 | 0 | 112 | C83 Y87 C89 | C83-C85 HydrophobicContact CB-CB 3.86Å; C83-C85 WeakPolarHBondContact CB-SG 3.13Å; C83-C85 PolarHBondContact O-N 3.15Å; C83-C85 WeakPolarHBondContact SG-CB 3.4Å; C83-C85 PolarHBondContact SG-N 3.48Å; C83-C85 CovalentContact SG-SG 2.05Å; C83-C85 PolarHBondContact SG-SG 3.09Å; C85-Y87 PolarHBondContact O-N 2.88Å; C85-C89 PolarHBondContact SG-N 2.97Å; C85-C89 PolarHBondContact SG-SG 3.17Å | ||
| 86 | P | 71.8 | Confident | 72.8 | Confident | 119 Ų | 119 | 102 Ų | 102 | 77% | 0.773 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.5 | -11.9 | -177.4 | 29 | -35 | 0 | 0 | 0 | 114.3 | ||
| 87 | Y | 70.8 | Confident | 74.4 | Confident | 213 Ų | 213 | 101 Ų | 101 | 84% | 0.835 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.8 | 7.8 | -173.3 | -60.3 | -63 | 0 | 0 | 0 | 114.9 | C85 C89 | C85-Y87 PolarHBondContact O-N 2.88Å; Y87-C89 VanDerWaalsContact C-N 3.35Å; Y87-C89 PolarHBondContact O-N 3.22Å |
| 88 | N | 70.3 | Confident | 75.9 | Confident | 93 Ų | 93 | 95.4 Ų | 95.4 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | trans | 55.6 | 38.4 | 175.7 | -169.4 | 65.2 | 0 | 0 | 0 | 115 | A81 E90 | A81-N88 HydrophobicContact CB-CB 4.38Å; A81-N88 WeakPolarHBondContact CB-OD1 3.27Å; N88-E90 PolarHBondContact O-N 3.21Å | ||
| 89 | C | 84.1 | Confident | 77.5 | Confident | 33 Ų | 33 | 91.9 Ų | 91.9 | 22% | 0.223 | 50% | 0.502 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.9 | 26.4 | 178.4 | 68 | 0 | 0 | 0 | 0 | 114.8 | C85 Y87 D91 E92 I93 | C85-C89 PolarHBondContact SG-N 2.97Å; C85-C89 PolarHBondContact SG-SG 3.17Å; Y87-C89 VanDerWaalsContact C-N 3.35Å; Y87-C89 PolarHBondContact O-N 3.22Å; C89-D91 VanDerWaalsContact C-N 3.29Å; C89-D91 PolarHBondContact O-N 3.47Å; C89-E92 HydrophobicContact CB-CB 4.19Å; C89-E92 HydrophobicContact CB-CG 4.33Å; C89-E92 WeakPolarHBondContact CB-OE2 3.29Å; C89-E92 PolarHBondContact O-N 3.48Å; C89-I93 WeakPolarHBondContact O-CB 3.44Å; C89-I93 VanDerWaalsContact O-CG1 3.25Å; C89-I93 WeakPolarHBondContact O-CG1 3.21Å; C89-I93 PolarHBondContact O-N 2.86Å |
| 90 | E | 84.4 | Confident | 78.9 | Confident | 38 Ų | 38 | 87.5 Ų | 87.5 | 18% | 0.178 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -62.5 | -38.1 | 177.3 | -166 | 70.2 | -129.2 | 0 | 0 | 111.3 | S82 C83 N88 I93 L94 R97 | S82-E90 VanDerWaalsContact CA-OE2 3.27Å; S82-E90 WeakPolarHBondContact CA-OE2 3.38Å; S82-E90 WeakPolarHBondContact CB-OE2 3.49Å; S82-E90 PolarHBondContact N-OE2 2.05Å; S82-E90 PolarHBondContact OG-OE1 3.09Å; S82-E90 PolarHBondContact OG-OE2 3.16Å; C83-E90 PolarHBondContact N-OE2 2.99Å; C83-E90 VanDerWaalsContact N-OE2 3.09Å; N88-E90 PolarHBondContact O-N 3.21Å; E90-I93 PolarHBondContact O-N 2.93Å; E90-L94 VanDerWaalsContact O-CB 3.31Å; E90-L94 WeakPolarHBondContact O-CB 3.49Å; E90-L94 PolarHBondContact O-N 3.32Å; E90-R97 IonicContact OE1-CZ 2.66Å; E90-R97 IonicContact OE1-NH1 2.92Å; E90-R97 PolarHBondContact OE1-NH1 2.58Å |
| 91 | D | 84 | Confident | 80.3 | Confident | 114 Ų | 114 | 83.8 Ų | 83.8 | 61% | 0.61 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -68.1 | -37.7 | 178.1 | -61 | -49.7 | 0 | 0 | 0 | 112 | C89 L94 A95 | C89-D91 VanDerWaalsContact C-N 3.29Å; C89-D91 PolarHBondContact O-N 3.47Å; D91-L94 PolarHBondContact O-N 2.67Å; D91-A95 WeakPolarHBondContact O-CB 3.22Å; D91-A95 PolarHBondContact O-N 3.46Å |
| 92 | E | 86.7 | Confident | 81.6 | Confident | 133 Ų | 133 | 88.6 Ų | 88.6 | 62% | 0.621 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.4 | -44.2 | 173.4 | -60.9 | 178.8 | 165.7 | 0 | 0 | 111.2 | C89 L94 A95 L96 | C89-E92 HydrophobicContact CB-CB 4.19Å; C89-E92 HydrophobicContact CB-CG 4.33Å; C89-E92 WeakPolarHBondContact CB-OE2 3.29Å; C89-E92 PolarHBondContact O-N 3.48Å; E92-L94 VanDerWaalsContact C-N 3.31Å; E92-L94 PolarHBondContact O-N 3.19Å; E92-A95 PolarHBondContact O-N 2.97Å; E92-L96 WeakPolarHBondContact O-CB 3.25Å; E92-L96 WeakPolarHBondContact O-CG 3.45Å; E92-L96 PolarHBondContact O-N 2.96Å |
| 93 | I | 86.5 | Confident | 82.1 | Confident | 47 Ų | 47 | 89.2 Ų | 89.2 | 24% | 0.241 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -64.1 | -37.4 | 175.5 | -68.6 | 167.3 | 0 | 0 | 0 | 110.6 | C83 C89 E90 L96 R97 | C83-I93 HydrophobicContact CB-CD1 3.68Å; C89-I93 WeakPolarHBondContact O-CB 3.44Å; C89-I93 VanDerWaalsContact O-CG1 3.25Å; C89-I93 WeakPolarHBondContact O-CG1 3.21Å; C89-I93 PolarHBondContact O-N 2.86Å; E90-I93 PolarHBondContact O-N 2.93Å; I93-L96 PolarHBondContact O-N 3.42Å; I93-R97 HydrophobicContact CG2-CG 4.46Å; I93-R97 WeakPolarHBondContact O-CB 3.17Å; I93-R97 WeakPolarHBondContact O-CG 3.4Å; I93-R97 PolarHBondContact O-N 3.49Å |
| 94 | L | 88.6 | Confident | 82.1 | Confident | 86 Ų | 86 | 94 Ų | 94 | 45% | 0.45 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.5 | -44.8 | 174.6 | -165.4 | 80.2 | 0 | 0 | 0 | 111.1 | E90 D91 E92 L96 R97 N98 | E90-L94 VanDerWaalsContact O-CB 3.31Å; E90-L94 WeakPolarHBondContact O-CB 3.49Å; E90-L94 PolarHBondContact O-N 3.32Å; D91-L94 PolarHBondContact O-N 2.67Å; E92-L94 VanDerWaalsContact C-N 3.31Å; E92-L94 PolarHBondContact O-N 3.19Å; L94-L96 PolarHBondContact O-N 3.29Å; L94-R97 PolarHBondContact O-N 2.76Å; L94-N98 WeakPolarHBondContact O-CB 3.3Å; L94-N98 PolarHBondContact O-N 3.09Å; L94-N98 PolarHBondContact O-ND2 3.5Å |
| 95 | A | 90.5 | Very high | 82.1 | Confident | 60 Ų | 60 | 94.1 Ų | 94.1 | 50% | 0.496 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61 | -43.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | D91 E92 N98 S99 | D91-A95 WeakPolarHBondContact O-CB 3.22Å; D91-A95 PolarHBondContact O-N 3.46Å; E92-A95 PolarHBondContact O-N 2.97Å; A95-N98 PolarHBondContact O-N 3.13Å; A95-S99 WeakPolarHBondContact O-CB 3.46Å; A95-S99 PolarHBondContact O-N 3.02Å |
| 96 | L | 89.8 | Confident | 81.5 | Confident | 110 Ų | 110 | 94.8 Ų | 94.8 | 58% | 0.576 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -64.4 | -44.1 | 174.8 | -72.7 | 169.2 | 0 | 0 | 0 | 112.2 | E92 I93 L94 N98 S99 I100 | E92-L96 WeakPolarHBondContact O-CB 3.25Å; E92-L96 WeakPolarHBondContact O-CG 3.45Å; E92-L96 PolarHBondContact O-N 2.96Å; I93-L96 PolarHBondContact O-N 3.42Å; L94-L96 PolarHBondContact O-N 3.29Å; L96-N98 VanDerWaalsContact C-N 3.34Å; L96-N98 PolarHBondContact O-N 3.45Å; L96-S99 PolarHBondContact O-N 3.1Å; L96-I100 WeakPolarHBondContact O-CB 3.31Å; L96-I100 VanDerWaalsContact O-CG1 3.28Å; L96-I100 WeakPolarHBondContact O-CG1 3.41Å; L96-I100 PolarHBondContact O-N 3.46Å |
| 97 | R | 89 | Confident | 80.9 | Confident | 127 Ų | 127 | 94.8 Ų | 94.8 | 48% | 0.479 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -57.7 | -45.7 | 173.9 | -75.7 | 166.6 | 179.7 | 149 | 0.8 | 111.3 | E90 I93 L94 I100 E101 | E90-R97 IonicContact OE1-CZ 2.66Å; E90-R97 IonicContact OE1-NH1 2.92Å; E90-R97 PolarHBondContact OE1-NH1 2.58Å; I93-R97 HydrophobicContact CG2-CG 4.46Å; I93-R97 WeakPolarHBondContact O-CB 3.17Å; I93-R97 WeakPolarHBondContact O-CG 3.4Å; I93-R97 PolarHBondContact O-N 3.49Å; L94-R97 PolarHBondContact O-N 2.76Å; R97-I100 PolarHBondContact O-N 3.21Å; R97-E101 PolarHBondContact O-N 3.41Å |
| 98 | N | 88.3 | Confident | 80.1 | Confident | 89 Ų | 89 | 87.1 Ų | 87.1 | 48% | 0.476 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.7 | -41.6 | 177.7 | -67.9 | -18.2 | 0 | 0 | 0 | 111.9 | L94 A95 L96 E101 N102 | L94-N98 WeakPolarHBondContact O-CB 3.3Å; L94-N98 PolarHBondContact O-N 3.09Å; L94-N98 PolarHBondContact O-ND2 3.5Å; A95-N98 PolarHBondContact O-N 3.13Å; L96-N98 VanDerWaalsContact C-N 3.34Å; L96-N98 PolarHBondContact O-N 3.45Å; N98-E101 PolarHBondContact O-N 2.8Å; N98-N102 WeakPolarHBondContact O-CB 3.21Å; N98-N102 PolarHBondContact O-N 3.15Å; N98-N102 PolarHBondContact O-ND2 3.46Å |
| 99 | S | 91.1 | Very high | 79.1 | Confident | 59 Ų | 59 | 90.1 Ų | 90.1 | 41% | 0.413 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.8 | -43.9 | 174.9 | -169.9 | 0 | 0 | 0 | 0 | 111.9 | A95 L96 N102 L103 | A95-S99 WeakPolarHBondContact O-CB 3.46Å; A95-S99 PolarHBondContact O-N 3.02Å; L96-S99 PolarHBondContact O-N 3.1Å; S99-N102 PolarHBondContact O-N 2.92Å; S99-L103 WeakPolarHBondContact O-CB 3.4Å; S99-L103 WeakPolarHBondContact O-CG 3.46Å; S99-L103 PolarHBondContact O-N 3.29Å |
| 100 | I | 87.3 | Confident | 77.6 | Confident | 108 Ų | 108 | 92.8 Ų | 92.8 | 55% | 0.554 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.6 | -42.1 | 176.7 | -70 | 165 | 0 | 0 | 0 | 111.3 | L96 R97 L103 R104 | L96-I100 WeakPolarHBondContact O-CB 3.31Å; L96-I100 VanDerWaalsContact O-CG1 3.28Å; L96-I100 WeakPolarHBondContact O-CG1 3.41Å; L96-I100 PolarHBondContact O-N 3.46Å; R97-I100 PolarHBondContact O-N 3.21Å; I100-L103 PolarHBondContact O-N 2.89Å; I100-R104 VanDerWaalsContact O-CB 3.28Å; I100-R104 WeakPolarHBondContact O-CB 3.33Å; I100-R104 PolarHBondContact O-N 3.39Å |
| 101 | E | 83.9 | Confident | 76.1 | Confident | 81 Ų | 81 | 98.5 Ų | 98.5 | 38% | 0.379 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -72.5 | -32.7 | 179.7 | -170.3 | 61.8 | -171.8 | 0 | 0 | 112.6 | R97 N98 R104 S105 | R97-E101 PolarHBondContact O-N 3.41Å; N98-E101 PolarHBondContact O-N 2.8Å; E101-R104 PolarHBondContact O-N 2.88Å; E101-R104 IonicContact OE1-CZ 3.6Å; E101-R104 IonicContact OE1-NE 2.99Å; E101-R104 IonicContact OE1-NH2 3.62Å; E101-R104 PolarHBondContact OE1-NH2 3.43Å; E101-R104 IonicContact OE2-CZ 2.64Å; E101-R104 IonicContact OE2-NE 3.99Å; E101-R104 PolarHBondContact OE2-NE 3.2Å; E101-R104 IonicContact OE2-NH2 2.93Å; E101-R104 PolarHBondContact OE2-NH2 2.86Å; E101-S105 WeakPolarHBondContact O-CB 3.35Å; E101-S105 PolarHBondContact O-N 3.43Å; E101-S105 PolarHBondContact O-OG 2.96Å |
| 102 | N | 81.4 | Confident | 74.6 | Confident | 117 Ų | 117 | 100.9 Ų | 100.9 | 63% | 0.626 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63 | -47.2 | 169.8 | -72.7 | -19.6 | 0 | 0 | 0 | 111.3 | N98 S99 S105 G106 | N98-N102 WeakPolarHBondContact O-CB 3.21Å; N98-N102 PolarHBondContact O-N 3.15Å; N98-N102 PolarHBondContact O-ND2 3.46Å; S99-N102 PolarHBondContact O-N 2.92Å; N102-S105 WeakPolarHBondContact O-CB 3.48Å; N102-S105 PolarHBondContact O-N 3.3Å; N102-G106 PolarHBondContact O-N 3.39Å |
| 103 | L | 78.6 | Confident | 73.2 | Confident | 108 Ų | 108 | 103.4 Ų | 103.4 | 57% | 0.565 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -61.4 | -43.4 | 174.1 | -72.4 | 169.1 | 0 | 0 | 0 | 111.5 | S99 I100 S105 G106 L107 | S99-L103 WeakPolarHBondContact O-CB 3.4Å; S99-L103 WeakPolarHBondContact O-CG 3.46Å; S99-L103 PolarHBondContact O-N 3.29Å; I100-L103 PolarHBondContact O-N 2.89Å; L103-S105 VanDerWaalsContact C-N 3.3Å; L103-S105 PolarHBondContact O-N 2.88Å; L103-G106 PolarHBondContact O-N 2.88Å; L103-L107 WeakPolarHBondContact O-CB 3.28Å; L103-L107 VanDerWaalsContact O-CG 3.28Å; L103-L107 WeakPolarHBondContact O-CG 3.45Å; L103-L107 PolarHBondContact O-N 3.49Å |
| 104 | R | 74.5 | Confident | 72.1 | Confident | 141 Ų | 141 | 107.2 Ų | 107.2 | 53% | 0.532 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.3 | -35.3 | 177.8 | -163.5 | 176.2 | 75.5 | 84.8 | 4.5 | 111.8 | I100 E101 S108 | I100-R104 VanDerWaalsContact O-CB 3.28Å; I100-R104 WeakPolarHBondContact O-CB 3.33Å; I100-R104 PolarHBondContact O-N 3.39Å; E101-R104 PolarHBondContact O-N 2.88Å; E101-R104 IonicContact OE1-CZ 3.6Å; E101-R104 IonicContact OE1-NE 2.99Å; E101-R104 IonicContact OE1-NH2 3.62Å; E101-R104 PolarHBondContact OE1-NH2 3.43Å; E101-R104 IonicContact OE2-CZ 2.64Å; E101-R104 IonicContact OE2-NE 3.99Å; E101-R104 PolarHBondContact OE2-NE 3.2Å; E101-R104 IonicContact OE2-NH2 2.93Å; E101-R104 PolarHBondContact OE2-NH2 2.86Å; R104-S108 WeakPolarHBondContact O-CB 3.33Å; R104-S108 PolarHBondContact O-N 2.76Å |
| 105 | S | 68.3 | Low | 71.3 | Confident | 67 Ų | 67 | 107 Ų | 107 | 47% | 0.469 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.2 | -48.9 | 174 | -60.3 | 0 | 0 | 0 | 0 | 111.3 | E101 N102 L103 S108 L109 | E101-S105 WeakPolarHBondContact O-CB 3.35Å; E101-S105 PolarHBondContact O-N 3.43Å; E101-S105 PolarHBondContact O-OG 2.96Å; N102-S105 WeakPolarHBondContact O-CB 3.48Å; N102-S105 PolarHBondContact O-N 3.3Å; L103-S105 VanDerWaalsContact C-N 3.3Å; L103-S105 PolarHBondContact O-N 2.88Å; S105-S108 PolarHBondContact O-N 3.33Å; S105-L109 WeakPolarHBondContact O-CB 3.45Å; S105-L109 PolarHBondContact O-N 2.93Å; S105-L109 VanDerWaalsContact O-N 3.1Å |
| 106 | G | 60.9 | Low | 70.6 | Confident | 47 Ų | 47 | 112.3 Ų | 112.3 | 49% | 0.485 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -60.4 | -47 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | N102 L103 L109 C110 | N102-G106 PolarHBondContact O-N 3.39Å; L103-G106 PolarHBondContact O-N 2.88Å; G106-L109 PolarHBondContact O-N 3.5Å; G106-C110 WeakPolarHBondContact O-CB 3.46Å; G106-C110 PolarHBondContact O-N 3.21Å |
| 107 | L | 59.6 | Low | 70.4 | Confident | 119 Ų | 119 | 111.5 Ų | 111.5 | 62% | 0.623 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -67 | -37.6 | 178.6 | -68.8 | 170.8 | 0 | 0 | 0 | 112.8 | L103 C110 | L103-L107 WeakPolarHBondContact O-CB 3.28Å; L103-L107 VanDerWaalsContact O-CG 3.28Å; L103-L107 WeakPolarHBondContact O-CG 3.45Å; L103-L107 PolarHBondContact O-N 3.49Å; L107-C110 PolarHBondContact O-N 3.16Å |
| 108 | S | 53.4 | Low | 70.4 | Confident | 53 Ų | 53 | 112.5 Ų | 112.5 | 37% | 0.371 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -71.7 | -31.9 | 180 | -165.5 | 0 | 0 | 0 | 0 | 112.5 | R104 S105 | R104-S108 WeakPolarHBondContact O-CB 3.33Å; R104-S108 PolarHBondContact O-N 2.76Å; S105-S108 PolarHBondContact O-N 3.33Å |
| 109 | L | 51 | Low | 70.5 | Confident | 156 Ų | 156 | 110.8 Ų | 110.8 | 82% | 0.817 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -72.1 | -31.3 | 176 | -161.2 | 72.3 | 0 | 0 | 0 | 112 | S105 G106 | S105-L109 WeakPolarHBondContact O-CB 3.45Å; S105-L109 PolarHBondContact O-N 2.93Å; S105-L109 VanDerWaalsContact O-N 3.1Å; G106-L109 PolarHBondContact O-N 3.5Å |
| 110 | C | 51.3 | Low | 70.5 | Confident | 89 Ų | 89 | 111.2 Ų | 111.2 | 60% | 0.601 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -76 | -24.3 | -171.5 | -166.3 | 0 | 0 | 0 | 0 | 114.9 | G106 L107 | G106-C110 WeakPolarHBondContact O-CB 3.46Å; G106-C110 PolarHBondContact O-N 3.21Å; L107-C110 PolarHBondContact O-N 3.16Å |
| 111 | H | 53.5 | Low | 70.7 | Confident | 157 Ų | 157 | 111.2 Ų | 111.2 | 73% | 0.727 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -133.4 | 3.9 | -162.1 | -74.5 | 7 | 0 | 0 | 0 | 116.7 | ||
| 112 | K | 52.9 | Low | 71.1 | Confident | 165 Ų | 165 | 108 Ų | 108 | 72% | 0.717 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -120 | -16.8 | -166 | -72.5 | -167.1 | 172.1 | -175.7 | 0 | 119.2 | ||
| 113 | E | 56.6 | Low | 71.6 | Confident | 186 Ų | 186 | 102.6 Ų | 102.6 | 87% | 0.869 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -133.6 | -4.9 | -173.7 | -65 | -173.1 | 167.1 | 0 | 0 | 115.3 | P115 | E113-P115 WeakPolarHBondContact O-CD 3.28Š|
| 114 | R | 64.2 | Low | 72.2 | Confident | 126 Ų | 126 | 103.9 Ų | 103.9 | 48% | 0.475 | 53% | 0.53 | S | S | . | . | P | Polyproline II helix | trans | -78.1 | 123.6 | 177.6 | -167.9 | 173.3 | 178.6 | -159.8 | -0.5 | 110.1 | E132 | R114-E132 IonicContact CZ-OE1 3.46Å; R114-E132 IonicContact CZ-OE2 2.67Å; R114-E132 IonicContact NH1-OE1 3.15Å; R114-E132 PolarHBondContact NH1-OE1 3.41Å; R114-E132 IonicContact NH1-OE2 2.72Å; R114-E132 PolarHBondContact NH1-OE2 2.79Å; R114-E132 IonicContact NH2-OE1 2.76Å; R114-E132 PolarHBondContact NH2-OE1 3.45Å; R114-E132 IonicContact NH2-OE2 3.1Å |
| 115 | P | 71.2 | Confident | 73 | Confident | 82 Ų | 82 | 100.5 Ų | 100.5 | 53% | 0.532 | 52% | 0.523 | S | S | . | . | P | Polyproline II helix | trans | -60.6 | 137.9 | 172.3 | 22 | -30.6 | 0 | 0 | 0 | 110.7 | E113 F117 | E113-P115 WeakPolarHBondContact O-CD 3.28Å; P115-F117 HydrophobicContact CB-CE2 4.17Å; P115-F117 HydrophobicContact CB-CZ 4.08Å; P115-F117 HydrophobicContact CG-CE2 3.63Å; P115-F117 HydrophobicContact CG-CZ 3.64Å; P115-F117 WeakPolarHBondContact O-CD2 3.48Å |
| 116 | I | 76.7 | Confident | 74.2 | Confident | 171 Ų | 171 | 98.6 Ų | 98.6 | 88% | 0.877 | 51% | 0.506 | S | S | * | . | P | Polyproline II helix | trans | -79.9 | 120.8 | 177.4 | -57.2 | 174 | 0 | 0 | 0 | 107.9 | ||
