| 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 | 31.9 | Very low | 24.5 | Very low | 242 Ų | 242 | 180.1 Ų | 180.1 | 100% | 1.192 | 87% | 0.872 | S | S | * | * | 0 | 101.1 | 0 | -76.1 | 179.6 | -84.2 | 0 | 0 | 108.7 | |||||
| 2 | M | 25.6 | Very low | 24.4 | Very low | 195 Ų | 195 | 177.8 Ų | 177.8 | 96% | 0.961 | 87% | 0.867 | S | S | * | * | trans | 177.2 | 111.2 | 159.5 | -107.1 | 178.5 | 166.1 | 0 | 0 | 105.5 | ||||
| 3 | L | 20.7 | Very low | 24.4 | Very low | 167 Ų | 167 | 176.5 Ų | 176.5 | 87% | 0.874 | 87% | 0.866 | S | S | * | * | trans | -131.5 | 118 | 179.9 | -79.4 | 166.4 | 0 | 0 | 0 | 106.6 | ||||
| 4 | D | 21.3 | Very low | 24.6 | Very low | 117 Ų | 117 | 181.2 Ų | 181.2 | 63% | 0.626 | 87% | 0.87 | S | S | * | * | trans | -174.9 | 117.3 | 136.3 | -107.2 | -33.1 | 0 | 0 | 0 | 111.3 | R6 | D4-R6 WeakPolarHBondContact OD1-CG 3.31Å; D4-R6 IonicContact OD1-NE 2.7Å; D4-R6 PolarHBondContact OD1-NE 2.74Å | ||
| 5 | F | 24.8 | Very low | 24.5 | Very low | 207 Ų | 207 | 177.5 Ų | 177.5 | 91% | 0.908 | 87% | 0.87 | S | S | * | * | trans | -141.9 | 60.3 | 154.4 | -102.6 | -73.3 | 0 | 0 | 0 | 108.4 | R7 | F5-R7 VanDerWaalsContact C-N 3.35Å; F5-R7 PolarHBondContact O-N 2.69Å | ||
| 6 | R | 23.1 | Very low | 24.8 | Very low | 214 Ų | 214 | 173.6 Ų | 173.6 | 81% | 0.808 | 86% | 0.86 | S | S | * | * | trans | -66.9 | 87.6 | 174.6 | -71.6 | 176.5 | -172 | -134.6 | 2.8 | 111.1 | D4 | D4-R6 WeakPolarHBondContact OD1-CG 3.31Å; D4-R6 IonicContact OD1-NE 2.7Å; D4-R6 PolarHBondContact OD1-NE 2.74Å | ||
| 7 | R | 24.5 | Very low | 25 | Very low | 242 Ų | 242 | 174.6 Ų | 174.6 | 91% | 0.913 | 86% | 0.862 | S | S | * | * | trans | 169.5 | 68.5 | 142 | -92.1 | 161.5 | -176.4 | -163.9 | 2.4 | 113.3 | F5 | F5-R7 VanDerWaalsContact C-N 3.35Å; F5-R7 PolarHBondContact O-N 2.69Å | ||
| 8 | T | 23.7 | Very low | 25 | Very low | 130 Ų | 130 | 175.8 Ų | 175.8 | 80% | 0.798 | 86% | 0.861 | S | S | * | * | trans | -142.7 | 118.3 | 153.3 | 30.6 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 9 | P | 23.7 | Very low | 24.9 | Very low | 120 Ų | 120 | 171.6 Ų | 171.6 | 78% | 0.779 | 85% | 0.851 | S | S | * | * | -141 | 115.6 | 122.9 | 33.5 | -18.8 | 0 | 0 | 0 | 112 | |||||
| 10 | C | 25.3 | Very low | 25 | Very low | 133 Ų | 133 | 172.3 Ų | 172.3 | 90% | 0.899 | 85% | 0.852 | S | S | * | * | trans | -139.4 | 44.1 | 160.2 | -76.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 11 | Y | 24.7 | Very low | 25.1 | Very low | 214 Ų | 214 | 170.4 Ų | 170.4 | 84% | 0.839 | 85% | 0.85 | S | S | * | * | trans | -90.6 | 173 | 143.5 | -98.8 | -106.1 | 0 | 0 | 0 | 107.5 | ||||
| 12 | D | 23.3 | Very low | 24.8 | Very low | 152 Ų | 152 | 164.3 Ų | 164.3 | 81% | 0.813 | 83% | 0.831 | S | S | * | * | trans | 70.2 | 53 | 177.6 | -52.4 | -25.3 | 0 | 0 | 0 | 116.8 | ||||
| 13 | L | 24.9 | Very low | 24.8 | Very low | 162 Ų | 162 | 162.3 Ų | 162.3 | 85% | 0.848 | 82% | 0.824 | S | S | * | * | S | Bend | trans | -149.4 | 58.6 | 151.2 | -150.7 | 80.1 | 0 | 0 | 0 | 115.2 | ||
| 14 | W | 26.2 | Very low | 25.1 | Very low | 242 Ų | 242 | 162.4 Ų | 162.4 | 92% | 0.917 | 82% | 0.82 | S | S | * | * | trans | -170.1 | 79.9 | 146.8 | -96.4 | 3.3 | 0 | 0 | 0 | 111.7 | ||||
| 15 | S | 24.3 | Very low | 25.3 | Very low | 125 Ų | 125 | 164.2 Ų | 164.2 | 87% | 0.874 | 83% | 0.83 | S | S | * | * | trans | -121.4 | 70.8 | 164.3 | -79.8 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 16 | T | 28.1 | Very low | 25.3 | Very low | 115 Ų | 115 | 160.2 Ų | 160.2 | 71% | 0.706 | 82% | 0.822 | S | S | * | * | trans | -126.2 | 94.9 | 174.2 | 44.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 17 | Q | 28.2 | Very low | 25.3 | Very low | 192 Ų | 192 | 155.5 Ų | 155.5 | 90% | 0.897 | 82% | 0.822 | S | S | * | * | trans | 53 | 122.4 | 155.7 | -72.2 | 168.6 | -48.2 | 0 | 0 | 119.8 | ||||
| 18 | K | 25.4 | Very low | 25.2 | Very low | 196 Ų | 196 | 154 Ų | 154 | 85% | 0.852 | 82% | 0.817 | S | S | * | * | trans | -62.8 | 148.3 | 155.3 | -67.4 | 177 | 173.4 | -179.9 | 0 | 110.3 | ||||
| 19 | S | 24.2 | Very low | 25.2 | Very low | 96 Ų | 96 | 154.4 Ų | 154.4 | 67% | 0.671 | 82% | 0.82 | S | S | * | * | trans | 10.7 | 125.5 | 148.9 | 58.4 | 0 | 0 | 0 | 0 | 119 | ||||
| 20 | E | 25.8 | Very low | 25.2 | Very low | 184 Ų | 184 | 151 Ų | 151 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | -176.8 | 95.7 | 107.8 | -98.9 | 166.1 | -148.4 | 0 | 0 | 111.3 | |||||
| 21 | V | 27.4 | Very low | 25.2 | Very low | 133 Ų | 133 | 150.3 Ų | 150.3 | 81% | 0.806 | 80% | 0.802 | S | S | * | * | trans | -140.3 | 119.8 | 156 | 179.7 | 0 | 0 | 0 | 0 | 107 | ||||
| 22 | S | 26 | Very low | 25.3 | Very low | 115 Ų | 115 | 145.2 Ų | 145.2 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -91.6 | 112.4 | 166.8 | 53.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 23 | D | 25.8 | Very low | 25.5 | Very low | 153 Ų | 153 | 140.9 Ų | 140.9 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -149.5 | 150 | 162.3 | -108.5 | -39.7 | 0 | 0 | 0 | 110.1 | ||||
| 24 | E | 26.9 | Very low | 25.9 | Very low | 169 Ų | 169 | 142.1 Ų | 142.1 | 79% | 0.79 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -87 | 153.3 | -168.4 | -58.6 | -179 | 161.2 | 0 | 0 | 112.1 | ||
| 25 | N | 25.5 | Very low | 26.3 | Very low | 155 Ų | 155 | 135.5 Ų | 135.5 | 83% | 0.829 | 77% | 0.771 | S | S | * | * | trans | 75.5 | 48.3 | 171.8 | -48.2 | -74 | 0 | 0 | 0 | 118.3 | ||||
| 26 | V | 23.7 | Very low | 26.7 | Very low | 123 Ų | 123 | 133.1 Ų | 133.1 | 75% | 0.745 | 75% | 0.753 | S | S | * | * | trans | -126.9 | 100.1 | 156.2 | -175.7 | 0 | 0 | 0 | 0 | 111.2 | Y28 | V26-Y28 HydrophobicContact CG1-CD2 4.33Å; V26-Y28 PolarHBondContact O-N 2.66Å; V26-Y28 VanDerWaalsContact O-N 3.09Å | ||
| 27 | S | 23.3 | Very low | 27.1 | Very low | 114 Ų | 114 | 132.1 Ų | 132.1 | 80% | 0.797 | 75% | 0.75 | S | S | * | * | trans | -79.2 | 86 | 173 | 57.6 | 0 | 0 | 0 | 0 | 110.9 | V29 | S27-V29 PolarHBondContact O-N 2.72Å; S27-V29 VanDerWaalsContact O-N 3.16Å | ||
| 28 | Y | 22.1 | Very low | 27.4 | Very low | 210 Ų | 210 | 127.9 Ų | 127.9 | 82% | 0.824 | 73% | 0.733 | S | S | * | * | trans | -69.4 | 106.7 | 178.7 | -141.8 | -82.9 | 0 | 0 | 0 | 110.9 | V26 G30 | V26-Y28 HydrophobicContact CG1-CD2 4.33Å; V26-Y28 PolarHBondContact O-N 2.66Å; V26-Y28 VanDerWaalsContact O-N 3.09Å; Y28-G30 PolarHBondContact O-N 2.82Å | ||
| 29 | V | 24.1 | Very low | 28.1 | Very low | 140 Ų | 140 | 120 Ų | 120 | 85% | 0.848 | 70% | 0.703 | S | S | * | * | trans | -77.9 | 71.1 | 171.8 | -173.1 | 0 | 0 | 0 | 0 | 108.9 | S27 | S27-V29 PolarHBondContact O-N 2.72Å; S27-V29 VanDerWaalsContact O-N 3.16Å | ||
| 30 | G | 23.4 | Very low | 28.9 | Very low | 48 Ų | 48 | 121.1 Ų | 121.1 | 50% | 0.495 | 70% | 0.701 | S | S | . | * | trans | -74.1 | 127.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | Y28 A32 | Y28-G30 PolarHBondContact O-N 2.82Å; G30-A32 PolarHBondContact O-N 3.18Å; G30-A32 VanDerWaalsContact O-N 3.11Å | ||
| 31 | C | 26.3 | Very low | 29.7 | Very low | 119 Ų | 119 | 116.8 Ų | 116.8 | 80% | 0.804 | 69% | 0.689 | S | S | * | * | trans | -58.3 | 114.4 | 173 | -64.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 32 | A | 26.6 | Very low | 30.3 | Very low | 106 Ų | 106 | 112.6 Ų | 112.6 | 88% | 0.876 | 66% | 0.662 | S | S | * | * | trans | -81.8 | 133.4 | -171.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | G30 | G30-A32 PolarHBondContact O-N 3.18Å; G30-A32 VanDerWaalsContact O-N 3.11Å | ||
| 33 | G | 27.9 | Very low | 31.3 | Very low | 61 Ų | 61 | 109.4 Ų | 109.4 | 63% | 0.629 | 64% | 0.635 | S | S | * | * | trans | 90.3 | 70.2 | 155.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | I35 | G33-I35 PolarHBondContact O-N 3.44Š| ||
| 34 | Y | 31.8 | Very low | 32.3 | Very low | 188 Ų | 188 | 106 Ų | 106 | 74% | 0.737 | 62% | 0.617 | S | S | * | * | trans | -68 | 112.3 | 154 | -178.7 | -104.6 | 0 | 0 | 0 | 109 | P36 | Y34-P36 HydrophobicContact CD1-CG 3.97Å; Y34-P36 HydrophobicContact CE1-CB 4.28Å; Y34-P36 HydrophobicContact CE1-CG 3.78Å; Y34-P36 WeakPolarHBondContact O-CD 3.43Å | ||
| 35 | I | 36.1 | Very low | 33.1 | Very low | 103 Ų | 103 | 100.5 Ų | 100.5 | 53% | 0.528 | 60% | 0.601 | S | S | . | * | trans | -109.1 | 101.9 | 179.9 | -59.7 | 177.1 | 0 | 0 | 0 | 108.7 | G33 S37 L38 | G33-I35 PolarHBondContact O-N 3.44Å; I35-S37 VanDerWaalsContact C-N 3.35Å; I35-S37 PolarHBondContact O-N 2.97Å; I35-L38 HydrophobicContact CG2-CD1 4.42Å | ||
| 36 | P | 31.9 | Very low | 33.9 | Very low | 75 Ų | 75 | 93.6 Ų | 93.6 | 49% | 0.487 | 56% | 0.564 | S | S | . | * | G | 310 helix | trans | -67.2 | -32.8 | -173.9 | -18.9 | 30.1 | 0 | 0 | 0 | 113.9 | Y34 L38 C39 | Y34-P36 HydrophobicContact CD1-CG 3.97Å; Y34-P36 HydrophobicContact CE1-CB 4.28Å; Y34-P36 HydrophobicContact CE1-CG 3.78Å; Y34-P36 WeakPolarHBondContact O-CD 3.43Å; P36-L38 PolarHBondContact O-N 2.77Å; P36-C39 PolarHBondContact O-N 3.37Å |
| 37 | S | 36.6 | Very low | 35.1 | Very low | 94 Ų | 94 | 93 Ų | 93 | 66% | 0.657 | 56% | 0.556 | S | S | * | * | G | 310 helix | trans | -69.8 | -5.5 | -164.5 | 52.5 | 0 | 0 | 0 | 0 | 116.1 | I35 | I35-S37 VanDerWaalsContact C-N 3.35Å; I35-S37 PolarHBondContact O-N 2.97Å |
| 38 | L | 34.1 | Very low | 36.4 | Very low | 104 Ų | 104 | 94.7 Ų | 94.7 | 55% | 0.545 | 55% | 0.549 | S | S | . | . | G | 310 helix | trans | -104.4 | -10.3 | 178.7 | -73.4 | 168.4 | 0 | 0 | 0 | 113.7 | I35 P36 L42 | I35-L38 HydrophobicContact CG2-CD1 4.42Å; P36-L38 PolarHBondContact O-N 2.77Å; L38-L42 VanDerWaalsContact O-CB 3.23Å; L38-L42 WeakPolarHBondContact O-CB 3.29Å |
| 39 | C | 40 | Very low | 37.2 | Very low | 31 Ų | 31 | 88.6 Ų | 88.6 | 21% | 0.209 | 53% | 0.53 | C | S | . | . | H | α-helix | trans | -70.3 | -46.8 | -173.7 | -72.1 | 0 | 0 | 0 | 0 | 113 | P36 L43 | P36-C39 PolarHBondContact O-N 3.37Å; C39-L43 WeakPolarHBondContact O-CB 3.41Å; C39-L43 PolarHBondContact O-N 3.23Å |
| 40 | D | 42.5 | Very low | 38 | Very low | 119 Ų | 119 | 87 Ų | 87 | 64% | 0.636 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -73.5 | -47.9 | -167 | -54.9 | -49.9 | 0 | 0 | 0 | 115 | L42 L43 D44 | D40-L42 PolarHBondContact O-N 2.91Å; D40-L43 PolarHBondContact O-N 3.45Å; D40-D44 PolarHBondContact O-N 3.09Å |
| 41 | P | 42.1 | Very low | 38.7 | Very low | 92 Ų | 92 | 88.1 Ų | 88.1 | 60% | 0.597 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.4 | -33.4 | 179.6 | -17.8 | 31.7 | 0 | 0 | 0 | 111.8 | A45 | P41-A45 WeakPolarHBondContact O-CB 3.26Å; P41-A45 PolarHBondContact O-N 3.13Å; P41-A45 VanDerWaalsContact O-N 3.1Å |
| 42 | L | 39.4 | Very low | 38.9 | Very low | 46 Ų | 46 | 87 Ų | 87 | 24% | 0.241 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -70.9 | -45.9 | 177.5 | -173.8 | 95.1 | 0 | 0 | 0 | 111.4 | L38 D40 D44 A45 L46 I192 L245 | L38-L42 VanDerWaalsContact O-CB 3.23Å; L38-L42 WeakPolarHBondContact O-CB 3.29Å; D40-L42 PolarHBondContact O-N 2.91Å; L42-D44 VanDerWaalsContact C-N 3.31Å; L42-D44 PolarHBondContact O-N 3.16Å; L42-A45 PolarHBondContact O-N 3.47Å; L42-L46 HydrophobicContact CD2-CD1 3.69Å; L42-L46 HydrophobicContact CG-CD1 3.69Å; L42-L46 HydrophobicContact CG-CG 4.48Å; L42-L46 WeakPolarHBondContact O-CB 3.34Å; L42-L46 WeakPolarHBondContact O-CD1 3.44Å; L42-L46 VanDerWaalsContact O-CG 3.23Å; L42-L46 WeakPolarHBondContact O-CG 3.18Å; L42-L46 PolarHBondContact O-N 3.47Å; L42-I192 HydrophobicContact CD1-CD1 3.67Å; L42-I192 HydrophobicContact CD1-CG2 4.28Å; L42-I192 HydrophobicContact CD2-CD1 3.29Å; L42-I192 HydrophobicContact CD2-CG1 4.4Å; L42-I192 HydrophobicContact CG-CD1 4.03Å; L42-L245 HydrophobicContact CD2-CD2 3.96Å |
| 43 | L | 48.2 | Very low | 39.1 | Very low | 48 Ų | 48 | 85.8 Ų | 85.8 | 25% | 0.251 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.2 | -42.7 | 176.6 | 176.1 | 51.4 | 0 | 0 | 0 | 111.3 | C39 D40 L46 N47 S244 | C39-L43 WeakPolarHBondContact O-CB 3.41Å; C39-L43 PolarHBondContact O-N 3.23Å; D40-L43 PolarHBondContact O-N 3.45Å; L43-L46 PolarHBondContact O-N 2.91Å; L43-N47 WeakPolarHBondContact O-CB 3.5Å; L43-N47 PolarHBondContact O-N 2.91Å; L43-N47 PolarHBondContact O-ND2 2.94Å; L43-S244 WeakPolarHBondContact CD1-OG 3.48Å |
| 44 | D | 46.6 | Very low | 39 | Very low | 80 Ų | 80 | 88.9 Ų | 88.9 | 43% | 0.428 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.6 | -45.7 | 173.6 | 177 | 50.4 | 0 | 0 | 0 | 112.3 | D40 L42 L46 N47 K48 | D40-D44 PolarHBondContact O-N 3.09Å; L42-D44 VanDerWaalsContact C-N 3.31Å; L42-D44 PolarHBondContact O-N 3.16Å; D44-L46 VanDerWaalsContact C-N 3.29Å; D44-L46 PolarHBondContact O-N 3.26Å; D44-N47 PolarHBondContact O-N 2.88Å; D44-K48 VanDerWaalsContact CG-NZ 3.28Å; D44-K48 WeakPolarHBondContact O-CD 3.1Å; D44-K48 VanDerWaalsContact O-CG 3.31Å; D44-K48 WeakPolarHBondContact O-CG 3.26Å; D44-K48 PolarHBondContact O-N 2.77Å; D44-K48 VanDerWaalsContact O-N 3.17Å; D44-K48 WeakPolarHBondContact OD1-CE 3.35Å; D44-K48 IonicContact OD1-NZ 3.34Å; D44-K48 PolarHBondContact OD1-NZ 3.09Å; D44-K48 WeakPolarHBondContact OD2-CE 3.43Å; D44-K48 IonicContact OD2-NZ 3.3Å; D44-K48 PolarHBondContact OD2-NZ 3.43Å |
| 45 | A | 43.2 | Very low | 38.7 | Very low | 54 Ų | 54 | 83.7 Ų | 83.7 | 45% | 0.446 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.8 | -35.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | P41 L42 | P41-A45 WeakPolarHBondContact O-CB 3.26Å; P41-A45 PolarHBondContact O-N 3.13Å; P41-A45 VanDerWaalsContact O-N 3.1Å; L42-A45 PolarHBondContact O-N 3.47Å |
| 46 | L | 41.6 | Very low | 38.3 | Very low | 11 Ų | 11 | 84.9 Ų | 84.9 | 6% | 0.058 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -78.3 | -37.1 | 179.5 | -70.6 | 160.6 | 0 | 0 | 0 | 112.5 | L42 L43 D44 K48 L49 I192 L196 L245 I248 | L42-L46 HydrophobicContact CD2-CD1 3.69Å; L42-L46 HydrophobicContact CG-CD1 3.69Å; L42-L46 HydrophobicContact CG-CG 4.48Å; L42-L46 WeakPolarHBondContact O-CB 3.34Å; L42-L46 WeakPolarHBondContact O-CD1 3.44Å; L42-L46 VanDerWaalsContact O-CG 3.23Å; L42-L46 WeakPolarHBondContact O-CG 3.18Å; L42-L46 PolarHBondContact O-N 3.47Å; L43-L46 PolarHBondContact O-N 2.91Å; D44-L46 VanDerWaalsContact C-N 3.29Å; D44-L46 PolarHBondContact O-N 3.26Å; L46-K48 PolarHBondContact O-N 3.13Å; L46-L49 HydrophobicContact CD2-CD1 4.37Å; L46-L49 WeakPolarHBondContact O-CB 3.34Å; L46-L49 PolarHBondContact O-N 2.91Å; L46-L49 VanDerWaalsContact O-N 3.14Å; L46-I192 HydrophobicContact CD2-CG2 4.32Å; L46-L196 HydrophobicContact CD2-CD2 3.96Å; L46-L245 HydrophobicContact CD1-CD2 3.85Å; L46-I248 HydrophobicContact CB-CD1 3.92Å; L46-I248 HydrophobicContact CD1-CD1 3.62Å; L46-I248 HydrophobicContact CD2-CD1 3.86Å; L46-I248 HydrophobicContact CG-CD1 4Å |
| 47 | N | 49.8 | Very low | 37.9 | Very low | 110 Ų | 110 | 87.5 Ų | 87.5 | 59% | 0.588 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.8 | -34.4 | 173.3 | -73.8 | -27.3 | 0 | 0 | 0 | 111.6 | L43 D44 L49 S50 | L43-N47 WeakPolarHBondContact O-CB 3.5Å; L43-N47 PolarHBondContact O-N 2.91Å; L43-N47 PolarHBondContact O-ND2 2.94Å; D44-N47 PolarHBondContact O-N 2.88Å; N47-L49 PolarHBondContact O-N 3.49Å; N47-S50 PolarHBondContact O-N 3.25Å |
| 48 | K | 50.4 | Low | 37.4 | Very low | 149 Ų | 149 | 94.6 Ų | 94.6 | 65% | 0.648 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.7 | -14.5 | 175.6 | -73.5 | 163.3 | 180 | 169.1 | 0 | 114.4 | D44 L46 S50 | D44-K48 VanDerWaalsContact CG-NZ 3.28Å; D44-K48 WeakPolarHBondContact O-CD 3.1Å; D44-K48 VanDerWaalsContact O-CG 3.31Å; D44-K48 WeakPolarHBondContact O-CG 3.26Å; D44-K48 PolarHBondContact O-N 2.77Å; D44-K48 VanDerWaalsContact O-N 3.17Å; D44-K48 WeakPolarHBondContact OD1-CE 3.35Å; D44-K48 IonicContact OD1-NZ 3.34Å; D44-K48 PolarHBondContact OD1-NZ 3.09Å; D44-K48 WeakPolarHBondContact OD2-CE 3.43Å; D44-K48 IonicContact OD2-NZ 3.3Å; D44-K48 PolarHBondContact OD2-NZ 3.43Å; L46-K48 PolarHBondContact O-N 3.13Å; K48-S50 VanDerWaalsContact C-N 3.31Å |
| 49 | L | 39 | Very low | 37.1 | Very low | 82 Ų | 82 | 97.7 Ų | 97.7 | 43% | 0.429 | 55% | 0.547 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 4.2 | 176.1 | -65.6 | 170.4 | 0 | 0 | 0 | 114.3 | L46 N47 I51 L196 | L46-L49 HydrophobicContact CD2-CD1 4.37Å; L46-L49 WeakPolarHBondContact O-CB 3.34Å; L46-L49 PolarHBondContact O-N 2.91Å; L46-L49 VanDerWaalsContact O-N 3.14Å; N47-L49 PolarHBondContact O-N 3.49Å; L49-I51 HydrophobicContact CB-CD1 4.39Å; L49-I51 HydrophobicContact CB-CG1 4.17Å; L49-I51 PolarHBondContact O-N 3.35Å; L49-L196 HydrophobicContact CD1-CD2 3.33Å |
| 50 | S | 40.4 | Very low | 36.4 | Very low | 106 Ų | 106 | 102.6 Ų | 102.6 | 74% | 0.741 | 58% | 0.581 | S | S | * | * | trans | 49.2 | 32.7 | 172.4 | 70.6 | 0 | 0 | 0 | 0 | 116.2 | N47 K48 S52 | N47-S50 PolarHBondContact O-N 3.25Å; K48-S50 VanDerWaalsContact C-N 3.31Å; S50-S52 PolarHBondContact O-N 2.93Å | ||