| 117 | F | 84.2 | Confident | 75.6 | Confident | 93 Ų | 93 | 100.8 Ų | 100.8 | 41% | 0.408 | 50% | 0.501 | S | S | . | . | trans | -110.7 | 157.1 | 175.4 | -61.3 | -75.4 | 0 | 0 | 0 | 110.8 | P115 H121 F122 | P115-F117 HydrophobicContact CB-CE2 4.17Å; P115-F117 HydrophobicContact CB-CZ 4.08Å; P115-F117 HydrophobicContact CG-CE2 3.63Å; P115-F117 HydrophobicContact CG-CZ 3.64Å; P115-F117 WeakPolarHBondContact O-CD2 3.48Å; F117-H121 HydrophobicContact CB-CB 3.77Å; F117-H121 HydrophobicContact CD1-CB 4.38Å; F117-H121 AromaticContact CD1-CD2 3.5Å; F117-H121 AromaticContact CD1-CG 3.88Å; F117-H121 AromaticContact CD1-NE2 3.96Å; F117-H121 AromaticContact CD2-CD2 3.47Å; F117-H121 VanDerWaalsContact CD2-CD2 3.47Å; F117-H121 WeakPolarHBondContact CD2-CD2 3.49Å; F117-H121 AromaticContact CE1-CD2 3.82Å; F117-H121 AromaticContact CE1-NE2 3.76Å; F117-H121 AromaticContact CE2-CD2 3.75Å; F117-H121 AromaticContact CE2-NE2 3.81Å; F117-H121 HydrophobicContact CG-CB 4.2Å; F117-H121 AromaticContact CG-CD2 3.31Å; F117-H121 WeakPolarHBondContact CG-CD2 3.33Å; F117-H121 AromaticContact CG-CG 3.9Å; F117-H121 AromaticContact CZ-CD2 3.92Å; F117-H121 AromaticContact CZ-NE2 3.67Å; F117-F122 HydrophobicContact CB-CE2 3.92Å; F117-F122 HydrophobicContact CB-CZ 3.9Å; F117-F122 HydrophobicContact CD2-CE1 4.36Å; F117-F122 AromaticContact CD2-CZ 3.79Å; F117-F122 HydrophobicContact CD2-CZ 3.79Å; F117-F122 HydrophobicContact CG-CZ 4.25Å | ||
| 118 | Q | 89.9 | Confident | 77.1 | Confident | 149 Ų | 149 | 98.9 Ų | 98.9 | 70% | 0.696 | 49% | 0.489 | S | S | * | . | trans | -68.9 | 153.9 | 162.9 | -66.7 | 176 | -106.4 | 0 | 0 | 109.6 | D120 H121 | Q118-D120 PolarHBondContact O-N 3.34Å; Q118-D120 VanDerWaalsContact O-N 3.11Å; Q118-H121 WeakPolarHBondContact O-CB 3.43Å; Q118-H121 PolarHBondContact O-N 2.87Å | ||
| 119 | L | 90.7 | Very high | 79 | Confident | 53 Ų | 53 | 96.7 Ų | 96.7 | 28% | 0.277 | 47% | 0.473 | S | S | . | . | G | 310 helix | trans | -56.1 | -30 | 177.7 | -68.8 | 176.8 | 0 | 0 | 0 | 112.2 | H121 F122 L129 E132 A133 L214 | L119-H121 PolarHBondContact O-N 3.2Å; L119-F122 PolarHBondContact O-N 3.4Å; L119-L129 HydrophobicContact CB-CD1 3.93Å; L119-L129 HydrophobicContact CD2-CD1 4.44Å; L119-L129 VanDerWaalsContact O-CD1 3.31Å; L119-L129 WeakPolarHBondContact O-CD1 3.48Å; L119-E132 HydrophobicContact CD2-CB 3.86Å; L119-A133 HydrophobicContact CD1-CB 4.34Å; L119-A133 HydrophobicContact CD2-CB 4.24Å; L119-L214 HydrophobicContact CB-CD1 4.47Å; L119-L214 HydrophobicContact CB-CD2 4.17Å; L119-L214 HydrophobicContact CD1-CD2 4.17Å |
| 120 | D | 90.6 | Very high | 81 | Confident | 68 Ų | 68 | 90.1 Ų | 90.1 | 36% | 0.364 | 44% | 0.438 | S | S | . | . | G | 310 helix | trans | -57.7 | -20.9 | 176.5 | -49.8 | -61.7 | 0 | 0 | 0 | 114.1 | Q118 F122 I123 L214 | Q118-D120 PolarHBondContact O-N 3.34Å; Q118-D120 VanDerWaalsContact O-N 3.11Å; D120-F122 PolarHBondContact O-N 3.23Å; D120-I123 HydrophobicContact CB-CD1 4.05Å; D120-I123 WeakPolarHBondContact O-CD1 3.21Å; D120-L214 WeakPolarHBondContact OD1-CB 3.47Å |
| 121 | H | 91.2 | Very high | 83 | Confident | 107 Ų | 107 | 87 Ų | 87 | 50% | 0.495 | 42% | 0.417 | S | S | . | . | G | 310 helix | trans | -69 | -23.5 | 175.5 | -175 | 45.2 | 0 | 0 | 0 | 113.1 | F117 Q118 L119 | F117-H121 HydrophobicContact CB-CB 3.77Å; F117-H121 HydrophobicContact CD1-CB 4.38Å; F117-H121 AromaticContact CD1-CD2 3.5Å; F117-H121 AromaticContact CD1-CG 3.88Å; F117-H121 AromaticContact CD1-NE2 3.96Å; F117-H121 AromaticContact CD2-CD2 3.47Å; F117-H121 VanDerWaalsContact CD2-CD2 3.47Å; F117-H121 WeakPolarHBondContact CD2-CD2 3.49Å; F117-H121 AromaticContact CE1-CD2 3.82Å; F117-H121 AromaticContact CE1-NE2 3.76Å; F117-H121 AromaticContact CE2-CD2 3.75Å; F117-H121 AromaticContact CE2-NE2 3.81Å; F117-H121 HydrophobicContact CG-CB 4.2Å; F117-H121 AromaticContact CG-CD2 3.31Å; F117-H121 WeakPolarHBondContact CG-CD2 3.33Å; F117-H121 AromaticContact CG-CG 3.9Å; F117-H121 AromaticContact CZ-CD2 3.92Å; F117-H121 AromaticContact CZ-NE2 3.67Å; Q118-H121 WeakPolarHBondContact O-CB 3.43Å; Q118-H121 PolarHBondContact O-N 2.87Å; L119-H121 PolarHBondContact O-N 3.2Å |
| 122 | F | 91.6 | Very high | 84.7 | Confident | 13 Ų | 13 | 80.9 Ų | 80.9 | 6% | 0.057 | 39% | 0.389 | C | S | . | . | G | 310 helix | trans | -104.5 | 6.2 | -170.7 | -54.5 | -66.3 | 0 | 0 | 0 | 113.8 | F117 L119 D120 D124 D125 Q128 L129 E132 | F117-F122 HydrophobicContact CB-CE2 3.92Å; F117-F122 HydrophobicContact CB-CZ 3.9Å; F117-F122 HydrophobicContact CD2-CE1 4.36Å; F117-F122 AromaticContact CD2-CZ 3.79Å; F117-F122 HydrophobicContact CD2-CZ 3.79Å; F117-F122 HydrophobicContact CG-CZ 4.25Å; L119-F122 PolarHBondContact O-N 3.4Å; D120-F122 PolarHBondContact O-N 3.23Å; F122-D124 PolarHBondContact O-N 3.1Å; F122-D124 VanDerWaalsContact O-N 3.14Å; F122-D125 CarbonylContact O-C 3.26Å; F122-D125 VanDerWaalsContact O-C 3.26Å; F122-D125 PolarHBondContact O-N 3Å; F122-Q128 HydrophobicContact CD1-CB 4.3Å; F122-Q128 HydrophobicContact CD1-CG 3.54Å; F122-Q128 HydrophobicContact CE1-CG 3.91Å; F122-Q128 HydrophobicContact CG-CG 4.12Å; F122-L129 HydrophobicContact CB-CB 3.99Å; F122-L129 HydrophobicContact CB-CD1 4.31Å; F122-E132 HydrophobicContact CD2-CB 4.31Å; F122-E132 HydrophobicContact CD2-CG 3.86Å; F122-E132 HydrophobicContact CE1-CG 4.5Å; F122-E132 HydrophobicContact CE2-CB 4.22Å; F122-E132 HydrophobicContact CE2-CG 3.57Å; F122-E132 HydrophobicContact CG-CG 4.44Å; F122-E132 HydrophobicContact CZ-CG 3.89Å |
| 123 | I | 92.3 | Very high | 86.6 | Confident | 4 Ų | 4 | 74 Ų | 74 | 2% | 0.021 | 36% | 0.363 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.6 | -29.6 | -173 | -60.7 | 161.1 | 0 | 0 | 0 | 112.5 | D120 D125 H126 I207 I210 K211 L214 | D120-I123 HydrophobicContact CB-CD1 4.05Å; D120-I123 WeakPolarHBondContact O-CD1 3.21Å; I123-D125 PolarHBondContact O-N 3.35Å; I123-H126 PolarHBondContact O-CD2 3.33Å; I123-H126 VanDerWaalsContact O-CD2 3.29Å; I123-I207 HydrophobicContact CG2-CB 4.26Å; I123-I207 HydrophobicContact CG2-CG1 4.23Å; I123-I207 HydrophobicContact CG2-CG2 3.89Å; I123-I210 HydrophobicContact CG1-CG2 4.29Å; I123-I210 HydrophobicContact CG2-CB 4.14Å; I123-I210 HydrophobicContact CG2-CG2 3.9Å; I123-K211 HydrophobicContact CD1-CB 4.37Å; I123-K211 HydrophobicContact CD1-CD 4.31Å; I123-K211 HydrophobicContact CD1-CG 3.32Å; I123-K211 HydrophobicContact CG2-CG 4.47Å; I123-L214 HydrophobicContact CD1-CD1 4Å; I123-L214 HydrophobicContact CG1-CD1 3.77Å |
| 124 | D | 91.1 | Very high | 88.3 | Confident | 135 Ų | 135 | 65.6 Ų | 65.6 | 72% | 0.722 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.2 | -10.5 | 177.5 | -56.9 | -34.3 | 0 | 0 | 0 | 113.3 | F122 | F122-D124 PolarHBondContact O-N 3.1Å; F122-D124 VanDerWaalsContact O-N 3.14Å |
| 125 | D | 91.8 | Very high | 89.5 | Confident | 71 Ų | 71 | 63.6 Ų | 63.6 | 38% | 0.38 | 32% | 0.321 | S | S | . | . | trans | -130.8 | 95.6 | 170.9 | 179.2 | 1.4 | 0 | 0 | 0 | 110.8 | F122 I123 Y127 Q128 L129 | F122-D125 CarbonylContact O-C 3.26Å; F122-D125 VanDerWaalsContact O-C 3.26Å; F122-D125 PolarHBondContact O-N 3Å; I123-D125 PolarHBondContact O-N 3.35Å; D125-Y127 PolarHBondContact O-N 2.89Å; D125-Y127 VanDerWaalsContact O-N 3.11Å; D125-Y127 WeakPolarHBondContact OD1-CB 3.42Å; D125-Y127 PolarHBondContact OD1-N 3.28Å; D125-Q128 HydrophobicContact CB-CB 4.14Å; D125-Q128 PolarHBondContact O-N 2.89Å; D125-Q128 VanDerWaalsContact O-N 3.08Å; D125-Q128 PolarHBondContact OD1-N 3.39Å; D125-Q128 WeakPolarHBondContact OD2-CB 3.38Å; D125-L129 WeakPolarHBondContact O-CB 3.47Å; D125-L129 PolarHBondContact O-N 3.29Å | ||
| 126 | H | 92.8 | Very high | 90.3 | Very high | 26 Ų | 26 | 63.9 Ų | 63.9 | 12% | 0.12 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -56.6 | -27.2 | 179.3 | -59.7 | 171 | 0 | 0 | 0 | 113.9 | I123 L130 L202 N203 I210 | I123-H126 PolarHBondContact O-CD2 3.33Å; I123-H126 VanDerWaalsContact O-CD2 3.29Å; H126-L130 WeakPolarHBondContact O-CB 3.32Å; H126-L130 PolarHBondContact O-N 2.81Å; H126-L202 HydrophobicContact CB-CB 4.19Å; H126-L202 HydrophobicContact CB-CD1 4.46Å; H126-L202 PolarHBondContact CE1-O 2.92Å; H126-L202 PolarHBondContact ND1-O 3.49Å; H126-N203 PolarHBondContact ND1-OD1 2.87Å; H126-I210 VanDerWaalsContact NE2-CD1 3.27Å; H126-I210 WeakPolarHBondContact NE2-CD1 3.49Å |
| 127 | Y | 91.9 | Very high | 91 | Very high | 94 Ų | 94 | 58.4 Ų | 58.4 | 37% | 0.369 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -72.6 | -45 | 176.2 | -65.3 | -84.1 | 0 | 0 | 0 | 111.6 | D125 S131 I175 I199 | D125-Y127 PolarHBondContact O-N 2.89Å; D125-Y127 VanDerWaalsContact O-N 3.11Å; D125-Y127 WeakPolarHBondContact OD1-CB 3.42Å; D125-Y127 PolarHBondContact OD1-N 3.28Å; Y127-S131 WeakPolarHBondContact O-CB 3.26Å; Y127-S131 PolarHBondContact O-N 3.46Å; Y127-I175 HydrophobicContact CD1-CD1 4.49Å; Y127-I175 HydrophobicContact CD1-CG2 3.63Å; Y127-I175 HydrophobicContact CE1-CD1 3.76Å; Y127-I175 HydrophobicContact CE1-CG1 4.35Å; Y127-I175 HydrophobicContact CE1-CG2 3.96Å; Y127-I199 HydrophobicContact CD1-CD1 3.55Å; Y127-I199 HydrophobicContact CD1-CG1 3.91Å; Y127-I199 HydrophobicContact CD1-CG2 4.14Å; Y127-I199 HydrophobicContact CE1-CB 4.31Å; Y127-I199 HydrophobicContact CE1-CD1 4.01Å; Y127-I199 HydrophobicContact CE1-CG1 3.94Å; Y127-I199 HydrophobicContact CE1-CG2 3.46Å; Y127-I199 VanDerWaalsContact CE1-CG2 3.46Å; Y127-I199 HydrophobicContact CE2-CG2 4.46Å; Y127-I199 HydrophobicContact CG-CD1 4.07Å |
| 128 | Q | 90.8 | Very high | 91.2 | Very high | 78 Ų | 78 | 54.8 Ų | 54.8 | 36% | 0.364 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -68.6 | -40.6 | 176.4 | -167.7 | 162.8 | 62.9 | 0 | 0 | 111 | F122 D125 L130 S131 E132 | F122-Q128 HydrophobicContact CD1-CB 4.3Å; F122-Q128 HydrophobicContact CD1-CG 3.54Å; F122-Q128 HydrophobicContact CE1-CG 3.91Å; F122-Q128 HydrophobicContact CG-CG 4.12Å; D125-Q128 HydrophobicContact CB-CB 4.14Å; D125-Q128 PolarHBondContact O-N 2.89Å; D125-Q128 VanDerWaalsContact O-N 3.08Å; D125-Q128 PolarHBondContact OD1-N 3.39Å; D125-Q128 WeakPolarHBondContact OD2-CB 3.38Å; Q128-L130 PolarHBondContact O-N 3.08Å; Q128-S131 WeakPolarHBondContact O-CB 3.28Å; Q128-S131 PolarHBondContact O-N 3.25Å; Q128-E132 HydrophobicContact CG-CG 4.43Å; Q128-E132 WeakPolarHBondContact O-CG 3.28Å; Q128-E132 PolarHBondContact O-N 3.19Å |
| 129 | L | 93.3 | Very high | 91.1 | Very high | 8 Ų | 8 | 49.7 Ų | 49.7 | 4% | 0.042 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -55.1 | -52.9 | 173.5 | 178.5 | 65.4 | 0 | 0 | 0 | 112.1 | L119 F122 D125 S131 A133 I210 L214 | L119-L129 HydrophobicContact CB-CD1 3.93Å; L119-L129 HydrophobicContact CD2-CD1 4.44Å; L119-L129 VanDerWaalsContact O-CD1 3.31Å; L119-L129 WeakPolarHBondContact O-CD1 3.48Å; F122-L129 HydrophobicContact CB-CB 3.99Å; F122-L129 HydrophobicContact CB-CD1 4.31Å; D125-L129 WeakPolarHBondContact O-CB 3.47Å; D125-L129 PolarHBondContact O-N 3.29Å; L129-S131 VanDerWaalsContact C-N 3.31Å; L129-S131 PolarHBondContact O-N 2.96Å; L129-A133 WeakPolarHBondContact O-CB 3.25Å; L129-A133 PolarHBondContact O-N 3.03Å; L129-I210 HydrophobicContact CD2-CG2 3.7Å; L129-L214 HydrophobicContact CD1-CD1 4.1Å |
| 130 | L | 93.6 | Very high | 90.9 | Very high | 17 Ų | 17 | 51 Ų | 51 | 9% | 0.089 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.5 | -35.4 | 179.9 | -168.5 | 71 | 0 | 0 | 0 | 111.6 | H126 Q128 A133 W134 W195 C198 I199 L202 | H126-L130 WeakPolarHBondContact O-CB 3.32Å; H126-L130 PolarHBondContact O-N 2.81Å; Q128-L130 PolarHBondContact O-N 3.08Å; L130-A133 PolarHBondContact O-N 2.97Å; L130-W134 WeakPolarHBondContact O-CB 3.48Å; L130-W134 VanDerWaalsContact O-CD1 3.31Å; L130-W134 PolarHBondContact O-N 3.39Å; L130-W195 HydrophobicContact CB-CH2 3.98Å; L130-W195 HydrophobicContact CB-CZ3 4.05Å; L130-W195 HydrophobicContact CD2-CD2 3.93Å; L130-W195 HydrophobicContact CD2-CE3 3.53Å; L130-W195 HydrophobicContact CD2-CH2 3.96Å; L130-W195 HydrophobicContact CD2-CZ2 4.32Å; L130-W195 HydrophobicContact CD2-CZ3 3.55Å; L130-W195 HydrophobicContact CG-CE3 4.02Å; L130-W195 HydrophobicContact CG-CH2 4.01Å; L130-W195 HydrophobicContact CG-CZ3 3.57Å; L130-C198 HydrophobicContact CD1-CB 3.87Å; L130-C198 HydrophobicContact CD2-CB 3.51Å; L130-C198 HydrophobicContact CG-CB 4.37Å; L130-I199 HydrophobicContact CB-CD1 3.87Å; L130-I199 HydrophobicContact CD2-CD1 3.51Å; L130-I199 HydrophobicContact CD2-CG1 3.7Å; L130-I199 HydrophobicContact CG-CD1 4.33Å; L130-L202 HydrophobicContact CB-CD1 4.04Å; L130-L202 HydrophobicContact CD1-CD1 4.04Å; L130-L202 HydrophobicContact CG-CD1 4.48Å |
| 131 | S | 91.7 | Very high | 90.9 | Very high | 23 Ų | 23 | 54.2 Ų | 54.2 | 16% | 0.161 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.8 | -55 | 176.1 | 175.1 | 0 | 0 | 0 | 0 | 111.3 | Y127 Q128 L129 A133 W134 I135 | Y127-S131 WeakPolarHBondContact O-CB 3.26Å; Y127-S131 PolarHBondContact O-N 3.46Å; Q128-S131 WeakPolarHBondContact O-CB 3.28Å; Q128-S131 PolarHBondContact O-N 3.25Å; L129-S131 VanDerWaalsContact C-N 3.31Å; L129-S131 PolarHBondContact O-N 2.96Å; S131-A133 VanDerWaalsContact C-N 3.29Å; S131-A133 PolarHBondContact O-N 3.39Å; S131-W134 PolarHBondContact O-N 3.46Å; S131-I135 WeakPolarHBondContact O-CB 3.4Å; S131-I135 WeakPolarHBondContact O-CD1 3.5Å; S131-I135 WeakPolarHBondContact O-CG1 3.25Å; S131-I135 PolarHBondContact O-N 2.91Å |
| 132 | E | 90.6 | Very high | 90.8 | Very high | 29 Ų | 29 | 49.6 Ų | 49.6 | 14% | 0.136 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.1 | -34.9 | 179 | -58.4 | -40.7 | 129.7 | 0 | 0 | 112 | R114 L119 F122 Q128 S136 | R114-E132 IonicContact CZ-OE1 3.46Å; R114-E132 IonicContact CZ-OE2 2.67Å; R114-E132 IonicContact NH1-OE1 3.15Å; R114-E132 PolarHBondContact NH1-OE1 3.41Å; R114-E132 IonicContact NH1-OE2 2.72Å; R114-E132 PolarHBondContact NH1-OE2 2.79Å; R114-E132 IonicContact NH2-OE1 2.76Å; R114-E132 PolarHBondContact NH2-OE1 3.45Å; R114-E132 IonicContact NH2-OE2 3.1Å; L119-E132 HydrophobicContact CD2-CB 3.86Å; F122-E132 HydrophobicContact CD2-CB 4.31Å; F122-E132 HydrophobicContact CD2-CG 3.86Å; F122-E132 HydrophobicContact CE1-CG 4.5Å; F122-E132 HydrophobicContact CE2-CB 4.22Å; F122-E132 HydrophobicContact CE2-CG 3.57Å; F122-E132 HydrophobicContact CG-CG 4.44Å; F122-E132 HydrophobicContact CZ-CG 3.89Å; Q128-E132 HydrophobicContact CG-CG 4.43Å; Q128-E132 WeakPolarHBondContact O-CG 3.28Å; Q128-E132 PolarHBondContact O-N 3.19Å; E132-S136 WeakPolarHBondContact O-CB 3.42Å; E132-S136 PolarHBondContact O-N 3Å; E132-S136 PolarHBondContact O-OG 2.86Å |
| 133 | A | 92 | Very high | 90.7 | Very high | 20 Ų | 20 | 53 Ų | 53 | 17% | 0.165 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.7 | -48.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | L119 L129 L130 S131 S136 I137 | L119-A133 HydrophobicContact CD1-CB 4.34Å; L119-A133 HydrophobicContact CD2-CB 4.24Å; L129-A133 WeakPolarHBondContact O-CB 3.25Å; L129-A133 PolarHBondContact O-N 3.03Å; L130-A133 PolarHBondContact O-N 2.97Å; S131-A133 VanDerWaalsContact C-N 3.29Å; S131-A133 PolarHBondContact O-N 3.39Å; A133-S136 PolarHBondContact O-N 2.93Å; A133-I137 WeakPolarHBondContact O-CD1 3.44Å; A133-I137 VanDerWaalsContact O-CG1 3.25Å; A133-I137 WeakPolarHBondContact O-CG1 3.49Å; A133-I137 PolarHBondContact O-N 3.02Å |
| 134 | W | 92.2 | Very high | 90.5 | Very high | 10 Ų | 10 | 59.3 Ų | 59.3 | 4% | 0.038 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -64.5 | -40.6 | 177.7 | -82.1 | 38.3 | 0 | 0 | 0 | 111.9 | L130 S131 I137 G138 L142 P178 Y179 I191 L194 W195 | L130-W134 WeakPolarHBondContact O-CB 3.48Å; L130-W134 VanDerWaalsContact O-CD1 3.31Å; L130-W134 PolarHBondContact O-N 3.39Å; S131-W134 PolarHBondContact O-N 3.46Å; W134-I137 PolarHBondContact O-N 3.2Å; W134-G138 PolarHBondContact O-N 3.4Å; W134-G138 VanDerWaalsContact O-N 3.13Å; W134-L142 HydrophobicContact CB-CD2 4.32Å; W134-L142 HydrophobicContact CD2-CD2 3.39Å; W134-L142 HydrophobicContact CE3-CD2 3.47Å; W134-L142 VanDerWaalsContact CE3-CD2 3.47Å; W134-L142 HydrophobicContact CG-CD2 3.8Å; W134-L142 HydrophobicContact CH2-CD2 4.32Å; W134-L142 HydrophobicContact CZ2-CD2 4.27Å; W134-L142 HydrophobicContact CZ3-CD2 3.95Å; W134-P178 HydrophobicContact CB-CB 4.49Å; W134-P178 HydrophobicContact CB-CG 4.02Å; W134-Y179 HydrophobicContact CB-CE2 4.13Å; W134-Y179 HydrophobicContact CE3-CD2 4Å; W134-Y179 VanDerWaalsContact O-CE2 3.3Å; W134-Y179 WeakPolarHBondContact O-CE2 3.47Å; W134-Y179 PolarHBondContact O-OH 3.25Å; W134-I191 HydrophobicContact CH2-CG2 4.4Å; W134-I191 HydrophobicContact CZ3-CG2 3.98Å; W134-L194 HydrophobicContact CH2-CD2 4.34Å; W134-L194 HydrophobicContact CH2-CG 4.34Å; W134-L194 HydrophobicContact CZ2-CD2 4.49Å; W134-L194 HydrophobicContact CZ2-CG 4.37Å; W134-W195 HydrophobicContact CB-CZ3 4.43Å; W134-W195 AromaticContact CD2-CE3 3.65Å; W134-W195 HydrophobicContact CD2-CE3 3.65Å; W134-W195 AromaticContact CD2-CZ3 3.83Å; W134-W195 HydrophobicContact CD2-CZ3 3.83Å; W134-W195 AromaticContact CE2-CE3 3.84Å; W134-W195 AromaticContact CE3-CE3 3.59Å; W134-W195 HydrophobicContact CE3-CE3 3.59Å; W134-W195 HydrophobicContact CE3-CZ3 4.04Å; W134-W195 HydrophobicContact CG-CE3 4.31Å; W134-W195 HydrophobicContact CG-CZ3 4.01Å; W134-W195 HydrophobicContact CH2-CB 3.73Å; W134-W195 AromaticContact CH2-CE3 3.97Å; W134-W195 HydrophobicContact CH2-CE3 3.97Å; W134-W195 HydrophobicContact CZ2-CB 4.36Å; W134-W195 HydrophobicContact CZ2-CE3 4.01Å; W134-W195 HydrophobicContact CZ3-CB 4.12Å; W134-W195 AromaticContact CZ3-CE3 3.76Å; W134-W195 HydrophobicContact CZ3-CE3 3.76Å |
| 135 | I | 89.1 | Confident | 90.5 | Very high | 84 Ų | 84 | 59 Ų | 59 | 43% | 0.431 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.3 | -45.7 | 173.2 | -69.5 | 166.1 | 0 | 0 | 0 | 110.5 | S131 I137 G138 P178 Y179 | S131-I135 WeakPolarHBondContact O-CB 3.4Å; S131-I135 WeakPolarHBondContact O-CD1 3.5Å; S131-I135 WeakPolarHBondContact O-CG1 3.25Å; S131-I135 PolarHBondContact O-N 2.91Å; I135-I137 PolarHBondContact O-N 3.45Å; I135-G138 PolarHBondContact O-N 3.01Å; I135-P178 HydrophobicContact CD1-CB 4.4Å; I135-P178 HydrophobicContact CD1-CG 4.21Å; I135-P178 HydrophobicContact CG1-CB 3.74Å; I135-P178 HydrophobicContact CG1-CG 3.84Å; I135-Y179 WeakPolarHBondContact CA-OH 3.4Å |
| 136 | S | 88.5 | Confident | 90.4 | Very high | 89 Ų | 89 | 56.7 Ų | 56.7 | 62% | 0.622 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -68.2 | -31.7 | -178.8 | -60.6 | 0 | 0 | 0 | 0 | 113.8 | E132 A133 | E132-S136 WeakPolarHBondContact O-CB 3.42Å; E132-S136 PolarHBondContact O-N 3Å; E132-S136 PolarHBondContact O-OG 2.86Å; A133-S136 PolarHBondContact O-N 2.93Å |
| 137 | I | 90.4 | Very high | 90.4 | Very high | 55 Ų | 55 | 58.7 Ų | 58.7 | 28% | 0.282 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -73.5 | -41.4 | 176.5 | -69.5 | 164.7 | 0 | 0 | 0 | 110.8 | A133 W134 I135 K141 L142 L145 | A133-I137 WeakPolarHBondContact O-CD1 3.44Å; A133-I137 VanDerWaalsContact O-CG1 3.25Å; A133-I137 WeakPolarHBondContact O-CG1 3.49Å; A133-I137 PolarHBondContact O-N 3.02Å; W134-I137 PolarHBondContact O-N 3.2Å; I135-I137 PolarHBondContact O-N 3.45Å; I137-K141 HydrophobicContact CG2-CB 3.73Å; I137-K141 WeakPolarHBondContact O-CD 3.48Å; I137-L142 HydrophobicContact CG2-CB 3.92Å; I137-L145 HydrophobicContact CG2-CD1 4.02Å |
| 138 | G | 89 | Confident | 90.2 | Very high | 18 Ų | 18 | 58.1 Ų | 58.1 | 19% | 0.186 | 34% | 0.336 | C | S | . | . | trans | 82.9 | 150.8 | -173.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | W134 I135 S140 K141 L142 Y179 | W134-G138 PolarHBondContact O-N 3.4Å; W134-G138 VanDerWaalsContact O-N 3.13Å; I135-G138 PolarHBondContact O-N 3.01Å; G138-S140 PolarHBondContact O-N 3.38Å; G138-K141 PolarHBondContact O-N 3.36Å; G138-L142 WeakPolarHBondContact O-CB 3.28Å; G138-L142 PolarHBondContact O-N 2.8Å; G138-Y179 VanDerWaalsContact CA-OH 3.29Å; G138-Y179 WeakPolarHBondContact CA-OH 3.45Å | ||
| 139 | P | 88.1 | Confident | 90.2 | Very high | 41 Ų | 41 | 59.7 Ų | 59.7 | 27% | 0.266 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -65.2 | -36.7 | -168.8 | 24.5 | -32.4 | 0 | 0 | 0 | 113 | L142 K143 Y179 F182 | P139-L142 PolarHBondContact O-N 2.95Å; P139-K143 PolarHBondContact O-N 3.4Å; P139-Y179 HydrophobicContact CB-CD1 3.92Å; P139-Y179 HydrophobicContact CB-CD2 4.29Å; P139-Y179 HydrophobicContact CB-CE1 3.96Å; P139-Y179 HydrophobicContact CB-CE2 4.31Å; P139-Y179 HydrophobicContact CB-CG 4.11Å; P139-Y179 HydrophobicContact CG-CD1 4.28Å; P139-Y179 HydrophobicContact CG-CE1 3.97Å; P139-F182 HydrophobicContact CB-CB 4.27Å; P139-F182 HydrophobicContact CB-CD1 4.03Å |
| 140 | S | 86.5 | Confident | 90.2 | Very high | 80 Ų | 80 | 62.6 Ų | 62.6 | 56% | 0.559 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -65.9 | -49.1 | 180 | -43 | 0 | 0 | 0 | 0 | 112.2 | G138 L142 K143 D144 | G138-S140 PolarHBondContact O-N 3.38Å; S140-L142 VanDerWaalsContact C-N 3.28Å; S140-L142 PolarHBondContact O-N 3.4Å; S140-K143 VanDerWaalsContact O-CB 3.31Å; S140-K143 WeakPolarHBondContact O-CB 3.48Å; S140-K143 PolarHBondContact O-N 2.65Å; S140-D144 PolarHBondContact O-N 2.97Å; S140-D144 VanDerWaalsContact O-N 3.07Å |
| 141 | K | 90.1 | Very high | 90 | Very high | 136 Ų | 136 | 63 Ų | 63 | 59% | 0.591 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -66 | -33.6 | 177 | -63.3 | -172.5 | -167.4 | 164.6 | 0 | 112 | I137 G138 K143 D144 L145 | I137-K141 HydrophobicContact CG2-CB 3.73Å; I137-K141 WeakPolarHBondContact O-CD 3.48Å; G138-K141 PolarHBondContact O-N 3.36Å; K141-K143 VanDerWaalsContact C-N 3.33Å; K141-D144 PolarHBondContact O-N 2.75Å; K141-L145 VanDerWaalsContact O-CG 3.29Å; K141-L145 WeakPolarHBondContact O-CG 3.35Å; K141-L145 PolarHBondContact O-N 3.18Å |
| 142 | L | 90.5 | Very high | 89.9 | Confident | 11 Ų | 11 | 65 Ų | 65 | 6% | 0.058 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -66.1 | -37.1 | 175.9 | -174.6 | 56 | 0 | 0 | 0 | 111.3 | W134 I137 G138 P139 S140 D144 L145 V146 Y179 F182 | W134-L142 HydrophobicContact CB-CD2 4.32Å; W134-L142 HydrophobicContact CD2-CD2 3.39Å; W134-L142 HydrophobicContact CE3-CD2 3.47Å; W134-L142 VanDerWaalsContact CE3-CD2 3.47Å; W134-L142 HydrophobicContact CG-CD2 3.8Å; W134-L142 HydrophobicContact CH2-CD2 4.32Å; W134-L142 HydrophobicContact CZ2-CD2 4.27Å; W134-L142 HydrophobicContact CZ3-CD2 3.95Å; I137-L142 HydrophobicContact CG2-CB 3.92Å; G138-L142 WeakPolarHBondContact O-CB 3.28Å; G138-L142 PolarHBondContact O-N 2.8Å; P139-L142 PolarHBondContact O-N 2.95Å; S140-L142 VanDerWaalsContact C-N 3.28Å; S140-L142 PolarHBondContact O-N 3.4Å; L142-D144 VanDerWaalsContact C-N 3.34Å; L142-L145 PolarHBondContact O-N 2.94Å; L142-V146 HydrophobicContact CD1-CG2 4.27Å; L142-V146 WeakPolarHBondContact O-CB 3.39Å; L142-V146 WeakPolarHBondContact O-CG2 3.12Å; L142-V146 PolarHBondContact O-N 3.25Å; L142-Y179 HydrophobicContact CD2-CD2 4.01Å; L142-Y179 HydrophobicContact CD2-CE2 4.02Å; L142-F182 HydrophobicContact CB-CE1 4.16Å; L142-F182 HydrophobicContact CB-CZ 4.49Å; L142-F182 HydrophobicContact CD2-CE1 3.7Å; L142-F182 HydrophobicContact CD2-CZ 4.18Å; L142-F182 HydrophobicContact CG-CE1 3.8Å; L142-F182 HydrophobicContact CG-CZ 3.91Å |
| 143 | K | 88 | Confident | 90 | Very high | 83 Ų | 83 | 66.1 Ų | 66.1 | 36% | 0.361 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -61.1 | -39.9 | 169.3 | -168.5 | 175 | -175.8 | 170.6 | 0 | 112.2 | P139 S140 K141 F182 D183 | P139-K143 PolarHBondContact O-N 3.4Å; S140-K143 VanDerWaalsContact O-CB 3.31Å; S140-K143 WeakPolarHBondContact O-CB 3.48Å; S140-K143 PolarHBondContact O-N 2.65Å; K141-K143 VanDerWaalsContact C-N 3.33Å; K143-F182 HydrophobicContact CB-CB 4.08Å; K143-F182 HydrophobicContact CB-CD2 3.54Å; K143-F182 HydrophobicContact CB-CE2 4.13Å; K143-F182 HydrophobicContact CB-CG 3.94Å; K143-F182 HydrophobicContact CD-CB 3.95Å; K143-F182 HydrophobicContact CD-CD2 4.13Å; K143-F182 HydrophobicContact CD-CG 4.49Å; K143-F182 HydrophobicContact CG-CB 4.38Å; K143-F182 HydrophobicContact CG-CD2 3.73Å; K143-F182 HydrophobicContact CG-CE2 4.43Å; K143-F182 HydrophobicContact CG-CG 4.41Å; K143-D183 IonicContact NZ-OD2 2.98Å; K143-D183 PolarHBondContact NZ-OD2 3.1Å |
| 144 | D | 89.6 | Confident | 90 | Very high | 137 Ų | 137 | 65.2 Ų | 65.2 | 73% | 0.733 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -72.6 | -32.3 | 179.5 | -60.5 | -32 | 0 | 0 | 0 | 113.2 | S140 K141 L142 | S140-D144 PolarHBondContact O-N 2.97Å; S140-D144 VanDerWaalsContact O-N 3.07Å; K141-D144 PolarHBondContact O-N 2.75Å; L142-D144 VanDerWaalsContact C-N 3.34Å |
| 145 | L | 90.6 | Very high | 89.9 | Confident | 129 Ų | 129 | 65.3 Ų | 65.3 | 68% | 0.675 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -74.9 | -22.9 | 176.3 | -71.8 | 169.1 | 0 | 0 | 0 | 113.2 | I137 K141 L142 | I137-L145 HydrophobicContact CG2-CD1 4.02Å; K141-L145 VanDerWaalsContact O-CG 3.29Å; K141-L145 WeakPolarHBondContact O-CG 3.35Å; K141-L145 PolarHBondContact O-N 3.18Å; L142-L145 PolarHBondContact O-N 2.94Å |
| 146 | V | 90.1 | Very high | 90 | Very high | 22 Ų | 22 | 69 Ų | 69 | 13% | 0.133 | 39% | 0.388 | C | S | . | . | S | Bend | trans | -97.9 | 113.6 | -174.6 | 173 | 0 | 0 | 0 | 0 | 110.4 | L142 A148 L150 L151 L194 | L142-V146 HydrophobicContact CD1-CG2 4.27Å; L142-V146 WeakPolarHBondContact O-CB 3.39Å; L142-V146 WeakPolarHBondContact O-CG2 3.12Å; L142-V146 PolarHBondContact O-N 3.25Å; V146-A148 PolarHBondContact O-N 3.26Å; V146-L150 HydrophobicContact CG1-CD2 4.49Å; V146-L151 HydrophobicContact CG1-CB 4.13Å; V146-L194 HydrophobicContact CB-CD2 4.44Å; V146-L194 HydrophobicContact CG1-CD2 3.89Å; V146-L194 HydrophobicContact CG2-CD2 3.68Å |
| 147 | S | 91 | Very high | 90.1 | Very high | 69 Ų | 69 | 68.8 Ų | 68.8 | 48% | 0.483 | 37% | 0.374 | S | S | . | . | trans | -58.2 | 137.8 | 177.7 | 76.4 | 0 | 0 | 0 | 0 | 112.2 | N149 L150 L151 | S147-N149 PolarHBondContact O-N 3.44Å; S147-N149 VanDerWaalsContact O-N 3.14Å; S147-L150 PolarHBondContact O-N 3.42Å; S147-L150 WeakPolarHBondContact OG-CB 3.47Å; S147-L150 PolarHBondContact OG-N 2.98Å; S147-L151 PolarHBondContact O-N 2.93Å | ||
| 148 | A | 88.7 | Confident | 90 | Very high | 82 Ų | 82 | 67.8 Ų | 67.8 | 68% | 0.678 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -57.3 | -31.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | V146 S152 | V146-A148 PolarHBondContact O-N 3.26Å; A148-S152 WeakPolarHBondContact O-CB 3.28Å; A148-S152 PolarHBondContact O-N 3.07Å |
| 149 | N | 91.3 | Very high | 89.9 | Confident | 110 Ų | 110 | 74.1 Ų | 74.1 | 59% | 0.588 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -62.6 | -51.4 | 173.3 | -175.3 | 29.2 | 0 | 0 | 0 | 111.5 | S147 L151 S152 I153 | S147-N149 PolarHBondContact O-N 3.44Å; S147-N149 VanDerWaalsContact O-N 3.14Å; N149-L151 PolarHBondContact O-N 2.93Å; N149-S152 PolarHBondContact O-N 3.38Å; N149-S152 VanDerWaalsContact O-N 3.14Å; N149-S152 PolarHBondContact O-OG 2.88Å; N149-I153 WeakPolarHBondContact O-CG1 3.48Å; N149-I153 PolarHBondContact O-N 2.66Å |
| 150 | L | 91.7 | Very high | 89.9 | Confident | 69 Ų | 69 | 78.1 Ų | 78.1 | 36% | 0.361 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -57.5 | -47.4 | 177.3 | 177.7 | 59.7 | 0 | 0 | 0 | 111.3 | V146 S147 S152 I153 C154 L194 | V146-L150 HydrophobicContact CG1-CD2 4.49Å; S147-L150 PolarHBondContact O-N 3.42Å; S147-L150 WeakPolarHBondContact OG-CB 3.47Å; S147-L150 PolarHBondContact OG-N 2.98Å; L150-S152 VanDerWaalsContact C-N 3.3Å; L150-S152 PolarHBondContact O-N 3.49Å; L150-I153 WeakPolarHBondContact O-CB 3.15Å; L150-I153 PolarHBondContact O-N 2.92Å; L150-I153 VanDerWaalsContact O-N 3.14Å; L150-C154 PolarHBondContact O-N 3.33Å; L150-C154 PolarHBondContact O-SG 3.42Å; L150-C154 VanDerWaalsContact O-SG 3.36Å; L150-L194 HydrophobicContact CD2-CD1 4.02Å; L150-L194 HydrophobicContact CG-CD1 4.34Å |
| 151 | L | 90.5 | Very high | 89.8 | Confident | 26 Ų | 26 | 78 Ų | 78 | 14% | 0.136 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.5 | -38.9 | 177.7 | -171.3 | 67.3 | 0 | 0 | 0 | 111.9 | V146 S147 N149 I153 C154 A155 Q188 I191 | V146-L151 HydrophobicContact CG1-CB 4.13Å; S147-L151 PolarHBondContact O-N 2.93Å; N149-L151 PolarHBondContact O-N 2.93Å; L151-I153 VanDerWaalsContact C-N 3.33Å; L151-I153 PolarHBondContact O-N 3.46Å; L151-C154 PolarHBondContact O-N 2.91Å; L151-A155 WeakPolarHBondContact O-CB 3.44Å; L151-A155 PolarHBondContact O-N 3.3Å; L151-Q188 HydrophobicContact CD2-CG 4.12Å; L151-Q188 VanDerWaalsContact CD2-NE2 3.33Å; L151-I191 HydrophobicContact CD1-CG1 4.28Å |
| 152 | S | 89.9 | Confident | 89.4 | Confident | 65 Ų | 65 | 78.2 Ų | 78.2 | 46% | 0.455 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -64.8 | -35.2 | 175.9 | 82.8 | 0 | 0 | 0 | 0 | 113 | A148 N149 L150 R156 | A148-S152 WeakPolarHBondContact O-CB 3.28Å; A148-S152 PolarHBondContact O-N 3.07Å; N149-S152 PolarHBondContact O-N 3.38Å; N149-S152 VanDerWaalsContact O-N 3.14Å; N149-S152 PolarHBondContact O-OG 2.88Å; L150-S152 VanDerWaalsContact C-N 3.3Å; L150-S152 PolarHBondContact O-N 3.49Å; S152-R156 WeakPolarHBondContact O-CB 3.48Å; S152-R156 PolarHBondContact O-N 2.85Å |
| 153 | I | 91.8 | Very high | 88.9 | Confident | 53 Ų | 53 | 86 Ų | 86 | 27% | 0.272 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -67.9 | -44.8 | 175.3 | -67.8 | 164.4 | 0 | 0 | 0 | 109.9 | N149 L150 L151 R156 R157 | N149-I153 WeakPolarHBondContact O-CG1 3.48Å; N149-I153 PolarHBondContact O-N 2.66Å; L150-I153 WeakPolarHBondContact O-CB 3.15Å; L150-I153 PolarHBondContact O-N 2.92Å; L150-I153 VanDerWaalsContact O-N 3.14Å; L151-I153 VanDerWaalsContact C-N 3.33Å; L151-I153 PolarHBondContact O-N 3.46Å; I153-R156 PolarHBondContact O-N 3.41Å; I153-R157 PolarHBondContact O-N 2.89Å |
| 154 | C | 92.1 | Very high | 88.1 | Confident | 0 Ų | 0 | 89.1 Ų | 89.1 | 0% | 0 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -62.3 | -45.7 | 175.3 | -64.6 | 0 | 0 | 0 | 0 | 111.4 | L150 L151 R156 R157 E158 G190 E193 | L150-C154 PolarHBondContact O-N 3.33Å; L150-C154 PolarHBondContact O-SG 3.42Å; L150-C154 VanDerWaalsContact O-SG 3.36Å; L151-C154 PolarHBondContact O-N 2.91Å; C154-R156 VanDerWaalsContact C-N 3.27Å; C154-R156 PolarHBondContact O-N 2.75Å; C154-R157 PolarHBondContact O-N 3.31Å; C154-R157 VanDerWaalsContact O-N 3.09Å; C154-E158 PolarHBondContact O-N 3.03Å; C154-G190 VanDerWaalsContact CB-O 3.27Å; C154-G190 WeakPolarHBondContact CB-O 3.33Å; C154-E193 HydrophobicContact CB-CB 3.97Å; C154-E193 HydrophobicContact CB-CG 3.64Å |
| 155 | A | 90.2 | Very high | 87 | Confident | 13 Ų | 13 | 85.2 Ų | 85.2 | 11% | 0.107 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -60.2 | -35.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L151 R159 L189 G190 | L151-A155 WeakPolarHBondContact O-CB 3.44Å; L151-A155 PolarHBondContact O-N 3.3Å; A155-R159 VanDerWaalsContact O-CB 3.3Å; A155-R159 WeakPolarHBondContact O-CB 3.29Å; A155-R159 WeakPolarHBondContact O-CD 3.3Å; A155-R159 WeakPolarHBondContact O-CG 3.4Å; A155-R159 PolarHBondContact O-N 3.1Å; A155-R159 VanDerWaalsContact O-N 3.07Å; A155-L189 HydrophobicContact CB-CB 4.15Å; A155-L189 WeakPolarHBondContact CB-O 3.45Å; A155-G190 VanDerWaalsContact N-CA 3.34Å |
| 156 | R | 90.7 | Very high | 85.5 | Confident | 162 Ų | 162 | 84.2 Ų | 84.2 | 61% | 0.611 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -71.3 | -32.7 | 175.9 | -168.7 | -179.4 | 70.7 | 151.2 | -0.4 | 112.5 | S152 I153 C154 R160 | S152-R156 WeakPolarHBondContact O-CB 3.48Å; S152-R156 PolarHBondContact O-N 2.85Å; I153-R156 PolarHBondContact O-N 3.41Å; C154-R156 VanDerWaalsContact C-N 3.27Å; C154-R156 PolarHBondContact O-N 2.75Å; R156-R160 WeakPolarHBondContact O-CB 3.26Å; R156-R160 PolarHBondContact O-N 3.44Å |
| 157 | R | 90.9 | Very high | 83.9 | Confident | 83 Ų | 83 | 89.2 Ų | 89.2 | 31% | 0.313 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -71 | -53.1 | 173.1 | -74.6 | -178.3 | 173.7 | 134.7 | -11.5 | 110.9 | I153 C154 R159 R160 D161 E193 R197 | I153-R157 PolarHBondContact O-N 2.89Å; C154-R157 PolarHBondContact O-N 3.31Å; C154-R157 VanDerWaalsContact O-N 3.09Å; R157-R159 VanDerWaalsContact C-N 3.28Å; R157-R159 PolarHBondContact O-N 3.42Å; R157-R159 VanDerWaalsContact O-N 3.16Å; R157-R160 CarbonylContact O-C 3.57Å; R157-R160 WeakPolarHBondContact O-CA 3.31Å; R157-R160 VanDerWaalsContact O-CB 3.25Å; R157-R160 WeakPolarHBondContact O-CB 3.49Å; R157-R160 PolarHBondContact O-N 2.96Å; R157-D161 PolarHBondContact O-N 2.71Å; R157-E193 HydrophobicContact CB-CG 3.99Å; R157-E193 WeakPolarHBondContact CD-OE1 3.48Å; R157-E193 IonicContact NE-OE1 3.74Å; R157-R197 VanDerWaalsContact NH1-CZ 3.32Å; R157-R197 VanDerWaalsContact NH1-NE 3.1Å |
| 158 | E | 88.6 | Confident | 82.4 | Confident | 35 Ų | 35 | 95.8 Ų | 95.8 | 16% | 0.164 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -53.9 | -42.8 | 176.3 | -168.5 | 172.7 | -151.7 | 0 | 0 | 112.2 | C154 R160 D161 M162 L189 G190 S192 E193 | C154-E158 PolarHBondContact O-N 3.03Å; E158-R160 VanDerWaalsContact C-N 3.32Å; E158-R160 PolarHBondContact O-N 2.87Å; E158-D161 PolarHBondContact O-N 3.3Å; E158-M162 WeakPolarHBondContact O-CB 3.36Å; E158-M162 VanDerWaalsContact O-CG 3.25Å; E158-M162 WeakPolarHBondContact O-CG 3.35Å; E158-M162 PolarHBondContact O-N 3.43Å; E158-L189 WeakPolarHBondContact OE2-CA 3.47Å; E158-G190 PolarHBondContact OE2-N 3.48Å; E158-S192 WeakPolarHBondContact OE1-CB 3.21Å; E158-S192 PolarHBondContact OE1-OG 3.27Å; E158-E193 HydrophobicContact CB-CB 4.33Å |