| 51 | I | 39.1 | Very low | 35.4 | Very low | 73 Ų | 73 | 100 Ų | 100 | 37% | 0.374 | 58% | 0.582 | S | S | . | * | trans | -72.2 | 73.6 | 176.3 | -49.5 | 179.3 | 0 | 0 | 0 | 109.8 | L49 L199 | L49-I51 HydrophobicContact CB-CD1 4.39Å; L49-I51 HydrophobicContact CB-CG1 4.17Å; L49-I51 PolarHBondContact O-N 3.35Å; I51-L199 HydrophobicContact CD1-CD1 3.98Å | ||
| 52 | S | 30.5 | Very low | 34.7 | Very low | 96 Ų | 96 | 101.1 Ų | 101.1 | 67% | 0.671 | 58% | 0.583 | S | S | * | * | trans | -66.2 | 125.8 | 176.2 | -172.1 | 0 | 0 | 0 | 0 | 109.9 | S50 V54 | S50-S52 PolarHBondContact O-N 2.93Å; S52-V54 PolarHBondContact O-N 3.02Å | ||
| 53 | P | 29.3 | Very low | 34 | Very low | 80 Ų | 80 | 102.3 Ų | 102.3 | 52% | 0.519 | 61% | 0.605 | S | S | . | * | trans | -73.9 | 91.2 | 179.1 | 30.2 | -33.8 | 0 | 0 | 0 | 109.8 | S55 | P53-S55 PolarHBondContact O-N 3.24Å; P53-S55 VanDerWaalsContact O-N 3.11Å | ||
| 54 | V | 26.9 | Very low | 32.8 | Very low | 125 Ų | 125 | 109.2 Ų | 109.2 | 76% | 0.758 | 63% | 0.63 | S | S | * | * | trans | -58.3 | 115.3 | 167.8 | -179.1 | 0 | 0 | 0 | 0 | 108.3 | S52 | S52-V54 PolarHBondContact O-N 3.02Š| ||
| 55 | S | 24.4 | Very low | 31.8 | Very low | 79 Ų | 79 | 114.3 Ų | 114.3 | 55% | 0.552 | 65% | 0.651 | S | S | * | * | trans | -53.7 | 144.9 | 179.6 | -59.7 | 0 | 0 | 0 | 0 | 111.5 | P53 D57 | P53-S55 PolarHBondContact O-N 3.24Å; P53-S55 VanDerWaalsContact O-N 3.11Å; S55-D57 PolarHBondContact O-N 3.03Å | ||
| 56 | P | 27.6 | Very low | 30.9 | Very low | 129 Ų | 129 | 118 Ų | 118 | 84% | 0.838 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -71.5 | 23.8 | 178.1 | 31.6 | -36 | 0 | 0 | 0 | 114.2 | R58 | P56-R58 PolarHBondContact O-N 3.33Š|
| 57 | D | 24.9 | Very low | 30 | Very low | 130 Ų | 130 | 120.7 Ų | 120.7 | 70% | 0.695 | 70% | 0.698 | S | S | * | * | trans | -94.6 | 68.6 | -177.1 | -70.4 | -57.2 | 0 | 0 | 0 | 112.1 | S55 | S55-D57 PolarHBondContact O-N 3.03Š| ||
| 58 | R | 24.6 | Very low | 28.8 | Very low | 242 Ų | 242 | 123 Ų | 123 | 91% | 0.913 | 71% | 0.71 | S | S | * | * | trans | 174.8 | 71.8 | 151.1 | -95.7 | 154 | -169.1 | -135.6 | 2.6 | 112.3 | P56 | P56-R58 PolarHBondContact O-N 3.33Š| ||
| 59 | L | 27.7 | Very low | 27.5 | Very low | 169 Ų | 169 | 123.2 Ų | 123.2 | 89% | 0.885 | 72% | 0.718 | S | S | * | * | trans | -122.9 | 22.2 | 160.1 | -91.6 | 171.7 | 0 | 0 | 0 | 113.9 | G61 | L59-G61 VanDerWaalsContact C-N 3.34Å; L59-G61 PolarHBondContact O-N 3.19Å; L59-G61 VanDerWaalsContact O-N 3.11Å | ||
| 60 | S | 25.4 | Very low | 26.8 | Very low | 134 Ų | 134 | 127 Ų | 127 | 94% | 0.937 | 74% | 0.738 | S | S | * | * | trans | -75.2 | 87 | 156.8 | -61.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 61 | G | 23.4 | Very low | 26.1 | Very low | 64 Ų | 64 | 128.1 Ų | 128.1 | 66% | 0.66 | 74% | 0.74 | S | S | * | * | trans | -167.1 | 30.3 | -165.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | L59 | L59-G61 VanDerWaalsContact C-N 3.34Å; L59-G61 PolarHBondContact O-N 3.19Å; L59-G61 VanDerWaalsContact O-N 3.11Å | ||
| 62 | I | 27.1 | Very low | 25.4 | Very low | 117 Ų | 117 | 130.1 Ų | 130.1 | 60% | 0.6 | 76% | 0.758 | S | S | * | * | trans | -132.3 | 90.8 | 164.1 | -52.1 | -180 | 0 | 0 | 0 | 107.9 | Y64 | I62-Y64 HydrophobicContact CG2-CD2 4.01Å; I62-Y64 HydrophobicContact CG2-CE2 3.94Å | ||
| 63 | G | 23.3 | Very low | 24.9 | Very low | 70 Ų | 70 | 131.7 Ų | 131.7 | 72% | 0.722 | 76% | 0.763 | S | S | * | * | trans | -91.5 | 113.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 64 | Y | 23.5 | Very low | 24.7 | Very low | 193 Ų | 193 | 134.3 Ų | 134.3 | 76% | 0.757 | 78% | 0.777 | S | S | * | * | trans | -140.2 | 107.8 | 155.2 | -63.3 | -73.1 | 0 | 0 | 0 | 107.3 | I62 | I62-Y64 HydrophobicContact CG2-CD2 4.01Å; I62-Y64 HydrophobicContact CG2-CE2 3.94Å | ||
| 65 | H | 25.8 | Very low | 24.5 | Very low | 188 Ų | 188 | 139 Ų | 139 | 87% | 0.87 | 78% | 0.781 | S | S | * | * | trans | -176 | 131.9 | 132.1 | -92.6 | -63.5 | 0 | 0 | 0 | 109.3 | ||||
| 66 | T | 24.2 | Very low | 24.6 | Very low | 132 Ų | 132 | 141.1 Ų | 141.1 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | trans | -50.9 | 139.5 | 176.2 | 43.7 | 0 | 0 | 0 | 0 | 116 | ||||
| 67 | G | 21.9 | Very low | 24.5 | Very low | 66 Ų | 66 | 140.2 Ų | 140.2 | 68% | 0.68 | 78% | 0.78 | S | S | * | * | trans | 70 | 129.1 | 163.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 68 | D | 24.9 | Very low | 24.5 | Very low | 159 Ų | 159 | 140 Ų | 140 | 85% | 0.85 | 78% | 0.779 | S | S | * | * | cis | -158.9 | -175.2 | 34.8 | -88 | -32.9 | 0 | 0 | 0 | 112.4 | ||||
| 69 | N | 23.6 | Very low | 24.7 | Very low | 154 Ų | 154 | 133.2 Ų | 133.2 | 82% | 0.824 | 77% | 0.769 | S | S | * | * | trans | -71.6 | 122.5 | -172.5 | -56.7 | -78.4 | 0 | 0 | 0 | 114.6 | ||||
| 70 | I | 25.4 | Very low | 24.6 | Very low | 162 Ų | 162 | 133.6 Ų | 133.6 | 83% | 0.831 | 77% | 0.766 | S | S | * | * | trans | -138.9 | 127.2 | 141 | -76.1 | 100.8 | 0 | 0 | 0 | 108.9 | ||||
| 71 | T | 24.8 | Very low | 24.7 | Very low | 128 Ų | 128 | 132.7 Ų | 132.7 | 79% | 0.785 | 76% | 0.755 | S | S | * | * | trans | -95.9 | 136.3 | 168.3 | 42 | 0 | 0 | 0 | 0 | 111 | ||||
| 72 | P | 24 | Very low | 24.9 | Very low | 116 Ų | 116 | 140.7 Ų | 140.7 | 75% | 0.753 | 77% | 0.765 | S | S | * | * | trans | -104.1 | 108.1 | 165.4 | 32 | -23.5 | 0 | 0 | 0 | 111.2 | ||||
| 73 | V | 21.1 | Very low | 24.6 | Very low | 128 Ų | 128 | 145 Ų | 145 | 78% | 0.776 | 78% | 0.775 | S | S | * | * | trans | -70.8 | 126 | 165.5 | 170.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 74 | V | 25 | Very low | 24.8 | Very low | 135 Ų | 135 | 147.6 Ų | 147.6 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -133 | 134 | 161.2 | -176.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 75 | R | 22.7 | Very low | 24.8 | Very low | 224 Ų | 224 | 147.2 Ų | 147.2 | 85% | 0.845 | 78% | 0.782 | S | S | * | * | trans | -89.8 | 144 | 179.7 | -59.9 | 173.3 | 178.2 | 170.4 | -2.4 | 110.2 | ||||
| 76 | N | 25 | Very low | 25 | Very low | 123 Ų | 123 | 147.9 Ų | 147.9 | 66% | 0.658 | 79% | 0.785 | S | S | * | * | trans | -79.3 | 153.6 | 151.4 | -159.1 | 38.2 | 0 | 0 | 0 | 108.2 | D78 | N76-D78 PolarHBondContact ND2-N 2.9Å; N76-D78 PolarHBondContact ND2-OD1 3.07Å | ||
| 77 | P | 27.1 | Very low | 25 | Very low | 111 Ų | 111 | 146.9 Ų | 146.9 | 72% | 0.721 | 78% | 0.783 | S | S | * | * | -145.9 | 134.1 | 95.3 | 35.7 | -18.8 | 0 | 0 | 0 | 116 | |||||
| 78 | D | 23.7 | Very low | 25.2 | Very low | 125 Ų | 125 | 153.8 Ų | 153.8 | 67% | 0.668 | 80% | 0.795 | S | S | * | * | trans | 26.7 | 128.3 | 132.4 | -47.6 | -38.9 | 0 | 0 | 0 | 121.4 | N76 | N76-D78 PolarHBondContact ND2-N 2.9Å; N76-D78 PolarHBondContact ND2-OD1 3.07Å | ||
| 79 | S | 28.6 | Very low | 25.1 | Very low | 100 Ų | 100 | 151.8 Ų | 151.8 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | -167.8 | 114 | 118.7 | 21.3 | 0 | 0 | 0 | 0 | 114 | |||||
| 80 | H | 26.7 | Very low | 25.4 | Very low | 176 Ų | 176 | 150.7 Ų | 150.7 | 82% | 0.815 | 79% | 0.792 | S | S | * | * | trans | 62.3 | 145.4 | 144.9 | -54.2 | -49.4 | 0 | 0 | 0 | 120.2 | ||||
| 81 | T | 27.3 | Very low | 25.3 | Very low | 115 Ų | 115 | 151.4 Ų | 151.4 | 71% | 0.706 | 79% | 0.792 | S | S | * | * | cis | -154.3 | 147.7 | 8.9 | -13.4 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 82 | R | 26.4 | Very low | 25.3 | Very low | 232 Ų | 232 | 151.4 Ų | 151.4 | 88% | 0.875 | 79% | 0.786 | S | S | * | * | trans | 71 | 111.6 | 140.9 | -152.9 | 165 | -72 | -176 | -0.5 | 121.3 | ||||
| 83 | Y | 20.8 | Very low | 25.4 | Very low | 207 Ų | 207 | 152.5 Ų | 152.5 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | trans | -65.3 | 175.9 | 161.6 | -78.1 | -70.4 | 0 | 0 | 0 | 113.5 | ||||
| 84 | P | 29.1 | Very low | 25.4 | Very low | 126 Ų | 126 | 155.6 Ų | 155.6 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | cis | -144 | -172.7 | 30 | 43.8 | -22.4 | 0 | 0 | 0 | 119.2 | ||||
| 85 | K | 23.6 | Very low | 25.4 | Very low | 184 Ų | 184 | 157 Ų | 157 | 80% | 0.8 | 79% | 0.792 | S | S | * | * | trans | -83.4 | 150 | 178.6 | -47.7 | 165.7 | -177.6 | 173.8 | 0 | 111.3 | ||||
| 86 | E | 28.4 | Very low | 25.4 | Very low | 203 Ų | 203 | 150.1 Ų | 150.1 | 95% | 0.949 | 78% | 0.784 | S | S | * | * | trans | -137 | 169.4 | 145.3 | -78.2 | -152 | 157.2 | 0 | 0 | 110.4 | ||||
| 87 | S | 24.1 | Very low | 25.4 | Very low | 110 Ų | 110 | 151.5 Ų | 151.5 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | trans | -114 | 155.4 | -165.9 | 56.6 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 88 | K | 27.2 | Very low | 25.1 | Very low | 211 Ų | 211 | 156.5 Ų | 156.5 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | trans | -164.2 | 128.6 | 140.8 | -105.7 | 148.3 | -170.5 | 171.4 | 0 | 110.5 | ||||
| 89 | S | 22.6 | Very low | 25.1 | Very low | 118 Ų | 118 | 157.6 Ų | 157.6 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -129.9 | 143.2 | 162.6 | 54.2 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 90 | T | 29.7 | Very low | 25 | Very low | 130 Ų | 130 | 159.9 Ų | 159.9 | 80% | 0.798 | 81% | 0.81 | S | S | * | * | trans | -138.5 | 125.4 | 176.1 | 44.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 91 | H | 23.6 | Very low | 25 | Very low | 177 Ų | 177 | 155.7 Ų | 155.7 | 82% | 0.819 | 80% | 0.798 | S | S | * | * | trans | -63.6 | 160.1 | 155.6 | -90.2 | -136.8 | 0 | 0 | 0 | 110.1 | ||||
| 92 | L | 25.1 | Very low | 24.8 | Very low | 128 Ų | 128 | 159.9 Ų | 159.9 | 67% | 0.67 | 81% | 0.807 | S | S | * | * | cis | -112.5 | -157.5 | 1.1 | -118.8 | 166.3 | 0 | 0 | 0 | 107.9 | ||||
| 93 | D | 25.4 | Very low | 24.6 | Very low | 139 Ų | 139 | 152.4 Ų | 152.4 | 74% | 0.743 | 80% | 0.803 | S | S | * | * | cis | -136.5 | 167.4 | 16.6 | -99.9 | -61.1 | 0 | 0 | 0 | 113.5 | ||||
| 94 | F | 22 | Very low | 24.8 | Very low | 193 Ų | 193 | 149.5 Ų | 149.5 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | trans | -133.5 | 126.2 | 164.5 | -117.9 | -93.5 | 0 | 0 | 0 | 106.6 | ||||
| 95 | D | 25.5 | Very low | 24.6 | Very low | 164 Ų | 164 | 148.3 Ų | 148.3 | 88% | 0.877 | 80% | 0.801 | S | S | * | * | trans | -137.6 | 141.2 | 165.2 | -143.3 | -21.9 | 0 | 0 | 0 | 111.2 | ||||
| 96 | A | 22 | Very low | 24.7 | Very low | 81 Ų | 81 | 145 Ų | 145 | 67% | 0.669 | 80% | 0.798 | S | S | * | * | trans | -132.3 | 88.3 | -159.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 97 | V | 24.8 | Very low | 24.4 | Very low | 151 Ų | 151 | 141.4 Ų | 141.4 | 92% | 0.915 | 79% | 0.785 | S | S | * | * | trans | -83.1 | 125.2 | 167.7 | -177 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 98 | R | 21.4 | Very low | 24.5 | Very low | 216 Ų | 216 | 146.1 Ų | 146.1 | 82% | 0.815 | 79% | 0.788 | S | S | * | * | trans | -119.4 | 147.7 | -170.6 | -151.3 | -175 | -160.6 | -136 | 8.9 | 109.4 | ||||
| 99 | L | 23.8 | Very low | 24.4 | Very low | 148 Ų | 148 | 144.2 Ų | 144.2 | 78% | 0.775 | 78% | 0.784 | S | S | * | * | trans | 71.5 | 138.6 | 178.5 | -44.3 | 170 | 0 | 0 | 0 | 111.9 | ||||
| 100 | N | 25.1 | Very low | 24.4 | Very low | 148 Ų | 148 | 146.4 Ų | 146.4 | 79% | 0.791 | 78% | 0.781 | S | S | * | * | cis | -148.6 | 141.3 | 45 | -162.8 | 31 | 0 | 0 | 0 | 112.2 | ||||
| 101 | P | 26.7 | Very low | 24.3 | Very low | 88 Ų | 88 | 146.2 Ų | 146.2 | 57% | 0.571 | 78% | 0.78 | S | S | * | * | trans | -82.8 | 159.3 | 169.5 | 34.7 | -35.3 | 0 | 0 | 0 | 112.4 | ||||
| 102 | F | 22.9 | Very low | 24.4 | Very low | 203 Ų | 203 | 145.3 Ų | 145.3 | 89% | 0.89 | 77% | 0.774 | S | S | * | * | trans | 58.5 | 93.2 | 179.8 | -64 | -81.8 | 0 | 0 | 0 | 115.6 | ||||
| 103 | G | 23.4 | Very low | 24.4 | Very low | 76 Ų | 76 | 147.3 Ų | 147.3 | 78% | 0.784 | 78% | 0.78 | S | S | * | * | trans | -147.8 | 65 | 172 | 0 | 0 | 0 | 0 | 0 | 111.3 | S105 | G103-S105 PolarHBondContact O-N 3.22Š| ||
| 104 | V | 24.3 | Very low | 24.5 | Very low | 146 Ų | 146 | 148.7 Ų | 148.7 | 89% | 0.885 | 79% | 0.788 | S | S | * | * | trans | -81.5 | 101.4 | 175.2 | -178.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 105 | S | 24 | Very low | 24.6 | Very low | 101 Ų | 101 | 146.7 Ų | 146.7 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | trans | -106 | 128.3 | 167.6 | -169.5 | 0 | 0 | 0 | 0 | 109.3 | G103 N107 | G103-S105 PolarHBondContact O-N 3.22Å; S105-N107 PolarHBondContact O-N 2.71Å | ||
| 106 | P | 26 | Very low | 24.7 | Very low | 115 Ų | 115 | 143.9 Ų | 143.9 | 75% | 0.747 | 78% | 0.777 | S | S | * | * | trans | -84.2 | 95.2 | -174.5 | 32.8 | -33.1 | 0 | 0 | 0 | 111 | ||||
| 107 | N | 23.6 | Very low | 24.8 | Very low | 126 Ų | 126 | 144.3 Ų | 144.3 | 67% | 0.674 | 79% | 0.789 | S | S | * | * | trans | -152.6 | 67.9 | 170.1 | -99 | -16.5 | 0 | 0 | 0 | 111.9 | S105 | S105-N107 PolarHBondContact O-N 2.71Š| ||
| 108 | Y | 24.6 | Very low | 24.9 | Very low | 210 Ų | 210 | 142.6 Ų | 142.6 | 82% | 0.824 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -138 | 47.4 | 172 | -159.9 | -100.7 | 0 | 0 | 0 | 111.8 | ||
| 109 | M | 25.7 | Very low | 25.2 | Very low | 171 Ų | 171 | 136 Ų | 136 | 84% | 0.842 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -138.4 | -12.6 | 171.8 | -80.2 | -64.8 | 151.3 | 0 | 0 | 114.3 | T111 | M109-T111 PolarHBondContact O-N 3.31Š|
| 110 | E | 23.5 | Very low | 25.3 | Very low | 163 Ų | 163 | 137.9 Ų | 137.9 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | 35.7 | -172 | -83 | -173.4 | 159.4 | 0 | 0 | 115 | ||
| 111 | T | 26.4 | Very low | 25.5 | Very low | 127 Ų | 127 | 138.8 Ų | 138.8 | 78% | 0.779 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.8 | 12.6 | -177.9 | -16.5 | 0 | 0 | 0 | 0 | 116 | M109 | M109-T111 PolarHBondContact O-N 3.31Š|
| 112 | F | 25.7 | Very low | 25.3 | Very low | 157 Ų | 157 | 140.2 Ų | 140.2 | 69% | 0.689 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -119.9 | -9.6 | -179.7 | -99.3 | -80.7 | 0 | 0 | 0 | 116 | N114 | F112-N114 VanDerWaalsContact C-N 3.33Å; F112-N114 PolarHBondContact O-N 3.4Å |
| 113 | E | 25.3 | Very low | 25.3 | Very low | 171 Ų | 171 | 139.3 Ų | 139.3 | 80% | 0.799 | 80% | 0.797 | S | S | * | * | G | 310 helix | trans | -74.1 | -19.1 | -174.6 | -61.8 | -168.1 | 130.4 | 0 | 0 | 114.4 | L115 | E113-L115 PolarHBondContact O-N 3.38Š|
| 114 | N | 27.2 | Very low | 25.5 | Very low | 168 Ų | 168 | 140.9 Ų | 140.9 | 90% | 0.898 | 80% | 0.796 | S | S | * | * | G | 310 helix | trans | -90.6 | 16.3 | -174.8 | -72.8 | -45.9 | 0 | 0 | 0 | 115.4 | F112 | F112-N114 VanDerWaalsContact C-N 3.33Å; F112-N114 PolarHBondContact O-N 3.4Å |
| 115 | L | 24.9 | Very low | 25.4 | Very low | 150 Ų | 150 | 143.4 Ų | 143.4 | 79% | 0.785 | 80% | 0.798 | S | S | * | * | G | 310 helix | trans | -127.8 | 4.6 | -178.6 | -86.4 | 166.6 | 0 | 0 | 0 | 115.6 | E113 | E113-L115 PolarHBondContact O-N 3.38Š|
| 116 | C | 26.7 | Very low | 25.5 | Very low | 106 Ų | 106 | 146.6 Ų | 146.6 | 72% | 0.716 | 81% | 0.805 | S | S | * | * | trans | -125.8 | 87.5 | 173.6 | -71.7 | 0 | 0 | 0 | 0 | 111.3 | C118 | C116-C118 PolarHBondContact O-N 3.46Š| ||
| 117 | G | 24 | Very low | 25.3 | Very low | 89 Ų | 89 | 152.4 Ų | 152.4 | 92% | 0.918 | 81% | 0.812 | S | S | * | * | trans | -72.4 | 66.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 118 | C | 28.8 | Very low | 25.2 | Very low | 115 Ų | 115 | 154.5 Ų | 154.5 | 78% | 0.777 | 82% | 0.823 | S | S | * | * | trans | -119.4 | 99.8 | 171.2 | -67.7 | 0 | 0 | 0 | 0 | 109 | C116 | C116-C118 PolarHBondContact O-N 3.46Š| ||
| 119 | G | 27.1 | Very low | 25.2 | Very low | 78 Ų | 78 | 150.1 Ų | 150.1 | 80% | 0.804 | 82% | 0.82 | S | S | * | * | trans | -68.8 | 144.4 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | N121 | G119-N121 PolarHBondContact O-N 3.19Š| ||
| 120 | H | 25.1 | Very low | 25 | Very low | 187 Ų | 187 | 153.2 Ų | 153.2 | 87% | 0.866 | 82% | 0.822 | S | S | * | * | trans | -66.3 | 129.7 | 164.9 | -71.8 | -116.6 | 0 | 0 | 0 | 109.7 | ||||
| 121 | N | 28.9 | Very low | 25.1 | Very low | 168 Ų | 168 | 151 Ų | 151 | 90% | 0.898 | 83% | 0.825 | S | S | * | * | trans | -141 | 138.6 | 156.9 | -103.1 | -27.8 | 0 | 0 | 0 | 108.8 | G119 | G119-N121 PolarHBondContact O-N 3.19Š| ||
| 122 | T | 23.8 | Very low | 24.9 | Very low | 118 Ų | 118 | 151.7 Ų | 151.7 | 72% | 0.724 | 82% | 0.824 | S | S | * | * | trans | -108.7 | 167.7 | -176.8 | 50.2 | 0 | 0 | 0 | 0 | 111 | ||||
| 123 | Q | 22.5 | Very low | 24.8 | Very low | 183 Ų | 183 | 151.3 Ų | 151.3 | 86% | 0.855 | 83% | 0.829 | S | S | * | * | trans | 76.2 | 99 | 168.4 | -52.9 | -178.3 | -6.8 | 0 | 0 | 118.7 | ||||
| 124 | S | 27.7 | Very low | 24.7 | Very low | 110 Ų | 110 | 150.4 Ų | 150.4 | 77% | 0.769 | 83% | 0.828 | S | S | * | * | trans | 179.5 | 109.2 | 132.9 | 25.9 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 125 | E | 21.7 | Very low | 24.5 | Very low | 198 Ų | 198 | 150.8 Ų | 150.8 | 93% | 0.925 | 82% | 0.822 | S | S | * | * | 54.9 | 76.6 | 80.3 | -70.8 | -144.6 | 121.7 | 0 | 0 | 114.9 | |||||