| 159 | R | 87.2 | Confident | 80.6 | Confident | 151 Ų | 151 | 99.3 Ų | 99.3 | 57% | 0.57 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -66.1 | -23.6 | 173 | -73.5 | 173.6 | -175.6 | -168.4 | 1 | 115.4 | A155 R157 K163 L189 | A155-R159 VanDerWaalsContact O-CB 3.3Å; A155-R159 WeakPolarHBondContact O-CB 3.29Å; A155-R159 WeakPolarHBondContact O-CD 3.3Å; A155-R159 WeakPolarHBondContact O-CG 3.4Å; A155-R159 PolarHBondContact O-N 3.1Å; A155-R159 VanDerWaalsContact O-N 3.07Å; R157-R159 VanDerWaalsContact C-N 3.28Å; R157-R159 PolarHBondContact O-N 3.42Å; R157-R159 VanDerWaalsContact O-N 3.16Å; R159-K163 WeakPolarHBondContact O-CD 3.14Å; R159-K163 WeakPolarHBondContact O-CG 3.41Å; R159-L189 HydrophobicContact CG-CD2 3.62Å |
| 160 | R | 88.8 | Confident | 78.5 | Confident | 125 Ų | 125 | 97.4 Ų | 97.4 | 47% | 0.472 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -78.5 | -48.4 | 172.6 | 168.3 | -167.6 | -65 | -178.9 | -6.9 | 108.8 | R156 R157 E158 M162 K163 H164 | R156-R160 WeakPolarHBondContact O-CB 3.26Å; R156-R160 PolarHBondContact O-N 3.44Å; R157-R160 CarbonylContact O-C 3.57Å; R157-R160 WeakPolarHBondContact O-CA 3.31Å; R157-R160 VanDerWaalsContact O-CB 3.25Å; R157-R160 WeakPolarHBondContact O-CB 3.49Å; R157-R160 PolarHBondContact O-N 2.96Å; E158-R160 VanDerWaalsContact C-N 3.32Å; E158-R160 PolarHBondContact O-N 2.87Å; R160-M162 VanDerWaalsContact C-N 3.35Å; R160-M162 PolarHBondContact O-N 3.19Å; R160-K163 WeakPolarHBondContact O-CA 3.41Å; R160-K163 WeakPolarHBondContact O-CB 3.25Å; R160-K163 PolarHBondContact O-N 3.36Å; R160-H164 PolarHBondContact O-CD2 2.6Å; R160-H164 PolarHBondContact O-N 3.47Å |
| 161 | D | 84.4 | Confident | 76.3 | Confident | 77 Ų | 77 | 103.5 Ų | 103.5 | 41% | 0.412 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -71.4 | -34.7 | -171 | -52.4 | -33.2 | 0 | 0 | 0 | 110.5 | R157 E158 K163 H164 S165 | R157-D161 PolarHBondContact O-N 2.71Å; E158-D161 PolarHBondContact O-N 3.3Å; D161-K163 PolarHBondContact O-N 3.19Å; D161-H164 PolarHBondContact O-N 3.5Å; D161-S165 VanDerWaalsContact O-CB 3.26Å; D161-S165 WeakPolarHBondContact O-CB 3.3Å; D161-S165 PolarHBondContact O-N 2.64Å |
| 162 | M | 80.7 | Confident | 74.1 | Confident | 141 Ų | 141 | 106.6 Ų | 106.6 | 70% | 0.695 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -60.7 | -21.4 | 166.3 | -70.5 | -175.5 | 90.7 | 0 | 0 | 114.6 | E158 R160 | E158-M162 WeakPolarHBondContact O-CB 3.36Å; E158-M162 VanDerWaalsContact O-CG 3.25Å; E158-M162 WeakPolarHBondContact O-CG 3.35Å; E158-M162 PolarHBondContact O-N 3.43Å; R160-M162 VanDerWaalsContact C-N 3.35Å; R160-M162 PolarHBondContact O-N 3.19Å |
| 163 | K | 80.4 | Confident | 71.9 | Confident | 173 Ų | 173 | 107.5 Ų | 107.5 | 75% | 0.752 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -91.6 | -29.6 | 176.2 | -71.7 | 178.1 | 178.4 | -171.6 | 0 | 113.3 | R159 R160 D161 | R159-K163 WeakPolarHBondContact O-CD 3.14Å; R159-K163 WeakPolarHBondContact O-CG 3.41Å; R160-K163 WeakPolarHBondContact O-CA 3.41Å; R160-K163 WeakPolarHBondContact O-CB 3.25Å; R160-K163 PolarHBondContact O-N 3.36Å; D161-K163 PolarHBondContact O-N 3.19Å |
| 164 | H | 70.2 | Confident | 69.5 | Low | 149 Ų | 149 | 110.7 Ų | 110.7 | 69% | 0.69 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -94.1 | -12.2 | 179.2 | -65.6 | -72.6 | 0 | 0 | 0 | 113.2 | R160 D161 S166 | R160-H164 PolarHBondContact O-CD2 2.6Å; R160-H164 PolarHBondContact O-N 3.47Å; D161-H164 PolarHBondContact O-N 3.5Å; H164-S166 PolarHBondContact O-N 3.1Å |
| 165 | S | 66.6 | Low | 67.8 | Low | 55 Ų | 55 | 113.2 Ų | 113.2 | 39% | 0.385 | 57% | 0.567 | S | S | . | * | trans | -69.1 | 73.2 | 166.6 | -165.7 | 0 | 0 | 0 | 0 | 111.3 | D161 | D161-S165 VanDerWaalsContact O-CB 3.26Å; D161-S165 WeakPolarHBondContact O-CB 3.3Å; D161-S165 PolarHBondContact O-N 2.64Å | ||
| 166 | S | 59.3 | Low | 66.4 | Low | 109 Ų | 109 | 118.4 Ų | 118.4 | 76% | 0.762 | 60% | 0.597 | S | S | * | * | trans | -70.2 | -25.1 | 170.6 | -164.9 | 0 | 0 | 0 | 0 | 111.6 | H164 K168 | H164-S166 PolarHBondContact O-N 3.1Å; S166-K168 PolarHBondContact O-N 2.7Å | ||
| 167 | D | 57.6 | Low | 65.6 | Low | 126 Ų | 126 | 112.1 Ų | 112.1 | 67% | 0.674 | 58% | 0.575 | S | S | * | * | trans | -76.9 | 102.5 | 176.1 | -76.4 | -47.6 | 0 | 0 | 0 | 111.8 | N169 S170 | D167-N169 PolarHBondContact O-N 3.41Å; D167-S170 PolarHBondContact O-N 3.47Å | ||
| 168 | K | 58.5 | Low | 64.7 | Low | 207 Ų | 207 | 109.9 Ų | 109.9 | 90% | 0.9 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | -4.2 | 175.6 | -61.8 | 177.3 | -178.2 | 174.8 | 0 | 114.8 | S166 | S166-K168 PolarHBondContact O-N 2.7Š|
| 169 | N | 51.3 | Low | 64.1 | Low | 156 Ų | 156 | 109.9 Ų | 109.9 | 83% | 0.834 | 57% | 0.57 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | -8.6 | 175.7 | -71.3 | -16.3 | 0 | 0 | 0 | 113.8 | D167 K171 | D167-N169 PolarHBondContact O-N 3.41Å; N169-K171 PolarHBondContact O-N 3.32Å |
| 170 | S | 46.8 | Very low | 63.2 | Low | 71 Ų | 71 | 108.4 Ų | 108.4 | 50% | 0.497 | 58% | 0.578 | S | S | . | * | trans | -78.5 | 60.3 | 173.4 | -159.8 | 0 | 0 | 0 | 0 | 111.4 | D167 V172 | D167-S170 PolarHBondContact O-N 3.47Å; S170-V172 VanDerWaalsContact C-N 3.26Å; S170-V172 PolarHBondContact O-N 3.42Å; S170-V172 VanDerWaalsContact O-N 3.1Å | ||
| 171 | K | 45.4 | Very low | 62.4 | Low | 196 Ų | 196 | 103.2 Ų | 103.2 | 85% | 0.852 | 56% | 0.56 | S | S | * | * | trans | -66.9 | 97.7 | 147 | -88 | -172 | 172.7 | -176.9 | 0 | 105.9 | N169 S173 | N169-K171 PolarHBondContact O-N 3.32Å; K171-S173 PolarHBondContact O-N 2.97Å | ||
| 172 | V | 44.4 | Very low | 61.8 | Low | 92 Ų | 92 | 100 Ų | 100 | 56% | 0.558 | 54% | 0.543 | S | S | * | . | trans | -44.3 | 129.4 | 161.1 | 178.3 | 0 | 0 | 0 | 0 | 107.1 | S170 C174 H196 | S170-V172 VanDerWaalsContact C-N 3.26Å; S170-V172 PolarHBondContact O-N 3.42Å; S170-V172 VanDerWaalsContact O-N 3.1Å; V172-C174 PolarHBondContact O-N 3.07Å; V172-H196 WeakPolarHBondContact CG1-NE2 3.43Å | ||
| 173 | S | 44 | Very low | 61.1 | Low | 84 Ų | 84 | 97.6 Ų | 97.6 | 59% | 0.587 | 53% | 0.532 | S | S | * | . | trans | -49.1 | 139.4 | -166.7 | -171.9 | 0 | 0 | 0 | 0 | 110.9 | K171 I175 | K171-S173 PolarHBondContact O-N 2.97Å; S173-I175 PolarHBondContact O-N 3.21Å | ||
| 174 | C | 42.3 | Very low | 60.2 | Low | 119 Ų | 119 | 92.5 Ų | 92.5 | 80% | 0.804 | 53% | 0.53 | S | S | * | . | trans | -74.5 | 60.8 | -176.9 | 56.2 | 0 | 0 | 0 | 0 | 112.1 | V172 V176 | V172-C174 PolarHBondContact O-N 3.07Å; C174-V176 PolarHBondContact O-N 2.86Å | ||
| 175 | I | 55.1 | Low | 59.9 | Low | 54 Ų | 54 | 88.1 Ų | 88.1 | 28% | 0.277 | 52% | 0.515 | S | S | . | . | trans | -70.3 | 114.5 | 166.5 | -63.9 | 158.1 | 0 | 0 | 0 | 105.6 | Y127 S173 Q177 W195 | Y127-I175 HydrophobicContact CD1-CD1 4.49Å; Y127-I175 HydrophobicContact CD1-CG2 3.63Å; Y127-I175 HydrophobicContact CE1-CD1 3.76Å; Y127-I175 HydrophobicContact CE1-CG1 4.35Å; Y127-I175 HydrophobicContact CE1-CG2 3.96Å; S173-I175 PolarHBondContact O-N 3.21Å; I175-Q177 VanDerWaalsContact C-N 3.34Å; I175-Q177 PolarHBondContact O-N 2.91Å; I175-W195 HydrophobicContact CG2-CZ2 4.24Å | ||
| 176 | V | 62.5 | Low | 59.4 | Low | 121 Ų | 121 | 92.3 Ų | 92.3 | 73% | 0.733 | 53% | 0.534 | S | S | * | . | trans | -78 | 86.1 | -171.4 | -175.5 | 0 | 0 | 0 | 0 | 109.4 | C174 | C174-V176 PolarHBondContact O-N 2.86Š| ||
| 177 | Q | 73.5 | Confident | 59.1 | Low | 30 Ų | 30 | 96 Ų | 96 | 14% | 0.14 | 53% | 0.532 | C | S | . | . | trans | -56.1 | 134.1 | 164.8 | 58.9 | 178.3 | -17.1 | 0 | 0 | 109.3 | I175 Y179 S192 W195 | I175-Q177 VanDerWaalsContact C-N 3.34Å; I175-Q177 PolarHBondContact O-N 2.91Å; Q177-Y179 WeakPolarHBondContact CG-O 3.1Å; Q177-Y179 PolarHBondContact O-N 2.85Å; Q177-Y179 VanDerWaalsContact O-N 3.1Å; Q177-S192 PolarHBondContact NE2-OG 3.32Å; Q177-S192 VanDerWaalsContact OE1-CA 3.29Å; Q177-W195 HydrophobicContact CB-CB 4.3Å; Q177-W195 HydrophobicContact CB-CD2 3.69Å; Q177-W195 HydrophobicContact CB-CE3 4.13Å; Q177-W195 HydrophobicContact CB-CG 3.75Å | ||
| 178 | P | 72.4 | Confident | 59.6 | Low | 37 Ų | 37 | 91.4 Ų | 91.4 | 24% | 0.24 | 51% | 0.507 | C | S | . | . | S | Bend | trans | -60.7 | -23.1 | -175.2 | -30.1 | 37.6 | 0 | 0 | 0 | 115.2 | W134 I135 W195 | W134-P178 HydrophobicContact CB-CB 4.49Å; W134-P178 HydrophobicContact CB-CG 4.02Å; I135-P178 HydrophobicContact CD1-CB 4.4Å; I135-P178 HydrophobicContact CD1-CG 4.21Å; I135-P178 HydrophobicContact CG1-CB 3.74Å; I135-P178 HydrophobicContact CG1-CG 3.84Å; P178-W195 VanDerWaalsContact CD-CZ3 3.4Å; P178-W195 HydrophobicContact CG-CH2 4.49Å; P178-W195 HydrophobicContact CG-CZ3 4.24Å |
| 179 | Y | 75.2 | Confident | 60.4 | Low | 35 Ų | 35 | 84 Ų | 84 | 14% | 0.137 | 48% | 0.476 | C | S | . | . | trans | -132.7 | 134 | -178.7 | -46.4 | -59.7 | 0 | 0 | 0 | 110.7 | W134 I135 G138 P139 L142 Q177 F182 | W134-Y179 HydrophobicContact CB-CE2 4.13Å; W134-Y179 HydrophobicContact CE3-CD2 4Å; W134-Y179 VanDerWaalsContact O-CE2 3.3Å; W134-Y179 WeakPolarHBondContact O-CE2 3.47Å; W134-Y179 PolarHBondContact O-OH 3.25Å; I135-Y179 WeakPolarHBondContact CA-OH 3.4Å; G138-Y179 VanDerWaalsContact CA-OH 3.29Å; G138-Y179 WeakPolarHBondContact CA-OH 3.45Å; P139-Y179 HydrophobicContact CB-CD1 3.92Å; P139-Y179 HydrophobicContact CB-CD2 4.29Å; P139-Y179 HydrophobicContact CB-CE1 3.96Å; P139-Y179 HydrophobicContact CB-CE2 4.31Å; P139-Y179 HydrophobicContact CB-CG 4.11Å; P139-Y179 HydrophobicContact CG-CD1 4.28Å; P139-Y179 HydrophobicContact CG-CE1 3.97Å; L142-Y179 HydrophobicContact CD2-CD2 4.01Å; L142-Y179 HydrophobicContact CD2-CE2 4.02Å; Q177-Y179 WeakPolarHBondContact CG-O 3.1Å; Q177-Y179 PolarHBondContact O-N 2.85Å; Q177-Y179 VanDerWaalsContact O-N 3.1Å; Y179-F182 HydrophobicContact CD2-CD1 4.5Å; Y179-F182 HydrophobicContact CD2-CE1 4.38Å | ||
| 180 | V | 68.4 | Low | 62.1 | Low | 120 Ų | 120 | 76.5 Ų | 76.5 | 73% | 0.727 | 44% | 0.437 | S | S | * | . | S | Bend | trans | -98.3 | -10.6 | 167.1 | -64.3 | 0 | 0 | 0 | 0 | 112.6 | ||
| 181 | S | 71.3 | Confident | 64.1 | Low | 16 Ų | 16 | 73.2 Ų | 73.2 | 11% | 0.112 | 41% | 0.413 | C | S | . | . | trans | -160.2 | 146.3 | 178.1 | 176.3 | 0 | 0 | 0 | 0 | 108.5 | D183 G184 S185 | S181-D183 PolarHBondContact OG-N 2.81Å; S181-D183 PolarHBondContact OG-OD1 2.87Å; S181-G184 PolarHBondContact OG-N 2.72Å; S181-S185 WeakPolarHBondContact CB-O 3.33Å; S181-S185 PolarHBondContact OG-N 3.43Å; S181-S185 PolarHBondContact OG-O 3.28Å | ||
| 182 | F | 72.2 | Confident | 66.1 | Low | 10 Ų | 10 | 65.3 Ų | 65.3 | 4% | 0.044 | 38% | 0.383 | C | S | . | . | S | Bend | trans | -86.3 | -17.7 | 177.2 | -60.7 | -44.6 | 0 | 0 | 0 | 114 | P139 L142 K143 Y179 Q188 I191 | P139-F182 HydrophobicContact CB-CB 4.27Å; P139-F182 HydrophobicContact CB-CD1 4.03Å; L142-F182 HydrophobicContact CB-CE1 4.16Å; L142-F182 HydrophobicContact CB-CZ 4.49Å; L142-F182 HydrophobicContact CD2-CE1 3.7Å; L142-F182 HydrophobicContact CD2-CZ 4.18Å; L142-F182 HydrophobicContact CG-CE1 3.8Å; L142-F182 HydrophobicContact CG-CZ 3.91Å; K143-F182 HydrophobicContact CB-CB 4.08Å; K143-F182 HydrophobicContact CB-CD2 3.54Å; K143-F182 HydrophobicContact CB-CE2 4.13Å; K143-F182 HydrophobicContact CB-CG 3.94Å; K143-F182 HydrophobicContact CD-CB 3.95Å; K143-F182 HydrophobicContact CD-CD2 4.13Å; K143-F182 HydrophobicContact CD-CG 4.49Å; K143-F182 HydrophobicContact CG-CB 4.38Å; K143-F182 HydrophobicContact CG-CD2 3.73Å; K143-F182 HydrophobicContact CG-CE2 4.43Å; K143-F182 HydrophobicContact CG-CG 4.41Å; Y179-F182 HydrophobicContact CD2-CD1 4.5Å; Y179-F182 HydrophobicContact CD2-CE1 4.38Å; F182-Q188 VanDerWaalsContact CB-OE1 3.26Å; F182-Q188 VanDerWaalsContact CD2-OE1 3.28Å; F182-Q188 VanDerWaalsContact N-OE1 3.16Å; F182-I191 HydrophobicContact CD1-CD1 3.86Å; F182-I191 HydrophobicContact CD2-CD1 3.8Å; F182-I191 HydrophobicContact CD2-CG1 4.31Å; F182-I191 HydrophobicContact CE1-CD1 3.9Å; F182-I191 HydrophobicContact CE1-CG1 4.24Å; F182-I191 HydrophobicContact CE1-CG2 4.37Å; F182-I191 HydrophobicContact CE2-CD1 3.87Å; F182-I191 HydrophobicContact CE2-CG1 3.88Å; F182-I191 HydrophobicContact CG-CD1 3.8Å; F182-I191 HydrophobicContact CZ-CD1 3.92Å; F182-I191 HydrophobicContact CZ-CG1 3.84Å; F182-I191 HydrophobicContact CZ-CG2 4.46Å |
| 183 | D | 66.7 | Low | 68.3 | Low | 89 Ų | 89 | 62.2 Ų | 62.2 | 48% | 0.476 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -123.6 | 4.4 | -178.1 | 49.1 | 46.7 | 0 | 0 | 0 | 113.8 | K143 S181 S185 | K143-D183 IonicContact NZ-OD2 2.98Å; K143-D183 PolarHBondContact NZ-OD2 3.1Å; S181-D183 PolarHBondContact OG-N 2.81Å; S181-D183 PolarHBondContact OG-OD1 2.87Å; D183-S185 PolarHBondContact O-N 3.4Å; D183-S185 VanDerWaalsContact OD1-CB 3.28Å; D183-S185 WeakPolarHBondContact OD1-CB 3.42Å; D183-S185 PolarHBondContact OD1-N 3.04Å; D183-S185 PolarHBondContact OD1-OG 2.88Å |
| 184 | G | 61.8 | Low | 70.6 | Confident | 67 Ų | 67 | 58.7 Ų | 58.7 | 69% | 0.691 | 34% | 0.337 | S | S | * | . | S | Bend | trans | 77.1 | 2.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | S181 | S181-G184 PolarHBondContact OG-N 2.72Š|
| 185 | S | 62.7 | Low | 73 | Confident | 56 Ų | 56 | 53.2 Ų | 53.2 | 39% | 0.392 | 30% | 0.299 | S | S | . | . | trans | -73.5 | 144.7 | 164.6 | 71.2 | 0 | 0 | 0 | 0 | 110.5 | S181 D183 Y187 | S181-S185 WeakPolarHBondContact CB-O 3.33Å; S181-S185 PolarHBondContact OG-N 3.43Å; S181-S185 PolarHBondContact OG-O 3.28Å; D183-S185 PolarHBondContact O-N 3.4Å; D183-S185 VanDerWaalsContact OD1-CB 3.28Å; D183-S185 WeakPolarHBondContact OD1-CB 3.42Å; D183-S185 PolarHBondContact OD1-N 3.04Å; D183-S185 PolarHBondContact OD1-OG 2.88Å; S185-Y187 PolarHBondContact O-N 3.21Å | ||
| 186 | D | 55.6 | Low | 74.7 | Confident | 144 Ų | 144 | 53.9 Ų | 53.9 | 77% | 0.77 | 30% | 0.301 | S | S | * | . | S | Bend | trans | -68.2 | 2.3 | -175.6 | -61.5 | -58.9 | 0 | 0 | 0 | 114.8 | ||
| 187 | Y | 53.8 | Low | 76.1 | Confident | 187 Ų | 187 | 51.1 Ų | 51.1 | 73% | 0.733 | 28% | 0.277 | S | S | * | . | trans | -135.5 | 50.6 | -163.8 | -62.2 | -70.7 | 0 | 0 | 0 | 115.3 | S185 L189 | S185-Y187 PolarHBondContact O-N 3.21Å; Y187-L189 HydrophobicContact CD1-CD1 4.43Å | ||
| 188 | Q | 67.7 | Low | 77 | Confident | 29 Ų | 29 | 51.6 Ų | 51.6 | 14% | 0.136 | 28% | 0.284 | C | S | . | . | trans | -107 | 65 | 165 | -157.5 | 164.3 | 18 | 0 | 0 | 112.7 | L151 F182 I191 | L151-Q188 HydrophobicContact CD2-CG 4.12Å; L151-Q188 VanDerWaalsContact CD2-NE2 3.33Å; F182-Q188 VanDerWaalsContact CB-OE1 3.26Å; F182-Q188 VanDerWaalsContact CD2-OE1 3.28Å; F182-Q188 VanDerWaalsContact N-OE1 3.16Å; Q188-I191 HydrophobicContact CB-CD1 3.85Å; Q188-I191 HydrophobicContact CG-CD1 3.82Å; Q188-I191 HydrophobicContact CG-CG1 4.17Å; Q188-I191 WeakPolarHBondContact O-CG1 3.43Å | ||
| 189 | L | 76 | Confident | 78 | Confident | 50 Ų | 50 | 50.2 Ų | 50.2 | 26% | 0.262 | 27% | 0.274 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.5 | 145.2 | 168.2 | -72.4 | 77.4 | 0 | 0 | 0 | 110.1 | A155 E158 R159 Y187 | A155-L189 HydrophobicContact CB-CB 4.15Å; A155-L189 WeakPolarHBondContact CB-O 3.45Å; E158-L189 WeakPolarHBondContact OE2-CA 3.47Å; R159-L189 HydrophobicContact CG-CD2 3.62Å; Y187-L189 HydrophobicContact CD1-CD1 4.43Å |
| 190 | G | 85.9 | Confident | 78.8 | Confident | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 104.8 | -19.3 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114 | C154 A155 E158 L194 | C154-G190 VanDerWaalsContact CB-O 3.27Å; C154-G190 WeakPolarHBondContact CB-O 3.33Å; A155-G190 VanDerWaalsContact N-CA 3.34Å; E158-G190 PolarHBondContact OE2-N 3.48Å; G190-L194 WeakPolarHBondContact O-CB 3.34Å; G190-L194 PolarHBondContact O-N 3.23Å |
| 191 | I | 89 | Confident | 79.9 | Confident | 1 Ų | 1 | 51.7 Ų | 51.7 | 1% | 0.005 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -68 | -45.1 | 178 | -63.3 | 174.7 | 0 | 0 | 0 | 111 | W134 L151 F182 Q188 E193 L194 W195 | W134-I191 HydrophobicContact CH2-CG2 4.4Å; W134-I191 HydrophobicContact CZ3-CG2 3.98Å; L151-I191 HydrophobicContact CD1-CG1 4.28Å; F182-I191 HydrophobicContact CD1-CD1 3.86Å; F182-I191 HydrophobicContact CD2-CD1 3.8Å; F182-I191 HydrophobicContact CD2-CG1 4.31Å; F182-I191 HydrophobicContact CE1-CD1 3.9Å; F182-I191 HydrophobicContact CE1-CG1 4.24Å; F182-I191 HydrophobicContact CE1-CG2 4.37Å; F182-I191 HydrophobicContact CE2-CD1 3.87Å; F182-I191 HydrophobicContact CE2-CG1 3.88Å; F182-I191 HydrophobicContact CG-CD1 3.8Å; F182-I191 HydrophobicContact CZ-CD1 3.92Å; F182-I191 HydrophobicContact CZ-CG1 3.84Å; F182-I191 HydrophobicContact CZ-CG2 4.46Å; Q188-I191 HydrophobicContact CB-CD1 3.85Å; Q188-I191 HydrophobicContact CG-CD1 3.82Å; Q188-I191 HydrophobicContact CG-CG1 4.17Å; Q188-I191 WeakPolarHBondContact O-CG1 3.43Å; I191-E193 PolarHBondContact O-N 3.36Å; I191-L194 WeakPolarHBondContact O-CB 3.27Å; I191-L194 PolarHBondContact O-N 2.96Å; I191-W195 PolarHBondContact O-N 3.43Å |
| 192 | S | 88.4 | Confident | 80.9 | Confident | 30 Ų | 30 | 52.3 Ų | 52.3 | 21% | 0.21 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.5 | -47.1 | 178.4 | -32.8 | 0 | 0 | 0 | 0 | 111.9 | E158 Q177 L194 W195 H196 | E158-S192 WeakPolarHBondContact OE1-CB 3.21Å; E158-S192 PolarHBondContact OE1-OG 3.27Å; Q177-S192 PolarHBondContact NE2-OG 3.32Å; Q177-S192 VanDerWaalsContact OE1-CA 3.29Å; S192-L194 VanDerWaalsContact C-N 3.33Å; S192-L194 PolarHBondContact O-N 3.16Å; S192-W195 PolarHBondContact O-N 3.45Å; S192-H196 PolarHBondContact O-N 2.9Å; S192-H196 PolarHBondContact O-ND1 3.37Å |
| 193 | E | 90.1 | Very high | 81.8 | Confident | 28 Ų | 28 | 55.6 Ų | 55.6 | 13% | 0.131 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.3 | -34.6 | 177.3 | 167.2 | 65.2 | 176.5 | 0 | 0 | 111.9 | C154 R157 E158 I191 R197 | C154-E193 HydrophobicContact CB-CB 3.97Å; C154-E193 HydrophobicContact CB-CG 3.64Å; R157-E193 HydrophobicContact CB-CG 3.99Å; R157-E193 WeakPolarHBondContact CD-OE1 3.48Å; R157-E193 IonicContact NE-OE1 3.74Å; E158-E193 HydrophobicContact CB-CB 4.33Å; I191-E193 PolarHBondContact O-N 3.36Å; E193-R197 WeakPolarHBondContact O-CB 3.19Å; E193-R197 VanDerWaalsContact O-CG 3.3Å; E193-R197 WeakPolarHBondContact O-CG 3.21Å; E193-R197 PolarHBondContact O-N 2.91Å; E193-R197 IonicContact OE1-CZ 2.74Å; E193-R197 IonicContact OE1-NE 3.98Å; E193-R197 PolarHBondContact OE1-NE 2.76Å; E193-R197 IonicContact OE1-NH2 2.7Å; E193-R197 PolarHBondContact OE1-NH2 2.79Å |
| 194 | L | 92.5 | Very high | 83 | Confident | 10 Ų | 10 | 56.8 Ų | 56.8 | 5% | 0.052 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -65.3 | -44.1 | 172.9 | 179.3 | 67.7 | 0 | 0 | 0 | 111.7 | W134 V146 L150 G190 I191 S192 R197 C198 | W134-L194 HydrophobicContact CH2-CD2 4.34Å; W134-L194 HydrophobicContact CH2-CG 4.34Å; W134-L194 HydrophobicContact CZ2-CD2 4.49Å; W134-L194 HydrophobicContact CZ2-CG 4.37Å; V146-L194 HydrophobicContact CB-CD2 4.44Å; V146-L194 HydrophobicContact CG1-CD2 3.89Å; V146-L194 HydrophobicContact CG2-CD2 3.68Å; L150-L194 HydrophobicContact CD2-CD1 4.02Å; L150-L194 HydrophobicContact CG-CD1 4.34Å; G190-L194 WeakPolarHBondContact O-CB 3.34Å; G190-L194 PolarHBondContact O-N 3.23Å; I191-L194 WeakPolarHBondContact O-CB 3.27Å; I191-L194 PolarHBondContact O-N 2.96Å; S192-L194 VanDerWaalsContact C-N 3.33Å; S192-L194 PolarHBondContact O-N 3.16Å; L194-R197 PolarHBondContact O-N 3.07Å; L194-C198 PolarHBondContact O-N 2.71Å; L194-C198 PolarHBondContact O-SG 2.68Å; L194-C198 VanDerWaalsContact O-SG 3.39Å |
| 195 | W | 91.8 | Very high | 84.3 | Confident | 3 Ų | 3 | 55 Ų | 55 | 1% | 0.011 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -58.7 | -50.7 | 175.6 | 170.5 | -93.3 | 0 | 0 | 0 | 111.5 | L130 W134 I175 Q177 P178 I191 S192 R197 C198 I199 | L130-W195 HydrophobicContact CB-CH2 3.98Å; L130-W195 HydrophobicContact CB-CZ3 4.05Å; L130-W195 HydrophobicContact CD2-CD2 3.93Å; L130-W195 HydrophobicContact CD2-CE3 3.53Å; L130-W195 HydrophobicContact CD2-CH2 3.96Å; L130-W195 HydrophobicContact CD2-CZ2 4.32Å; L130-W195 HydrophobicContact CD2-CZ3 3.55Å; L130-W195 HydrophobicContact CG-CE3 4.02Å; L130-W195 HydrophobicContact CG-CH2 4.01Å; L130-W195 HydrophobicContact CG-CZ3 3.57Å; W134-W195 HydrophobicContact CB-CZ3 4.43Å; W134-W195 AromaticContact CD2-CE3 3.65Å; W134-W195 HydrophobicContact CD2-CE3 3.65Å; W134-W195 AromaticContact CD2-CZ3 3.83Å; W134-W195 HydrophobicContact CD2-CZ3 3.83Å; W134-W195 AromaticContact CE2-CE3 3.84Å; W134-W195 AromaticContact CE3-CE3 3.59Å; W134-W195 HydrophobicContact CE3-CE3 3.59Å; W134-W195 HydrophobicContact CE3-CZ3 4.04Å; W134-W195 HydrophobicContact CG-CE3 4.31Å; W134-W195 HydrophobicContact CG-CZ3 4.01Å; W134-W195 HydrophobicContact CH2-CB 3.73Å; W134-W195 AromaticContact CH2-CE3 3.97Å; W134-W195 HydrophobicContact CH2-CE3 3.97Å; W134-W195 HydrophobicContact CZ2-CB 4.36Å; W134-W195 HydrophobicContact CZ2-CE3 4.01Å; W134-W195 HydrophobicContact CZ3-CB 4.12Å; W134-W195 AromaticContact CZ3-CE3 3.76Å; W134-W195 HydrophobicContact CZ3-CE3 3.76Å; I175-W195 HydrophobicContact CG2-CZ2 4.24Å; Q177-W195 HydrophobicContact CB-CB 4.3Å; Q177-W195 HydrophobicContact CB-CD2 3.69Å; Q177-W195 HydrophobicContact CB-CE3 4.13Å; Q177-W195 HydrophobicContact CB-CG 3.75Å; P178-W195 VanDerWaalsContact CD-CZ3 3.4Å; P178-W195 HydrophobicContact CG-CH2 4.49Å; P178-W195 HydrophobicContact CG-CZ3 4.24Å; I191-W195 PolarHBondContact O-N 3.43Å; S192-W195 PolarHBondContact O-N 3.45Å; W195-R197 PolarHBondContact O-N 3.24Å; W195-C198 PolarHBondContact O-N 2.85Å; W195-I199 HydrophobicContact CZ2-CD1 4.22Å; W195-I199 HydrophobicContact CZ2-CG1 4.4Å; W195-I199 WeakPolarHBondContact O-CG1 3.4Å; W195-I199 PolarHBondContact O-N 3.19Å |
| 196 | H | 90.7 | Very high | 85.7 | Confident | 69 Ų | 69 | 55 Ų | 55 | 32% | 0.319 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -60.5 | -35 | 178.1 | -73.2 | 88 | 0 | 0 | 0 | 112.2 | V172 S192 Q200 | V172-H196 WeakPolarHBondContact CG1-NE2 3.43Å; S192-H196 PolarHBondContact O-N 2.9Å; S192-H196 PolarHBondContact O-ND1 3.37Å; H196-Q200 WeakPolarHBondContact O-CB 3.43Å; H196-Q200 PolarHBondContact O-N 3.29Å |
| 197 | R | 92 | Very high | 87.4 | Confident | 63 Ų | 63 | 51.3 Ų | 51.3 | 24% | 0.238 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.6 | -49.1 | 172.2 | -76 | -175.8 | 178.8 | -60 | -32.1 | 113.1 | R157 E193 L194 W195 I199 Q200 E201 | R157-R197 VanDerWaalsContact NH1-CZ 3.32Å; R157-R197 VanDerWaalsContact NH1-NE 3.1Å; E193-R197 WeakPolarHBondContact O-CB 3.19Å; E193-R197 VanDerWaalsContact O-CG 3.3Å; E193-R197 WeakPolarHBondContact O-CG 3.21Å; E193-R197 PolarHBondContact O-N 2.91Å; E193-R197 IonicContact OE1-CZ 2.74Å; E193-R197 IonicContact OE1-NE 3.98Å; E193-R197 PolarHBondContact OE1-NE 2.76Å; E193-R197 IonicContact OE1-NH2 2.7Å; E193-R197 PolarHBondContact OE1-NH2 2.79Å; L194-R197 PolarHBondContact O-N 3.07Å; W195-R197 PolarHBondContact O-N 3.24Å; R197-I199 PolarHBondContact O-N 2.98Å; R197-Q200 PolarHBondContact O-N 2.72Å; R197-E201 VanDerWaalsContact O-CG 3.26Å; R197-E201 WeakPolarHBondContact O-CG 3.25Å; R197-E201 PolarHBondContact O-N 2.92Å |
| 198 | C | 93.5 | Very high | 89.1 | Confident | 40 Ų | 40 | 47.6 Ų | 47.6 | 27% | 0.27 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -58.3 | -35.7 | 177.3 | -69.7 | 0 | 0 | 0 | 0 | 112.2 | L130 L194 W195 L202 | L130-C198 HydrophobicContact CD1-CB 3.87Å; L130-C198 HydrophobicContact CD2-CB 3.51Å; L130-C198 HydrophobicContact CG-CB 4.37Å; L194-C198 PolarHBondContact O-N 2.71Å; L194-C198 PolarHBondContact O-SG 2.68Å; L194-C198 VanDerWaalsContact O-SG 3.39Å; W195-C198 PolarHBondContact O-N 2.85Å; C198-L202 WeakPolarHBondContact O-CB 3.18Å; C198-L202 VanDerWaalsContact O-CG 3.27Å; C198-L202 WeakPolarHBondContact O-CG 3.48Å; C198-L202 PolarHBondContact O-N 2.83Å |
| 199 | I | 92.5 | Very high | 90.2 | Very high | 7 Ų | 7 | 48.9 Ų | 48.9 | 4% | 0.036 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.6 | -45.9 | 170.3 | -68.4 | -61 | 0 | 0 | 0 | 111.9 | Y127 L130 W195 R197 L202 N203 | Y127-I199 HydrophobicContact CD1-CD1 3.55Å; Y127-I199 HydrophobicContact CD1-CG1 3.91Å; Y127-I199 HydrophobicContact CD1-CG2 4.14Å; Y127-I199 HydrophobicContact CE1-CB 4.31Å; Y127-I199 HydrophobicContact CE1-CD1 4.01Å; Y127-I199 HydrophobicContact CE1-CG1 3.94Å; Y127-I199 HydrophobicContact CE1-CG2 3.46Å; Y127-I199 VanDerWaalsContact CE1-CG2 3.46Å; Y127-I199 HydrophobicContact CE2-CG2 4.46Å; Y127-I199 HydrophobicContact CG-CD1 4.07Å; L130-I199 HydrophobicContact CB-CD1 3.87Å; L130-I199 HydrophobicContact CD2-CD1 3.51Å; L130-I199 HydrophobicContact CD2-CG1 3.7Å; L130-I199 HydrophobicContact CG-CD1 4.33Å; W195-I199 HydrophobicContact CZ2-CD1 4.22Å; W195-I199 HydrophobicContact CZ2-CG1 4.4Å; W195-I199 WeakPolarHBondContact O-CG1 3.4Å; W195-I199 PolarHBondContact O-N 3.19Å; R197-I199 PolarHBondContact O-N 2.98Å; I199-L202 PolarHBondContact O-N 3.32Å; I199-N203 PolarHBondContact O-N 3.45Å; I199-N203 PolarHBondContact O-ND2 3.26Å; I199-N203 VanDerWaalsContact O-ND2 3.16Å |
| 200 | Q | 91.9 | Very high | 91 | Very high | 97 Ų | 97 | 46.8 Ų | 46.8 | 45% | 0.453 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -60.4 | -51.9 | 179.7 | -174.2 | -175.3 | -20.1 | 0 | 0 | 111.3 | H196 R197 L202 N203 D204 | H196-Q200 WeakPolarHBondContact O-CB 3.43Å; H196-Q200 PolarHBondContact O-N 3.29Å; R197-Q200 PolarHBondContact O-N 2.72Å; Q200-L202 PolarHBondContact O-N 3.13Å; Q200-N203 WeakPolarHBondContact O-CA 3.39Å; Q200-N203 WeakPolarHBondContact O-CB 3.46Å; Q200-N203 PolarHBondContact O-N 2.68Å; Q200-D204 PolarHBondContact O-N 2.97Å; Q200-D204 VanDerWaalsContact O-N 3.09Å |
| 201 | E | 91.8 | Very high | 91.3 | Very high | 89 Ų | 89 | 50.7 Ų | 50.7 | 42% | 0.416 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -61.7 | -32.5 | -180 | -52.8 | -81.9 | 158 | 0 | 0 | 111.2 | R197 L205 | R197-E201 VanDerWaalsContact O-CG 3.26Å; R197-E201 WeakPolarHBondContact O-CG 3.25Å; R197-E201 PolarHBondContact O-N 2.92Å; E201-L205 WeakPolarHBondContact O-CG 3.29Å |
| 202 | L | 92.6 | Very high | 91.3 | Very high | 29 Ų | 29 | 51.8 Ų | 51.8 | 15% | 0.152 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -67.7 | -38.4 | 171.2 | -79.4 | 172.2 | 0 | 0 | 0 | 112.8 | H126 L130 C198 I199 Q200 D204 L205 I210 | H126-L202 HydrophobicContact CB-CB 4.19Å; H126-L202 HydrophobicContact CB-CD1 4.46Å; H126-L202 PolarHBondContact CE1-O 2.92Å; H126-L202 PolarHBondContact ND1-O 3.49Å; L130-L202 HydrophobicContact CB-CD1 4.04Å; L130-L202 HydrophobicContact CD1-CD1 4.04Å; L130-L202 HydrophobicContact CG-CD1 4.48Å; C198-L202 WeakPolarHBondContact O-CB 3.18Å; C198-L202 VanDerWaalsContact O-CG 3.27Å; C198-L202 WeakPolarHBondContact O-CG 3.48Å; C198-L202 PolarHBondContact O-N 2.83Å; I199-L202 PolarHBondContact O-N 3.32Å; Q200-L202 PolarHBondContact O-N 3.13Å; L202-D204 VanDerWaalsContact C-N 3.27Å; L202-D204 PolarHBondContact O-N 3.19Å; L202-L205 PolarHBondContact O-N 3.46Å; L202-I210 HydrophobicContact CD2-CD1 4.18Å; L202-I210 HydrophobicContact CD2-CG1 4.31Å |
| 203 | N | 91.7 | Very high | 91.4 | Very high | 79 Ų | 79 | 54 Ų | 54 | 42% | 0.422 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -68.6 | -26.1 | 177.7 | -66.2 | -30.5 | 0 | 0 | 0 | 113.3 | H126 I199 Q200 L205 | H126-N203 PolarHBondContact ND1-OD1 2.87Å; I199-N203 PolarHBondContact O-N 3.45Å; I199-N203 PolarHBondContact O-ND2 3.26Å; I199-N203 VanDerWaalsContact O-ND2 3.16Å; Q200-N203 WeakPolarHBondContact O-CA 3.39Å; Q200-N203 WeakPolarHBondContact O-CB 3.46Å; Q200-N203 PolarHBondContact O-N 2.68Å; N203-L205 VanDerWaalsContact C-N 3.26Å |
| 204 | D | 90.4 | Very high | 91.4 | Very high | 114 Ų | 114 | 55.7 Ų | 55.7 | 61% | 0.61 | 29% | 0.287 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79 | -9 | 175.2 | -67.2 | -36.6 | 0 | 0 | 0 | 112.5 | Q200 L202 | Q200-D204 PolarHBondContact O-N 2.97Å; Q200-D204 VanDerWaalsContact O-N 3.09Å; L202-D204 VanDerWaalsContact C-N 3.27Å; L202-D204 PolarHBondContact O-N 3.19Å |
| 205 | L | 89.9 | Confident | 91.3 | Very high | 31 Ų | 31 | 58.9 Ų | 58.9 | 16% | 0.162 | 31% | 0.31 | C | S | . | . | S | Bend | trans | -98 | 147.5 | 174.5 | -62.8 | -179.4 | 0 | 0 | 0 | 112.9 | E201 L202 N203 I210 I213 L225 | E201-L205 WeakPolarHBondContact O-CG 3.29Å; L202-L205 PolarHBondContact O-N 3.46Å; N203-L205 VanDerWaalsContact C-N 3.26Å; L205-I210 HydrophobicContact CB-CD1 4.22Å; L205-I210 HydrophobicContact CB-CG1 3.94Å; L205-I210 HydrophobicContact CD1-CG1 4.41Å; L205-I213 HydrophobicContact CD1-CD1 3.96Å; L205-L225 HydrophobicContact CD1-CD2 4.3Å; L205-L225 HydrophobicContact CD2-CB 4.46Å; L205-L225 HydrophobicContact CD2-CD2 3.52Å |
| 206 | S | 91.3 | Very high | 91 | Very high | 55 Ų | 55 | 61.9 Ų | 61.9 | 39% | 0.385 | 34% | 0.342 | S | S | . | . | trans | -76.7 | 149.7 | 170 | 67.4 | 0 | 0 | 0 | 0 | 112.2 | D208 Q209 I210 | S206-D208 PolarHBondContact O-N 3.06Å; S206-D208 VanDerWaalsContact O-N 3.08Å; S206-Q209 WeakPolarHBondContact O-CA 3.47Å; S206-Q209 WeakPolarHBondContact O-CB 3.22Å; S206-Q209 PolarHBondContact O-N 3.43Å; S206-Q209 WeakPolarHBondContact OG-CG 3.34Å; S206-Q209 PolarHBondContact OG-N 2.93Å; S206-Q209 PolarHBondContact OG-OE1 3.2Å; S206-I210 WeakPolarHBondContact O-CG1 3.31Å; S206-I210 PolarHBondContact O-N 3.24Å | ||
| 207 | I | 91.7 | Very high | 90.6 | Very high | 66 Ų | 66 | 63.5 Ų | 63.5 | 34% | 0.338 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -47.3 | -37.7 | 173.4 | -76.1 | 171 | 0 | 0 | 0 | 112.4 | I123 I210 K211 | I123-I207 HydrophobicContact CG2-CB 4.26Å; I123-I207 HydrophobicContact CG2-CG1 4.23Å; I123-I207 HydrophobicContact CG2-CG2 3.89Å; I207-I210 PolarHBondContact O-N 3.45Å; I207-K211 HydrophobicContact CG2-CD 4.1Å; I207-K211 VanDerWaalsContact CG2-CE 3.46Å; I207-K211 VanDerWaalsContact O-CG 3.27Å; I207-K211 WeakPolarHBondContact O-CG 3.25Å; I207-K211 PolarHBondContact O-N 3.39Å |
| 208 | D | 90.5 | Very high | 89.6 | Confident | 110 Ų | 110 | 63.5 Ų | 63.5 | 59% | 0.588 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -78.3 | -31.6 | -179.3 | -60.9 | -37.1 | 0 | 0 | 0 | 112.9 | S206 K211 A212 | S206-D208 PolarHBondContact O-N 3.06Å; S206-D208 VanDerWaalsContact O-N 3.08Å; D208-K211 IonicContact OD1-NZ 3.25Å; D208-A212 VanDerWaalsContact O-CB 3.29Å; D208-A212 WeakPolarHBondContact O-CB 3.34Å; D208-A212 PolarHBondContact O-N 2.74Å |
| 209 | Q | 90.9 | Very high | 88.3 | Confident | 56 Ų | 56 | 70 Ų | 70 | 26% | 0.262 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -64.9 | -43.8 | 167.6 | -73.3 | 161.9 | -63.4 | 0 | 0 | 110.8 | S206 A212 I213 | S206-Q209 WeakPolarHBondContact O-CA 3.47Å; S206-Q209 WeakPolarHBondContact O-CB 3.22Å; S206-Q209 PolarHBondContact O-N 3.43Å; S206-Q209 WeakPolarHBondContact OG-CG 3.34Å; S206-Q209 PolarHBondContact OG-N 2.93Å; S206-Q209 PolarHBondContact OG-OE1 3.2Å; Q209-A212 PolarHBondContact O-N 2.96Å; Q209-I213 WeakPolarHBondContact O-CB 2.93Å; Q209-I213 WeakPolarHBondContact O-CD1 3.48Å; Q209-I213 VanDerWaalsContact O-CG1 3.25Å; Q209-I213 WeakPolarHBondContact O-CG1 3.3Å; Q209-I213 PolarHBondContact O-N 3.34Å |
| 210 | I | 92.5 | Very high | 87 | Confident | 5 Ų | 5 | 72.4 Ų | 72.4 | 3% | 0.026 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -61.7 | -46.6 | 177.6 | -63.4 | 168.8 | 0 | 0 | 0 | 110.5 | I123 H126 L129 L202 L205 S206 I207 A212 I213 L214 | I123-I210 HydrophobicContact CG1-CG2 4.29Å; I123-I210 HydrophobicContact CG2-CB 4.14Å; I123-I210 HydrophobicContact CG2-CG2 3.9Å; H126-I210 VanDerWaalsContact NE2-CD1 3.27Å; H126-I210 WeakPolarHBondContact NE2-CD1 3.49Å; L129-I210 HydrophobicContact CD2-CG2 3.7Å; L202-I210 HydrophobicContact CD2-CD1 4.18Å; L202-I210 HydrophobicContact CD2-CG1 4.31Å; L205-I210 HydrophobicContact CB-CD1 4.22Å; L205-I210 HydrophobicContact CB-CG1 3.94Å; L205-I210 HydrophobicContact CD1-CG1 4.41Å; S206-I210 WeakPolarHBondContact O-CG1 3.31Å; S206-I210 PolarHBondContact O-N 3.24Å; I207-I210 PolarHBondContact O-N 3.45Å; I210-A212 VanDerWaalsContact C-N 3.3Å; I210-A212 PolarHBondContact O-N 3.19Å; I210-I213 PolarHBondContact O-N 3.08Å; I210-L214 HydrophobicContact CG2-CD1 3.97Å; I210-L214 HydrophobicContact CG2-CG 4.43Å; I210-L214 WeakPolarHBondContact O-CG 3.38Å; I210-L214 PolarHBondContact O-N 3.09Å |
| 211 | K | 91.4 | Very high | 85.7 | Confident | 83 Ų | 83 | 71.9 Ų | 71.9 | 36% | 0.361 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -53.6 | -46.1 | 172.5 | -78 | 166.7 | -173.9 | 165.6 | 0 | 112.4 | I123 I207 D208 L214 S215 | I123-K211 HydrophobicContact CD1-CB 4.37Å; I123-K211 HydrophobicContact CD1-CD 4.31Å; I123-K211 HydrophobicContact CD1-CG 3.32Å; I123-K211 HydrophobicContact CG2-CG 4.47Å; I207-K211 HydrophobicContact CG2-CD 4.1Å; I207-K211 VanDerWaalsContact CG2-CE 3.46Å; I207-K211 VanDerWaalsContact O-CG 3.27Å; I207-K211 WeakPolarHBondContact O-CG 3.25Å; I207-K211 PolarHBondContact O-N 3.39Å; D208-K211 IonicContact OD1-NZ 3.25Å; K211-L214 PolarHBondContact O-N 2.74Å; K211-S215 VanDerWaalsContact O-CB 3.26Å; K211-S215 WeakPolarHBondContact O-CB 3.47Å; K211-S215 PolarHBondContact O-N 2.87Å; K211-S215 PolarHBondContact O-OG 3.3Å |