| 126 | I | 26.7 | Very low | 24.3 | Very low | 168 Ų | 168 | 149.3 Ų | 149.3 | 86% | 0.862 | 82% | 0.824 | S | S | * | * | trans | -130.6 | 138.4 | 154.9 | -60.6 | -176.4 | 0 | 0 | 0 | 108.6 | ||||
| 127 | R | 22 | Very low | 24.2 | Very low | 237 Ų | 237 | 151.7 Ų | 151.7 | 89% | 0.894 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 142.3 | -172.1 | -66.1 | 176 | 175.8 | 169.9 | -2.3 | 113 | ||
| 128 | L | 20.7 | Very low | 24.1 | Very low | 171 Ų | 171 | 152.4 Ų | 152.4 | 90% | 0.895 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 129.1 | 158.1 | -70.7 | 167.2 | 0 | 0 | 0 | 110.4 | ||
| 129 | P | 24.8 | Very low | 23.8 | Very low | 117 Ų | 117 | 153.1 Ų | 153.1 | 76% | 0.76 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 149.2 | 156.2 | 33.8 | -30.3 | 0 | 0 | 0 | 110.6 | ||
| 130 | R | 21.7 | Very low | 23.6 | Very low | 237 Ų | 237 | 156 Ų | 156 | 89% | 0.894 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -86.7 | 148.6 | 161.8 | -72.2 | -179.2 | 169.2 | 96.5 | -5.1 | 109.2 | ||
| 131 | S | 25.8 | Very low | 23.4 | Very low | 117 Ų | 117 | 153.4 Ų | 153.4 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | trans | -148.9 | 112 | 162.4 | 57.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 132 | D | 22.2 | Very low | 23.2 | Very low | 140 Ų | 140 | 150.1 Ų | 150.1 | 75% | 0.749 | 81% | 0.807 | S | S | * | * | trans | -76.3 | 152.2 | 172.9 | -57.5 | -80.4 | 0 | 0 | 0 | 111.1 | ||||
| 133 | N | 24 | Very low | 23.2 | Very low | 150 Ų | 150 | 147 Ų | 147 | 80% | 0.802 | 80% | 0.798 | S | S | * | * | trans | 40.9 | 99.4 | 158 | -62 | -29.7 | 0 | 0 | 0 | 119.2 | ||||
| 134 | I | 22.5 | Very low | 23.2 | Very low | 152 Ų | 152 | 146.3 Ų | 146.3 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | -166.7 | 119.2 | 126.1 | -94.2 | 144.6 | 0 | 0 | 0 | 107.8 | |||||
| 135 | F | 22.7 | Very low | 23.2 | Very low | 176 Ų | 176 | 147 Ų | 147 | 77% | 0.772 | 80% | 0.8 | S | S | * | * | trans | 170.2 | 107.8 | 134.3 | -100.2 | -64.3 | 0 | 0 | 0 | 110.5 | H137 | F135-H137 AromaticContact CD1-CD2 3.64Å; F135-H137 AromaticContact CD1-NE2 3.24Å; F135-H137 WeakPolarHBondContact CD1-NE2 3.1Å; F135-H137 AromaticContact CE1-NE2 3.59Å | ||
| 136 | S | 21.1 | Very low | 23.5 | Very low | 118 Ų | 118 | 145 Ų | 145 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | -93.8 | 112.1 | 169.9 | 53.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 137 | H | 24.5 | Very low | 23.6 | Very low | 157 Ų | 157 | 142.9 Ų | 142.9 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | trans | -125.3 | 130.8 | 171.7 | -79.7 | -72.6 | 0 | 0 | 0 | 112 | F135 | F135-H137 AromaticContact CD1-CD2 3.64Å; F135-H137 AromaticContact CD1-NE2 3.24Å; F135-H137 WeakPolarHBondContact CD1-NE2 3.1Å; F135-H137 AromaticContact CE1-NE2 3.59Å | ||
| 138 | S | 21.2 | Very low | 23.8 | Very low | 104 Ų | 104 | 134 Ų | 134 | 73% | 0.727 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 156.1 | 177.6 | -55 | 0 | 0 | 0 | 0 | 112.1 | V140 | S138-V140 PolarHBondContact O-N 3.44Š|
| 139 | P | 22.7 | Very low | 24.1 | Very low | 130 Ų | 130 | 133.6 Ų | 133.6 | 84% | 0.844 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 118.3 | 177.3 | 25.8 | -34.7 | 0 | 0 | 0 | 111.3 | ||
| 140 | V | 23.1 | Very low | 24.2 | Very low | 138 Ų | 138 | 132.6 Ų | 132.6 | 84% | 0.836 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 129.1 | 177.5 | 178.4 | 0 | 0 | 0 | 0 | 110 | S138 C142 | S138-V140 PolarHBondContact O-N 3.44Å; V140-C142 PolarHBondContact O-N 2.87Å |
| 141 | T | 22.1 | Very low | 24.3 | Very low | 133 Ų | 133 | 127.7 Ų | 127.7 | 82% | 0.816 | 73% | 0.731 | S | S | * | * | trans | -69.8 | 111.8 | 177.4 | 49.8 | 0 | 0 | 0 | 0 | 110.9 | G143 | T141-G143 PolarHBondContact O-N 3.41Š| ||
| 142 | C | 24.2 | Very low | 24.5 | Very low | 99 Ų | 99 | 124.3 Ų | 124.3 | 67% | 0.669 | 70% | 0.704 | S | S | * | * | trans | -71.1 | 94.9 | 177.7 | -177.6 | 0 | 0 | 0 | 0 | 111.4 | V140 | V140-C142 PolarHBondContact O-N 2.87Š| ||
| 143 | G | 23.4 | Very low | 25 | Very low | 53 Ų | 53 | 125.3 Ų | 125.3 | 55% | 0.546 | 70% | 0.704 | S | S | . | * | trans | -93.1 | 135.1 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | T141 V145 | T141-G143 PolarHBondContact O-N 3.41Å; G143-V145 PolarHBondContact O-N 3.07Å | ||
| 144 | D | 23.6 | Very low | 25.5 | Very low | 168 Ų | 168 | 119.3 Ų | 119.3 | 90% | 0.898 | 67% | 0.673 | S | S | * | * | trans | 37 | 47.3 | 152 | -60.2 | -33 | 0 | 0 | 0 | 119.1 | N146 | D144-N146 PolarHBondContact O-N 3.44Š| ||
| 145 | V | 27.1 | Very low | 26.1 | Very low | 125 Ų | 125 | 119.4 Ų | 119.4 | 76% | 0.758 | 68% | 0.675 | S | S | * | * | trans | -65.7 | 120.8 | 162.6 | -174 | 0 | 0 | 0 | 0 | 108.9 | G143 K147 | G143-V145 PolarHBondContact O-N 3.07Å; V145-K147 PolarHBondContact O-N 2.96Å | ||
| 146 | N | 27.6 | Very low | 27.1 | Very low | 154 Ų | 154 | 113.4 Ų | 113.4 | 82% | 0.824 | 65% | 0.649 | S | S | * | * | trans | -42.5 | 105.6 | -169.4 | -68.7 | -64.6 | 0 | 0 | 0 | 115 | D144 A148 | D144-N146 PolarHBondContact O-N 3.44Å; N146-A148 PolarHBondContact O-N 2.76Å; N146-A148 VanDerWaalsContact O-N 3.11Å | ||
| 147 | K | 28.6 | Very low | 27.8 | Very low | 125 Ų | 125 | 113.9 Ų | 113.9 | 54% | 0.543 | 64% | 0.642 | S | S | . | * | trans | -61.9 | 112.8 | 156.8 | -80.2 | -166.7 | -175.5 | -177.8 | 0 | 107.9 | V145 Q149 S159 I160 | V145-K147 PolarHBondContact O-N 2.96Å; K147-Q149 PolarHBondContact O-N 3.3Å; K147-Q149 VanDerWaalsContact O-N 3.1Å; K147-S159 PolarHBondContact NZ-OG 3.09Å; K147-S159 VanDerWaalsContact NZ-OG 3.1Å; K147-I160 PolarHBondContact NZ-O 3.44Å | ||
| 148 | A | 26.4 | Very low | 28.4 | Very low | 51 Ų | 51 | 108.7 Ų | 108.7 | 42% | 0.421 | 62% | 0.621 | S | S | . | * | trans | -53.8 | 118.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | N146 F150 L239 | N146-A148 PolarHBondContact O-N 2.76Å; N146-A148 VanDerWaalsContact O-N 3.11Å; A148-F150 HydrophobicContact CB-CD2 3.78Å; A148-F150 HydrophobicContact CB-CE2 3.61Å; A148-F150 PolarHBondContact O-N 3.03Å; A148-L239 HydrophobicContact CB-CD1 3.97Å | ||
| 149 | Q | 26.1 | Very low | 28.9 | Very low | 161 Ų | 161 | 106.8 Ų | 106.8 | 75% | 0.752 | 61% | 0.608 | S | S | * | * | trans | -74.7 | 70.1 | -179.8 | -71.6 | -175.3 | -18.8 | 0 | 0 | 111 | K147 T151 | K147-Q149 PolarHBondContact O-N 3.3Å; K147-Q149 VanDerWaalsContact O-N 3.1Å; Q149-T151 PolarHBondContact O-N 2.99Å | ||
| 150 | F | 26.8 | Very low | 29.3 | Very low | 97 Ų | 97 | 102.2 Ų | 102.2 | 43% | 0.425 | 58% | 0.576 | S | S | . | * | trans | -67.2 | 102.2 | 167.5 | -76.5 | -76.1 | 0 | 0 | 0 | 109.3 | A148 N152 L239 | A148-F150 HydrophobicContact CB-CD2 3.78Å; A148-F150 HydrophobicContact CB-CE2 3.61Å; A148-F150 PolarHBondContact O-N 3.03Å; F150-N152 PolarHBondContact O-N 3.24Å; F150-L239 HydrophobicContact CE1-CD2 4.05Å; F150-L239 HydrophobicContact CZ-CD1 4.43Å; F150-L239 HydrophobicContact CZ-CD2 3.7Å; F150-L239 HydrophobicContact CZ-CG 4.08Å | ||
| 151 | T | 25.3 | Very low | 29.7 | Very low | 133 Ų | 133 | 105 Ų | 105 | 82% | 0.816 | 57% | 0.571 | S | S | * | * | trans | -71.3 | 72.2 | 174.5 | 40.8 | 0 | 0 | 0 | 0 | 110.5 | Q149 | Q149-T151 PolarHBondContact O-N 2.99Š| ||
| 152 | N | 29.1 | Very low | 30.1 | Very low | 47 Ų | 47 | 103.6 Ų | 103.6 | 25% | 0.251 | 55% | 0.554 | S | S | . | * | trans | -59.6 | 152.5 | -179.4 | -73.6 | -16.4 | 0 | 0 | 0 | 112.4 | F150 T154 N268 N269 | F150-N152 PolarHBondContact O-N 3.24Å; N152-T154 PolarHBondContact O-N 3.28Å; N152-N268 PolarHBondContact ND2-O 2.66Å; N152-N269 WeakPolarHBondContact ND2-CA 3.28Å; N152-N269 PolarHBondContact ND2-OD1 3.11Å | ||
| 153 | Q | 33.5 | Very low | 30.4 | Very low | 160 Ų | 160 | 105.6 Ų | 105.6 | 75% | 0.748 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -73.2 | 35.9 | -175.4 | -58.5 | 178.9 | -4.5 | 0 | 0 | 114.3 | R312 | Q153-R312 PolarHBondContact O-NH1 3Š|
| 154 | T | 33.5 | Very low | 31 | Very low | 24 Ų | 24 | 108.9 Ų | 108.9 | 15% | 0.147 | 56% | 0.563 | C | S | . | * | S | Bend | trans | -138.7 | 109.5 | 174.1 | 46.7 | 0 | 0 | 0 | 0 | 106.1 | N152 Q156 | N152-T154 PolarHBondContact O-N 3.28Å; T154-Q156 PolarHBondContact O-N 2.83Å |
| 155 | N | 36.1 | Very low | 31.5 | Very low | 154 Ų | 154 | 103.2 Ų | 103.2 | 82% | 0.824 | 54% | 0.536 | S | S | * | . | S | Bend | trans | -71.5 | 46.5 | -167.8 | -65.8 | 8.6 | 0 | 0 | 0 | 114.9 | ||
| 156 | Q | 43 | Very low | 31.9 | Very low | 50 Ų | 50 | 101.5 Ų | 101.5 | 23% | 0.234 | 53% | 0.527 | C | S | . | . | trans | -140.4 | 110.7 | 172.6 | -65.3 | -175.8 | -88.8 | 0 | 0 | 108.5 | T154 V158 I311 | T154-Q156 PolarHBondContact O-N 2.83Å; Q156-V158 VanDerWaalsContact C-N 3.31Å; Q156-V158 HydrophobicContact CB-CG2 4.16Å; Q156-V158 PolarHBondContact O-N 3.14Å; Q156-I311 HydrophobicContact CG-CG2 4.2Å; Q156-I311 VanDerWaalsContact OE1-N 3.15Å | ||
| 157 | L | 35.3 | Very low | 32.1 | Very low | 129 Ų | 129 | 97 Ų | 97 | 68% | 0.675 | 50% | 0.503 | S | S | * | . | trans | -76.3 | 80 | 176.1 | -174.5 | 76.5 | 0 | 0 | 0 | 109.6 | S159 | L157-S159 PolarHBondContact O-N 3.31Š| ||
| 158 | V | 37.1 | Very low | 32.2 | Very low | 47 Ų | 47 | 94.1 Ų | 94.1 | 29% | 0.285 | 50% | 0.497 | S | S | . | . | trans | -77.4 | 65.3 | -179.8 | -167.7 | 0 | 0 | 0 | 0 | 110.5 | Q156 I160 L296 | Q156-V158 VanDerWaalsContact C-N 3.31Å; Q156-V158 HydrophobicContact CB-CG2 4.16Å; Q156-V158 PolarHBondContact O-N 3.14Å; V158-I160 HydrophobicContact CG1-CG1 4.14Å; V158-I160 PolarHBondContact O-N 3.33Å; V158-I160 VanDerWaalsContact O-N 3.07Å; V158-L296 HydrophobicContact CG2-CD1 3.98Å; V158-L296 HydrophobicContact CG2-CD2 4.45Å | ||
| 159 | S | 33.3 | Very low | 32.4 | Very low | 65 Ų | 65 | 95.5 Ų | 95.5 | 46% | 0.455 | 50% | 0.503 | S | S | . | . | trans | -78.2 | 90.1 | 168.8 | -169.4 | 0 | 0 | 0 | 0 | 109.5 | K147 L157 R161 | K147-S159 PolarHBondContact NZ-OG 3.09Å; K147-S159 VanDerWaalsContact NZ-OG 3.1Å; L157-S159 PolarHBondContact O-N 3.31Å; S159-R161 PolarHBondContact O-N 3.48Å; S159-R161 VanDerWaalsContact O-N 3.1Å | ||
| 160 | I | 31 | Very low | 32.7 | Very low | 33 Ų | 33 | 95.2 Ų | 95.2 | 17% | 0.169 | 51% | 0.507 | C | S | . | . | trans | -60.8 | 114.3 | 165.3 | -58.3 | -174.3 | 0 | 0 | 0 | 107.4 | K147 V158 N164 C165 V292 V295 | K147-I160 PolarHBondContact NZ-O 3.44Å; V158-I160 HydrophobicContact CG1-CG1 4.14Å; V158-I160 PolarHBondContact O-N 3.33Å; V158-I160 VanDerWaalsContact O-N 3.07Å; I160-N164 HydrophobicContact CG2-CB 4.36Å; I160-C165 HydrophobicContact CG2-CB 4.29Å; I160-V292 HydrophobicContact CD1-CB 4.29Å; I160-V292 HydrophobicContact CD1-CG1 3.78Å; I160-V295 HydrophobicContact CD1-CG2 3.75Å | ||
| 161 | R | 30.7 | Very low | 32.8 | Very low | 197 Ų | 197 | 98.2 Ų | 98.2 | 74% | 0.743 | 52% | 0.522 | S | S | * | . | trans | -66.3 | 140.5 | 161.1 | -68.1 | -176.4 | 176.2 | -172.7 | -2.8 | 107.2 | S159 N163 N164 | S159-R161 PolarHBondContact O-N 3.48Å; S159-R161 VanDerWaalsContact O-N 3.1Å; R161-N163 PolarHBondContact O-N 2.85Å; R161-N164 PolarHBondContact O-N 3.11Å | ||
| 162 | K | 31.8 | Very low | 33 | Very low | 103 Ų | 103 | 96.3 Ų | 96.3 | 45% | 0.448 | 50% | 0.5 | S | S | . | . | G | 310 helix | trans | -44.3 | -41.3 | -176.9 | -80.9 | -177.7 | 170.6 | 179.3 | 0 | 112.7 | N164 C165 N175 | K162-N164 PolarHBondContact O-N 3.3Å; K162-C165 PolarHBondContact O-N 3.47Å; K162-C165 VanDerWaalsContact O-N 3.13Å; K162-N175 WeakPolarHBondContact CE-OD1 3.4Å |
| 163 | N | 30.1 | Very low | 32.8 | Very low | 142 Ų | 142 | 98.7 Ų | 98.7 | 76% | 0.759 | 52% | 0.518 | S | S | * | . | G | 310 helix | trans | -53.5 | -22.4 | 178.8 | -43.9 | 62.3 | 0 | 0 | 0 | 115.6 | R161 | R161-N163 PolarHBondContact O-N 2.85Š|
| 164 | N | 35.9 | Very low | 32.5 | Very low | 122 Ų | 122 | 94.6 Ų | 94.6 | 65% | 0.652 | 51% | 0.512 | S | S | * | . | G | 310 helix | trans | -112.6 | 11.8 | -176.2 | -69.2 | 31.3 | 0 | 0 | 0 | 112.8 | I160 R161 K162 | I160-N164 HydrophobicContact CG2-CB 4.36Å; R161-N164 PolarHBondContact O-N 3.11Å; K162-N164 PolarHBondContact O-N 3.3Å |
| 165 | C | 33.5 | Very low | 32.3 | Very low | 48 Ų | 48 | 98.6 Ų | 98.6 | 32% | 0.324 | 53% | 0.533 | S | S | . | . | trans | -78.2 | 128.1 | 172.7 | -162.5 | 0 | 0 | 0 | 0 | 109.8 | I160 K162 L167 | I160-C165 HydrophobicContact CG2-CB 4.29Å; K162-C165 PolarHBondContact O-N 3.47Å; K162-C165 VanDerWaalsContact O-N 3.13Å; C165-L167 PolarHBondContact O-N 2.96Å | ||
| 166 | P | 36.1 | Very low | 32 | Very low | 89 Ų | 89 | 95.8 Ų | 95.8 | 58% | 0.578 | 52% | 0.517 | S | S | * | . | S | Bend | trans | -73.3 | -2.2 | 177.8 | -18.1 | 32.2 | 0 | 0 | 0 | 115 | V295 | P166-V295 HydrophobicContact CG-CG1 3.44Å; P166-V295 VanDerWaalsContact CG-CG1 3.44Å |
| 167 | L | 32.1 | Very low | 31.4 | Very low | 59 Ų | 59 | 98 Ų | 98 | 31% | 0.309 | 53% | 0.534 | S | S | . | . | S | Bend | trans | -85.2 | 136.3 | 176.6 | -59.9 | 175.1 | 0 | 0 | 0 | 109.1 | C165 C169 Y172 P291 | C165-L167 PolarHBondContact O-N 2.96Å; L167-C169 PolarHBondContact O-N 2.97Å; L167-Y172 HydrophobicContact CB-CE2 4.38Å; L167-Y172 HydrophobicContact CD1-CE2 3.99Å; L167-P291 HydrophobicContact CD1-CG 4.43Å |
| 168 | P | 29.4 | Very low | 31.2 | Very low | 66 Ų | 66 | 95.9 Ų | 95.9 | 43% | 0.429 | 52% | 0.522 | S | S | . | . | trans | -59.8 | 123.2 | 172.9 | 25.8 | -33 | 0 | 0 | 0 | 109.4 | D170 E171 | P168-D170 PolarHBondContact O-N 3.47Å; P168-E171 HydrophobicContact CG-CB 4.45Å; P168-E171 HydrophobicContact CG-CG 4.2Å; P168-E171 PolarHBondContact O-N 2.93Å | ||
| 169 | C | 31.3 | Very low | 30.7 | Very low | 80 Ų | 80 | 99.8 Ų | 99.8 | 54% | 0.541 | 54% | 0.541 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -14.5 | -178.3 | -67.1 | 0 | 0 | 0 | 0 | 113.4 | L167 | L167-C169 PolarHBondContact O-N 2.97Š|
| 170 | D | 31.7 | Very low | 30.8 | Very low | 155 Ų | 155 | 99 Ų | 99 | 83% | 0.829 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | -19.9 | -174.3 | -46.1 | -61.9 | 0 | 0 | 0 | 113.4 | P168 | P168-D170 PolarHBondContact O-N 3.47Š|
| 171 | E | 30 | Very low | 30.6 | Very low | 159 Ų | 159 | 99.4 Ų | 99.4 | 74% | 0.743 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -90 | -13 | 177.8 | -70.8 | -163.2 | 132.8 | 0 | 0 | 113.9 | P168 | P168-E171 HydrophobicContact CG-CB 4.45Å; P168-E171 HydrophobicContact CG-CG 4.2Å; P168-E171 PolarHBondContact O-N 2.93Å |
| 172 | Y | 28.9 | Very low | 30.7 | Very low | 93 Ų | 93 | 94.6 Ų | 94.6 | 37% | 0.365 | 56% | 0.558 | S | S | . | * | S | Bend | trans | -112.2 | 126 | 176.2 | -72.7 | -94.3 | 0 | 0 | 0 | 109.6 | L167 A174 | L167-Y172 HydrophobicContact CB-CE2 4.38Å; L167-Y172 HydrophobicContact CD1-CE2 3.99Å; Y172-A174 PolarHBondContact O-N 2.96Å |
| 173 | P | 24.7 | Very low | 31 | Very low | 97 Ų | 97 | 96.9 Ų | 96.9 | 63% | 0.63 | 56% | 0.564 | S | S | * | * | trans | -58.8 | 111.5 | 177.1 | 24.6 | -33.2 | 0 | 0 | 0 | 109.3 | N175 I176 | P173-N175 PolarHBondContact O-N 3.13Å; P173-I176 HydrophobicContact CB-CG1 4.16Å; P173-I176 HydrophobicContact CG-CD1 4.13Å; P173-I176 HydrophobicContact CG-CG1 4Å | ||
| 174 | A | 26.9 | Very low | 31.5 | Very low | 75 Ų | 75 | 97.3 Ų | 97.3 | 62% | 0.62 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.6 | 107.8 | -163.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y172 | Y172-A174 PolarHBondContact O-N 2.96Š|
| 175 | N | 30.5 | Very low | 32 | Very low | 107 Ų | 107 | 94.7 Ų | 94.7 | 57% | 0.572 | 57% | 0.568 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 24.6 | 87.9 | -168.2 | -72.2 | 25.5 | 0 | 0 | 0 | 111.9 | K162 P173 V177 | K162-N175 WeakPolarHBondContact CE-OD1 3.4Å; P173-N175 PolarHBondContact O-N 3.13Å; N175-V177 VanDerWaalsContact C-N 3.34Å; N175-V177 PolarHBondContact O-N 3.1Å |
| 176 | I | 28.2 | Very low | 33 | Very low | 96 Ų | 96 | 95.4 Ų | 95.4 | 49% | 0.492 | 57% | 0.568 | S | S | . | * | trans | -43.7 | 104 | 178.1 | -59.9 | 178.1 | 0 | 0 | 0 | 108.6 | P173 I178 | P173-I176 HydrophobicContact CB-CG1 4.16Å; P173-I176 HydrophobicContact CG-CD1 4.13Å; P173-I176 HydrophobicContact CG-CG1 4Å; I176-I178 HydrophobicContact CG2-CG1 3.97Å; I176-I178 PolarHBondContact O-N 3.07Å | ||
| 177 | V | 30.8 | Very low | 34.3 | Very low | 97 Ų | 97 | 94.2 Ų | 94.2 | 59% | 0.588 | 56% | 0.561 | S | S | * | * | trans | -71.8 | 99.9 | 172.6 | 175 | 0 | 0 | 0 | 0 | 102.2 | N175 D179 | N175-V177 VanDerWaalsContact C-N 3.34Å; N175-V177 PolarHBondContact O-N 3.1Å; V177-D179 PolarHBondContact O-N 2.87Å | ||
| 178 | I | 30.8 | Very low | 35.9 | Very low | 84 Ų | 84 | 94.4 Ų | 94.4 | 43% | 0.431 | 56% | 0.561 | S | S | . | * | trans | -72.5 | 72.9 | 162.9 | -54.6 | 179.1 | 0 | 0 | 0 | 105 | I176 G180 | I176-I178 HydrophobicContact CG2-CG1 3.97Å; I176-I178 PolarHBondContact O-N 3.07Å; I178-G180 PolarHBondContact O-N 3.03Å | ||
| 179 | D | 27.7 | Very low | 37.7 | Very low | 129 Ų | 129 | 99.6 Ų | 99.6 | 69% | 0.69 | 57% | 0.573 | S | S | * | * | trans | -35.1 | 125.8 | 133.4 | -76.5 | -26 | 0 | 0 | 0 | 105.6 | V177 G181 | V177-D179 PolarHBondContact O-N 2.87Å; D179-G181 VanDerWaalsContact C-N 3.28Å; D179-G181 WeakPolarHBondContact O-CA 3.32Å; D179-G181 PolarHBondContact O-N 2.93Å | ||
| 180 | G | 35 | Very low | 39.6 | Very low | 49 Ų | 49 | 98.4 Ų | 98.4 | 51% | 0.505 | 56% | 0.561 | S | S | . | * | trans | -55.3 | 85.9 | -168 | 0 | 0 | 0 | 0 | 0 | 112.7 | I178 A182 | I178-G180 PolarHBondContact O-N 3.03Å; G180-A182 VanDerWaalsContact C-N 3.34Å; G180-A182 PolarHBondContact O-N 3.49Å | ||
| 181 | G | 26.1 | Very low | 41.5 | Very low | 40 Ų | 40 | 91.1 Ų | 91.1 | 41% | 0.412 | 52% | 0.522 | S | S | . | . | trans | -86.5 | 72.2 | -133.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | D179 W183 | D179-G181 VanDerWaalsContact C-N 3.28Å; D179-G181 WeakPolarHBondContact O-CA 3.32Å; D179-G181 PolarHBondContact O-N 2.93Å; G181-W183 PolarHBondContact O-N 3.35Å; G181-W183 VanDerWaalsContact O-N 3.13Å | ||
| 182 | A | 34.2 | Very low | 43.5 | Very low | 96 Ų | 96 | 84 Ų | 84 | 79% | 0.793 | 49% | 0.489 | S | S | * | . | S | Bend | trans | 57.1 | 16.8 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | G180 | G180-A182 VanDerWaalsContact C-N 3.34Å; G180-A182 PolarHBondContact O-N 3.49Å |
| 183 | W | 36.8 | Very low | 45.8 | Very low | 151 Ų | 151 | 81 Ų | 81 | 57% | 0.572 | 49% | 0.487 | S | S | * | . | trans | -95.4 | 5.6 | 172.2 | -66.4 | 105.4 | 0 | 0 | 0 | 113.8 | G181 G185 L186 | G181-W183 PolarHBondContact O-N 3.35Å; G181-W183 VanDerWaalsContact O-N 3.13Å; W183-G185 PolarHBondContact O-N 3.32Å; W183-L186 HydrophobicContact CE3-CB 3.93Å; W183-L186 HydrophobicContact CE3-CD2 4.3Å; W183-L186 HydrophobicContact CZ3-CB 4.46Å; W183-L186 HydrophobicContact CZ3-CD2 4.45Å; W183-L186 PolarHBondContact O-N 3.36Å; W183-L186 VanDerWaalsContact O-N 3.11Å | ||
| 184 | N | 41 | Very low | 48.4 | Very low | 151 Ų | 151 | 78.2 Ų | 78.2 | 81% | 0.807 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59 | -8.7 | 165.2 | -58.8 | -10.6 | 0 | 0 | 0 | 112.9 | ||
| 185 | G | 47 | Very low | 51 | Low | 68 Ų | 68 | 74.6 Ų | 74.6 | 70% | 0.701 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.7 | 3.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 116 | W183 P187 | W183-G185 PolarHBondContact O-N 3.32Å; G185-P187 VanDerWaalsContact O-CD 3.31Å; G185-P187 WeakPolarHBondContact O-CD 3.27Å |
| 186 | L | 53.7 | Low | 53.3 | Low | 62 Ų | 62 | 72.1 Ų | 72.1 | 33% | 0.325 | 43% | 0.429 | S | S | . | . | S | Bend | trans | -100 | 97.8 | 171.2 | -169.8 | 74.8 | 0 | 0 | 0 | 109.1 | W183 D190 | W183-L186 HydrophobicContact CE3-CB 3.93Å; W183-L186 HydrophobicContact CE3-CD2 4.3Å; W183-L186 HydrophobicContact CZ3-CB 4.46Å; W183-L186 HydrophobicContact CZ3-CD2 4.45Å; W183-L186 PolarHBondContact O-N 3.36Å; W183-L186 VanDerWaalsContact O-N 3.11Å; L186-D190 HydrophobicContact CD1-CB 3.79Å; L186-D190 HydrophobicContact CG-CB 4.23Å |
| 187 | P | 64.4 | Low | 55.9 | Low | 65 Ų | 65 | 72.3 Ų | 72.3 | 42% | 0.422 | 43% | 0.434 | S | S | . | . | trans | -65 | 153.2 | -174.3 | 27.8 | -35.1 | 0 | 0 | 0 | 110.9 | G185 R189 D190 A191 | G185-P187 VanDerWaalsContact O-CD 3.31Å; G185-P187 WeakPolarHBondContact O-CD 3.27Å; P187-R189 PolarHBondContact O-N 2.97Å; P187-D190 HydrophobicContact CG-CB 4.27Å; P187-D190 PolarHBondContact O-N 3.35Å; P187-A191 PolarHBondContact O-N 3.39Å | ||
| 188 | L | 63.9 | Low | 58.4 | Low | 62 Ų | 62 | 68.8 Ų | 68.8 | 33% | 0.325 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -49.5 | -37.7 | -178.1 | -179.5 | 57.5 | 0 | 0 | 0 | 112.6 | D190 A191 I192 M241 | L188-D190 VanDerWaalsContact C-N 3.34Å; L188-D190 PolarHBondContact O-N 3.09Å; L188-A191 WeakPolarHBondContact O-CB 3.44Å; L188-A191 PolarHBondContact O-N 3.15Å; L188-I192 HydrophobicContact CD1-CD1 3.83Å; L188-I192 HydrophobicContact CD1-CG1 4.23Å; L188-I192 HydrophobicContact CG-CD1 3.68Å; L188-I192 WeakPolarHBondContact O-CD1 3.21Å; L188-I192 WeakPolarHBondContact O-CG1 3.31Å; L188-I192 PolarHBondContact O-N 2.88Å; L188-M241 HydrophobicContact CD1-CE 4.44Å |
| 189 | R | 67.6 | Low | 60.9 | Low | 176 Ų | 176 | 66.4 Ų | 66.4 | 66% | 0.664 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -44.6 | -52.3 | 169.3 | 174.1 | -169.9 | 173.5 | -108.3 | 12.4 | 113.4 | P187 I192 G193 | P187-R189 PolarHBondContact O-N 2.97Å; R189-I192 PolarHBondContact O-N 2.79Å; R189-G193 PolarHBondContact O-N 2.76Å |
| 190 | D | 72 | Confident | 63.4 | Low | 55 Ų | 55 | 65.3 Ų | 65.3 | 29% | 0.294 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -81 | -36.3 | -168 | -62.2 | 5 | 0 | 0 | 0 | 110.2 | L186 P187 L188 I192 G193 A194 | L186-D190 HydrophobicContact CD1-CB 3.79Å; L186-D190 HydrophobicContact CG-CB 4.23Å; P187-D190 HydrophobicContact CG-CB 4.27Å; P187-D190 PolarHBondContact O-N 3.35Å; L188-D190 VanDerWaalsContact C-N 3.34Å; L188-D190 PolarHBondContact O-N 3.09Å; D190-I192 VanDerWaalsContact C-N 3.3Å; D190-I192 PolarHBondContact O-N 3.34Å; D190-G193 PolarHBondContact O-N 3.2Å; D190-A194 PolarHBondContact O-N 3.36Å |
| 191 | A | 70.9 | Confident | 65.5 | Low | 2 Ų | 2 | 65.5 Ų | 65.5 | 2% | 0.017 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -52.5 | -44.8 | 164.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | P187 L188 A195 W232 | P187-A191 PolarHBondContact O-N 3.39Å; L188-A191 WeakPolarHBondContact O-CB 3.44Å; L188-A191 PolarHBondContact O-N 3.15Å; A191-A195 WeakPolarHBondContact O-CB 3.45Å; A191-A195 PolarHBondContact O-N 2.94Å; A191-W232 HydrophobicContact CB-CH2 3.27Å; A191-W232 HydrophobicContact CB-CZ2 3.54Å; A191-W232 HydrophobicContact CB-CZ3 4.17Å |
| 192 | I | 73 | Confident | 67.5 | Low | 8 Ų | 8 | 72.3 Ų | 72.3 | 4% | 0.041 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -74.2 | -35 | 176.4 | -63.2 | 152.8 | 0 | 0 | 0 | 111.3 | L42 L46 L188 R189 D190 A194 A195 L196 | L42-I192 HydrophobicContact CD1-CD1 3.67Å; L42-I192 HydrophobicContact CD1-CG2 4.28Å; L42-I192 HydrophobicContact CD2-CD1 3.29Å; L42-I192 HydrophobicContact CD2-CG1 4.4Å; L42-I192 HydrophobicContact CG-CD1 4.03Å; L46-I192 HydrophobicContact CD2-CG2 4.32Å; L188-I192 HydrophobicContact CD1-CD1 3.83Å; L188-I192 HydrophobicContact CD1-CG1 4.23Å; L188-I192 HydrophobicContact CG-CD1 3.68Å; L188-I192 WeakPolarHBondContact O-CD1 3.21Å; L188-I192 WeakPolarHBondContact O-CG1 3.31Å; L188-I192 PolarHBondContact O-N 2.88Å; R189-I192 PolarHBondContact O-N 2.79Å; D190-I192 VanDerWaalsContact C-N 3.3Å; D190-I192 PolarHBondContact O-N 3.34Å; I192-A194 VanDerWaalsContact C-N 3.35Å; I192-A194 PolarHBondContact O-N 3.24Å; I192-A195 WeakPolarHBondContact O-CB 3.49Å; I192-A195 PolarHBondContact O-N 2.7Å; I192-L196 HydrophobicContact CG2-CD1 4.06Å; I192-L196 HydrophobicContact CG2-CG 4.24Å; I192-L196 WeakPolarHBondContact O-CB 3.34Å; I192-L196 VanDerWaalsContact O-CG 3.3Å; I192-L196 WeakPolarHBondContact O-CG 3.38Å; I192-L196 PolarHBondContact O-N 2.99Å |
| 193 | G | 77.2 | Confident | 68.7 | Low | 32 Ų | 32 | 69.7 Ų | 69.7 | 33% | 0.33 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -55.6 | -48.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | R189 D190 L196 V197 | R189-G193 PolarHBondContact O-N 2.76Å; D190-G193 PolarHBondContact O-N 3.2Å; G193-L196 PolarHBondContact O-N 2.7Å; G193-V197 WeakPolarHBondContact O-CG2 3.46Å; G193-V197 PolarHBondContact O-N 3.36Å |
| 194 | A | 78.9 | Confident | 69.4 | Low | 37 Ų | 37 | 70.4 Ų | 70.4 | 31% | 0.306 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.2 | -44.2 | 174 | 0 | 0 | 0 | 0 | 0 | 112.1 | D190 I192 L196 V197 I198 | D190-A194 PolarHBondContact O-N 3.36Å; I192-A194 VanDerWaalsContact C-N 3.35Å; I192-A194 PolarHBondContact O-N 3.24Å; A194-L196 VanDerWaalsContact C-N 3.34Å; A194-L196 PolarHBondContact O-N 2.99Å; A194-V197 PolarHBondContact O-N 3.02Å; A194-I198 WeakPolarHBondContact O-CD1 3.34Å; A194-I198 VanDerWaalsContact O-CG1 3.28Å; A194-I198 WeakPolarHBondContact O-CG1 3.49Å; A194-I198 PolarHBondContact O-N 3.25Å |
| 195 | A | 81.4 | Confident | 69.7 | Low | 0 Ų | 0 | 64.7 Ų | 64.7 | 0% | 0 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -56.5 | -45.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | A191 I192 I198 L199 F233 I248 V252 | A191-A195 WeakPolarHBondContact O-CB 3.45Å; A191-A195 PolarHBondContact O-N 2.94Å; I192-A195 WeakPolarHBondContact O-CB 3.49Å; I192-A195 PolarHBondContact O-N 2.7Å; A195-I198 PolarHBondContact O-N 3.09Å; A195-L199 WeakPolarHBondContact O-CB 3.46Å; A195-L199 VanDerWaalsContact O-CG 3.25Å; A195-L199 WeakPolarHBondContact O-CG 3.48Å; A195-L199 PolarHBondContact O-N 3.1Å; A195-F233 HydrophobicContact CB-CE1 4.01Å; A195-F233 HydrophobicContact CB-CZ 4.01Å; A195-I248 HydrophobicContact CB-CG2 4.33Å; A195-V252 HydrophobicContact CB-CG2 3.59Å |
| 196 | L | 79.6 | Confident | 69.4 | Low | 55 Ų | 55 | 64.9 Ų | 64.9 | 29% | 0.288 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -67.7 | -41.4 | 178.9 | -71.5 | 173.8 | 0 | 0 | 0 | 112.5 | L46 L49 I192 G193 A194 I198 L199 T200 | L46-L196 HydrophobicContact CD2-CD2 3.96Å; L49-L196 HydrophobicContact CD1-CD2 3.33Å; I192-L196 HydrophobicContact CG2-CD1 4.06Å; I192-L196 HydrophobicContact CG2-CG 4.24Å; I192-L196 WeakPolarHBondContact O-CB 3.34Å; I192-L196 VanDerWaalsContact O-CG 3.3Å; I192-L196 WeakPolarHBondContact O-CG 3.38Å; I192-L196 PolarHBondContact O-N 2.99Å; G193-L196 PolarHBondContact O-N 2.7Å; A194-L196 VanDerWaalsContact C-N 3.34Å; A194-L196 PolarHBondContact O-N 2.99Å; L196-I198 VanDerWaalsContact C-N 3.34Å; L196-I198 PolarHBondContact O-N 3.11Å; L196-L199 PolarHBondContact O-N 2.62Å; L196-T200 WeakPolarHBondContact O-CB 3.34Å; L196-T200 WeakPolarHBondContact O-CG2 3.49Å; L196-T200 PolarHBondContact O-N 3.29Å; L196-T200 PolarHBondContact O-OG1 2.84Å |
| 197 | V | 82.5 | Confident | 68.5 | Low | 99 Ų | 99 | 65.1 Ų | 65.1 | 60% | 0.6 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -60.8 | -43 | 173.6 | 169.5 | 0 | 0 | 0 | 0 | 110.9 | G193 A194 T200 S201 | G193-V197 WeakPolarHBondContact O-CG2 3.46Å; G193-V197 PolarHBondContact O-N 3.36Å; A194-V197 PolarHBondContact O-N 3.02Å; V197-T200 PolarHBondContact O-OG1 3.26Å; V197-S201 VanDerWaalsContact O-CB 3.31Å; V197-S201 WeakPolarHBondContact O-CB 3.33Å; V197-S201 PolarHBondContact O-N 2.95Å |
| 198 | I | 82.1 | Confident | 66.8 | Low | 23 Ų | 23 | 67.6 Ų | 67.6 | 12% | 0.118 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.7 | -49.3 | 175.3 | -63.1 | 158.1 | 0 | 0 | 0 | 110 | A194 A195 L196 T200 S201 F233 V252 K255 L256 | A194-I198 WeakPolarHBondContact O-CD1 3.34Å; A194-I198 VanDerWaalsContact O-CG1 3.28Å; A194-I198 WeakPolarHBondContact O-CG1 3.49Å; A194-I198 PolarHBondContact O-N 3.25Å; A195-I198 PolarHBondContact O-N 3.09Å; L196-I198 VanDerWaalsContact C-N 3.34Å; L196-I198 PolarHBondContact O-N 3.11Å; I198-T200 VanDerWaalsContact C-N 3.28Å; I198-T200 PolarHBondContact O-N 2.85Å; I198-S201 PolarHBondContact O-N 3.44Å; I198-S201 PolarHBondContact O-OG 3.08Å; I198-F233 HydrophobicContact CD1-CE2 3.77Å; I198-F233 HydrophobicContact CD1-CZ 4.21Å; I198-V252 HydrophobicContact CB-CG1 4.06Å; I198-V252 HydrophobicContact CD1-CG1 3.6Å; I198-V252 HydrophobicContact CG1-CG1 4.44Å; I198-V252 HydrophobicContact CG2-CG1 3.88Å; I198-K255 HydrophobicContact CG2-CB 4.45Å; I198-K255 WeakPolarHBondContact O-CD 3.24Å; I198-K255 WeakPolarHBondContact O-CE 3.4Å; I198-K255 PolarHBondContact O-NZ 2.97Å; I198-L256 HydrophobicContact CD1-CD1 4.37Å; I198-L256 HydrophobicContact CD1-CD2 3.99Å; I198-L256 HydrophobicContact CD1-CG 4.4Å; I198-L256 HydrophobicContact CG1-CD2 4.24Å; I198-L256 HydrophobicContact CG2-CD2 3.95Å; I198-L256 HydrophobicContact CG2-CG 4.13Å |
| 199 | L | 83.3 | Confident | 65.5 | Low | 34 Ų | 34 | 70.3 Ų | 70.3 | 18% | 0.178 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -63.9 | -27.5 | -178.4 | -74.8 | 167.7 | 0 | 0 | 0 | 113.9 | I51 A195 L196 I248 V252 K255 | I51-L199 HydrophobicContact CD1-CD1 3.98Å; A195-L199 WeakPolarHBondContact O-CB 3.46Å; A195-L199 VanDerWaalsContact O-CG 3.25Å; A195-L199 WeakPolarHBondContact O-CG 3.48Å; A195-L199 PolarHBondContact O-N 3.1Å; L196-L199 PolarHBondContact O-N 2.62Å; L199-I248 HydrophobicContact CD1-CG2 3.89Å; L199-V252 HydrophobicContact CD1-CG2 3.77Å; L199-V252 HydrophobicContact CD2-CG2 4.31Å; L199-V252 HydrophobicContact CG-CG2 3.76Å; L199-K255 PolarHBondContact O-NZ 3.13Å |
| 200 | T | 80 | Confident | 63.9 | Low | 107 Ų | 107 | 74.1 Ų | 74.1 | 66% | 0.656 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -91.8 | -22.9 | 175.1 | 54.3 | 0 | 0 | 0 | 0 | 114 | L196 V197 I198 | L196-T200 WeakPolarHBondContact O-CB 3.34Å; L196-T200 WeakPolarHBondContact O-CG2 3.49Å; L196-T200 PolarHBondContact O-N 3.29Å; L196-T200 PolarHBondContact O-OG1 2.84Å; V197-T200 PolarHBondContact O-OG1 3.26Å; I198-T200 VanDerWaalsContact C-N 3.28Å; I198-T200 PolarHBondContact O-N 2.85Å |
| 201 | S | 79 | Confident | 62 | Low | 53 Ų | 53 | 80.5 Ų | 80.5 | 37% | 0.371 | 44% | 0.443 | S | S | . | . | S | Bend | trans | -54.4 | 142.6 | 179.8 | 69.2 | 0 | 0 | 0 | 0 | 112.9 | V197 I198 K255 | V197-S201 VanDerWaalsContact O-CB 3.31Å; V197-S201 WeakPolarHBondContact O-CB 3.33Å; V197-S201 PolarHBondContact O-N 2.95Å; I198-S201 PolarHBondContact O-N 3.44Å; I198-S201 PolarHBondContact O-OG 3.08Å; S201-K255 WeakPolarHBondContact O-CE 3.29Å; S201-K255 PolarHBondContact O-NZ 2.96Å |
| 202 | K | 68.3 | Low | 60.2 | Low | 182 Ų | 182 | 84.5 Ų | 84.5 | 79% | 0.791 | 46% | 0.463 | S | S | * | . | P | Polyproline II helix | trans | -72.5 | 131.5 | 166.2 | -73.5 | 178.4 | -179.4 | 174.6 | 0 | 108 | ||
| 203 | S | 59.9 | Low | 58.5 | Low | 41 Ų | 41 | 87.7 Ų | 87.7 | 29% | 0.287 | 49% | 0.486 | S | S | . | . | P | Polyproline II helix | trans | -59 | 146.5 | 175.9 | 61.4 | 0 | 0 | 0 | 0 | 109.7 | A205 S206 | S203-A205 PolarHBondContact O-N 2.94Å; S203-S206 PolarHBondContact O-N 3.43Å |
| 204 | K | 52.8 | Low | 56.8 | Low | 166 Ų | 166 | 94.4 Ų | 94.4 | 72% | 0.722 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.2 | -7.4 | -174.1 | -55.2 | 173.6 | -178.2 | 172.7 | 0 | 112.6 | D259 | K204-D259 WeakPolarHBondContact CB-OD2 3.49Š|
| 205 | A | 45.9 | Very low | 55.1 | Low | 32 Ų | 32 | 96.2 Ų | 96.2 | 26% | 0.264 | 51% | 0.512 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | -15.7 | 173 | 0 | 0 | 0 | 0 | 0 | 115.5 | S203 G207 | S203-A205 PolarHBondContact O-N 2.94Å; A205-G207 PolarHBondContact O-N 2.99Å |
| 206 | S | 40.6 | Very low | 53.4 | Low | 72 Ų | 72 | 98.8 Ų | 98.8 | 50% | 0.503 | 53% | 0.53 | S | S | . | . | trans | -76.7 | 12.1 | -161.8 | 102.8 | 0 | 0 | 0 | 0 | 116.7 | S203 | S203-S206 PolarHBondContact O-N 3.43Š| ||
| 207 | G | 34.8 | Very low | 51.8 | Low | 67 Ų | 67 | 98.2 Ų | 98.2 | 69% | 0.691 | 53% | 0.526 | S | S | * | . | S | Bend | trans | -86.7 | -74.8 | 180 | 0 | 0 | 0 | 0 | 0 | 113.1 | A205 | A205-G207 PolarHBondContact O-N 2.99Š|
| 208 | C | 30 | Very low | 50.3 | Low | 117 Ų | 117 | 98.3 Ų | 98.3 | 79% | 0.791 | 52% | 0.515 | S | S | * | . | S | Bend | trans | -146.3 | 65.4 | -177.7 | -65.2 | 0 | 0 | 0 | 0 | 111.3 | ||
| 209 | R | 34.8 | Very low | 48.9 | Very low | 118 Ų | 118 | 104.5 Ų | 104.5 | 45% | 0.445 | 55% | 0.548 | S | S | . | . | trans | -150 | 48.7 | -172.1 | -142.7 | 162.3 | -76.6 | -137.9 | -1.6 | 118.9 | I212 S216 | R209-I212 HydrophobicContact CG-CB 3.81Å; R209-I212 HydrophobicContact CG-CD1 4.27Å; R209-I212 HydrophobicContact CG-CG1 4.27Å; R209-S216 PolarHBondContact NH1-OG 3.26Å; R209-S216 VanDerWaalsContact NH1-OG 3.11Å | ||
| 210 | R | 35.9 | Very low | 48 | Very low | 257 Ų | 257 | 106 Ų | 106 | 97% | 0.97 | 55% | 0.554 | S | S | * | * | S | Bend | trans | -91 | -11.1 | 154.9 | -80.4 | -173.4 | 179.6 | 142.8 | 1.5 | 114.2 | ||
| 211 | M | 32.2 | Very low | 47.6 | Very low | 189 Ų | 189 | 110.2 Ų | 110.2 | 93% | 0.931 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -104.4 | -16.1 | -174.2 | -81.4 | -76.1 | -154.3 | 0 | 0 | 115.1 | ||
| 212 | I | 33.1 | Very low | 47.7 | Very low | 85 Ų | 85 | 108.3 Ų | 108.3 | 44% | 0.436 | 55% | 0.547 | S | S | . | . | S | Bend | trans | -94.2 | 133.5 | -177.6 | -56.9 | 175.1 | 0 | 0 | 0 | 108.9 | R209 | R209-I212 HydrophobicContact CG-CB 3.81Å; R209-I212 HydrophobicContact CG-CD1 4.27Å; R209-I212 HydrophobicContact CG-CG1 4.27Å |
| 213 | S | 37.1 | Very low | 48.4 | Very low | 76 Ų | 76 | 102.9 Ų | 102.9 | 53% | 0.531 | 53% | 0.527 | S | S | . | . | trans | -48 | 143.4 | -169.2 | -176.8 | 0 | 0 | 0 | 0 | 114.8 | S215 S216 | S213-S215 WeakPolarHBondContact CB-OG 3.39Å; S213-S215 PolarHBondContact O-N 3.38Å; S213-S215 PolarHBondContact OG-N 3.16Å; S213-S215 PolarHBondContact OG-OG 3.38Å; S213-S216 WeakPolarHBondContact O-CB 3.31Å; S213-S216 PolarHBondContact O-N 2.73Å | ||