| 212 | A | 89.6 | Confident | 84.5 | Confident | 23 Ų | 23 | 72.4 Ų | 72.4 | 19% | 0.19 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -73.9 | -32.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | D208 Q209 I210 G216 T217 V218 | D208-A212 VanDerWaalsContact O-CB 3.29Å; D208-A212 WeakPolarHBondContact O-CB 3.34Å; D208-A212 PolarHBondContact O-N 2.74Å; Q209-A212 PolarHBondContact O-N 2.96Å; I210-A212 VanDerWaalsContact C-N 3.3Å; I210-A212 PolarHBondContact O-N 3.19Å; A212-G216 PolarHBondContact O-N 3Å; A212-G216 VanDerWaalsContact O-N 3.17Å; A212-T217 WeakPolarHBondContact CA-OG1 3.47Å; A212-T217 PolarHBondContact O-N 3.11Å; A212-T217 PolarHBondContact O-OG1 2.93Å; A212-T217 VanDerWaalsContact O-OG1 3.12Å; A212-V218 HydrophobicContact CB-CG2 3.26Å |
| 213 | I | 90.3 | Very high | 83.3 | Confident | 77 Ų | 77 | 74.5 Ų | 74.5 | 40% | 0.395 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -64.8 | -49.7 | 169.3 | -69.7 | 162.7 | 0 | 0 | 0 | 110.6 | L205 Q209 I210 S215 G216 L225 | L205-I213 HydrophobicContact CD1-CD1 3.96Å; Q209-I213 WeakPolarHBondContact O-CB 2.93Å; Q209-I213 WeakPolarHBondContact O-CD1 3.48Å; Q209-I213 VanDerWaalsContact O-CG1 3.25Å; Q209-I213 WeakPolarHBondContact O-CG1 3.3Å; Q209-I213 PolarHBondContact O-N 3.34Å; I210-I213 PolarHBondContact O-N 3.08Å; I213-S215 VanDerWaalsContact C-N 3.29Å; I213-S215 PolarHBondContact O-N 2.91Å; I213-G216 PolarHBondContact O-N 3.04Å; I213-L225 HydrophobicContact CD1-CD1 4.44Å; I213-L225 HydrophobicContact CD1-CD2 4.13Å |
| 214 | L | 91 | Very high | 82.1 | Confident | 64 Ų | 64 | 76.3 Ų | 76.3 | 34% | 0.335 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -62.7 | -35.8 | 177.7 | -69.5 | 171.8 | 0 | 0 | 0 | 112.4 | L119 D120 I123 L129 I210 K211 G216 | L119-L214 HydrophobicContact CB-CD1 4.47Å; L119-L214 HydrophobicContact CB-CD2 4.17Å; L119-L214 HydrophobicContact CD1-CD2 4.17Å; D120-L214 WeakPolarHBondContact OD1-CB 3.47Å; I123-L214 HydrophobicContact CD1-CD1 4Å; I123-L214 HydrophobicContact CG1-CD1 3.77Å; L129-L214 HydrophobicContact CD1-CD1 4.1Å; I210-L214 HydrophobicContact CG2-CD1 3.97Å; I210-L214 HydrophobicContact CG2-CG 4.43Å; I210-L214 WeakPolarHBondContact O-CG 3.38Å; I210-L214 PolarHBondContact O-N 3.09Å; K211-L214 PolarHBondContact O-N 2.74Å; L214-G216 PolarHBondContact O-N 3.32Å |
| 215 | S | 88.5 | Confident | 80.8 | Confident | 77 Ų | 77 | 73 Ų | 73 | 54% | 0.538 | 42% | 0.421 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.4 | -9.7 | 174 | -57.6 | 0 | 0 | 0 | 0 | 113.8 | K211 I213 T217 | K211-S215 VanDerWaalsContact O-CB 3.26Å; K211-S215 WeakPolarHBondContact O-CB 3.47Å; K211-S215 PolarHBondContact O-N 2.87Å; K211-S215 PolarHBondContact O-OG 3.3Å; I213-S215 VanDerWaalsContact C-N 3.29Å; I213-S215 PolarHBondContact O-N 2.91Å; S215-T217 PolarHBondContact O-N 2.7Å |
| 216 | G | 86.8 | Confident | 79.5 | Confident | 66 Ų | 66 | 76.6 Ų | 76.6 | 68% | 0.68 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.8 | 20.7 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | A212 I213 L214 | A212-G216 PolarHBondContact O-N 3Å; A212-G216 VanDerWaalsContact O-N 3.17Å; I213-G216 PolarHBondContact O-N 3.04Å; L214-G216 PolarHBondContact O-N 3.32Å |
| 217 | T | 81.7 | Confident | 77.8 | Confident | 103 Ų | 103 | 82.4 Ų | 82.4 | 63% | 0.632 | 46% | 0.458 | S | S | * | . | trans | -86.6 | -12.2 | -172.2 | 51 | 0 | 0 | 0 | 0 | 114.2 | A212 S215 | A212-T217 WeakPolarHBondContact CA-OG1 3.47Å; A212-T217 PolarHBondContact O-N 3.11Å; A212-T217 PolarHBondContact O-OG1 2.93Å; A212-T217 VanDerWaalsContact O-OG1 3.12Å; S215-T217 PolarHBondContact O-N 2.7Å | ||
| 218 | V | 72.1 | Confident | 75.9 | Confident | 62 Ų | 62 | 84.7 Ų | 84.7 | 38% | 0.376 | 47% | 0.469 | S | S | . | . | trans | -117.5 | 119.1 | -176.8 | -131.1 | 0 | 0 | 0 | 0 | 112.4 | A212 L220 | A212-V218 HydrophobicContact CB-CG2 3.26Å; V218-L220 HydrophobicContact CB-CD1 4.14Å; V218-L220 HydrophobicContact CB-CG 3.85Å; V218-L220 HydrophobicContact CG1-CD1 4.03Å; V218-L220 HydrophobicContact CG1-CD2 3.97Å; V218-L220 HydrophobicContact CG1-CG 3.57Å; V218-L220 PolarHBondContact O-N 3.27Å; V218-L220 VanDerWaalsContact O-N 3.07Å | ||
| 219 | N | 65.7 | Low | 73.7 | Confident | 176 Ų | 176 | 85 Ų | 85 | 94% | 0.941 | 48% | 0.478 | S | S | * | . | trans | -79.2 | 67.7 | 160.5 | -71 | -61.8 | 0 | 0 | 0 | 109.3 | ||||
| 220 | L | 63.7 | Low | 71.2 | Confident | 59 Ų | 59 | 86 Ų | 86 | 31% | 0.309 | 50% | 0.503 | S | S | . | . | trans | -81 | 129 | 168.4 | -67.8 | 171 | 0 | 0 | 0 | 108.8 | V218 P222 L225 | V218-L220 HydrophobicContact CB-CD1 4.14Å; V218-L220 HydrophobicContact CB-CG 3.85Å; V218-L220 HydrophobicContact CG1-CD1 4.03Å; V218-L220 HydrophobicContact CG1-CD2 3.97Å; V218-L220 HydrophobicContact CG1-CG 3.57Å; V218-L220 PolarHBondContact O-N 3.27Å; V218-L220 VanDerWaalsContact O-N 3.07Å; L220-P222 WeakPolarHBondContact O-CD 3.35Å; L220-L225 HydrophobicContact CB-CD1 4.08Å; L220-L225 HydrophobicContact CB-CG 4.08Å; L220-L225 HydrophobicContact CD1-CD1 4.42Å; L220-L225 HydrophobicContact CD1-CD2 3.6Å; L220-L225 HydrophobicContact CD1-CG 3.97Å | ||
| 221 | D | 66.3 | Low | 68.6 | Low | 86 Ų | 86 | 92.2 Ų | 92.2 | 46% | 0.46 | 54% | 0.536 | S | S | . | . | trans | -61.6 | 128.1 | 162.9 | -174.7 | -25.8 | 0 | 0 | 0 | 107.7 | V223 E224 | D221-V223 PolarHBondContact O-N 3.39Å; D221-V223 VanDerWaalsContact OD1-CB 3.31Å; D221-V223 WeakPolarHBondContact OD1-CB 3.32Å; D221-V223 WeakPolarHBondContact OD1-CG2 3.34Å; D221-V223 PolarHBondContact OD1-N 3.49Å; D221-E224 HydrophobicContact CB-CG 4.29Å; D221-E224 PolarHBondContact O-N 2.91Å | ||
| 222 | P | 66.3 | Low | 66 | Low | 99 Ų | 99 | 98.9 Ų | 98.9 | 64% | 0.643 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -49.4 | -24.1 | 172.3 | -29.5 | 36.6 | 0 | 0 | 0 | 114.3 | L220 | L220-P222 WeakPolarHBondContact O-CD 3.35Å |
| 223 | V | 67.2 | Low | 63.7 | Low | 73 Ų | 73 | 102.2 Ų | 102.2 | 44% | 0.442 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -74.9 | -24.7 | 177.3 | -179.3 | 0 | 0 | 0 | 0 | 113.4 | D221 R227 | D221-V223 PolarHBondContact O-N 3.39Å; D221-V223 VanDerWaalsContact OD1-CB 3.31Å; D221-V223 WeakPolarHBondContact OD1-CB 3.32Å; D221-V223 WeakPolarHBondContact OD1-CG2 3.34Å; D221-V223 PolarHBondContact OD1-N 3.49Å; V223-R227 WeakPolarHBondContact O-CG 3.37Å; V223-R227 PolarHBondContact O-NE 3.18Å |
| 224 | E | 65.3 | Low | 61 | Low | 118 Ų | 118 | 107 Ų | 107 | 55% | 0.551 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -85.3 | -35.6 | 179.2 | -69.4 | -167.1 | 152.5 | 0 | 0 | 112.8 | D221 V226 R227 | D221-E224 HydrophobicContact CB-CG 4.29Å; D221-E224 PolarHBondContact O-N 2.91Å; E224-V226 PolarHBondContact O-N 3.05Å; E224-R227 PolarHBondContact O-N 2.99Å |
| 225 | L | 63.8 | Low | 58.7 | Low | 45 Ų | 45 | 111.4 Ų | 111.4 | 24% | 0.236 | 63% | 0.63 | C | S | . | * | H | α-helix | trans | -53 | -38 | 177.4 | -83 | 160.5 | 0 | 0 | 0 | 112.9 | L205 I213 L220 R227 | L205-L225 HydrophobicContact CD1-CD2 4.3Å; L205-L225 HydrophobicContact CD2-CB 4.46Å; L205-L225 HydrophobicContact CD2-CD2 3.52Å; I213-L225 HydrophobicContact CD1-CD1 4.44Å; I213-L225 HydrophobicContact CD1-CD2 4.13Å; L220-L225 HydrophobicContact CB-CD1 4.08Å; L220-L225 HydrophobicContact CB-CG 4.08Å; L220-L225 HydrophobicContact CD1-CD1 4.42Å; L220-L225 HydrophobicContact CD1-CD2 3.6Å; L220-L225 HydrophobicContact CD1-CG 3.97Å; L225-R227 PolarHBondContact O-N 2.92Å |
| 226 | V | 62 | Low | 56.3 | Low | 105 Ų | 105 | 111.8 Ų | 111.8 | 64% | 0.636 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | 1.3 | -173.2 | -177.5 | 0 | 0 | 0 | 0 | 113.3 | E224 | E224-V226 PolarHBondContact O-N 3.05Š|
| 227 | R | 57.1 | Low | 54 | Low | 178 Ų | 178 | 114.6 Ų | 114.6 | 67% | 0.672 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.1 | 4.2 | -163.5 | -66.8 | -169.2 | -170.5 | 178.9 | 4.2 | 118.1 | V223 E224 L225 P229 | V223-R227 WeakPolarHBondContact O-CG 3.37Å; V223-R227 PolarHBondContact O-NE 3.18Å; E224-R227 PolarHBondContact O-N 2.99Å; L225-R227 PolarHBondContact O-N 2.92Å; R227-P229 VanDerWaalsContact C-CD 3.42Å; R227-P229 WeakPolarHBondContact O-CD 3.49Å |
| 228 | I | 51.8 | Low | 52.3 | Low | 114 Ų | 114 | 115 Ų | 115 | 59% | 0.585 | 65% | 0.654 | S | S | * | * | trans | -115.1 | 76.3 | -171.8 | -46.4 | -177.3 | 0 | 0 | 0 | 112.8 | G230 | I228-G230 PolarHBondContact O-N 3.29Š| ||
| 229 | P | 43.7 | Very low | 51 | Low | 117 Ų | 117 | 120.5 Ų | 120.5 | 76% | 0.76 | 68% | 0.676 | S | S | * | * | trans | -67.2 | 120.9 | 161.9 | 30.1 | -31.5 | 0 | 0 | 0 | 108.8 | R227 | R227-P229 VanDerWaalsContact C-CD 3.42Å; R227-P229 WeakPolarHBondContact O-CD 3.49Å | ||
| 230 | G | 37.8 | Very low | 50.4 | Low | 77 Ų | 77 | 121 Ų | 121 | 79% | 0.794 | 67% | 0.67 | S | S | * | * | trans | -62.8 | 135.6 | -153.7 | 0 | 0 | 0 | 0 | 0 | 117.8 | I228 | I228-G230 PolarHBondContact O-N 3.29Š| ||
| 231 | N | 38 | Very low | 49.5 | Very low | 135 Ų | 135 | 124 Ų | 124 | 72% | 0.722 | 69% | 0.686 | S | S | * | * | trans | -125.2 | 89.7 | 169.3 | 53.8 | -20.6 | 0 | 0 | 0 | 111.3 | S233 | N231-S233 PolarHBondContact O-N 3.45Š| ||
| 232 | K | 37 | Very low | 48.6 | Very low | 222 Ų | 222 | 127.5 Ų | 127.5 | 97% | 0.965 | 71% | 0.705 | S | S | * | * | trans | -78.7 | 92.6 | 175.4 | -73 | -175.8 | 176.5 | -179.5 | 0 | 112.2 | ||||
| 233 | S | 40.9 | Very low | 47.5 | Very low | 94 Ų | 94 | 128.5 Ų | 128.5 | 66% | 0.657 | 71% | 0.713 | S | S | * | * | trans | -167.9 | 118.2 | 156.8 | -169.4 | 0 | 0 | 0 | 0 | 105.4 | N231 | N231-S233 PolarHBondContact O-N 3.45Š| ||
| 234 | E | 34.1 | Very low | 46.4 | Very low | 178 Ų | 178 | 129.1 Ų | 129.1 | 83% | 0.832 | 72% | 0.72 | S | S | * | * | 61.3 | 138.8 | 56.6 | -161.2 | 166.9 | -168.9 | 0 | 0 | 112.9 | |||||
| 235 | I | 43.3 | Very low | 45.7 | Very low | 156 Ų | 156 | 131.4 Ų | 131.4 | 80% | 0.8 | 73% | 0.73 | S | S | * | * | trans | 72.9 | 99.6 | -165 | -46.6 | 167 | 0 | 0 | 0 | 111.6 | ||||
| 236 | A | 38.6 | Very low | 45 | Very low | 85 Ų | 85 | 134.1 Ų | 134.1 | 70% | 0.702 | 75% | 0.753 | S | S | * | * | cis | 92.9 | 110 | 42.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 237 | S | 37.4 | Very low | 44 | Very low | 125 Ų | 125 | 135.1 Ų | 135.1 | 87% | 0.874 | 76% | 0.762 | S | S | * | * | trans | 79 | 146.6 | 148.6 | -55.6 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 238 | S | 47.4 | Very low | 43.6 | Very low | 111 Ų | 111 | 136.4 Ų | 136.4 | 78% | 0.776 | 77% | 0.772 | S | S | * | * | trans | 82.9 | 73.6 | 158.9 | -155.8 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 239 | E | 44.3 | Very low | 43.1 | Very low | 178 Ų | 178 | 136 Ų | 136 | 83% | 0.832 | 78% | 0.777 | S | S | * | * | 27.7 | 103.3 | 111.2 | -170.3 | -176.7 | 140.2 | 0 | 0 | 117.7 | |||||
| 240 | K | 52.4 | Low | 43 | Very low | 187 Ų | 187 | 137.7 Ų | 137.7 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | trans | -167 | 145.6 | 131.4 | -119.1 | 172.7 | -177.9 | 170.4 | 0 | 118.2 | ||||
| 241 | D | 45.3 | Very low | 43.5 | Very low | 122 Ų | 122 | 140 Ų | 140 | 65% | 0.652 | 78% | 0.784 | S | S | * | * | trans | -44.4 | 134 | 174.4 | -38.3 | -59.2 | 0 | 0 | 0 | 117.5 | ||||
| 242 | N | 47.9 | Very low | 43.9 | Very low | 159 Ų | 159 | 139.9 Ų | 139.9 | 85% | 0.85 | 79% | 0.787 | S | S | * | * | 166.9 | 154.1 | 99.1 | -93.6 | -60.4 | 0 | 0 | 0 | 113.8 | |||||
| 243 | C | 41.5 | Very low | 44 | Very low | 120 Ų | 120 | 135.6 Ų | 135.6 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | trans | -92.5 | 149 | -172.2 | -63.6 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 244 | S | 44.8 | Very low | 44.2 | Very low | 85 Ų | 85 | 139 Ų | 139 | 59% | 0.594 | 79% | 0.789 | S | S | * | * | trans | 52.6 | 124.2 | 133.9 | -168.8 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 245 | H | 51.9 | Low | 44.7 | Very low | 166 Ų | 166 | 138.1 Ų | 138.1 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | -179.7 | 128.3 | 99.2 | -95.6 | -66.2 | 0 | 0 | 0 | 115.1 | |||||
| 246 | S | 48.8 | Very low | 44.6 | Very low | 103 Ų | 103 | 137.4 Ų | 137.4 | 72% | 0.72 | 79% | 0.791 | S | S | * | * | trans | 61.7 | 124.3 | 141.1 | -53.8 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 247 | P | 39.9 | Very low | 45 | Very low | 126 Ų | 126 | 138.6 Ų | 138.6 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -96.9 | 172.5 | 175.6 | 39.4 | -36.4 | 0 | 0 | 0 | 114.3 | ||||
| 248 | K | 48.7 | Very low | 45.4 | Very low | 205 Ų | 205 | 142.7 Ų | 142.7 | 89% | 0.891 | 80% | 0.796 | S | S | * | * | trans | -150.2 | 153.9 | 156.7 | -108.2 | 171.4 | -176.2 | 176.2 | 0 | 111.6 | ||||
| 249 | P | 41.2 | Very low | 45.4 | Very low | 104 Ų | 104 | 146 Ų | 146 | 68% | 0.675 | 80% | 0.801 | S | S | * | * | trans | -125.9 | -168.7 | -159.1 | 36.4 | -16.8 | 0 | 0 | 0 | 115.2 | ||||
| 250 | N | 42.8 | Very low | 45.3 | Very low | 153 Ų | 153 | 146.7 Ų | 146.7 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | 91.5 | 110.3 | 162.6 | -49.4 | -21 | 0 | 0 | 0 | 118.2 | ||||
| 251 | S | 47.7 | Very low | 44.8 | Very low | 126 Ų | 126 | 143.1 Ų | 143.1 | 88% | 0.881 | 80% | 0.798 | S | S | * | * | -161.8 | 143.1 | 128.9 | -166.1 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 252 | V | 46.1 | Very low | 44.9 | Very low | 132 Ų | 132 | 146 Ų | 146 | 80% | 0.8 | 81% | 0.807 | S | S | * | * | trans | -79.1 | 145.5 | -174.6 | 176.8 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 253 | C | 38.8 | Very low | 44.9 | Very low | 132 Ų | 132 | 145.9 Ų | 145.9 | 89% | 0.892 | 81% | 0.806 | S | S | * | * | trans | -150.1 | 169.1 | 147.4 | -153.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 254 | E | 44.7 | Very low | 45.2 | Very low | 165 Ų | 165 | 144.9 Ų | 144.9 | 77% | 0.771 | 81% | 0.807 | S | S | * | * | trans | -124.2 | 151.9 | -146.5 | -157.3 | 178.2 | 138.1 | 0 | 0 | 114.7 | ||||
| 255 | M | 46.2 | Very low | 45.1 | Very low | 160 Ų | 160 | 148.9 Ų | 148.9 | 79% | 0.788 | 82% | 0.821 | S | S | * | * | trans | 24.7 | 114.8 | 159.5 | -73.3 | -72 | -179.3 | 0 | 0 | 119.8 | ||||
| 256 | T | 41 | Very low | 44.9 | Very low | 142 Ų | 142 | 146.5 Ų | 146.5 | 87% | 0.871 | 82% | 0.824 | S | S | * | * | -166 | 139.2 | 108.3 | 15.2 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 257 | S | 45.7 | Very low | 44.8 | Very low | 109 Ų | 109 | 147 Ų | 147 | 76% | 0.762 | 82% | 0.823 | S | S | * | * | trans | -37 | 136.7 | 178 | 54.7 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 258 | K | 45.7 | Very low | 45.1 | Very low | 212 Ų | 212 | 147.6 Ų | 147.6 | 92% | 0.922 | 82% | 0.824 | S | S | * | * | -155.4 | 141.1 | 128.5 | -112.7 | 165.5 | -173.7 | 173.9 | 0 | 111.3 | |||||
| 259 | M | 47.2 | Very low | 44.8 | Very low | 181 Ų | 181 | 142.3 Ų | 142.3 | 89% | 0.892 | 82% | 0.819 | S | S | * | * | trans | -82 | 135.9 | 179.9 | -66.3 | 153.7 | 58.9 | 0 | 0 | 111.2 | ||||
| 260 | Q | 42.9 | Very low | 44.5 | Very low | 191 Ų | 191 | 145.3 Ų | 145.3 | 89% | 0.893 | 83% | 0.828 | S | S | * | * | trans | -152.8 | 158.9 | 143.8 | -117.6 | 166.2 | 8.6 | 0 | 0 | 110.6 | ||||
| 261 | V | 41.6 | Very low | 44.2 | Very low | 113 Ų | 113 | 144.6 Ų | 144.6 | 69% | 0.685 | 83% | 0.833 | S | S | * | * | trans | -104.2 | 130 | -161 | 179 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 262 | H | 47.1 | Very low | 43.8 | Very low | 181 Ų | 181 | 144.5 Ų | 144.5 | 84% | 0.838 | 83% | 0.833 | S | S | * | * | trans | -140.9 | 121.4 | 160.2 | -74.4 | -67.3 | 0 | 0 | 0 | 109.2 | ||||
| 263 | D | 48.5 | Very low | 43.7 | Very low | 157 Ų | 157 | 144.7 Ų | 144.7 | 84% | 0.84 | 83% | 0.834 | S | S | * | * | trans | -70.8 | 145.4 | 177.3 | -59.8 | -79.2 | 0 | 0 | 0 | 111.5 | ||||
| 264 | A | 47.3 | Very low | 43.6 | Very low | 100 Ų | 100 | 145.9 Ų | 145.9 | 83% | 0.826 | 83% | 0.831 | S | S | * | * | trans | -118.8 | 110 | -178.5 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 265 | D | 43.4 | Very low | 43.4 | Very low | 168 Ų | 168 | 147 Ų | 147 | 90% | 0.898 | 84% | 0.836 | S | S | * | * | trans | -126.1 | 71 | 169.8 | -153.2 | 6.5 | 0 | 0 | 0 | 108.7 | ||||
| 266 | S | 48.5 | Very low | 43 | Very low | 117 Ų | 117 | 145.8 Ų | 145.8 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | trans | -98.2 | 129.1 | 179.5 | -170.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 267 | T | 45.6 | Very low | 42.8 | Very low | 114 Ų | 114 | 146.7 Ų | 146.7 | 70% | 0.699 | 83% | 0.827 | S | S | * | * | trans | -75.4 | 179.5 | -169.6 | 53.7 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 268 | T | 47.5 | Very low | 42.3 | Very low | 138 Ų | 138 | 151.5 Ų | 151.5 | 85% | 0.847 | 84% | 0.835 | S | S | * | * | trans | 85.5 | 85.5 | 169.4 | 70.3 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 269 | A | 41.6 | Very low | 41.9 | Very low | 94 Ų | 94 | 148.4 Ų | 148.4 | 78% | 0.777 | 83% | 0.828 | S | S | * | * | trans | -149 | 119.4 | 149 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 270 | L | 35.4 | Very low | 41.5 | Very low | 167 Ų | 167 | 146.4 Ų | 146.4 | 87% | 0.874 | 82% | 0.819 | S | S | * | * | trans | 29.2 | 115.1 | 144 | -55 | 172.9 | 0 | 0 | 0 | 119.6 | ||||
| 271 | C | 36 | Very low | 41.3 | Very low | 137 Ų | 137 | 146.8 Ų | 146.8 | 93% | 0.926 | 82% | 0.821 | S | S | * | * | trans | -159 | 77.1 | 143.3 | -102.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 272 | S | 39.9 | Very low | 40.9 | Very low | 125 Ų | 125 | 151 Ų | 151 | 87% | 0.874 | 83% | 0.83 | S | S | * | * | trans | -99.1 | 101 | 157.5 | -61.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 273 | V | 43.1 | Very low | 40.4 | Very low | 135 Ų | 135 | 146.5 Ų | 146.5 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | trans | -174.6 | 159.7 | 165.8 | 126.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 274 | L | 37.3 | Very low | 39.9 | Very low | 158 Ų | 158 | 145.2 Ų | 145.2 | 83% | 0.827 | 82% | 0.823 | S | S | * | * | trans | 78.2 | 57.6 | -176.2 | -51.1 | -173.9 | 0 | 0 | 0 | 117 | ||||
| 275 | E | 39.1 | Very low | 39.3 | Very low | 189 Ų | 189 | 146.8 Ų | 146.8 | 88% | 0.883 | 82% | 0.817 | S | S | * | * | -74.8 | 120.3 | 128.5 | -71.7 | -176.1 | 122.3 | 0 | 0 | 108.3 | |||||
| 276 | N | 38.8 | Very low | 39.2 | Very low | 134 Ų | 134 | 147.1 Ų | 147.1 | 72% | 0.717 | 81% | 0.813 | S | S | * | * | trans | -169.4 | 141.1 | 147.2 | -114.7 | -62.8 | 0 | 0 | 0 | 113 | ||||
| 277 | Q | 36.6 | Very low | 38.6 | Very low | 160 Ų | 160 | 144.8 Ų | 144.8 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | trans | 52.8 | 98.7 | 155.4 | -72.8 | 159.3 | 67.6 | 0 | 0 | 118.3 | ||||
| 278 | F | 35.1 | Very low | 38.2 | Very low | 211 Ų | 211 | 147.1 Ų | 147.1 | 93% | 0.925 | 81% | 0.814 | S | S | * | * | -49.3 | 133.4 | 126.5 | -79.8 | -112.1 | 0 | 0 | 0 | 109.1 | |||||
| 279 | D | 38.3 | Very low | 38 | Very low | 146 Ų | 146 | 148.4 Ų | 148.4 | 78% | 0.781 | 81% | 0.814 | S | S | * | * | trans | -156.4 | 166.7 | 134.6 | -134.9 | -37.6 | 0 | 0 | 0 | 112.3 | ||||
| 280 | I | 37.5 | Very low | 37.8 | Very low | 139 Ų | 139 | 149.2 Ų | 149.2 | 71% | 0.713 | 81% | 0.814 | S | S | * | * | trans | -109.6 | 125.6 | -165.3 | -57.7 | 161.7 | 0 | 0 | 0 | 110.6 | ||||
| 281 | Q | 38.4 | Very low | 38.2 | Very low | 200 Ų | 200 | 149 Ų | 149 | 94% | 0.935 | 81% | 0.813 | S | S | * | * | trans | -168.4 | 171.9 | 140.3 | -109 | 146.1 | 91.1 | 0 | 0 | 115.9 | ||||
| 282 | K | 34 | Very low | 38.4 | Very low | 200 Ų | 200 | 151 Ų | 151 | 87% | 0.87 | 81% | 0.807 | S | S | * | * | trans | -144.1 | 125 | -156.8 | 159.4 | -164.2 | 174.4 | -179.5 | 0 | 110.1 | ||||
| 283 | A | 36.3 | Very low | 38.4 | Very low | 88 Ų | 88 | 153 Ų | 153 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | -177.4 | 156.5 | 156.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 284 | T | 37.5 | Very low | 38 | Very low | 130 Ų | 130 | 154.6 Ų | 154.6 | 80% | 0.798 | 81% | 0.805 | S | S | * | * | trans | 67.8 | 115.1 | 162.4 | -4 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 285 | D | 36.4 | Very low | 38.3 | Very low | 133 Ų | 133 | 153.5 Ų | 153.5 | 71% | 0.711 | 81% | 0.805 | S | S | * | * | cis | 101.5 | 146 | 19.7 | -154.9 | -2.8 | 0 | 0 | 0 | 114.8 | ||||
| 286 | H | 40.8 | Very low | 38.1 | Very low | 174 Ų | 174 | 152.2 Ų | 152.2 | 81% | 0.806 | 80% | 0.804 | S | S | * | * | trans | 85.3 | 140.6 | 175.8 | -57.8 | -29.9 | 0 | 0 | 0 | 122.2 | ||||
| 287 | G | 36.2 | Very low | 38.3 | Very low | 68 Ų | 68 | 151.4 Ų | 151.4 | 70% | 0.701 | 81% | 0.809 | S | S | * | * | trans | 97.2 | 74.5 | 161 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 288 | I | 36.7 | Very low | 38.3 | Very low | 163 Ų | 163 | 153 Ų | 153 | 84% | 0.836 | 82% | 0.817 | S | S | * | * | 43 | 104 | 74.1 | -51.2 | 179.9 | 0 | 0 | 0 | 114.4 | |||||
| 289 | I | 43 | Very low | 38.7 | Very low | 165 Ų | 165 | 148.5 Ų | 148.5 | 85% | 0.846 | 81% | 0.811 | S | S | * | * | -160.8 | 145.5 | 124.3 | -97.4 | 153.7 | 0 | 0 | 0 | 107.4 | |||||
| 290 | S | 36.7 | Very low | 38.5 | Very low | 111 Ų | 111 | 151.5 Ų | 151.5 | 78% | 0.776 | 82% | 0.817 | S | S | * | * | trans | -125.7 | 148.1 | 170.3 | -57.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 291 | D | 44.4 | Very low | 38.7 | Very low | 162 Ų | 162 | 151.9 Ų | 151.9 | 87% | 0.866 | 83% | 0.826 | S | S | * | * | trans | -153.8 | 163.4 | 136.8 | -130 | -34.9 | 0 | 0 | 0 | 113.7 | ||||
| 292 | K | 39.3 | Very low | 38.8 | Very low | 180 Ų | 180 | 151.9 Ų | 151.9 | 78% | 0.783 | 82% | 0.823 | S | S | * | * | trans | -96.8 | 153 | -176.4 | -62.6 | 169.5 | -179.3 | 170.3 | 0 | 111.4 | ||||
| 293 | L | 40 | Very low | 38.5 | Very low | 166 Ų | 166 | 146.8 Ų | 146.8 | 87% | 0.869 | 81% | 0.813 | S | S | * | * | trans | -145.9 | 142.6 | 138.8 | -108.9 | 168.8 | 0 | 0 | 0 | 110.5 | ||||
| 294 | H | 36.1 | Very low | 38.3 | Very low | 170 Ų | 170 | 154 Ų | 154 | 79% | 0.787 | 82% | 0.821 | S | S | * | * | trans | -119.5 | 134.8 | 173.7 | -93.6 | 45.8 | 0 | 0 | 0 | 108.2 | ||||
| 295 | T | 44 | Very low | 38.1 | Very low | 134 Ų | 134 | 153.2 Ų | 153.2 | 82% | 0.822 | 82% | 0.821 | S | S | * | * | trans | -145.2 | 121 | 159.8 | 48.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 296 | N | 34.4 | Very low | 37.8 | Very low | 162 Ų | 162 | 153.6 Ų | 153.6 | 87% | 0.866 | 83% | 0.833 | S | S | * | * | trans | -77.9 | 148.1 | 169.2 | -86 | -8.2 | 0 | 0 | 0 | 110.7 | ||||
| 297 | S | 41.8 | Very low | 37.4 | Very low | 117 Ų | 117 | 152 Ų | 152 | 82% | 0.818 | 84% | 0.835 | S | S | * | * | trans | -151.2 | 120.8 | 155.2 | 58.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 298 | E | 37.1 | Very low | 37.3 | Very low | 195 Ų | 195 | 154 Ų | 154 | 91% | 0.911 | 84% | 0.839 | S | S | * | * | trans | -81.1 | 141.5 | -175.2 | -62.5 | 166.6 | 105.8 | 0 | 0 | 112 | ||||
| 299 | S | 42.9 | Very low | 37.7 | Very low | 116 Ų | 116 | 152.1 Ų | 152.1 | 81% | 0.811 | 84% | 0.837 | S | S | * | * | trans | -147.5 | 132.1 | 160.8 | 61.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 300 | F | 35.8 | Very low | 37.6 | Very low | 208 Ų | 208 | 152.8 Ų | 152.8 | 91% | 0.912 | 83% | 0.834 | S | S | * | * | trans | -62.4 | 138.8 | -173.5 | -92.5 | -133 | 0 | 0 | 0 | 113.5 | ||||
| 301 | T | 40.8 | Very low | 37.9 | Very low | 147 Ų | 147 | 154.2 Ų | 154.2 | 90% | 0.902 | 83% | 0.833 | S | S | * | * | trans | -158.8 | 164.5 | 135.6 | 5.6 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 302 | K | 39.8 | Very low | 38 | Very low | 201 Ų | 201 | 153.1 Ų | 153.1 | 87% | 0.874 | 83% | 0.832 | S | S | * | * | trans | -82.6 | 136 | -163.9 | -76.7 | 178 | 174.7 | 175.1 | 0 | 114.3 | ||||
| 303 | S | 29.3 | Very low | 38 | Very low | 93 Ų | 93 | 155.7 Ų | 155.7 | 65% | 0.65 | 84% | 0.837 | S | S | * | * | 54.1 | 128.8 | 127.5 | -162.8 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 304 | W | 32.1 | Very low | 38.2 | Very low | 239 Ų | 239 | 154.6 Ų | 154.6 | 91% | 0.905 | 84% | 0.837 | S | S | * | * | cis | -118.6 | 157.8 | 22.5 | -63.8 | -60.3 | 0 | 0 | 0 | 114.2 | ||||
| 305 | S | 32.3 | Very low | 38.4 | Very low | 113 Ų | 113 | 155 Ų | 155 | 79% | 0.79 | 84% | 0.839 | S | S | * | * | trans | -155.1 | 125.9 | 165.2 | -60.2 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 306 | C | 30.2 | Very low | 38.3 | Very low | 142 Ų | 142 | 157.2 Ų | 157.2 | 96% | 0.959 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 126.9 | 173.1 | -71.5 | 0 | 0 | 0 | 0 | 110.3 | ||
| 307 | T | 32.3 | Very low | 38.4 | Very low | 139 Ų | 139 | 157.1 Ų | 157.1 | 85% | 0.853 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -91.7 | 135.8 | 175.9 | 40.9 | 0 | 0 | 0 | 0 | 110.8 | ||
| 308 | S | 34.9 | Very low | 38 | Very low | 111 Ų | 111 | 159.3 Ų | 159.3 | 78% | 0.776 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -99.7 | 143.3 | 170.5 | -164.7 | 0 | 0 | 0 | 0 | 110.5 | ||
| 309 | P | 44.9 | Very low | 38.2 | Very low | 123 Ų | 123 | 156 Ų | 156 | 80% | 0.799 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 173.6 | 176.8 | -21.8 | 35 | 0 | 0 | 0 | 114.6 | ||
| 310 | K | 39.7 | Very low | 38 | Very low | 179 Ų | 179 | 157.1 Ų | 157.1 | 78% | 0.778 | 83% | 0.829 | S | S | * | * | trans | -107.9 | 167.4 | -167.7 | -50.5 | 178.9 | 176.9 | 179.3 | 0 | 115.2 | ||||
| 311 | D | 43.1 | Very low | 38.2 | Very low | 141 Ų | 141 | 150.1 Ų | 150.1 | 75% | 0.754 | 82% | 0.816 | S | S | * | * | trans | 85.3 | 158.2 | 137.9 | -71 | -38.7 | 0 | 0 | 0 | 121.5 | ||||
| 312 | V | 47.8 | Very low | 38.2 | Very low | 139 Ų | 139 | 152.8 Ų | 152.8 | 84% | 0.842 | 82% | 0.818 | S | S | * | * | trans | 86 | 110.7 | 169.6 | -166.9 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 313 | R | 39.2 | Very low | 38.2 | Very low | 235 Ų | 235 | 149.1 Ų | 149.1 | 89% | 0.887 | 81% | 0.813 | S | S | * | * | trans | -81.5 | 153.4 | 164.1 | -59.8 | 172.5 | 171.9 | -174 | -3.3 | 111.2 | ||||
| 314 | T | 44.2 | Very low | 39 | Very low | 142 Ų | 142 | 150 Ų | 150 | 87% | 0.871 | 82% | 0.818 | S | S | * | * | trans | -158.8 | 167.2 | 138.1 | -72.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 315 | E | 40.3 | Very low | 39.7 | Very low | 180 Ų | 180 | 146.4 Ų | 146.4 | 84% | 0.841 | 81% | 0.81 | S | S | * | * | trans | -99.1 | -171.5 | -157.6 | -49.9 | -164.4 | 152 | 0 | 0 | 116.1 | ||||
| 316 | E | 40.9 | Very low | 40.7 | Very low | 179 Ų | 179 | 145.5 Ų | 145.5 | 84% | 0.836 | 80% | 0.796 | S | S | * | * | trans | 80.5 | 149.8 | 169 | -53 | -159.4 | 130.3 | 0 | 0 | 118.9 | ||||
| 317 | K | 37 | Very low | 41.8 | Very low | 161 Ų | 161 | 143.2 Ų | 143.2 | 70% | 0.7 | 78% | 0.782 | S | S | * | * | cis | -169.7 | 149.1 | -46.1 | -141.5 | 173 | 176.7 | 172.6 | 0 | 107.8 | ||||
| 318 | H | 34.3 | Very low | 43 | Very low | 163 Ų | 163 | 142 Ų | 142 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | trans | 57.4 | 108.3 | 168.3 | -55 | -73.8 | 0 | 0 | 0 | 118.8 | ||||
| 319 | S | 40.3 | Very low | 44.7 | Very low | 124 Ų | 124 | 141.5 Ų | 141.5 | 87% | 0.867 | 77% | 0.766 | S | S | * | * | -168.7 | 145.6 | 99.1 | -169.1 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 320 | T | 37.8 | Very low | 46.2 | Very low | 140 Ų | 140 | 142.9 Ų | 142.9 | 86% | 0.859 | 76% | 0.76 | S | S | * | * | trans | -81.1 | 141.4 | 177.4 | -45.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 321 | G | 39.8 | Very low | 48.3 | Very low | 61 Ų | 61 | 138.6 Ų | 138.6 | 63% | 0.629 | 75% | 0.746 | S | S | * | * | trans | -137.3 | 140.3 | 164.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | T323 | G321-T323 PolarHBondContact O-N 3.25Š| ||
| 322 | E | 41.4 | Very low | 50.2 | Low | 203 Ų | 203 | 136.7 Ų | 136.7 | 95% | 0.949 | 74% | 0.735 | S | S | * | * | trans | -72.6 | 125.7 | -171.6 | -69.8 | 165 | 103.2 | 0 | 0 | 111.9 | ||||
| 323 | T | 41.2 | Very low | 52.1 | Low | 125 Ų | 125 | 134 Ų | 134 | 77% | 0.767 | 72% | 0.718 | S | S | * | * | trans | -101.8 | 108.2 | 171.3 | -48.1 | 0 | 0 | 0 | 0 | 108.6 | G321 | G321-T323 PolarHBondContact O-N 3.25Š| ||
| 324 | C | 44.2 | Very low | 54.5 | Low | 112 Ų | 112 | 127.6 Ų | 127.6 | 76% | 0.757 | 70% | 0.702 | S | S | * | * | trans | -77.5 | 122.7 | 177 | -167.9 | 0 | 0 | 0 | 0 | 110.4 | I326 | C324-I326 PolarHBondContact O-N 2.89Š| ||
| 325 | H | 48 | Very low | 56.7 | Low | 162 Ų | 162 | 125 Ų | 125 | 75% | 0.75 | 68% | 0.682 | S | S | * | * | trans | -78.5 | 79.3 | 175.6 | -91.4 | -94.5 | 0 | 0 | 0 | 111.2 | S327 | H325-S327 PolarHBondContact O-N 3.44Å; H325-S327 VanDerWaalsContact O-N 3.08Å; H325-S327 PolarHBondContact O-OG 3.03Å | ||
| 326 | I | 53.4 | Low | 59.2 | Low | 95 Ų | 95 | 119.8 Ų | 119.8 | 49% | 0.487 | 66% | 0.662 | S | S | . | * | trans | -63 | 110.8 | 165.6 | -55.5 | 177.1 | 0 | 0 | 0 | 107.1 | C324 D331 | C324-I326 PolarHBondContact O-N 2.89Å; I326-D331 HydrophobicContact CG2-CB 3.77Å | ||
| 327 | S | 53.6 | Low | 61.7 | Low | 94 Ų | 94 | 116.7 Ų | 116.7 | 66% | 0.657 | 65% | 0.648 | S | S | * | * | trans | -118.9 | 1.8 | -165.3 | -57.3 | 0 | 0 | 0 | 0 | 114.2 | H325 | H325-S327 PolarHBondContact O-N 3.44Å; H325-S327 VanDerWaalsContact O-N 3.08Å; H325-S327 PolarHBondContact O-OG 3.03Å | ||
| 328 | D | 56.9 | Low | 64.4 | Low | 113 Ų | 113 | 115.3 Ų | 115.3 | 60% | 0.604 | 64% | 0.644 | S | S | * | * | trans | -119.1 | 135.1 | 173.1 | -88.3 | -66.6 | 0 | 0 | 0 | 110.1 | K330 D331 | D328-K330 PolarHBondContact O-N 3.5Å; D328-D331 PolarHBondContact O-N 3.01Å | ||
| 329 | S | 70.4 | Confident | 67.3 | Low | 101 Ų | 101 | 113.3 Ų | 113.3 | 71% | 0.706 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -66.4 | -17.7 | 180 | 56.8 | 0 | 0 | 0 | 0 | 113.3 | V333 | S329-V333 WeakPolarHBondContact O-CG2 3.37Å; S329-V333 PolarHBondContact O-N 3Å |
| 330 | K | 77.1 | Confident | 70 | Confident | 152 Ų | 152 | 111.5 Ų | 111.5 | 66% | 0.661 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -71.9 | -45.1 | -179.8 | -138.6 | 167.7 | -173.1 | 173.7 | 0 | 112 | D328 L332 V333 D334 | D328-K330 PolarHBondContact O-N 3.5Å; K330-L332 PolarHBondContact O-N 3.11Å; K330-V333 PolarHBondContact O-N 3.27Å; K330-V333 VanDerWaalsContact O-N 3.07Å; K330-D334 PolarHBondContact O-N 2.96Å |
| 331 | D | 83.2 | Confident | 72.7 | Confident | 89 Ų | 89 | 108.5 Ų | 108.5 | 48% | 0.476 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -56.8 | -38.1 | 175.4 | -66.3 | 1 | 0 | 0 | 0 | 111.6 | I326 D328 L335 | I326-D331 HydrophobicContact CG2-CB 3.77Å; D328-D331 PolarHBondContact O-N 3.01Å; D331-L335 WeakPolarHBondContact O-CB 3.48Å; D331-L335 PolarHBondContact O-N 2.99Å |
| 332 | L | 82.2 | Confident | 75.4 | Confident | 100 Ų | 100 | 109.8 Ų | 109.8 | 52% | 0.524 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -68 | -40.8 | 177.2 | -173.3 | 66.4 | 0 | 0 | 0 | 112.2 | K330 V336 | K330-L332 PolarHBondContact O-N 3.11Å; L332-V336 WeakPolarHBondContact O-CB 3.37Å; L332-V336 VanDerWaalsContact O-CG2 3.28Å; L332-V336 WeakPolarHBondContact O-CG2 3.43Å; L332-V336 PolarHBondContact O-N 3.37Å |
| 333 | V | 89.1 | Confident | 78 | Confident | 82 Ų | 82 | 104.5 Ų | 104.5 | 50% | 0.497 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66.1 | -43.5 | 176.5 | 169.5 | 0 | 0 | 0 | 0 | 111 | S329 K330 V336 H337 | S329-V333 WeakPolarHBondContact O-CG2 3.37Å; S329-V333 PolarHBondContact O-N 3Å; K330-V333 PolarHBondContact O-N 3.27Å; K330-V333 VanDerWaalsContact O-N 3.07Å; V333-V336 PolarHBondContact O-N 3.14Å; V333-H337 WeakPolarHBondContact O-CB 3.38Å; V333-H337 PolarHBondContact O-CD2 3.36Å; V333-H337 PolarHBondContact O-N 2.96Å |
| 334 | D | 89.4 | Confident | 80.7 | Confident | 101 Ų | 101 | 102.7 Ų | 102.7 | 54% | 0.54 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.1 | -38.9 | 178.2 | -71.8 | -22.7 | 0 | 0 | 0 | 111.6 | K330 H337 Q338 | K330-D334 PolarHBondContact O-N 2.96Å; D334-H337 PolarHBondContact O-N 3.42Å; D334-Q338 WeakPolarHBondContact O-CB 3.35Å; D334-Q338 PolarHBondContact O-N 3.14Å |
| 335 | L | 89.6 | Confident | 83.2 | Confident | 88 Ų | 88 | 103 Ų | 103 | 46% | 0.461 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.6 | -43.2 | 174.4 | -174.1 | 66.8 | 0 | 0 | 0 | 112.3 | D331 Q338 E339 | D331-L335 WeakPolarHBondContact O-CB 3.48Å; D331-L335 PolarHBondContact O-N 2.99Å; L335-Q338 WeakPolarHBondContact O-CB 3.49Å; L335-Q338 PolarHBondContact O-N 2.73Å; L335-E339 PolarHBondContact O-N 3.28Å |
| 336 | V | 93.9 | Very high | 85.5 | Confident | 71 Ų | 71 | 101.8 Ų | 101.8 | 43% | 0.43 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.7 | -41 | 175.1 | 167.5 | 0 | 0 | 0 | 0 | 111 | L332 V333 Q338 E339 I340 | L332-V336 WeakPolarHBondContact O-CB 3.37Å; L332-V336 VanDerWaalsContact O-CG2 3.28Å; L332-V336 WeakPolarHBondContact O-CG2 3.43Å; L332-V336 PolarHBondContact O-N 3.37Å; V333-V336 PolarHBondContact O-N 3.14Å; V336-Q338 VanDerWaalsContact C-N 3.34Å; V336-Q338 PolarHBondContact O-N 2.95Å; V336-E339 PolarHBondContact O-N 3.14Å; V336-I340 HydrophobicContact CG1-CD1 3.82Å; V336-I340 HydrophobicContact CG1-CG1 4.49Å; V336-I340 WeakPolarHBondContact O-CB 3.26Å; V336-I340 VanDerWaalsContact O-CG1 3.25Å; V336-I340 WeakPolarHBondContact O-CG1 3.27Å; V336-I340 PolarHBondContact O-N 3.33Å |