| 214 | R | 41 | Very low | 49.3 | Very low | 173 Ų | 173 | 110.1 Ų | 110.1 | 65% | 0.653 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.9 | -24.3 | 173.3 | -80 | 177.4 | 163.8 | 166.6 | -6.5 | 113.3 | S216 H217 | R214-S216 PolarHBondContact O-N 2.99Å; R214-H217 PolarHBondContact O-N 2.76Å |
| 215 | S | 43.2 | Very low | 50.5 | Low | 75 Ų | 75 | 106.8 Ų | 106.8 | 52% | 0.524 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -55 | -36.7 | 173.3 | 55.4 | 0 | 0 | 0 | 0 | 113.2 | S213 H217 R218 | S213-S215 WeakPolarHBondContact CB-OG 3.39Å; S213-S215 PolarHBondContact O-N 3.38Å; S213-S215 PolarHBondContact OG-N 3.16Å; S213-S215 PolarHBondContact OG-OG 3.38Å; S215-H217 PolarHBondContact O-N 2.9Å; S215-H217 VanDerWaalsContact O-N 3.09Å; S215-R218 PolarHBondContact O-N 3.09Å |
| 216 | S | 44.4 | Very low | 52.1 | Low | 54 Ų | 54 | 106.2 Ų | 106.2 | 38% | 0.378 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.4 | -14 | -176.1 | -179.3 | 0 | 0 | 0 | 0 | 114.5 | R209 S213 R214 | R209-S216 PolarHBondContact NH1-OG 3.26Å; R209-S216 VanDerWaalsContact NH1-OG 3.11Å; S213-S216 WeakPolarHBondContact O-CB 3.31Å; S213-S216 PolarHBondContact O-N 2.73Å; R214-S216 PolarHBondContact O-N 2.99Å |
| 217 | H | 47.9 | Very low | 54.1 | Low | 43 Ų | 43 | 104.5 Ų | 104.5 | 20% | 0.199 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -104.2 | -22.4 | 179.9 | -75.5 | -119.3 | 0 | 0 | 0 | 113.2 | R214 S215 N219 K220 D259 | R214-H217 PolarHBondContact O-N 2.76Å; S215-H217 PolarHBondContact O-N 2.9Å; S215-H217 VanDerWaalsContact O-N 3.09Å; H217-N219 PolarHBondContact O-N 2.79Å; H217-N219 VanDerWaalsContact O-N 3.14Å; H217-K220 PolarHBondContact O-N 2.91Å; H217-D259 IonicContact CE1-OD1 3.19Å; H217-D259 PolarHBondContact CE1-OD1 2.98Å; H217-D259 IonicContact ND1-OD1 3.25Å; H217-D259 PolarHBondContact ND1-OD1 3.3Å |
| 218 | R | 49.7 | Very low | 56.2 | Low | 100 Ų | 100 | 105.6 Ų | 105.6 | 38% | 0.377 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.8 | -28.2 | -173.3 | -56.7 | -156.3 | -155.3 | -158.3 | 17.7 | 114.2 | S215 V261 E280 | S215-R218 PolarHBondContact O-N 3.09Å; R218-V261 HydrophobicContact CB-CG2 4.19Å; R218-V261 HydrophobicContact CG-CG2 4.25Å; R218-E280 IonicContact NH1-OE1 2.82Å |
| 219 | N | 52.1 | Low | 58.5 | Low | 153 Ų | 153 | 103.4 Ų | 103.4 | 82% | 0.818 | 48% | 0.479 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97.2 | 13.3 | -174.7 | -62.9 | 4.2 | 0 | 0 | 0 | 113.6 | H217 K221 | H217-N219 PolarHBondContact O-N 2.79Å; H217-N219 VanDerWaalsContact O-N 3.14Å; N219-K221 PolarHBondContact O-N 2.99Å |
| 220 | K | 65.3 | Low | 60.8 | Low | 67 Ų | 67 | 97.8 Ų | 97.8 | 29% | 0.291 | 46% | 0.458 | S | S | . | . | trans | -70.1 | 94.8 | 169.7 | -76.8 | 179.4 | 176.2 | 176.4 | 0 | 109.2 | H217 D259 Y260 | H217-K220 PolarHBondContact O-N 2.91Å; K220-D259 WeakPolarHBondContact CD-O 3.25Å; K220-D259 IonicContact NZ-OD1 3.18Å; K220-D259 PolarHBondContact NZ-OD1 2.99Å; K220-D259 IonicContact NZ-OD2 3.16Å; K220-D259 PolarHBondContact NZ-OD2 2.92Å; K220-Y260 HydrophobicContact CB-CD1 3.87Å; K220-Y260 HydrophobicContact CB-CE1 3.93Å; K220-Y260 VanDerWaalsContact O-CD1 3.25Å; K220-Y260 WeakPolarHBondContact O-CD1 3.43Å | ||
| 221 | K | 72.3 | Confident | 62.8 | Low | 194 Ų | 194 | 86.2 Ų | 86.2 | 84% | 0.843 | 42% | 0.416 | S | S | * | . | P | Polyproline II helix | trans | -68.9 | 138.1 | 167.1 | -171.8 | 172.4 | -178.6 | 174.4 | 0 | 109.1 | N219 | N219-K221 PolarHBondContact O-N 2.99Š|
| 222 | W | 80.8 | Confident | 64.9 | Low | 13 Ų | 13 | 79.7 Ų | 79.7 | 5% | 0.049 | 38% | 0.382 | C | S | . | . | P | Polyproline II helix | trans | -66.9 | 132.6 | 171.7 | -66.7 | 65.6 | 0 | 0 | 0 | 109.6 | T226 L227 H230 L256 E257 Y260 I277 | W222-T226 HydrophobicContact CE3-CG2 3.5Å; W222-T226 VanDerWaalsContact CE3-CG2 3.5Å; W222-T226 HydrophobicContact CZ3-CG2 3.61Å; W222-L227 HydrophobicContact CB-CD1 4.43Å; W222-L227 HydrophobicContact CB-CG 4.02Å; W222-H230 AromaticContact CH2-CD2 3.43Å; W222-H230 VanDerWaalsContact CH2-CD2 3.43Å; W222-H230 WeakPolarHBondContact CH2-CD2 3.37Å; W222-H230 AromaticContact CH2-CG 3.96Å; W222-H230 AromaticContact CH2-NE2 3.87Å; W222-H230 HydrophobicContact CZ3-CB 3.87Å; W222-H230 AromaticContact CZ3-CD2 3.38Å; W222-H230 WeakPolarHBondContact CZ3-CD2 3.35Å; W222-H230 AromaticContact CZ3-CG 3.67Å; W222-L256 HydrophobicContact CH2-CB 4.38Å; W222-L256 HydrophobicContact CZ3-CB 4.44Å; W222-E257 HydrophobicContact CH2-CB 4.48Å; W222-E257 HydrophobicContact CH2-CG 3.78Å; W222-E257 HydrophobicContact CZ2-CG 4.05Å; W222-Y260 HydrophobicContact CB-CE1 4.45Å; W222-Y260 AromaticContact CD1-CD1 3.49Å; W222-Y260 VanDerWaalsContact CD1-CD1 3.49Å; W222-Y260 AromaticContact CD1-CE1 3.84Å; W222-Y260 AromaticContact CD1-CG 3.97Å; W222-Y260 HydrophobicContact CD2-CD1 4.16Å; W222-Y260 HydrophobicContact CD2-CD2 4.21Å; W222-Y260 HydrophobicContact CD2-CE1 4.16Å; W222-Y260 HydrophobicContact CD2-CE2 4.17Å; W222-Y260 HydrophobicContact CD2-CG 4.19Å; W222-Y260 AromaticContact CE2-CD1 3.77Å; W222-Y260 AromaticContact CE2-CD2 3.63Å; W222-Y260 AromaticContact CE2-CG 3.45Å; W222-Y260 VanDerWaalsContact CE2-CG 3.45Å; W222-Y260 HydrophobicContact CE3-CE2 4.36Å; W222-Y260 AromaticContact CG-CD1 3.98Å; W222-Y260 HydrophobicContact CG-CD1 3.98Å; W222-Y260 AromaticContact CG-CE1 3.9Å; W222-Y260 HydrophobicContact CG-CE1 3.9Å; W222-Y260 HydrophobicContact CG-CG 4.46Å; W222-Y260 HydrophobicContact CH2-CD2 4.03Å; W222-Y260 HydrophobicContact CH2-CE2 4.32Å; W222-Y260 HydrophobicContact CZ2-CD1 4.47Å; W222-Y260 AromaticContact CZ2-CD2 3.54Å; W222-Y260 HydrophobicContact CZ2-CD2 3.54Å; W222-Y260 HydrophobicContact CZ2-CE2 4.16Å; W222-Y260 AromaticContact CZ2-CG 3.71Å; W222-Y260 HydrophobicContact CZ2-CG 3.71Å; W222-Y260 HydrophobicContact CZ3-CE2 4.43Å; W222-Y260 AromaticContact NE1-CD1 3.34Å; W222-Y260 VanDerWaalsContact NE1-CD1 3.34Å; W222-Y260 AromaticContact NE1-CG 3.32Å; W222-Y260 VanDerWaalsContact NE1-CG 3.32Å; W222-I277 HydrophobicContact CB-CD1 3.6Å; W222-I277 HydrophobicContact CD2-CD1 4.33Å; W222-I277 HydrophobicContact CD2-CG2 4.09Å; W222-I277 HydrophobicContact CG-CB 4.45Å; W222-I277 HydrophobicContact CG-CD1 3.54Å; W222-I277 HydrophobicContact CG-CG2 4.22Å; W222-I277 HydrophobicContact CZ2-CG2 4.08Å; W222-I277 VanDerWaalsContact NE1-CG2 3.32Å |
| 223 | D | 82.2 | Confident | 66.9 | Low | 69 Ų | 69 | 75.7 Ų | 75.7 | 37% | 0.369 | 36% | 0.361 | S | S | . | . | P | Polyproline II helix | trans | -78.6 | 166.9 | 170.6 | 69.4 | 81.6 | 0 | 0 | 0 | 111.5 | E225 T226 L227 | D223-E225 VanDerWaalsContact C-N 3.32Å; D223-E225 PolarHBondContact O-N 3.17Å; D223-E225 PolarHBondContact OD1-N 3Å; D223-T226 VanDerWaalsContact CG-OG1 3.29Å; D223-T226 PolarHBondContact OD1-N 3.11Å; D223-T226 PolarHBondContact OD1-OG1 2.96Å; D223-T226 WeakPolarHBondContact OD2-CB 3.43Å; D223-T226 PolarHBondContact OD2-OG1 2.92Å; D223-L227 WeakPolarHBondContact O-CB 3.43Å; D223-L227 PolarHBondContact O-N 2.87Å |
| 224 | R | 78.5 | Confident | 68.6 | Low | 192 Ų | 192 | 73.4 Ų | 73.4 | 73% | 0.725 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -65.6 | -31.8 | -172.8 | -162.6 | 176.6 | -162 | -137 | 0.7 | 113.5 | K228 | R224-K228 WeakPolarHBondContact O-CD 3.38Å; R224-K228 WeakPolarHBondContact O-CG 3.43Å; R224-K228 PolarHBondContact O-N 2.98Å |
| 225 | E | 77.8 | Confident | 69.8 | Low | 97 Ų | 97 | 67.6 Ų | 67.6 | 45% | 0.453 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -84.4 | -38.5 | -176.8 | -52.7 | -49.6 | 119.3 | 0 | 0 | 110.8 | D223 L227 K228 L229 | D223-E225 VanDerWaalsContact C-N 3.32Å; D223-E225 PolarHBondContact O-N 3.17Å; D223-E225 PolarHBondContact OD1-N 3Å; E225-L227 VanDerWaalsContact C-N 3.29Å; E225-L227 PolarHBondContact O-N 2.83Å; E225-K228 PolarHBondContact O-N 3.26Å; E225-K228 IonicContact OE1-NZ 3.81Å; E225-K228 PolarHBondContact OE1-NZ 3.1Å; E225-K228 WeakPolarHBondContact OE2-CD 3.34Å; E225-K228 IonicContact OE2-NZ 3.94Å; E225-K228 PolarHBondContact OE2-NZ 3.35Å; E225-L229 WeakPolarHBondContact O-CB 3.04Å; E225-L229 WeakPolarHBondContact O-CG 3.49Å; E225-L229 PolarHBondContact O-N 2.8Å |
| 226 | T | 80.9 | Confident | 70.7 | Confident | 20 Ų | 20 | 67.9 Ų | 67.9 | 12% | 0.123 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.5 | -39.8 | 167.7 | -54.3 | 0 | 0 | 0 | 0 | 110.8 | W222 D223 H230 | W222-T226 HydrophobicContact CE3-CG2 3.5Å; W222-T226 VanDerWaalsContact CE3-CG2 3.5Å; W222-T226 HydrophobicContact CZ3-CG2 3.61Å; D223-T226 VanDerWaalsContact CG-OG1 3.29Å; D223-T226 PolarHBondContact OD1-N 3.11Å; D223-T226 PolarHBondContact OD1-OG1 2.96Å; D223-T226 WeakPolarHBondContact OD2-CB 3.43Å; D223-T226 PolarHBondContact OD2-OG1 2.92Å; T226-H230 WeakPolarHBondContact O-CB 3.17Å; T226-H230 PolarHBondContact O-N 2.94Å |
| 227 | L | 82.7 | Confident | 71.1 | Confident | 36 Ų | 36 | 68.7 Ų | 68.7 | 19% | 0.188 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.7 | -52.5 | 172.8 | -96.8 | 170.7 | 0 | 0 | 0 | 112.5 | W222 D223 E225 L229 H230 S231 P273 E274 I277 | W222-L227 HydrophobicContact CB-CD1 4.43Å; W222-L227 HydrophobicContact CB-CG 4.02Å; D223-L227 WeakPolarHBondContact O-CB 3.43Å; D223-L227 PolarHBondContact O-N 2.87Å; E225-L227 VanDerWaalsContact C-N 3.29Å; E225-L227 PolarHBondContact O-N 2.83Å; L227-L229 VanDerWaalsContact C-N 3.33Å; L227-L229 PolarHBondContact O-N 3.45Å; L227-H230 WeakPolarHBondContact O-CB 3.5Å; L227-H230 PolarHBondContact O-N 3.05Å; L227-S231 WeakPolarHBondContact O-CB 3.14Å; L227-S231 PolarHBondContact O-N 3.35Å; L227-P273 HydrophobicContact CD2-CB 4.06Å; L227-E274 HydrophobicContact CD2-CG 4.17Å; L227-I277 HydrophobicContact CD1-CD1 4.14Å; L227-I277 HydrophobicContact CD2-CD1 3.78Å; L227-I277 HydrophobicContact CG-CD1 4.15Å |
| 228 | K | 79.4 | Confident | 71.4 | Confident | 90 Ų | 90 | 67.8 Ų | 67.8 | 39% | 0.391 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -53.1 | -48.4 | 176 | -78.8 | 159.7 | 162.3 | 175.7 | 0 | 112.2 | R224 E225 H230 S231 W232 | R224-K228 WeakPolarHBondContact O-CD 3.38Å; R224-K228 WeakPolarHBondContact O-CG 3.43Å; R224-K228 PolarHBondContact O-N 2.98Å; E225-K228 PolarHBondContact O-N 3.26Å; E225-K228 IonicContact OE1-NZ 3.81Å; E225-K228 PolarHBondContact OE1-NZ 3.1Å; E225-K228 WeakPolarHBondContact OE2-CD 3.34Å; E225-K228 IonicContact OE2-NZ 3.94Å; E225-K228 PolarHBondContact OE2-NZ 3.35Å; K228-H230 VanDerWaalsContact C-N 3.33Å; K228-H230 PolarHBondContact O-N 2.66Å; K228-S231 PolarHBondContact O-N 3.06Å; K228-W232 WeakPolarHBondContact O-CB 3.18Å; K228-W232 PolarHBondContact O-N 2.72Å |
| 229 | L | 77.6 | Confident | 71.7 | Confident | 70 Ų | 70 | 68.2 Ų | 68.2 | 37% | 0.366 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -58.9 | -46.2 | 176.3 | -73.4 | 168.4 | 0 | 0 | 0 | 110.6 | E225 L227 S231 W232 F233 | E225-L229 WeakPolarHBondContact O-CB 3.04Å; E225-L229 WeakPolarHBondContact O-CG 3.49Å; E225-L229 PolarHBondContact O-N 2.8Å; L227-L229 VanDerWaalsContact C-N 3.33Å; L227-L229 PolarHBondContact O-N 3.45Å; L229-S231 VanDerWaalsContact C-N 3.34Å; L229-S231 PolarHBondContact O-N 2.81Å; L229-W232 PolarHBondContact O-N 3.36Å; L229-F233 WeakPolarHBondContact O-CD2 3.38Å; L229-F233 PolarHBondContact O-N 3.36Å |
| 230 | H | 82.4 | Confident | 72.2 | Confident | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -65.9 | -36.5 | -179.6 | -147.7 | -76.3 | 0 | 0 | 0 | 113.7 | W222 T226 L227 K228 N234 R253 L256 E257 P273 Y276 | W222-H230 AromaticContact CH2-CD2 3.43Å; W222-H230 VanDerWaalsContact CH2-CD2 3.43Å; W222-H230 WeakPolarHBondContact CH2-CD2 3.37Å; W222-H230 AromaticContact CH2-CG 3.96Å; W222-H230 AromaticContact CH2-NE2 3.87Å; W222-H230 HydrophobicContact CZ3-CB 3.87Å; W222-H230 AromaticContact CZ3-CD2 3.38Å; W222-H230 WeakPolarHBondContact CZ3-CD2 3.35Å; W222-H230 AromaticContact CZ3-CG 3.67Å; T226-H230 WeakPolarHBondContact O-CB 3.17Å; T226-H230 PolarHBondContact O-N 2.94Å; L227-H230 WeakPolarHBondContact O-CB 3.5Å; L227-H230 PolarHBondContact O-N 3.05Å; K228-H230 VanDerWaalsContact C-N 3.33Å; K228-H230 PolarHBondContact O-N 2.66Å; H230-N234 WeakPolarHBondContact O-CB 3.39Å; H230-N234 PolarHBondContact O-N 2.87Å; H230-R253 WeakPolarHBondContact CE1-CG 3.35Å; H230-R253 VanDerWaalsContact NE2-CG 3.32Å; H230-R253 WeakPolarHBondContact NE2-CG 3.34Å; H230-R253 PolarHBondContact NE2-O 3.32Å; H230-L256 VanDerWaalsContact CD2-CB 3.49Å; H230-L256 WeakPolarHBondContact CD2-CB 3.42Å; H230-E257 IonicContact CE1-OE1 2.76Å; H230-E257 PolarHBondContact CE1-OE1 3.47Å; H230-E257 VanDerWaalsContact CE1-OE1 3.25Å; H230-E257 VanDerWaalsContact NE2-CG 3.29Å; H230-E257 WeakPolarHBondContact NE2-CG 3.32Å; H230-E257 IonicContact NE2-OE1 3.81Å; H230-P273 HydrophobicContact CB-CB 4.33Å; H230-P273 HydrophobicContact CB-CG 4.14Å; H230-P273 VanDerWaalsContact ND1-CG 3.32Å; H230-P273 WeakPolarHBondContact ND1-CG 3.31Å; H230-Y276 PolarHBondContact CE1-OH 3.29Å; H230-Y276 PolarHBondContact ND1-OH 3.41Å |
| 231 | S | 79 | Confident | 72.3 | Confident | 14 Ų | 14 | 65.4 Ų | 65.4 | 10% | 0.098 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -66 | -44.7 | 173.6 | -152 | 0 | 0 | 0 | 0 | 109.9 | L227 K228 L229 N234 S235 E274 | L227-S231 WeakPolarHBondContact O-CB 3.14Å; L227-S231 PolarHBondContact O-N 3.35Å; K228-S231 PolarHBondContact O-N 3.06Å; L229-S231 VanDerWaalsContact C-N 3.34Å; L229-S231 PolarHBondContact O-N 2.81Å; S231-N234 PolarHBondContact O-N 2.93Å; S231-N234 VanDerWaalsContact O-N 3.13Å; S231-S235 WeakPolarHBondContact O-CB 3.42Å; S231-S235 PolarHBondContact O-N 3.47Å; S231-E274 WeakPolarHBondContact CB-OE1 3.35Å; S231-E274 PolarHBondContact OG-OE1 2.73Å |
| 232 | W | 75.8 | Confident | 72.4 | Confident | 52 Ų | 52 | 58.5 Ų | 58.5 | 20% | 0.197 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.4 | -46.8 | 174.7 | -175.5 | 89.3 | 0 | 0 | 0 | 112.8 | A191 K228 L229 N234 S235 F236 F249 | A191-W232 HydrophobicContact CB-CH2 3.27Å; A191-W232 HydrophobicContact CB-CZ2 3.54Å; A191-W232 HydrophobicContact CB-CZ3 4.17Å; K228-W232 WeakPolarHBondContact O-CB 3.18Å; K228-W232 PolarHBondContact O-N 2.72Å; L229-W232 PolarHBondContact O-N 3.36Å; W232-N234 PolarHBondContact O-N 3.04Å; W232-S235 PolarHBondContact O-N 2.64Å; W232-F236 HydrophobicContact CZ2-CD2 4.08Å; W232-F236 PolarHBondContact O-N 3.21Å; W232-F249 AromaticContact CH2-CE1 3.53Å; W232-F249 HydrophobicContact CH2-CE1 3.53Å; W232-F249 AromaticContact CH2-CZ 3.69Å; W232-F249 HydrophobicContact CH2-CZ 3.69Å; W232-F249 HydrophobicContact CZ3-CD1 4.45Å; W232-F249 AromaticContact CZ3-CE1 3.58Å; W232-F249 HydrophobicContact CZ3-CE1 3.58Å; W232-F249 HydrophobicContact CZ3-CZ 4.03Å |
| 233 | F | 75.9 | Confident | 72.2 | Confident | 2 Ų | 2 | 61.7 Ų | 61.7 | 1% | 0.009 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -66.5 | -13.7 | 175.8 | -82.6 | -74 | 0 | 0 | 0 | 114.4 | A195 I198 L229 F249 V252 L256 | A195-F233 HydrophobicContact CB-CE1 4.01Å; A195-F233 HydrophobicContact CB-CZ 4.01Å; I198-F233 HydrophobicContact CD1-CE2 3.77Å; I198-F233 HydrophobicContact CD1-CZ 4.21Å; L229-F233 WeakPolarHBondContact O-CD2 3.38Å; L229-F233 PolarHBondContact O-N 3.36Å; F233-F249 HydrophobicContact CD1-CB 4.36Å; F233-F249 AromaticContact CD1-CD1 3.54Å; F233-F249 HydrophobicContact CD1-CD1 3.54Å; F233-F249 AromaticContact CD1-CE1 3.96Å; F233-F249 HydrophobicContact CD1-CE1 3.96Å; F233-F249 AromaticContact CD1-CG 3.97Å; F233-F249 HydrophobicContact CD1-CG 3.97Å; F233-F249 HydrophobicContact CE1-CD1 4.06Å; F233-F249 HydrophobicContact CE1-CE1 4.16Å; F233-F249 HydrophobicContact CE1-CG 4.31Å; F233-V252 HydrophobicContact CD1-CB 4.07Å; F233-V252 HydrophobicContact CD1-CG1 3.87Å; F233-V252 HydrophobicContact CD2-CG1 3.85Å; F233-V252 HydrophobicContact CE1-CB 3.92Å; F233-V252 HydrophobicContact CE1-CG1 3.63Å; F233-V252 HydrophobicContact CE1-CG2 3.95Å; F233-V252 HydrophobicContact CE2-CG1 3.64Å; F233-V252 HydrophobicContact CG-CG1 4.02Å; F233-V252 HydrophobicContact CZ-CB 4.31Å; F233-V252 HydrophobicContact CZ-CG1 3.56Å; F233-V252 HydrophobicContact CZ-CG2 4.33Å; F233-L256 HydrophobicContact CD2-CD1 4.06Å |
| 234 | N | 72.7 | Confident | 71.9 | Confident | 27 Ų | 27 | 60.1 Ų | 60.1 | 14% | 0.144 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -101.6 | -38.6 | 174.3 | -92.2 | -27 | 0 | 0 | 0 | 113.5 | H230 S231 W232 F236 R253 P273 Y276 | H230-N234 WeakPolarHBondContact O-CB 3.39Å; H230-N234 PolarHBondContact O-N 2.87Å; S231-N234 PolarHBondContact O-N 2.93Å; S231-N234 VanDerWaalsContact O-N 3.13Å; W232-N234 PolarHBondContact O-N 3.04Å; N234-F236 VanDerWaalsContact C-N 3.29Å; N234-R253 WeakPolarHBondContact OD1-CD 3.47Å; N234-R253 PolarHBondContact OD1-NH1 3.25Å; N234-P273 WeakPolarHBondContact ND2-CD 3.36Å; N234-P273 VanDerWaalsContact ND2-CG 3.29Å; N234-P273 WeakPolarHBondContact ND2-CG 3.35Å; N234-Y276 PolarHBondContact ND2-OH 2.84Å |
| 235 | S | 65.4 | Low | 71.7 | Confident | 52 Ų | 52 | 51.5 Ų | 51.5 | 36% | 0.364 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -76.2 | -18.1 | -176 | -172.2 | 0 | 0 | 0 | 0 | 112.5 | S231 W232 C237 | S231-S235 WeakPolarHBondContact O-CB 3.42Å; S231-S235 PolarHBondContact O-N 3.47Å; W232-S235 PolarHBondContact O-N 2.64Å; S235-C237 VanDerWaalsContact C-N 3.29Å; S235-C237 PolarHBondContact O-N 3.25Å |
| 236 | F | 61.6 | Low | 71.7 | Confident | 80 Ų | 80 | 49.8 Ų | 49.8 | 35% | 0.351 | 27% | 0.272 | S | S | . | . | S | Bend | trans | -68.5 | 94.5 | 159.9 | -138.6 | -55.4 | 0 | 0 | 0 | 108.1 | W232 N234 L238 M241 F249 | W232-F236 HydrophobicContact CZ2-CD2 4.08Å; W232-F236 PolarHBondContact O-N 3.21Å; N234-F236 VanDerWaalsContact C-N 3.29Å; F236-L238 PolarHBondContact O-N 3.37Å; F236-M241 HydrophobicContact CD1-CE 3.56Å; F236-M241 HydrophobicContact CD1-CG 3.94Å; F236-M241 HydrophobicContact CD2-CE 4.11Å; F236-M241 HydrophobicContact CE1-CE 3.46Å; F236-M241 VanDerWaalsContact CE1-CE 3.46Å; F236-M241 HydrophobicContact CE1-CG 4.34Å; F236-M241 HydrophobicContact CE2-CE 4Å; F236-M241 HydrophobicContact CG-CE 3.91Å; F236-M241 HydrophobicContact CZ-CE 3.69Å; F236-F249 HydrophobicContact CB-CE1 4.3Å |
| 237 | C | 52.8 | Low | 71.7 | Confident | 71 Ų | 71 | 53.1 Ų | 53.1 | 48% | 0.48 | 29% | 0.286 | S | S | . | . | trans | -48.6 | 110.2 | -175.3 | -82.4 | 0 | 0 | 0 | 0 | 110.9 | S235 L239 E240 | S235-C237 VanDerWaalsContact C-N 3.29Å; S235-C237 PolarHBondContact O-N 3.25Å; C237-L239 PolarHBondContact O-N 2.75Å; C237-E240 PolarHBondContact O-N 3.31Å; C237-E240 VanDerWaalsContact O-N 3.08Å | ||
| 238 | L | 55.7 | Low | 71.6 | Confident | 24 Ų | 24 | 52.1 Ų | 52.1 | 13% | 0.126 | 28% | 0.281 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | 19.6 | -178.7 | -59.2 | 174 | 0 | 0 | 0 | 113.3 | F236 K246 F249 L250 | F236-L238 PolarHBondContact O-N 3.37Å; L238-K246 HydrophobicContact CB-CD 4.41Å; L238-K246 HydrophobicContact CB-CG 4.33Å; L238-K246 HydrophobicContact CD2-CG 4.42Å; L238-K246 WeakPolarHBondContact O-CD 3.44Å; L238-K246 WeakPolarHBondContact O-CE 3.24Å; L238-K246 PolarHBondContact O-NZ 3.18Å; L238-F249 HydrophobicContact CD2-CB 4.09Å; L238-L250 HydrophobicContact CD1-CD2 3.87Å; L238-L250 HydrophobicContact CD1-CG 4.29Å |
| 239 | L | 54.9 | Low | 71.6 | Confident | 109 Ų | 109 | 48 Ų | 48 | 57% | 0.571 | 26% | 0.263 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.3 | -33.9 | 175.1 | -60.8 | 174.4 | 0 | 0 | 0 | 111.2 | A148 F150 C237 | A148-L239 HydrophobicContact CB-CD1 3.97Å; F150-L239 HydrophobicContact CE1-CD2 4.05Å; F150-L239 HydrophobicContact CZ-CD1 4.43Å; F150-L239 HydrophobicContact CZ-CD2 3.7Å; F150-L239 HydrophobicContact CZ-CG 4.08Å; C237-L239 PolarHBondContact O-N 2.75Å |
| 240 | E | 63 | Low | 71.8 | Confident | 143 Ų | 143 | 46.6 Ų | 46.6 | 67% | 0.668 | 26% | 0.256 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.2 | -20.3 | 178.5 | -62.3 | 178.6 | 173.5 | 0 | 0 | 112.4 | C237 | C237-E240 PolarHBondContact O-N 3.31Å; C237-E240 VanDerWaalsContact O-N 3.08Å |
| 241 | M | 67.9 | Low | 71.9 | Confident | 19 Ų | 19 | 47 Ų | 47 | 9% | 0.094 | 26% | 0.259 | C | S | . | . | S | Bend | trans | -71.4 | 132.2 | 178.6 | -90.1 | -76.1 | 166.9 | 0 | 0 | 112.7 | L188 F236 L245 F249 | L188-M241 HydrophobicContact CD1-CE 4.44Å; F236-M241 HydrophobicContact CD1-CE 3.56Å; F236-M241 HydrophobicContact CD1-CG 3.94Å; F236-M241 HydrophobicContact CD2-CE 4.11Å; F236-M241 HydrophobicContact CE1-CE 3.46Å; F236-M241 VanDerWaalsContact CE1-CE 3.46Å; F236-M241 HydrophobicContact CE1-CG 4.34Å; F236-M241 HydrophobicContact CE2-CE 4Å; F236-M241 HydrophobicContact CG-CE 3.91Å; F236-M241 HydrophobicContact CZ-CE 3.69Å; M241-L245 HydrophobicContact SD-CB 3.65Å; M241-L245 HydrophobicContact SD-CD1 3.71Å; M241-L245 HydrophobicContact SD-CG 4.34Å; M241-F249 HydrophobicContact CE-CE1 4.41Å; M241-F249 HydrophobicContact CE-CE2 4.47Å; M241-F249 HydrophobicContact CE-CZ 4Å |
| 242 | P | 73.7 | Confident | 72.2 | Confident | 49 Ų | 49 | 46.3 Ų | 46.3 | 32% | 0.318 | 25% | 0.254 | S | S | . | . | trans | -48.5 | 141.3 | 168 | -29.1 | 35.2 | 0 | 0 | 0 | 112.4 | S244 L245 K246 | P242-S244 PolarHBondContact O-N 2.88Å; P242-L245 HydrophobicContact CG-CD1 4.37Å; P242-L245 PolarHBondContact O-N 2.83Å; P242-K246 PolarHBondContact O-N 3.37Å | ||
| 243 | A | 77 | Confident | 72.6 | Confident | 79 Ų | 79 | 45.6 Ų | 45.6 | 65% | 0.653 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -57.3 | -27.5 | -171.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q247 | A243-Q247 PolarHBondContact O-N 2.67Å |
| 244 | S | 74.5 | Confident | 73 | Confident | 36 Ų | 36 | 51 Ų | 51 | 25% | 0.252 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -69.8 | -53.4 | 173.1 | 47.1 | 0 | 0 | 0 | 0 | 112.8 | L43 P242 K246 Q247 I248 | L43-S244 WeakPolarHBondContact CD1-OG 3.48Å; P242-S244 PolarHBondContact O-N 2.88Å; S244-K246 PolarHBondContact O-N 2.87Å; S244-Q247 PolarHBondContact O-N 2.89Å; S244-Q247 VanDerWaalsContact O-N 3.1Å; S244-I248 PolarHBondContact O-N 2.78Å |
| 245 | L | 75.6 | Confident | 73.6 | Confident | 11 Ų | 11 | 51.6 Ų | 51.6 | 6% | 0.058 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.3 | -37.8 | 175.2 | -65.4 | -176.8 | 0 | 0 | 0 | 111.3 | L42 L46 M241 P242 Q247 I248 F249 | L42-L245 HydrophobicContact CD2-CD2 3.96Å; L46-L245 HydrophobicContact CD1-CD2 3.85Å; M241-L245 HydrophobicContact SD-CB 3.65Å; M241-L245 HydrophobicContact SD-CD1 3.71Å; M241-L245 HydrophobicContact SD-CG 4.34Å; P242-L245 HydrophobicContact CG-CD1 4.37Å; P242-L245 PolarHBondContact O-N 2.83Å; L245-Q247 VanDerWaalsContact C-N 3.3Å; L245-Q247 PolarHBondContact O-N 3.05Å; L245-I248 HydrophobicContact CD2-CD1 4.2Å; L245-I248 WeakPolarHBondContact O-CB 3.14Å; L245-I248 PolarHBondContact O-N 3.19Å; L245-F249 VanDerWaalsContact O-CD2 3.26Å; L245-F249 WeakPolarHBondContact O-CD2 3.2Å; L245-F249 PolarHBondContact O-N 3.45Å |
| 246 | K | 77.6 | Confident | 74.4 | Confident | 61 Ų | 61 | 50.2 Ų | 50.2 | 27% | 0.265 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -54.6 | -40.4 | 173.9 | -175.3 | 170.4 | -177.9 | 163.3 | 0 | 113 | L238 P242 S244 L250 | L238-K246 HydrophobicContact CB-CD 4.41Å; L238-K246 HydrophobicContact CB-CG 4.33Å; L238-K246 HydrophobicContact CD2-CG 4.42Å; L238-K246 WeakPolarHBondContact O-CD 3.44Å; L238-K246 WeakPolarHBondContact O-CE 3.24Å; L238-K246 PolarHBondContact O-NZ 3.18Å; P242-K246 PolarHBondContact O-N 3.37Å; S244-K246 PolarHBondContact O-N 2.87Å; K246-L250 HydrophobicContact CG-CD1 4.1Å; K246-L250 VanDerWaalsContact O-CB 3.29Å; K246-L250 WeakPolarHBondContact O-CB 3.41Å; K246-L250 WeakPolarHBondContact O-CD1 3.49Å; K246-L250 WeakPolarHBondContact O-CG 3.38Å; K246-L250 PolarHBondContact O-N 3.38Å |
| 247 | Q | 79.7 | Confident | 75.6 | Confident | 90 Ų | 90 | 47 Ų | 47 | 42% | 0.421 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -70.1 | -34 | 176.9 | -65.7 | -59.1 | -20.2 | 0 | 0 | 113 | A243 S244 L245 S251 | A243-Q247 PolarHBondContact O-N 2.67Å; S244-Q247 PolarHBondContact O-N 2.89Å; S244-Q247 VanDerWaalsContact O-N 3.1Å; L245-Q247 VanDerWaalsContact C-N 3.3Å; L245-Q247 PolarHBondContact O-N 3.05Å; Q247-S251 VanDerWaalsContact O-CB 3.31Å; Q247-S251 WeakPolarHBondContact O-CB 3.42Å; Q247-S251 PolarHBondContact O-N 3.11Å; Q247-S251 PolarHBondContact O-OG 2.92Å |
| 248 | I | 80.6 | Confident | 76.9 | Confident | 16 Ų | 16 | 48.9 Ų | 48.9 | 8% | 0.082 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.2 | -51 | 176.6 | -68.4 | 152.5 | 0 | 0 | 0 | 109.7 | L46 A195 L199 S244 L245 L250 S251 V252 | L46-I248 HydrophobicContact CB-CD1 3.92Å; L46-I248 HydrophobicContact CD1-CD1 3.62Å; L46-I248 HydrophobicContact CD2-CD1 3.86Å; L46-I248 HydrophobicContact CG-CD1 4Å; A195-I248 HydrophobicContact CB-CG2 4.33Å; L199-I248 HydrophobicContact CD1-CG2 3.89Å; S244-I248 PolarHBondContact O-N 2.78Å; L245-I248 HydrophobicContact CD2-CD1 4.2Å; L245-I248 WeakPolarHBondContact O-CB 3.14Å; L245-I248 PolarHBondContact O-N 3.19Å; I248-L250 VanDerWaalsContact C-N 3.35Å; I248-L250 PolarHBondContact O-N 3.13Å; I248-S251 CarbonylContact O-C 3.59Å; I248-S251 WeakPolarHBondContact O-CA 3.32Å; I248-S251 PolarHBondContact O-N 2.84Å; I248-V252 HydrophobicContact CG2-CG2 4.49Å; I248-V252 WeakPolarHBondContact O-CG2 3.48Å; I248-V252 PolarHBondContact O-N 3.27Å |
| 249 | F | 80 | Confident | 77.8 | Confident | 2 Ų | 2 | 48.7 Ų | 48.7 | 1% | 0.009 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.3 | -43.1 | 177.8 | -80.6 | -123.2 | 0 | 0 | 0 | 111.2 | W232 F233 F236 L238 M241 L245 S251 V252 R253 | W232-F249 AromaticContact CH2-CE1 3.53Å; W232-F249 HydrophobicContact CH2-CE1 3.53Å; W232-F249 AromaticContact CH2-CZ 3.69Å; W232-F249 HydrophobicContact CH2-CZ 3.69Å; W232-F249 HydrophobicContact CZ3-CD1 4.45Å; W232-F249 AromaticContact CZ3-CE1 3.58Å; W232-F249 HydrophobicContact CZ3-CE1 3.58Å; W232-F249 HydrophobicContact CZ3-CZ 4.03Å; F233-F249 HydrophobicContact CD1-CB 4.36Å; F233-F249 AromaticContact CD1-CD1 3.54Å; F233-F249 HydrophobicContact CD1-CD1 3.54Å; F233-F249 AromaticContact CD1-CE1 3.96Å; F233-F249 HydrophobicContact CD1-CE1 3.96Å; F233-F249 AromaticContact CD1-CG 3.97Å; F233-F249 HydrophobicContact CD1-CG 3.97Å; F233-F249 HydrophobicContact CE1-CD1 4.06Å; F233-F249 HydrophobicContact CE1-CE1 4.16Å; F233-F249 HydrophobicContact CE1-CG 4.31Å; F236-F249 HydrophobicContact CB-CE1 4.3Å; L238-F249 HydrophobicContact CD2-CB 4.09Å; M241-F249 HydrophobicContact CE-CE1 4.41Å; M241-F249 HydrophobicContact CE-CE2 4.47Å; M241-F249 HydrophobicContact CE-CZ 4Å; L245-F249 VanDerWaalsContact O-CD2 3.26Å; L245-F249 WeakPolarHBondContact O-CD2 3.2Å; L245-F249 PolarHBondContact O-N 3.45Å; F249-S251 VanDerWaalsContact C-N 3.25Å; F249-S251 PolarHBondContact O-N 3.31Å; F249-V252 PolarHBondContact O-N 2.82Å; F249-R253 VanDerWaalsContact O-CB 3.24Å; F249-R253 WeakPolarHBondContact O-CB 3.46Å; F249-R253 PolarHBondContact O-N 2.64Å |
| 250 | L | 81.6 | Confident | 79.1 | Confident | 42 Ų | 42 | 45.3 Ų | 45.3 | 22% | 0.22 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.3 | -28.6 | 173 | -75.3 | 171.1 | 0 | 0 | 0 | 113.7 | L238 K246 I248 R254 | L238-L250 HydrophobicContact CD1-CD2 3.87Å; L238-L250 HydrophobicContact CD1-CG 4.29Å; K246-L250 HydrophobicContact CG-CD1 4.1Å; K246-L250 VanDerWaalsContact O-CB 3.29Å; K246-L250 WeakPolarHBondContact O-CB 3.41Å; K246-L250 WeakPolarHBondContact O-CD1 3.49Å; K246-L250 WeakPolarHBondContact O-CG 3.38Å; K246-L250 PolarHBondContact O-N 3.38Å; I248-L250 VanDerWaalsContact C-N 3.35Å; I248-L250 PolarHBondContact O-N 3.13Å; L250-R254 WeakPolarHBondContact O-CB 3.15Å; L250-R254 PolarHBondContact O-N 3.2Å |
| 251 | S | 84.6 | Confident | 80.1 | Confident | 8 Ų | 8 | 40.6 Ų | 40.6 | 6% | 0.056 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -83.2 | -37.9 | 177.8 | -60.1 | 0 | 0 | 0 | 0 | 112.3 | Q247 I248 F249 R254 K255 | Q247-S251 VanDerWaalsContact O-CB 3.31Å; Q247-S251 WeakPolarHBondContact O-CB 3.42Å; Q247-S251 PolarHBondContact O-N 3.11Å; Q247-S251 PolarHBondContact O-OG 2.92Å; I248-S251 CarbonylContact O-C 3.59Å; I248-S251 WeakPolarHBondContact O-CA 3.32Å; I248-S251 PolarHBondContact O-N 2.84Å; F249-S251 VanDerWaalsContact C-N 3.25Å; F249-S251 PolarHBondContact O-N 3.31Å; S251-R254 PolarHBondContact OG-NH2 2.73Å; S251-K255 WeakPolarHBondContact O-CB 3.33Å; S251-K255 PolarHBondContact O-N 3.2Å; S251-K255 VanDerWaalsContact O-N 3.11Å |
| 252 | V | 85.3 | Confident | 81.2 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.2 | -50.6 | 168.6 | 176.2 | 0 | 0 | 0 | 0 | 109.8 | A195 I198 L199 F233 I248 F249 R254 K255 L256 | A195-V252 HydrophobicContact CB-CG2 3.59Å; I198-V252 HydrophobicContact CB-CG1 4.06Å; I198-V252 HydrophobicContact CD1-CG1 3.6Å; I198-V252 HydrophobicContact CG1-CG1 4.44Å; I198-V252 HydrophobicContact CG2-CG1 3.88Å; L199-V252 HydrophobicContact CD1-CG2 3.77Å; L199-V252 HydrophobicContact CD2-CG2 4.31Å; L199-V252 HydrophobicContact CG-CG2 3.76Å; F233-V252 HydrophobicContact CD1-CB 4.07Å; F233-V252 HydrophobicContact CD1-CG1 3.87Å; F233-V252 HydrophobicContact CD2-CG1 3.85Å; F233-V252 HydrophobicContact CE1-CB 3.92Å; F233-V252 HydrophobicContact CE1-CG1 3.63Å; F233-V252 HydrophobicContact CE1-CG2 3.95Å; F233-V252 HydrophobicContact CE2-CG1 3.64Å; F233-V252 HydrophobicContact CG-CG1 4.02Å; F233-V252 HydrophobicContact CZ-CB 4.31Å; F233-V252 HydrophobicContact CZ-CG1 3.56Å; F233-V252 HydrophobicContact CZ-CG2 4.33Å; I248-V252 HydrophobicContact CG2-CG2 4.49Å; I248-V252 WeakPolarHBondContact O-CG2 3.48Å; I248-V252 PolarHBondContact O-N 3.27Å; F249-V252 PolarHBondContact O-N 2.82Å; V252-R254 PolarHBondContact O-N 3.46Å; V252-K255 CarbonylContact O-C 3.45Å; V252-K255 PolarHBondContact O-N 3.13Å; V252-L256 HydrophobicContact CG1-CD1 4.1Å; V252-L256 HydrophobicContact CG1-CG 4.31Å; V252-L256 PolarHBondContact O-N 3.02Å |
| 253 | R | 85 | Confident | 82.2 | Confident | 37 Ų | 37 | 39 Ų | 39 | 14% | 0.14 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -52.9 | -55.6 | 178.7 | -164 | 178.1 | 71.5 | 171.1 | 3.9 | 111.5 | H230 N234 F249 K255 L256 E257 | H230-R253 WeakPolarHBondContact CE1-CG 3.35Å; H230-R253 VanDerWaalsContact NE2-CG 3.32Å; H230-R253 WeakPolarHBondContact NE2-CG 3.34Å; H230-R253 PolarHBondContact NE2-O 3.32Å; N234-R253 WeakPolarHBondContact OD1-CD 3.47Å; N234-R253 PolarHBondContact OD1-NH1 3.25Å; F249-R253 VanDerWaalsContact O-CB 3.24Å; F249-R253 WeakPolarHBondContact O-CB 3.46Å; F249-R253 PolarHBondContact O-N 2.64Å; R253-K255 PolarHBondContact O-N 3.11Å; R253-K255 VanDerWaalsContact O-N 3.13Å; R253-L256 PolarHBondContact O-N 2.89Å; R253-E257 VanDerWaalsContact O-CG 3.28Å; R253-E257 WeakPolarHBondContact O-CG 3.18Å; R253-E257 PolarHBondContact O-N 2.94Å |
| 254 | R | 84.2 | Confident | 82.8 | Confident | 114 Ų | 114 | 37.9 Ų | 37.9 | 43% | 0.43 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -51.9 | -38.4 | 175.9 | -169.2 | -163 | -44.2 | 139.2 | 16 | 112.5 | L250 S251 V252 E257 E258 | L250-R254 WeakPolarHBondContact O-CB 3.15Å; L250-R254 PolarHBondContact O-N 3.2Å; S251-R254 PolarHBondContact OG-NH2 2.73Å; V252-R254 PolarHBondContact O-N 3.46Å; R254-E257 CarbonylContact O-C 3.57Å; R254-E257 PolarHBondContact O-N 3.48Å; R254-E258 PolarHBondContact O-N 3.37Å |
| 255 | K | 84.4 | Confident | 83.8 | Confident | 41 Ų | 41 | 37.5 Ų | 37.5 | 18% | 0.178 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -82.7 | -29.8 | -176 | -167 | 171.8 | -175.8 | -162.5 | 0 | 114 | I198 L199 S201 S251 V252 R253 | I198-K255 HydrophobicContact CG2-CB 4.45Å; I198-K255 WeakPolarHBondContact O-CD 3.24Å; I198-K255 WeakPolarHBondContact O-CE 3.4Å; I198-K255 PolarHBondContact O-NZ 2.97Å; L199-K255 PolarHBondContact O-NZ 3.13Å; S201-K255 WeakPolarHBondContact O-CE 3.29Å; S201-K255 PolarHBondContact O-NZ 2.96Å; S251-K255 WeakPolarHBondContact O-CB 3.33Å; S251-K255 PolarHBondContact O-N 3.2Å; S251-K255 VanDerWaalsContact O-N 3.11Å; V252-K255 CarbonylContact O-C 3.45Å; V252-K255 PolarHBondContact O-N 3.13Å; R253-K255 PolarHBondContact O-N 3.11Å; R253-K255 VanDerWaalsContact O-N 3.13Å |
| 256 | L | 83.6 | Confident | 84.4 | Confident | 23 Ų | 23 | 37 Ų | 37 | 12% | 0.12 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.3 | -34.8 | 164.7 | -67.7 | 173 | 0 | 0 | 0 | 110.5 | I198 W222 H230 F233 V252 R253 Y260 | I198-L256 HydrophobicContact CD1-CD1 4.37Å; I198-L256 HydrophobicContact CD1-CD2 3.99Å; I198-L256 HydrophobicContact CD1-CG 4.4Å; I198-L256 HydrophobicContact CG1-CD2 4.24Å; I198-L256 HydrophobicContact CG2-CD2 3.95Å; I198-L256 HydrophobicContact CG2-CG 4.13Å; W222-L256 HydrophobicContact CH2-CB 4.38Å; W222-L256 HydrophobicContact CZ3-CB 4.44Å; H230-L256 VanDerWaalsContact CD2-CB 3.49Å; H230-L256 WeakPolarHBondContact CD2-CB 3.42Å; F233-L256 HydrophobicContact CD2-CD1 4.06Å; V252-L256 HydrophobicContact CG1-CD1 4.1Å; V252-L256 HydrophobicContact CG1-CG 4.31Å; V252-L256 PolarHBondContact O-N 3.02Å; R253-L256 PolarHBondContact O-N 2.89Å; L256-Y260 WeakPolarHBondContact O-CD2 2.93Å; L256-Y260 VanDerWaalsContact O-CE2 3.24Å; L256-Y260 WeakPolarHBondContact O-CE2 3.28Å |