| 337 | H | 93 | Very high | 87.6 | Confident | 113 Ų | 113 | 99 Ų | 99 | 52% | 0.523 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.9 | -41.2 | 172.6 | -92.1 | -61.6 | 0 | 0 | 0 | 112.2 | V333 D334 I340 T341 | V333-H337 WeakPolarHBondContact O-CB 3.38Å; V333-H337 PolarHBondContact O-CD2 3.36Å; V333-H337 PolarHBondContact O-N 2.96Å; D334-H337 PolarHBondContact O-N 3.42Å; H337-I340 PolarHBondContact O-N 2.84Å; H337-T341 WeakPolarHBondContact O-CG2 3.31Å; H337-T341 PolarHBondContact O-N 2.93Å |
| 338 | Q | 94.1 | Very high | 89.6 | Confident | 132 Ų | 132 | 102 Ų | 102 | 62% | 0.617 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.2 | -48.7 | 175.8 | -173.4 | 174.6 | -1.3 | 0 | 0 | 111.2 | D334 L335 V336 I340 T341 E342 | D334-Q338 WeakPolarHBondContact O-CB 3.35Å; D334-Q338 PolarHBondContact O-N 3.14Å; L335-Q338 WeakPolarHBondContact O-CB 3.49Å; L335-Q338 PolarHBondContact O-N 2.73Å; V336-Q338 VanDerWaalsContact C-N 3.34Å; V336-Q338 PolarHBondContact O-N 2.95Å; Q338-I340 PolarHBondContact O-N 3.29Å; Q338-T341 PolarHBondContact O-N 3.06Å; Q338-T341 PolarHBondContact O-OG1 3.14Å; Q338-E342 PolarHBondContact O-N 3.02Å |
| 339 | E | 95.2 | Very high | 91.5 | Very high | 122 Ų | 122 | 99 Ų | 99 | 57% | 0.57 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.5 | -41.3 | 177.9 | -174.6 | 166.8 | -164.8 | 0 | 0 | 112.3 | L335 V336 T341 E342 L343 | L335-E339 PolarHBondContact O-N 3.28Å; V336-E339 PolarHBondContact O-N 3.14Å; E339-T341 VanDerWaalsContact C-N 3.34Å; E339-T341 PolarHBondContact O-N 3.42Å; E339-E342 PolarHBondContact O-N 3.16Å; E339-L343 HydrophobicContact CG-CD1 4.02Å; E339-L343 HydrophobicContact CG-CG 4.32Å; E339-L343 WeakPolarHBondContact O-CB 3.27Å; E339-L343 WeakPolarHBondContact O-CG 3.44Å; E339-L343 PolarHBondContact O-N 2.99Å |
| 340 | I | 95.7 | Very high | 92.7 | Very high | 85 Ų | 85 | 98.5 Ų | 98.5 | 44% | 0.436 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57.5 | -45.9 | 173.6 | -71.1 | 165.7 | 0 | 0 | 0 | 111 | V336 H337 Q338 E342 L343 E344 | V336-I340 HydrophobicContact CG1-CD1 3.82Å; V336-I340 HydrophobicContact CG1-CG1 4.49Å; V336-I340 WeakPolarHBondContact O-CB 3.26Å; V336-I340 VanDerWaalsContact O-CG1 3.25Å; V336-I340 WeakPolarHBondContact O-CG1 3.27Å; V336-I340 PolarHBondContact O-N 3.33Å; H337-I340 PolarHBondContact O-N 2.84Å; Q338-I340 PolarHBondContact O-N 3.29Å; I340-E342 VanDerWaalsContact C-N 3.34Å; I340-E342 PolarHBondContact O-N 2.88Å; I340-L343 PolarHBondContact O-N 3.17Å; I340-E344 WeakPolarHBondContact O-CB 3.35Å; I340-E344 PolarHBondContact O-N 2.88Å |
| 341 | T | 95.9 | Very high | 93.5 | Very high | 78 Ų | 78 | 98.4 Ų | 98.4 | 48% | 0.479 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.8 | -34.8 | 178.1 | 63.3 | 0 | 0 | 0 | 0 | 112.8 | H337 Q338 E339 E344 M345 | H337-T341 WeakPolarHBondContact O-CG2 3.31Å; H337-T341 PolarHBondContact O-N 2.93Å; Q338-T341 PolarHBondContact O-N 3.06Å; Q338-T341 PolarHBondContact O-OG1 3.14Å; E339-T341 VanDerWaalsContact C-N 3.34Å; E339-T341 PolarHBondContact O-N 3.42Å; T341-E344 WeakPolarHBondContact O-CB 3.47Å; T341-M345 WeakPolarHBondContact O-CG 3.43Å; T341-M345 PolarHBondContact O-N 3.36Å |
| 342 | E | 96.1 | Very high | 94 | Very high | 87 Ų | 87 | 96.9 Ų | 96.9 | 41% | 0.407 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -69.4 | -43.5 | 175.9 | -152 | -158 | 149.1 | 0 | 0 | 111.9 | Q338 E339 I340 E344 M345 R346 | Q338-E342 PolarHBondContact O-N 3.02Å; E339-E342 PolarHBondContact O-N 3.16Å; I340-E342 VanDerWaalsContact C-N 3.34Å; I340-E342 PolarHBondContact O-N 2.88Å; E342-E344 VanDerWaalsContact C-N 3.31Å; E342-E344 PolarHBondContact O-N 2.99Å; E342-M345 HydrophobicContact CG-CE 4.36Å; E342-M345 PolarHBondContact O-N 3.25Å; E342-R346 VanDerWaalsContact CD-NH2 3.35Å; E342-R346 WeakPolarHBondContact O-CB 3.5Å; E342-R346 VanDerWaalsContact O-CG 3.28Å; E342-R346 WeakPolarHBondContact O-CG 3.25Å; E342-R346 PolarHBondContact O-N 2.95Å; E342-R346 IonicContact OE1-CZ 2.71Å; E342-R346 IonicContact OE1-NE 3.74Å; E342-R346 PolarHBondContact OE1-NE 3.27Å; E342-R346 IonicContact OE1-NH2 3.51Å; E342-R346 PolarHBondContact OE1-NH2 3.19Å; E342-R346 IonicContact OE2-NH2 3.44Å; E342-R346 PolarHBondContact OE2-NH2 2.92Å |
| 343 | L | 96.8 | Very high | 94.5 | Very high | 92 Ų | 92 | 97.2 Ų | 97.2 | 48% | 0.482 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.2 | -39.8 | 175.1 | -70 | 172.8 | 0 | 0 | 0 | 111.6 | E339 I340 R346 A347 | E339-L343 HydrophobicContact CG-CD1 4.02Å; E339-L343 HydrophobicContact CG-CG 4.32Å; E339-L343 WeakPolarHBondContact O-CB 3.27Å; E339-L343 WeakPolarHBondContact O-CG 3.44Å; E339-L343 PolarHBondContact O-N 2.99Å; I340-L343 PolarHBondContact O-N 3.17Å; L343-R346 PolarHBondContact O-N 3.09Å; L343-A347 VanDerWaalsContact O-CB 3.26Å; L343-A347 WeakPolarHBondContact O-CB 3.49Å; L343-A347 PolarHBondContact O-N 3.45Å |
| 344 | E | 96 | Very high | 94.6 | Very high | 88 Ų | 88 | 98 Ų | 98 | 41% | 0.411 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58.9 | -49.2 | 170.9 | -93 | -127.8 | -145.3 | 0 | 0 | 112.7 | I340 T341 E342 A347 R348 | I340-E344 WeakPolarHBondContact O-CB 3.35Å; I340-E344 PolarHBondContact O-N 2.88Å; T341-E344 WeakPolarHBondContact O-CB 3.47Å; E342-E344 VanDerWaalsContact C-N 3.31Å; E342-E344 PolarHBondContact O-N 2.99Å; E344-A347 PolarHBondContact O-N 3.3Å; E344-R348 WeakPolarHBondContact O-CB 3.49Å; E344-R348 VanDerWaalsContact O-CG 3.25Å; E344-R348 WeakPolarHBondContact O-CG 3.27Å; E344-R348 PolarHBondContact O-N 3.41Å; E344-R348 IonicContact OE2-CZ 3.19Å; E344-R348 IonicContact OE2-NE 2.76Å; E344-R348 PolarHBondContact OE2-NE 2.98Å; E344-R348 IonicContact OE2-NH2 3.7Å; E344-R348 PolarHBondContact OE2-NH2 3.06Å |
| 345 | M | 96.8 | Very high | 94.6 | Very high | 118 Ų | 118 | 99.9 Ų | 99.9 | 58% | 0.581 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.6 | -46.6 | 177.6 | -74 | -171.2 | -69.3 | 0 | 0 | 111.8 | T341 E342 A347 R348 A349 | T341-M345 WeakPolarHBondContact O-CG 3.43Å; T341-M345 PolarHBondContact O-N 3.36Å; E342-M345 HydrophobicContact CG-CE 4.36Å; E342-M345 PolarHBondContact O-N 3.25Å; M345-A347 VanDerWaalsContact C-N 3.34Å; M345-A347 PolarHBondContact O-N 2.88Å; M345-R348 PolarHBondContact O-N 3.14Å; M345-A349 PolarHBondContact O-N 3.38Å |
| 346 | R | 96.7 | Very high | 94.2 | Very high | 137 Ų | 137 | 99.7 Ų | 99.7 | 52% | 0.517 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -56.8 | -46.2 | 174.5 | -70.8 | 171.7 | 177.7 | -161.2 | 7.8 | 111 | E342 L343 A349 I350 | E342-R346 VanDerWaalsContact CD-NH2 3.35Å; E342-R346 WeakPolarHBondContact O-CB 3.5Å; E342-R346 VanDerWaalsContact O-CG 3.28Å; E342-R346 WeakPolarHBondContact O-CG 3.25Å; E342-R346 PolarHBondContact O-N 2.95Å; E342-R346 IonicContact OE1-CZ 2.71Å; E342-R346 IonicContact OE1-NE 3.74Å; E342-R346 PolarHBondContact OE1-NE 3.27Å; E342-R346 IonicContact OE1-NH2 3.51Å; E342-R346 PolarHBondContact OE1-NH2 3.19Å; E342-R346 IonicContact OE2-NH2 3.44Å; E342-R346 PolarHBondContact OE2-NH2 2.92Å; L343-R346 PolarHBondContact O-N 3.09Å; R346-A349 PolarHBondContact O-N 3.44Å; R346-I350 WeakPolarHBondContact O-CG1 3.49Å; R346-I350 PolarHBondContact O-N 2.97Å |
| 347 | A | 97 | Very high | 93.3 | Very high | 36 Ų | 36 | 103 Ų | 103 | 30% | 0.298 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.7 | -34 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | L343 E344 M345 R351 | L343-A347 VanDerWaalsContact O-CB 3.26Å; L343-A347 WeakPolarHBondContact O-CB 3.49Å; L343-A347 PolarHBondContact O-N 3.45Å; E344-A347 PolarHBondContact O-N 3.3Å; M345-A347 VanDerWaalsContact C-N 3.34Å; M345-A347 PolarHBondContact O-N 2.88Å; A347-R351 WeakPolarHBondContact O-CB 3.26Å; A347-R351 WeakPolarHBondContact O-CG 3.38Å; A347-R351 PolarHBondContact O-N 3.01Å; A347-R351 VanDerWaalsContact O-N 3.16Å; A347-R351 PolarHBondContact O-NE 3.36Å |
| 348 | R | 96.9 | Very high | 92.3 | Very high | 156 Ų | 156 | 100.9 Ų | 100.9 | 59% | 0.589 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.2 | -44.3 | 172.5 | -71 | 167.8 | -170.6 | -132.9 | 8.2 | 110.7 | E344 M345 R351 A352 | E344-R348 WeakPolarHBondContact O-CB 3.49Å; E344-R348 VanDerWaalsContact O-CG 3.25Å; E344-R348 WeakPolarHBondContact O-CG 3.27Å; E344-R348 PolarHBondContact O-N 3.41Å; E344-R348 IonicContact OE2-CZ 3.19Å; E344-R348 IonicContact OE2-NE 2.76Å; E344-R348 PolarHBondContact OE2-NE 2.98Å; E344-R348 IonicContact OE2-NH2 3.7Å; E344-R348 PolarHBondContact OE2-NH2 3.06Å; M345-R348 PolarHBondContact O-N 3.14Å; R348-R351 PolarHBondContact O-N 3.4Å; R348-A352 PolarHBondContact O-N 3.17Å; R348-A352 VanDerWaalsContact O-N 3.1Å |
| 349 | A | 96.7 | Very high | 91.4 | Very high | 52 Ų | 52 | 98.7 Ų | 98.7 | 43% | 0.43 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.7 | -44.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | M345 R346 R351 A352 M353 | M345-A349 PolarHBondContact O-N 3.38Å; R346-A349 PolarHBondContact O-N 3.44Å; A349-R351 VanDerWaalsContact C-N 3.35Å; A349-R351 PolarHBondContact O-N 3.37Å; A349-A352 PolarHBondContact O-N 3.29Å; A349-M353 PolarHBondContact O-N 3.37Å |
| 350 | I | 95.8 | Very high | 90.3 | Very high | 90 Ų | 90 | 99.9 Ų | 99.9 | 46% | 0.462 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.8 | -43.6 | 175.9 | -68.7 | 164.9 | 0 | 0 | 0 | 111 | R346 A352 M353 L354 | R346-I350 WeakPolarHBondContact O-CG1 3.49Å; R346-I350 PolarHBondContact O-N 2.97Å; I350-A352 VanDerWaalsContact C-N 3.32Å; I350-A352 PolarHBondContact O-N 2.73Å; I350-M353 HydrophobicContact CG1-CE 4.08Å; I350-M353 PolarHBondContact O-N 2.87Å; I350-L354 HydrophobicContact CG2-CD1 3.96Å; I350-L354 HydrophobicContact CG2-CG 4.4Å; I350-L354 WeakPolarHBondContact O-CG 3.43Å; I350-L354 PolarHBondContact O-N 2.93Å |
| 351 | R | 94.3 | Very high | 89.1 | Confident | 150 Ų | 150 | 102.9 Ų | 102.9 | 57% | 0.566 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.9 | -38.4 | 176.4 | -77.6 | 174.9 | -77.9 | -162.2 | 1 | 112.4 | A347 R348 A349 L354 K355 | A347-R351 WeakPolarHBondContact O-CB 3.26Å; A347-R351 WeakPolarHBondContact O-CG 3.38Å; A347-R351 PolarHBondContact O-N 3.01Å; A347-R351 VanDerWaalsContact O-N 3.16Å; A347-R351 PolarHBondContact O-NE 3.36Å; R348-R351 PolarHBondContact O-N 3.4Å; A349-R351 VanDerWaalsContact C-N 3.35Å; A349-R351 PolarHBondContact O-N 3.37Å; R351-L354 PolarHBondContact O-N 3.47Å; R351-K355 WeakPolarHBondContact O-CB 3.29Å; R351-K355 PolarHBondContact O-N 3.25Å |
| 352 | A | 93.9 | Very high | 87.7 | Confident | 56 Ų | 56 | 107.6 Ų | 107.6 | 46% | 0.463 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.4 | -40.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | R348 A349 I350 L354 K355 T356 | R348-A352 PolarHBondContact O-N 3.17Å; R348-A352 VanDerWaalsContact O-N 3.1Å; A349-A352 PolarHBondContact O-N 3.29Å; I350-A352 VanDerWaalsContact C-N 3.32Å; I350-A352 PolarHBondContact O-N 2.73Å; A352-L354 VanDerWaalsContact C-N 3.34Å; A352-L354 PolarHBondContact O-N 2.96Å; A352-K355 PolarHBondContact O-N 2.67Å; A352-T356 PolarHBondContact O-N 3.21Å; A352-T356 VanDerWaalsContact O-N 3.13Å; A352-T356 PolarHBondContact O-OG1 3.04Å |
| 353 | M | 91.3 | Very high | 85.7 | Confident | 107 Ų | 107 | 113.6 Ų | 113.6 | 53% | 0.527 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -67 | -31.8 | 175.1 | -70.5 | -169.6 | -69.6 | 0 | 0 | 113.3 | A349 I350 T356 K357 | A349-M353 PolarHBondContact O-N 3.37Å; I350-M353 HydrophobicContact CG1-CE 4.08Å; I350-M353 PolarHBondContact O-N 2.87Å; M353-T356 PolarHBondContact O-OG1 2.97Å; M353-K357 WeakPolarHBondContact O-CB 3.5Å; M353-K357 VanDerWaalsContact O-CG 3.29Å; M353-K357 WeakPolarHBondContact O-CG 3.45Å; M353-K357 PolarHBondContact O-N 3.08Å |
| 354 | L | 91 | Very high | 85.1 | Confident | 100 Ų | 100 | 114.7 Ų | 114.7 | 52% | 0.524 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -77.5 | -36.1 | 175.9 | -67.9 | 173.9 | 0 | 0 | 0 | 112.3 | I350 R351 A352 S358 | I350-L354 HydrophobicContact CG2-CD1 3.96Å; I350-L354 HydrophobicContact CG2-CG 4.4Å; I350-L354 WeakPolarHBondContact O-CG 3.43Å; I350-L354 PolarHBondContact O-N 2.93Å; R351-L354 PolarHBondContact O-N 3.47Å; A352-L354 VanDerWaalsContact C-N 3.34Å; A352-L354 PolarHBondContact O-N 2.96Å; L354-S358 PolarHBondContact O-N 3.19Å; L354-S358 VanDerWaalsContact O-N 3.09Å; L354-S358 PolarHBondContact O-OG 3.07Å |
| 355 | K | 89.4 | Confident | 84.6 | Confident | 140 Ų | 140 | 116.1 Ų | 116.1 | 61% | 0.609 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -56.7 | -58.1 | 171.9 | -173.2 | 84.4 | 178.6 | -171.8 | 0 | 110.7 | R351 A352 K357 S358 D359 | R351-K355 WeakPolarHBondContact O-CB 3.29Å; R351-K355 PolarHBondContact O-N 3.25Å; A352-K355 PolarHBondContact O-N 2.67Å; K355-K357 VanDerWaalsContact C-N 3.32Å; K355-K357 PolarHBondContact O-N 2.96Å; K355-S358 WeakPolarHBondContact O-CA 3.32Å; K355-S358 VanDerWaalsContact O-CB 3.3Å; K355-S358 WeakPolarHBondContact O-CB 3.31Å; K355-S358 PolarHBondContact O-N 2.85Å; K355-D359 PolarHBondContact O-N 3.12Å; K355-D359 VanDerWaalsContact O-N 3.15Å |
| 356 | T | 82 | Confident | 83.9 | Confident | 84 Ų | 84 | 115.9 Ų | 115.9 | 52% | 0.515 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -60.4 | -35.9 | -178.7 | 47.4 | 0 | 0 | 0 | 0 | 113.6 | A352 M353 S358 D359 Q360 | A352-T356 PolarHBondContact O-N 3.21Å; A352-T356 VanDerWaalsContact O-N 3.13Å; A352-T356 PolarHBondContact O-OG1 3.04Å; M353-T356 PolarHBondContact O-OG1 2.97Å; T356-S358 VanDerWaalsContact C-N 3.32Å; T356-S358 PolarHBondContact O-N 2.91Å; T356-D359 PolarHBondContact O-N 2.98Å; T356-Q360 WeakPolarHBondContact O-CB 3.49Å; T356-Q360 WeakPolarHBondContact O-CG 3.09Å; T356-Q360 PolarHBondContact O-N 3.33Å; T356-Q360 VanDerWaalsContact O-N 3.1Å |
| 357 | K | 75.4 | Confident | 83.1 | Confident | 141 Ų | 141 | 114.7 Ų | 114.7 | 61% | 0.613 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -67.4 | -28.8 | 171.8 | -76.7 | 177.9 | 179.1 | -177.5 | 0 | 113.9 | M353 K355 L361 | M353-K357 WeakPolarHBondContact O-CB 3.5Å; M353-K357 VanDerWaalsContact O-CG 3.29Å; M353-K357 WeakPolarHBondContact O-CG 3.45Å; M353-K357 PolarHBondContact O-N 3.08Å; K355-K357 VanDerWaalsContact C-N 3.32Å; K355-K357 PolarHBondContact O-N 2.96Å; K357-L361 WeakPolarHBondContact O-CG 3.49Å |
| 358 | S | 72.4 | Confident | 82.3 | Confident | 67 Ų | 67 | 119.6 Ų | 119.6 | 47% | 0.469 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -74.9 | -33.8 | 177.3 | -55.2 | 0 | 0 | 0 | 0 | 111.9 | L354 K355 T356 L361 | L354-S358 PolarHBondContact O-N 3.19Å; L354-S358 VanDerWaalsContact O-N 3.09Å; L354-S358 PolarHBondContact O-OG 3.07Å; K355-S358 WeakPolarHBondContact O-CA 3.32Å; K355-S358 VanDerWaalsContact O-CB 3.3Å; K355-S358 WeakPolarHBondContact O-CB 3.31Å; K355-S358 PolarHBondContact O-N 2.85Å; T356-S358 VanDerWaalsContact C-N 3.32Å; T356-S358 PolarHBondContact O-N 2.91Å; S358-L361 PolarHBondContact O-N 3.2Å |
| 359 | D | 73.7 | Confident | 81.3 | Confident | 86 Ų | 86 | 117.2 Ų | 117.2 | 46% | 0.46 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -76.1 | -36.1 | 177.4 | -57.3 | -38.9 | 0 | 0 | 0 | 111.2 | K355 T356 L361 K362 | K355-D359 PolarHBondContact O-N 3.12Å; K355-D359 VanDerWaalsContact O-N 3.15Å; T356-D359 PolarHBondContact O-N 2.98Å; D359-L361 PolarHBondContact O-N 3.34Å; D359-K362 PolarHBondContact O-N 3.18Å |
| 360 | Q | 72 | Confident | 80.2 | Confident | 147 Ų | 147 | 121.9 Ų | 121.9 | 69% | 0.687 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | -10.3 | 171.5 | -72 | -84.1 | 8.1 | 0 | 0 | 114.6 | T356 | T356-Q360 WeakPolarHBondContact O-CB 3.49Å; T356-Q360 WeakPolarHBondContact O-CG 3.09Å; T356-Q360 PolarHBondContact O-N 3.33Å; T356-Q360 VanDerWaalsContact O-N 3.1Å |
| 361 | L | 71.1 | Confident | 79 | Confident | 148 Ų | 148 | 124.3 Ų | 124.3 | 78% | 0.775 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105 | 14.3 | 176.4 | -74.1 | 170.2 | 0 | 0 | 0 | 112.8 | K357 S358 D359 | K357-L361 WeakPolarHBondContact O-CG 3.49Å; S358-L361 PolarHBondContact O-N 3.2Å; D359-L361 PolarHBondContact O-N 3.34Å |
| 362 | K | 67.2 | Low | 77.7 | Confident | 177 Ų | 177 | 122.2 Ų | 122.2 | 77% | 0.77 | 63% | 0.627 | S | S | * | * | trans | -120.5 | 19.5 | 175.2 | -70.1 | -175.6 | 174.6 | -177.9 | 0 | 113 | D359 | D359-K362 PolarHBondContact O-N 3.18Š| ||
| 363 | L | 53.1 | Low | 76.2 | Confident | 213 Ų | 213 | 128.2 Ų | 128.2 | 100% | 1.115 | 64% | 0.642 | S | S | * | * | trans | -127.2 | 0 | 173.4 | -88.7 | 157.2 | 0 | 0 | 0 | 108.8 |
Retrieved 363 of 363 residues in 179.2 ms
(Link to these results)