| 257 | E | 85.7 | Confident | 84.9 | Confident | 11 Ų | 11 | 37.1 Ų | 37.1 | 5% | 0.051 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -82.9 | -19.1 | -178.7 | -66.4 | 163.7 | 140.7 | 0 | 0 | 114.9 | W222 H230 R253 R254 D259 Y260 L262 R267 Y276 | W222-E257 HydrophobicContact CH2-CB 4.48Å; W222-E257 HydrophobicContact CH2-CG 3.78Å; W222-E257 HydrophobicContact CZ2-CG 4.05Å; H230-E257 IonicContact CE1-OE1 2.76Å; H230-E257 PolarHBondContact CE1-OE1 3.47Å; H230-E257 VanDerWaalsContact CE1-OE1 3.25Å; H230-E257 VanDerWaalsContact NE2-CG 3.29Å; H230-E257 WeakPolarHBondContact NE2-CG 3.32Å; H230-E257 IonicContact NE2-OE1 3.81Å; R253-E257 VanDerWaalsContact O-CG 3.28Å; R253-E257 WeakPolarHBondContact O-CG 3.18Å; R253-E257 PolarHBondContact O-N 2.94Å; R254-E257 CarbonylContact O-C 3.57Å; R254-E257 PolarHBondContact O-N 3.48Å; E257-D259 PolarHBondContact O-N 2.82Å; E257-Y260 PolarHBondContact O-N 3.03Å; E257-Y260 VanDerWaalsContact O-N 3.09Å; E257-L262 HydrophobicContact CB-CD2 3.93Å; E257-L262 HydrophobicContact CG-CD2 3.89Å; E257-R267 VanDerWaalsContact OE1-CD 3.32Å; E257-R267 WeakPolarHBondContact OE1-CD 3.18Å; E257-R267 IonicContact OE1-CZ 3.96Å; E257-R267 IonicContact OE1-NE 2.6Å; E257-R267 PolarHBondContact OE1-NE 3.39Å; E257-R267 IonicContact OE1-NH2 2.78Å; E257-R267 IonicContact OE2-CZ 2.67Å; E257-R267 IonicContact OE2-NE 3.57Å; E257-R267 PolarHBondContact OE2-NE 3.02Å; E257-R267 IonicContact OE2-NH2 2.89Å; E257-R267 PolarHBondContact OE2-NH2 2.89Å; E257-Y276 WeakPolarHBondContact OE1-CE2 3.26Å; E257-Y276 PolarHBondContact OE1-OH 2.86Å |
| 258 | E | 81 | Confident | 85.2 | Confident | 112 Ų | 112 | 37.2 Ų | 37.2 | 52% | 0.523 | 18% | 0.182 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -49.6 | -28.5 | -171.1 | -101.5 | 175.4 | -148.9 | 0 | 0 | 115.2 | R254 | R254-E258 PolarHBondContact O-N 3.37Š|
| 259 | D | 74.7 | Confident | 85.4 | Confident | 20 Ų | 20 | 38.4 Ų | 38.4 | 11% | 0.107 | 19% | 0.189 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -109.4 | 2.2 | -168.2 | -138.5 | -11.8 | 0 | 0 | 0 | 113.2 | K204 H217 K220 E257 | K204-D259 WeakPolarHBondContact CB-OD2 3.49Å; H217-D259 IonicContact CE1-OD1 3.19Å; H217-D259 PolarHBondContact CE1-OD1 2.98Å; H217-D259 IonicContact ND1-OD1 3.25Å; H217-D259 PolarHBondContact ND1-OD1 3.3Å; K220-D259 WeakPolarHBondContact CD-O 3.25Å; K220-D259 IonicContact NZ-OD1 3.18Å; K220-D259 PolarHBondContact NZ-OD1 2.99Å; K220-D259 IonicContact NZ-OD2 3.16Å; K220-D259 PolarHBondContact NZ-OD2 2.92Å; E257-D259 PolarHBondContact O-N 2.82Å |
| 260 | Y | 80.6 | Confident | 85.5 | Confident | 37 Ų | 37 | 40.8 Ų | 40.8 | 15% | 0.145 | 21% | 0.214 | C | C | . | . | S | Bend | trans | -119.4 | 151.5 | -169.3 | -67.9 | -82.3 | 0 | 0 | 0 | 113.7 | K220 W222 L256 E257 | K220-Y260 HydrophobicContact CB-CD1 3.87Å; K220-Y260 HydrophobicContact CB-CE1 3.93Å; K220-Y260 VanDerWaalsContact O-CD1 3.25Å; K220-Y260 WeakPolarHBondContact O-CD1 3.43Å; W222-Y260 HydrophobicContact CB-CE1 4.45Å; W222-Y260 AromaticContact CD1-CD1 3.49Å; W222-Y260 VanDerWaalsContact CD1-CD1 3.49Å; W222-Y260 AromaticContact CD1-CE1 3.84Å; W222-Y260 AromaticContact CD1-CG 3.97Å; W222-Y260 HydrophobicContact CD2-CD1 4.16Å; W222-Y260 HydrophobicContact CD2-CD2 4.21Å; W222-Y260 HydrophobicContact CD2-CE1 4.16Å; W222-Y260 HydrophobicContact CD2-CE2 4.17Å; W222-Y260 HydrophobicContact CD2-CG 4.19Å; W222-Y260 AromaticContact CE2-CD1 3.77Å; W222-Y260 AromaticContact CE2-CD2 3.63Å; W222-Y260 AromaticContact CE2-CG 3.45Å; W222-Y260 VanDerWaalsContact CE2-CG 3.45Å; W222-Y260 HydrophobicContact CE3-CE2 4.36Å; W222-Y260 AromaticContact CG-CD1 3.98Å; W222-Y260 HydrophobicContact CG-CD1 3.98Å; W222-Y260 AromaticContact CG-CE1 3.9Å; W222-Y260 HydrophobicContact CG-CE1 3.9Å; W222-Y260 HydrophobicContact CG-CG 4.46Å; W222-Y260 HydrophobicContact CH2-CD2 4.03Å; W222-Y260 HydrophobicContact CH2-CE2 4.32Å; W222-Y260 HydrophobicContact CZ2-CD1 4.47Å; W222-Y260 AromaticContact CZ2-CD2 3.54Å; W222-Y260 HydrophobicContact CZ2-CD2 3.54Å; W222-Y260 HydrophobicContact CZ2-CE2 4.16Å; W222-Y260 AromaticContact CZ2-CG 3.71Å; W222-Y260 HydrophobicContact CZ2-CG 3.71Å; W222-Y260 HydrophobicContact CZ3-CE2 4.43Å; W222-Y260 AromaticContact NE1-CD1 3.34Å; W222-Y260 VanDerWaalsContact NE1-CD1 3.34Å; W222-Y260 AromaticContact NE1-CG 3.32Å; W222-Y260 VanDerWaalsContact NE1-CG 3.32Å; L256-Y260 WeakPolarHBondContact O-CD2 2.93Å; L256-Y260 VanDerWaalsContact O-CE2 3.24Å; L256-Y260 WeakPolarHBondContact O-CE2 3.28Å; E257-Y260 PolarHBondContact O-N 3.03Å; E257-Y260 VanDerWaalsContact O-N 3.09Å |
| 261 | V | 84.6 | Confident | 85.6 | Confident | 44 Ų | 44 | 41.4 Ų | 41.4 | 27% | 0.267 | 22% | 0.216 | S | C | . | . | trans | -86 | 136.6 | 168.3 | 169.1 | 0 | 0 | 0 | 0 | 109.5 | R218 E280 | R218-V261 HydrophobicContact CB-CG2 4.19Å; R218-V261 HydrophobicContact CG-CG2 4.25Å; V261-E280 VanDerWaalsContact CG1-CD 3.47Å; V261-E280 HydrophobicContact CG1-CG 3.31Å | ||
| 262 | L | 91 | Very high | 85.5 | Confident | 34 Ų | 34 | 44.2 Ų | 44.2 | 18% | 0.178 | 23% | 0.23 | C | C | . | . | trans | -158.5 | 162 | -177.1 | 60 | 80.5 | 0 | 0 | 0 | 112.9 | E257 A264 R267 Y276 H279 | E257-L262 HydrophobicContact CB-CD2 3.93Å; E257-L262 HydrophobicContact CG-CD2 3.89Å; L262-A264 PolarHBondContact O-N 3Å; L262-R267 HydrophobicContact CD1-CB 4.3Å; L262-Y276 HydrophobicContact CB-CD2 4.13Å; L262-Y276 HydrophobicContact CD2-CD2 4.36Å; L262-Y276 HydrophobicContact CD2-CE2 4.12Å; L262-H279 CarbonylContact C-O 3.47Å | ||
| 263 | C | 94.1 | Very high | 85.5 | Confident | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 23% | 0.23 | C | C | . | . | trans | -79.3 | 97.5 | 173.8 | -171.7 | 0 | 0 | 0 | 0 | 111.3 | F265 C266 R267 Y276 H279 | C263-F265 PolarHBondContact O-N 3.41Å; C263-F265 VanDerWaalsContact O-N 3.15Å; C263-C266 HydrophobicContact CB-CB 4.1Å; C263-C266 PolarHBondContact O-N 3.23Å; C263-C266 VanDerWaalsContact SG-SG 3.65Å; C263-R267 WeakPolarHBondContact O-CB 3.32Å; C263-R267 PolarHBondContact O-N 2.82Å; C263-Y276 WeakPolarHBondContact CB-O 3.34Å; C263-Y276 PolarHBondContact N-O 2.92Å; C263-H279 WeakPolarHBondContact CA-O 3.38Å; C263-H279 WeakPolarHBondContact CB-CD2 3.25Å; C263-H279 VanDerWaalsContact CB-NE2 3.34Å; C263-H279 WeakPolarHBondContact CB-NE2 3.32Å; C263-H279 WeakPolarHBondContact CB-O 3.29Å; C263-H279 PolarHBondContact N-O 3.06Å; C263-H279 VanDerWaalsContact SG-CD2 3.53Å; C263-H279 PolarHBondContact SG-NE2 3.37Å; C263-H279 VanDerWaalsContact SG-NE2 3.39Å | ||
| 264 | A | 91.4 | Very high | 85.4 | Confident | 56 Ų | 56 | 45.2 Ų | 45.2 | 46% | 0.463 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -57.1 | -28.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | L262 N268 V281 | L262-A264 PolarHBondContact O-N 3Å; A264-N268 WeakPolarHBondContact O-CB 3.21Å; A264-N268 PolarHBondContact O-N 2.71Å; A264-V281 HydrophobicContact CB-CG2 4.08Å |
| 265 | F | 93.6 | Very high | 85.5 | Confident | 29 Ų | 29 | 42.3 Ų | 42.3 | 13% | 0.127 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -69.1 | -55.6 | 177.2 | -177 | -107.6 | 0 | 0 | 0 | 111.9 | C263 R267 N268 N269 V281 V292 L293 T310 | C263-F265 PolarHBondContact O-N 3.41Å; C263-F265 VanDerWaalsContact O-N 3.15Å; F265-R267 VanDerWaalsContact C-N 3.34Å; F265-R267 PolarHBondContact O-N 3.3Å; F265-N268 PolarHBondContact O-N 2.71Å; F265-N268 VanDerWaalsContact O-N 3.16Å; F265-N269 VanDerWaalsContact CE1-ND2 3.31Å; F265-N269 WeakPolarHBondContact CE1-ND2 3.24Å; F265-N269 WeakPolarHBondContact CZ-ND2 2.9Å; F265-N269 PolarHBondContact O-N 3.32Å; F265-V281 HydrophobicContact CB-CG1 4.4Å; F265-V281 HydrophobicContact CB-CG2 4.19Å; F265-V292 HydrophobicContact CD1-CB 4.49Å; F265-V292 HydrophobicContact CE1-CB 4.24Å; F265-V292 HydrophobicContact CE1-CG1 3.94Å; F265-L293 HydrophobicContact CD1-CB 3.95Å; F265-L293 HydrophobicContact CE1-CB 3.89Å; F265-L293 HydrophobicContact CE1-CD1 4.17Å; F265-L293 HydrophobicContact CE2-CD1 4.21Å; F265-L293 HydrophobicContact CZ-CD1 3.92Å; F265-T310 HydrophobicContact CE2-CG2 3.82Å; F265-T310 HydrophobicContact CZ-CG2 4.32Å |
| 266 | C | 90.1 | Very high | 85.8 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.3 | -43.1 | 176.9 | -65.6 | 0 | 0 | 0 | 0 | 111.7 | C263 N268 N269 G270 E271 H279 C290 | C263-C266 HydrophobicContact CB-CB 4.1Å; C263-C266 PolarHBondContact O-N 3.23Å; C263-C266 VanDerWaalsContact SG-SG 3.65Å; C266-N268 VanDerWaalsContact C-N 3.33Å; C266-N268 PolarHBondContact O-N 2.91Å; C266-N269 CarbonylContact O-C 3.59Å; C266-N269 WeakPolarHBondContact O-CA 3.43Å; C266-N269 PolarHBondContact O-N 2.93Å; C266-N269 VanDerWaalsContact O-N 3.08Å; C266-G270 PolarHBondContact O-N 3.28Å; C266-E271 HydrophobicContact CB-CB 4.04Å; C266-E271 HydrophobicContact CB-CG 3.88Å; C266-E271 WeakPolarHBondContact O-CB 3.24Å; C266-E271 WeakPolarHBondContact O-CG 3.18Å; C266-E271 PolarHBondContact O-N 3Å; C266-E271 VanDerWaalsContact O-N 3.11Å; C266-H279 PolarHBondContact SG-NE2 3.28Å; C266-C290 PolarHBondContact SG-SG 3.3Å |
| 267 | R | 87.9 | Confident | 86 | Confident | 64 Ų | 64 | 41 Ų | 41 | 24% | 0.242 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59.3 | -39.9 | 174.4 | -179.2 | -177.7 | 172.8 | -88.5 | 7.4 | 112.9 | E257 L262 C263 F265 N269 G270 Y276 | E257-R267 VanDerWaalsContact OE1-CD 3.32Å; E257-R267 WeakPolarHBondContact OE1-CD 3.18Å; E257-R267 IonicContact OE1-CZ 3.96Å; E257-R267 IonicContact OE1-NE 2.6Å; E257-R267 PolarHBondContact OE1-NE 3.39Å; E257-R267 IonicContact OE1-NH2 2.78Å; E257-R267 IonicContact OE2-CZ 2.67Å; E257-R267 IonicContact OE2-NE 3.57Å; E257-R267 PolarHBondContact OE2-NE 3.02Å; E257-R267 IonicContact OE2-NH2 2.89Å; E257-R267 PolarHBondContact OE2-NH2 2.89Å; L262-R267 HydrophobicContact CD1-CB 4.3Å; C263-R267 WeakPolarHBondContact O-CB 3.32Å; C263-R267 PolarHBondContact O-N 2.82Å; F265-R267 VanDerWaalsContact C-N 3.34Å; F265-R267 PolarHBondContact O-N 3.3Å; R267-N269 VanDerWaalsContact C-N 3.33Å; R267-G270 PolarHBondContact O-N 3.16Å; R267-Y276 HydrophobicContact CB-CD1 3.95Å; R267-Y276 HydrophobicContact CB-CD2 3.95Å; R267-Y276 HydrophobicContact CB-CE1 4.12Å; R267-Y276 HydrophobicContact CB-CE2 4.11Å; R267-Y276 HydrophobicContact CB-CG 3.84Å; R267-Y276 HydrophobicContact CG-CD1 4.4Å; R267-Y276 HydrophobicContact CG-CD2 4.34Å; R267-Y276 HydrophobicContact CG-CE1 4.06Å; R267-Y276 HydrophobicContact CG-CE2 3.98Å |
| 268 | N | 86.3 | Confident | 86.2 | Confident | 92 Ų | 92 | 44.1 Ų | 44.1 | 49% | 0.492 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -71.4 | -30.1 | 175.8 | -170.3 | 88.4 | 0 | 0 | 0 | 111.9 | N152 A264 F265 C266 G270 | N152-N268 PolarHBondContact ND2-O 2.66Å; A264-N268 WeakPolarHBondContact O-CB 3.21Å; A264-N268 PolarHBondContact O-N 2.71Å; F265-N268 PolarHBondContact O-N 2.71Å; F265-N268 VanDerWaalsContact O-N 3.16Å; C266-N268 VanDerWaalsContact C-N 3.33Å; C266-N268 PolarHBondContact O-N 2.91Å; N268-G270 PolarHBondContact O-N 3.11Å |
| 269 | N | 84.6 | Confident | 86.7 | Confident | 41 Ų | 41 | 40.1 Ų | 40.1 | 22% | 0.219 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.4 | -2 | 174.2 | -68 | -11.7 | 0 | 0 | 0 | 114.3 | N152 F265 C266 R267 E271 | N152-N269 WeakPolarHBondContact ND2-CA 3.28Å; N152-N269 PolarHBondContact ND2-OD1 3.11Å; F265-N269 VanDerWaalsContact CE1-ND2 3.31Å; F265-N269 WeakPolarHBondContact CE1-ND2 3.24Å; F265-N269 WeakPolarHBondContact CZ-ND2 2.9Å; F265-N269 PolarHBondContact O-N 3.32Å; C266-N269 CarbonylContact O-C 3.59Å; C266-N269 WeakPolarHBondContact O-CA 3.43Å; C266-N269 PolarHBondContact O-N 2.93Å; C266-N269 VanDerWaalsContact O-N 3.08Å; R267-N269 VanDerWaalsContact C-N 3.33Å; N269-E271 VanDerWaalsContact C-N 3.29Å; N269-E271 HydrophobicContact CB-CG 4.38Å |
| 270 | G | 82.4 | Confident | 87.6 | Confident | 52 Ų | 52 | 42.6 Ų | 42.6 | 54% | 0.536 | 24% | 0.235 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 75.9 | 17 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | C266 R267 N268 | C266-G270 PolarHBondContact O-N 3.28Å; R267-G270 PolarHBondContact O-N 3.16Å; N268-G270 PolarHBondContact O-N 3.11Å |
| 271 | E | 83.4 | Confident | 88.3 | Confident | 55 Ų | 55 | 42.7 Ų | 42.7 | 26% | 0.257 | 24% | 0.24 | S | C | . | . | trans | -60.5 | 157.2 | 170.6 | -60.2 | -63.8 | 168.6 | 0 | 0 | 110.6 | C266 N269 I275 Y276 | C266-E271 HydrophobicContact CB-CB 4.04Å; C266-E271 HydrophobicContact CB-CG 3.88Å; C266-E271 WeakPolarHBondContact O-CB 3.24Å; C266-E271 WeakPolarHBondContact O-CG 3.18Å; C266-E271 PolarHBondContact O-N 3Å; C266-E271 VanDerWaalsContact O-N 3.11Å; N269-E271 VanDerWaalsContact C-N 3.29Å; N269-E271 HydrophobicContact CB-CG 4.38Å; E271-I275 HydrophobicContact CB-CB 4.28Å; E271-I275 HydrophobicContact CB-CD1 4.33Å; E271-I275 HydrophobicContact CB-CG2 4.26Å; E271-I275 WeakPolarHBondContact OE2-CD1 3.5Å; E271-Y276 WeakPolarHBondContact O-CD1 3.39Å; E271-Y276 WeakPolarHBondContact O-CE1 3.46Å | ||
| 272 | L | 82.8 | Confident | 88.7 | Confident | 66 Ų | 66 | 46.4 Ų | 46.4 | 35% | 0.346 | 25% | 0.249 | S | C | . | . | trans | -69 | 152.9 | 179.2 | -67 | 176.1 | 0 | 0 | 0 | 112.2 | E274 I275 Y276 | L272-E274 PolarHBondContact O-N 3.08Å; L272-I275 HydrophobicContact CB-CD1 4.41Å; L272-I275 WeakPolarHBondContact O-CA 3.37Å; L272-I275 WeakPolarHBondContact O-CB 3.31Å; L272-I275 PolarHBondContact O-N 2.85Å; L272-Y276 WeakPolarHBondContact O-CD1 3.29Å; L272-Y276 PolarHBondContact O-N 2.94Å; L272-Y276 VanDerWaalsContact O-N 3.09Å | ||
| 273 | P | 84 | Confident | 88.9 | Confident | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -49.6 | -46.3 | 175.6 | -28.3 | 36.2 | 0 | 0 | 0 | 112.7 | L227 H230 N234 I275 Y276 I277 | L227-P273 HydrophobicContact CD2-CB 4.06Å; H230-P273 HydrophobicContact CB-CB 4.33Å; H230-P273 HydrophobicContact CB-CG 4.14Å; H230-P273 VanDerWaalsContact ND1-CG 3.32Å; H230-P273 WeakPolarHBondContact ND1-CG 3.31Å; N234-P273 WeakPolarHBondContact ND2-CD 3.36Å; N234-P273 VanDerWaalsContact ND2-CG 3.29Å; N234-P273 WeakPolarHBondContact ND2-CG 3.35Å; P273-I275 CarbonylContact O-C 3.59Å; P273-I275 PolarHBondContact O-N 3.48Å; P273-Y276 HydrophobicContact CB-CE1 4.48Å; P273-Y276 HydrophobicContact CG-CE1 4.31Å; P273-Y276 PolarHBondContact O-N 3.35Å; P273-Y276 VanDerWaalsContact O-N 3.09Å; P273-I277 WeakPolarHBondContact O-CG1 3.11Å; P273-I277 WeakPolarHBondContact O-CG2 3.33Å; P273-I277 PolarHBondContact O-N 3.22Å |
| 274 | E | 83.3 | Confident | 88.8 | Confident | 58 Ų | 58 | 54.2 Ų | 54.2 | 27% | 0.271 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -55.3 | -23.3 | 178.9 | -64.4 | 74.4 | -166.2 | 0 | 0 | 112.9 | L227 S231 L272 T278 | L227-E274 HydrophobicContact CD2-CG 4.17Å; S231-E274 WeakPolarHBondContact CB-OE1 3.35Å; S231-E274 PolarHBondContact OG-OE1 2.73Å; L272-E274 PolarHBondContact O-N 3.08Å; E274-T278 VanDerWaalsContact O-CG2 3.24Å; E274-T278 WeakPolarHBondContact O-CG2 3.36Å |
| 275 | I | 86.5 | Confident | 88.9 | Confident | 53 Ų | 53 | 57.1 Ų | 57.1 | 27% | 0.272 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -88.9 | -56 | 172.5 | -58.7 | 172.3 | 0 | 0 | 0 | 109.9 | E271 L272 P273 I277 T278 H279 | E271-I275 HydrophobicContact CB-CB 4.28Å; E271-I275 HydrophobicContact CB-CD1 4.33Å; E271-I275 HydrophobicContact CB-CG2 4.26Å; E271-I275 WeakPolarHBondContact OE2-CD1 3.5Å; L272-I275 HydrophobicContact CB-CD1 4.41Å; L272-I275 WeakPolarHBondContact O-CA 3.37Å; L272-I275 WeakPolarHBondContact O-CB 3.31Å; L272-I275 PolarHBondContact O-N 2.85Å; P273-I275 CarbonylContact O-C 3.59Å; P273-I275 PolarHBondContact O-N 3.48Å; I275-I277 PolarHBondContact O-N 3.2Å; I275-T278 PolarHBondContact O-N 3.45Å; I275-T278 PolarHBondContact O-OG1 2.9Å; I275-H279 PolarHBondContact O-CE1 2.7Å; I275-H279 PolarHBondContact O-ND1 2.98Å |
| 276 | Y | 89.6 | Confident | 88.9 | Confident | 1 Ų | 1 | 57.7 Ų | 57.7 | 0% | 0.004 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -77.5 | -13.3 | -167.4 | 66.4 | -113.7 | 0 | 0 | 0 | 115.6 | H230 N234 E257 L262 C263 R267 E271 L272 P273 T278 | H230-Y276 PolarHBondContact CE1-OH 3.29Å; H230-Y276 PolarHBondContact ND1-OH 3.41Å; N234-Y276 PolarHBondContact ND2-OH 2.84Å; E257-Y276 WeakPolarHBondContact OE1-CE2 3.26Å; E257-Y276 PolarHBondContact OE1-OH 2.86Å; L262-Y276 HydrophobicContact CB-CD2 4.13Å; L262-Y276 HydrophobicContact CD2-CD2 4.36Å; L262-Y276 HydrophobicContact CD2-CE2 4.12Å; C263-Y276 WeakPolarHBondContact CB-O 3.34Å; C263-Y276 PolarHBondContact N-O 2.92Å; R267-Y276 HydrophobicContact CB-CD1 3.95Å; R267-Y276 HydrophobicContact CB-CD2 3.95Å; R267-Y276 HydrophobicContact CB-CE1 4.12Å; R267-Y276 HydrophobicContact CB-CE2 4.11Å; R267-Y276 HydrophobicContact CB-CG 3.84Å; R267-Y276 HydrophobicContact CG-CD1 4.4Å; R267-Y276 HydrophobicContact CG-CD2 4.34Å; R267-Y276 HydrophobicContact CG-CE1 4.06Å; R267-Y276 HydrophobicContact CG-CE2 3.98Å; E271-Y276 WeakPolarHBondContact O-CD1 3.39Å; E271-Y276 WeakPolarHBondContact O-CE1 3.46Å; L272-Y276 WeakPolarHBondContact O-CD1 3.29Å; L272-Y276 PolarHBondContact O-N 2.94Å; L272-Y276 VanDerWaalsContact O-N 3.09Å; P273-Y276 HydrophobicContact CB-CE1 4.48Å; P273-Y276 HydrophobicContact CG-CE1 4.31Å; P273-Y276 PolarHBondContact O-N 3.35Å; P273-Y276 VanDerWaalsContact O-N 3.09Å; Y276-T278 VanDerWaalsContact C-N 3.33Å |
| 277 | I | 88.4 | Confident | 89.2 | Confident | 36 Ų | 36 | 62.6 Ų | 62.6 | 19% | 0.185 | 33% | 0.326 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.2 | -7.8 | 173.3 | 72.5 | 162.2 | 0 | 0 | 0 | 113.7 | W222 L227 P273 I275 | W222-I277 HydrophobicContact CB-CD1 3.6Å; W222-I277 HydrophobicContact CD2-CD1 4.33Å; W222-I277 HydrophobicContact CD2-CG2 4.09Å; W222-I277 HydrophobicContact CG-CB 4.45Å; W222-I277 HydrophobicContact CG-CD1 3.54Å; W222-I277 HydrophobicContact CG-CG2 4.22Å; W222-I277 HydrophobicContact CZ2-CG2 4.08Å; W222-I277 VanDerWaalsContact NE1-CG2 3.32Å; L227-I277 HydrophobicContact CD1-CD1 4.14Å; L227-I277 HydrophobicContact CD2-CD1 3.78Å; L227-I277 HydrophobicContact CG-CD1 4.15Å; P273-I277 WeakPolarHBondContact O-CG1 3.11Å; P273-I277 WeakPolarHBondContact O-CG2 3.33Å; P273-I277 PolarHBondContact O-N 3.22Å; I275-I277 PolarHBondContact O-N 3.2Å |
| 278 | T | 89 | Confident | 89.6 | Confident | 76 Ų | 76 | 59.5 Ų | 59.5 | 47% | 0.466 | 31% | 0.314 | S | S | . | . | S | Bend | trans | -81.7 | -15.4 | -172.1 | 60.5 | 0 | 0 | 0 | 0 | 114 | E274 I275 Y276 | E274-T278 VanDerWaalsContact O-CG2 3.24Å; E274-T278 WeakPolarHBondContact O-CG2 3.36Å; I275-T278 PolarHBondContact O-N 3.45Å; I275-T278 PolarHBondContact O-OG1 2.9Å; Y276-T278 VanDerWaalsContact C-N 3.33Å |
| 279 | H | 92.3 | Very high | 90.1 | Very high | 29 Ų | 29 | 57.6 Ų | 57.6 | 13% | 0.134 | 31% | 0.306 | C | S | . | . | trans | -152.9 | 159.3 | -172.5 | 54.4 | -84.8 | 0 | 0 | 0 | 112.1 | L262 C263 C266 I275 | L262-H279 CarbonylContact C-O 3.47Å; C263-H279 WeakPolarHBondContact CA-O 3.38Å; C263-H279 WeakPolarHBondContact CB-CD2 3.25Å; C263-H279 VanDerWaalsContact CB-NE2 3.34Å; C263-H279 WeakPolarHBondContact CB-NE2 3.32Å; C263-H279 WeakPolarHBondContact CB-O 3.29Å; C263-H279 PolarHBondContact N-O 3.06Å; C263-H279 VanDerWaalsContact SG-CD2 3.53Å; C263-H279 PolarHBondContact SG-NE2 3.37Å; C263-H279 VanDerWaalsContact SG-NE2 3.39Å; C266-H279 PolarHBondContact SG-NE2 3.28Å; I275-H279 PolarHBondContact O-CE1 2.7Å; I275-H279 PolarHBondContact O-ND1 2.98Å | ||
| 280 | E | 93.3 | Very high | 90.7 | Very high | 71 Ų | 71 | 55.7 Ų | 55.7 | 33% | 0.332 | 30% | 0.296 | S | S | . | . | trans | -84.5 | 172.5 | 165.3 | -65.6 | -160.7 | -124.6 | 0 | 0 | 110.8 | R218 V261 R282 T289 | R218-E280 IonicContact NH1-OE1 2.82Å; V261-E280 VanDerWaalsContact CG1-CD 3.47Å; V261-E280 HydrophobicContact CG1-CG 3.31Å; E280-R282 WeakPolarHBondContact CB-O 3.41Å; E280-T289 PolarHBondContact O-OG1 2.83Å; E280-T289 VanDerWaalsContact O-OG1 3.09Å | ||
| 281 | V | 95.1 | Very high | 91.3 | Very high | 40 Ų | 40 | 54.5 Ų | 54.5 | 24% | 0.242 | 28% | 0.279 | C | S | . | . | S | Bend | trans | -71.8 | -39.8 | 170.6 | -175.5 | 0 | 0 | 0 | 0 | 110.5 | A264 F265 V288 T289 C290 L293 | A264-V281 HydrophobicContact CB-CG2 4.08Å; F265-V281 HydrophobicContact CB-CG1 4.4Å; F265-V281 HydrophobicContact CB-CG2 4.19Å; V281-V288 WeakPolarHBondContact O-CA 3.31Å; V281-T289 PolarHBondContact O-N 3.11Å; V281-T289 VanDerWaalsContact O-N 3.13Å; V281-C290 PolarHBondContact O-N 2.86Å; V281-L293 HydrophobicContact CG1-CD2 4.12Å |
| 282 | R | 94.7 | Very high | 91.8 | Very high | 122 Ų | 122 | 52.5 Ų | 52.5 | 46% | 0.46 | 27% | 0.27 | S | S | . | . | B | Isolated β-bridge | trans | -138.6 | 156.9 | 178.6 | -74.6 | 172.6 | 175.5 | 159.3 | 1.7 | 109.8 | E280 G286 R287 V288 T289 | E280-R282 WeakPolarHBondContact CB-O 3.41Å; R282-G286 VanDerWaalsContact CD-O 3.27Å; R282-G286 WeakPolarHBondContact CD-O 3.45Å; R282-R287 CarbonylContact C-O 3.56Å; R282-R287 WeakPolarHBondContact CA-O 3.37Å; R282-R287 WeakPolarHBondContact CB-O 3.39Å; R282-V288 HydrophobicContact CG-CG2 4.05Å; R282-T289 WeakPolarHBondContact CA-OG1 3.44Å; R282-T289 PolarHBondContact N-OG1 3.02Å |
| 283 | D | 93.8 | Very high | 92.4 | Very high | 44 Ų | 44 | 49.9 Ų | 49.9 | 24% | 0.235 | 26% | 0.256 | C | S | . | . | trans | -83.8 | -171.8 | 170.2 | 64.5 | 20.2 | 0 | 0 | 0 | 112.7 | D285 G286 R287 T289 | D283-D285 VanDerWaalsContact C-N 3.25Å; D283-D285 PolarHBondContact O-N 2.72Å; D283-D285 WeakPolarHBondContact OD1-CA 3.46Å; D283-D285 PolarHBondContact OD1-N 2.85Å; D283-G286 PolarHBondContact O-N 3.45Å; D283-G286 PolarHBondContact OD1-N 2.74Å; D283-R287 PolarHBondContact N-O 3.1Å; D283-R287 PolarHBondContact OD1-N 3.29Å; D283-R287 IonicContact OD1-NE 3.19Å; D283-R287 IonicContact OD2-CZ 2.66Å; D283-R287 IonicContact OD2-NE 2.72Å; D283-R287 PolarHBondContact OD2-NE 3.22Å; D283-R287 IonicContact OD2-NH2 3.19Å; D283-R287 PolarHBondContact OD2-NH2 2.92Å; D283-T289 HydrophobicContact CB-CG2 3.75Å | ||
| 284 | Q | 92.3 | Very high | 93 | Very high | 153 Ų | 153 | 54.1 Ų | 54.1 | 72% | 0.715 | 27% | 0.272 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -20 | 179.9 | -56.9 | -168.7 | 83 | 0 | 0 | 113.3 | G286 | Q284-G286 VanDerWaalsContact C-N 3.32Š|
| 285 | D | 94.2 | Very high | 93.5 | Very high | 118 Ų | 118 | 54.4 Ų | 54.4 | 63% | 0.631 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | 0.6 | 176.9 | -55.4 | -28.9 | 0 | 0 | 0 | 111.3 | D283 R287 | D283-D285 VanDerWaalsContact C-N 3.25Å; D283-D285 PolarHBondContact O-N 2.72Å; D283-D285 WeakPolarHBondContact OD1-CA 3.46Å; D283-D285 PolarHBondContact OD1-N 2.85Å; D285-R287 VanDerWaalsContact C-N 3.35Å; D285-R287 IonicContact OD2-CZ 2.72Å; D285-R287 IonicContact OD2-NH1 2.66Å; D285-R287 PolarHBondContact OD2-NH1 2.76Å; D285-R287 IonicContact OD2-NH2 2.69Å; D285-R287 PolarHBondContact OD2-NH2 3.09Å |
| 286 | G | 93.1 | Very high | 93.8 | Very high | 40 Ų | 40 | 52.8 Ų | 52.8 | 41% | 0.412 | 27% | 0.27 | S | S | . | . | S | Bend | trans | 83.6 | 0 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | R282 D283 Q284 | R282-G286 VanDerWaalsContact CD-O 3.27Å; R282-G286 WeakPolarHBondContact CD-O 3.45Å; D283-G286 PolarHBondContact O-N 3.45Å; D283-G286 PolarHBondContact OD1-N 2.74Å; Q284-G286 VanDerWaalsContact C-N 3.32Å |
| 287 | R | 96.2 | Very high | 94 | Very high | 103 Ų | 103 | 55.3 Ų | 55.3 | 39% | 0.389 | 29% | 0.287 | S | S | . | . | trans | -71.4 | 141.8 | 177.5 | -58.5 | 176.1 | -64.9 | -121.5 | -8.7 | 110 | R282 D283 D285 T289 D306 | R282-R287 CarbonylContact C-O 3.56Å; R282-R287 WeakPolarHBondContact CA-O 3.37Å; R282-R287 WeakPolarHBondContact CB-O 3.39Å; D283-R287 PolarHBondContact N-O 3.1Å; D283-R287 PolarHBondContact OD1-N 3.29Å; D283-R287 IonicContact OD1-NE 3.19Å; D283-R287 IonicContact OD2-CZ 2.66Å; D283-R287 IonicContact OD2-NE 2.72Å; D283-R287 PolarHBondContact OD2-NE 3.22Å; D283-R287 IonicContact OD2-NH2 3.19Å; D283-R287 PolarHBondContact OD2-NH2 2.92Å; D285-R287 VanDerWaalsContact C-N 3.35Å; D285-R287 IonicContact OD2-CZ 2.72Å; D285-R287 IonicContact OD2-NH1 2.66Å; D285-R287 PolarHBondContact OD2-NH1 2.76Å; D285-R287 IonicContact OD2-NH2 2.69Å; D285-R287 PolarHBondContact OD2-NH2 3.09Å; R287-T289 PolarHBondContact O-N 3.29Å; R287-D306 HydrophobicContact CB-CB 4.21Å; R287-D306 VanDerWaalsContact CD-OD2 3.31Å; R287-D306 WeakPolarHBondContact CD-OD2 3.49Å; R287-D306 HydrophobicContact CG-CB 4.32Å | ||
| 288 | V | 97 | Very high | 94.3 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 28% | 0.279 | C | S | . | . | B | Isolated β-bridge | trans | -69.9 | 116.3 | 177.7 | 178.6 | 0 | 0 | 0 | 0 | 110.9 | V281 R282 C290 L293 R294 D306 A308 | V281-V288 WeakPolarHBondContact O-CA 3.31Å; R282-V288 HydrophobicContact CG-CG2 4.05Å; V288-C290 HydrophobicContact CG1-CB 4.38Å; V288-L293 HydrophobicContact CG1-CB 3.84Å; V288-L293 HydrophobicContact CG1-CD2 3.81Å; V288-L293 HydrophobicContact CG1-CG 3.84Å; V288-L293 HydrophobicContact CG2-CD2 4.34Å; V288-R294 HydrophobicContact CB-CG 4.35Å; V288-R294 HydrophobicContact CG1-CG 3.9Å; V288-R294 VanDerWaalsContact O-CD 3.29Å; V288-R294 WeakPolarHBondContact O-CD 3.46Å; V288-R294 VanDerWaalsContact O-CG 3.26Å; V288-R294 WeakPolarHBondContact O-CG 3.23Å; V288-R294 PolarHBondContact O-NH1 3.14Å; V288-D306 PolarHBondContact N-O 2.89Å; V288-A308 VanDerWaalsContact CG2-O 3.32Å; V288-A308 WeakPolarHBondContact CG2-O 3.19Å |
| 289 | T | 96.3 | Very high | 94.5 | Very high | 52 Ų | 52 | 52.6 Ų | 52.6 | 32% | 0.319 | 27% | 0.274 | S | S | . | . | trans | -94.9 | -22.3 | 176.8 | 39.5 | 0 | 0 | 0 | 0 | 113.2 | E280 V281 R282 D283 R287 P291 | E280-T289 PolarHBondContact O-OG1 2.83Å; E280-T289 VanDerWaalsContact O-OG1 3.09Å; V281-T289 PolarHBondContact O-N 3.11Å; V281-T289 VanDerWaalsContact O-N 3.13Å; R282-T289 WeakPolarHBondContact CA-OG1 3.44Å; R282-T289 PolarHBondContact N-OG1 3.02Å; D283-T289 HydrophobicContact CB-CG2 3.75Å; R287-T289 PolarHBondContact O-N 3.29Å; T289-P291 WeakPolarHBondContact O-CD 3.22Å | ||
| 290 | C | 96.4 | Very high | 94.6 | Very high | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 27% | 0.271 | C | S | . | . | trans | -64.6 | 116 | 179.9 | 173.6 | 0 | 0 | 0 | 0 | 112.7 | C266 V281 V288 V292 L293 R294 | C266-C290 PolarHBondContact SG-SG 3.3Å; V281-C290 PolarHBondContact O-N 2.86Å; V288-C290 HydrophobicContact CG1-CB 4.38Å; C290-V292 VanDerWaalsContact C-N 3.32Å; C290-V292 PolarHBondContact O-N 3.02Å; C290-L293 HydrophobicContact CB-CB 4.04Å; C290-L293 PolarHBondContact O-N 3.48Å; C290-L293 VanDerWaalsContact O-N 3.07Å; C290-R294 WeakPolarHBondContact O-CG 3.36Å; C290-R294 PolarHBondContact O-N 3.35Å | ||
| 291 | P | 95.4 | Very high | 94.7 | Very high | 28 Ų | 28 | 50.1 Ų | 50.1 | 18% | 0.182 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63.2 | -35.9 | -175.7 | 24.5 | -33.4 | 0 | 0 | 0 | 112.9 | L167 T289 L293 R294 V295 | L167-P291 HydrophobicContact CD1-CG 4.43Å; T289-P291 WeakPolarHBondContact O-CD 3.22Å; P291-L293 VanDerWaalsContact C-N 3.28Å; P291-L293 PolarHBondContact O-N 2.96Å; P291-R294 PolarHBondContact O-N 2.93Å; P291-V295 PolarHBondContact O-N 3.04Å |
| 292 | V | 94.1 | Very high | 94.8 | Very high | 13 Ų | 13 | 54.8 Ų | 54.8 | 8% | 0.079 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.8 | -32.3 | 176.9 | -172 | 0 | 0 | 0 | 0 | 111.7 | I160 F265 C290 V295 | I160-V292 HydrophobicContact CD1-CB 4.29Å; I160-V292 HydrophobicContact CD1-CG1 3.78Å; F265-V292 HydrophobicContact CD1-CB 4.49Å; F265-V292 HydrophobicContact CE1-CB 4.24Å; F265-V292 HydrophobicContact CE1-CG1 3.94Å; C290-V292 VanDerWaalsContact C-N 3.32Å; C290-V292 PolarHBondContact O-N 3.02Å; V292-V295 WeakPolarHBondContact O-CG2 3.42Å |
| 293 | L | 94.6 | Very high | 94.9 | Very high | 10 Ų | 10 | 50.3 Ų | 50.3 | 5% | 0.052 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -85.4 | -36.2 | 175.9 | -172.6 | 57.7 | 0 | 0 | 0 | 112 | F265 V281 V288 C290 P291 V295 L296 A308 T310 | F265-L293 HydrophobicContact CD1-CB 3.95Å; F265-L293 HydrophobicContact CE1-CB 3.89Å; F265-L293 HydrophobicContact CE1-CD1 4.17Å; F265-L293 HydrophobicContact CE2-CD1 4.21Å; F265-L293 HydrophobicContact CZ-CD1 3.92Å; V281-L293 HydrophobicContact CG1-CD2 4.12Å; V288-L293 HydrophobicContact CG1-CB 3.84Å; V288-L293 HydrophobicContact CG1-CD2 3.81Å; V288-L293 HydrophobicContact CG1-CG 3.84Å; V288-L293 HydrophobicContact CG2-CD2 4.34Å; C290-L293 HydrophobicContact CB-CB 4.04Å; C290-L293 PolarHBondContact O-N 3.48Å; C290-L293 VanDerWaalsContact O-N 3.07Å; P291-L293 VanDerWaalsContact C-N 3.28Å; P291-L293 PolarHBondContact O-N 2.96Å; L293-V295 PolarHBondContact O-N 3.23Å; L293-L296 HydrophobicContact CD1-CB 4.34Å; L293-L296 HydrophobicContact CD1-CD2 3.96Å; L293-L296 VanDerWaalsContact O-CB 3.31Å; L293-L296 WeakPolarHBondContact O-CB 3.3Å; L293-L296 PolarHBondContact O-N 3.33Å; L293-A308 HydrophobicContact CG-CB 4.24Å; L293-A308 WeakPolarHBondContact O-CB 3.23Å; L293-T310 HydrophobicContact CD1-CG2 4.33Å |
| 294 | R | 96.7 | Very high | 95 | Very high | 89 Ų | 89 | 51.4 Ų | 51.4 | 34% | 0.336 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -57.8 | -30.2 | 180 | -74.9 | 179.4 | 71.6 | 75.1 | 3.4 | 113.8 | V288 C290 P291 L296 T304 G305 D306 | V288-R294 HydrophobicContact CB-CG 4.35Å; V288-R294 HydrophobicContact CG1-CG 3.9Å; V288-R294 VanDerWaalsContact O-CD 3.29Å; V288-R294 WeakPolarHBondContact O-CD 3.46Å; V288-R294 VanDerWaalsContact O-CG 3.26Å; V288-R294 WeakPolarHBondContact O-CG 3.23Å; V288-R294 PolarHBondContact O-NH1 3.14Å; C290-R294 WeakPolarHBondContact O-CG 3.36Å; C290-R294 PolarHBondContact O-N 3.35Å; P291-R294 PolarHBondContact O-N 2.93Å; R294-L296 VanDerWaalsContact C-N 3.32Å; R294-T304 PolarHBondContact O-OG1 3.38Å; R294-G305 WeakPolarHBondContact O-CA 3.31Å; R294-G305 PolarHBondContact O-N 3.5Å; R294-D306 IonicContact CZ-OD1 2.79Å; R294-D306 IonicContact NH1-OD1 2.99Å; R294-D306 PolarHBondContact NH1-OD1 3.22Å; R294-D306 IonicContact NH2-OD1 2.74Å; R294-D306 PolarHBondContact NH2-OD1 3.02Å |
| 295 | V | 94.5 | Very high | 95.2 | Very high | 65 Ų | 65 | 45 Ų | 45 | 39% | 0.394 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81 | -9 | 176.8 | -62.3 | 0 | 0 | 0 | 0 | 113.9 | I160 P166 P291 V292 L293 S297 | I160-V295 HydrophobicContact CD1-CG2 3.75Å; P166-V295 HydrophobicContact CG-CG1 3.44Å; P166-V295 VanDerWaalsContact CG-CG1 3.44Å; P291-V295 PolarHBondContact O-N 3.04Å; V292-V295 WeakPolarHBondContact O-CG2 3.42Å; L293-V295 PolarHBondContact O-N 3.23Å; V295-S297 PolarHBondContact O-N 3.27Å |
| 296 | L | 92 | Very high | 95.4 | Very high | 19 Ų | 19 | 42.2 Ų | 42.2 | 10% | 0.099 | 24% | 0.242 | C | C | . | . | trans | -83.1 | 113.3 | 179.5 | -175.2 | 65.5 | 0 | 0 | 0 | 110.9 | V158 L293 R294 T304 T310 | V158-L296 HydrophobicContact CG2-CD1 3.98Å; V158-L296 HydrophobicContact CG2-CD2 4.45Å; L293-L296 HydrophobicContact CD1-CB 4.34Å; L293-L296 HydrophobicContact CD1-CD2 3.96Å; L293-L296 VanDerWaalsContact O-CB 3.31Å; L293-L296 WeakPolarHBondContact O-CB 3.3Å; L293-L296 PolarHBondContact O-N 3.33Å; R294-L296 VanDerWaalsContact C-N 3.32Å; L296-T304 PolarHBondContact O-OG1 3.2Å; L296-T310 HydrophobicContact CD2-CG2 3.79Å | ||
| 297 | S | 95.3 | Very high | 95.5 | Very high | 53 Ų | 53 | 47 Ų | 47 | 37% | 0.371 | 25% | 0.253 | S | S | . | . | trans | -80.9 | 129 | 161.8 | -176.7 | 0 | 0 | 0 | 0 | 109.9 | V295 H302 A303 | V295-S297 PolarHBondContact O-N 3.27Å; S297-H302 VanDerWaalsContact OG-C 3.3Å; S297-H302 WeakPolarHBondContact OG-CA 3.41Å; S297-H302 PolarHBondContact OG-O 3.35Å; S297-A303 WeakPolarHBondContact CA-O 3.4Å | ||
| 298 | C | 94.7 | Very high | 95.6 | Very high | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 24% | 0.235 | C | C | . | . | trans | -71.3 | 124 | 177.2 | -178.4 | 0 | 0 | 0 | 0 | 110.5 | N300 C301 H302 A303 H309 | C298-N300 PolarHBondContact O-N 3.27Å; C298-C301 PolarHBondContact O-N 2.89Å; C298-H302 WeakPolarHBondContact O-CA 3.38Å; C298-H302 PolarHBondContact O-N 3.2Å; C298-A303 PolarHBondContact N-O 3.4Å; C298-H309 VanDerWaalsContact SG-CD2 3.51Å; C298-H309 PolarHBondContact SG-NE2 3.33Å | ||
| 299 | P | 93.3 | Very high | 95.5 | Very high | 56 Ų | 56 | 42.8 Ų | 42.8 | 36% | 0.364 | 24% | 0.238 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -67.6 | -11.7 | -173 | 28 | -36.7 | 0 | 0 | 0 | 114.3 | I311 | P299-I311 HydrophobicContact CG-CB 4.22Å; P299-I311 HydrophobicContact CG-CD1 4.18Å; P299-I311 HydrophobicContact CG-CG1 4.48Å |
| 300 | N | 93.8 | Very high | 95.4 | Very high | 15 Ų | 15 | 40.7 Ų | 40.7 | 8% | 0.08 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | -14.6 | -176.5 | -168.3 | 69.2 | 0 | 0 | 0 | 114.1 | C298 C314 Y316 P317 R318 Q319 | C298-N300 PolarHBondContact O-N 3.27Å; N300-C314 PolarHBondContact ND2-SG 3.3Å; N300-Y316 PolarHBondContact ND2-O 3.34Å; N300-P317 PolarHBondContact ND2-O 2.86Å; N300-R318 WeakPolarHBondContact OD1-CA 3.14Å; N300-Q319 PolarHBondContact OD1-N 3.43Å |
| 301 | C | 96.1 | Very high | 95.2 | Very high | 32 Ų | 32 | 41.8 Ų | 41.8 | 22% | 0.216 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -153.6 | 5.3 | -177 | 67.4 | 0 | 0 | 0 | 0 | 114.4 | C298 A303 H309 C314 Y316 | C298-C301 PolarHBondContact O-N 2.89Å; C301-A303 PolarHBondContact O-N 3.3Å; C301-H309 VanDerWaalsContact SG-CE1 3.55Å; C301-H309 PolarHBondContact SG-NE2 3.32Å; C301-H309 VanDerWaalsContact SG-NE2 3.35Å; C301-C314 PolarHBondContact SG-SG 2.9Å; C301-Y316 HydrophobicContact CB-CD2 3.3Å; C301-Y316 HydrophobicContact CB-CE2 3.65Å; C301-Y316 HydrophobicContact CB-CG 4.12Å |
| 302 | H | 95.9 | Very high | 95.1 | Very high | 139 Ų | 139 | 46.5 Ų | 46.5 | 64% | 0.644 | 25% | 0.245 | S | C | * | . | trans | 59.6 | -3.6 | 177.4 | -49.4 | -58.2 | 0 | 0 | 0 | 117.6 | S297 C298 T304 | S297-H302 VanDerWaalsContact OG-C 3.3Å; S297-H302 WeakPolarHBondContact OG-CA 3.41Å; S297-H302 PolarHBondContact OG-O 3.35Å; C298-H302 WeakPolarHBondContact O-CA 3.38Å; C298-H302 PolarHBondContact O-N 3.2Å; H302-T304 PolarHBondContact O-N 2.86Å | ||
| 303 | A | 96.6 | Very high | 95 | Very high | 27 Ų | 27 | 52.8 Ų | 52.8 | 22% | 0.223 | 27% | 0.268 | C | S | . | . | trans | -51.5 | 134.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | S297 C298 C301 | S297-A303 WeakPolarHBondContact CA-O 3.4Å; C298-A303 PolarHBondContact N-O 3.4Å; C301-A303 PolarHBondContact O-N 3.3Å | ||
| 304 | T | 96.5 | Very high | 95.1 | Very high | 68 Ų | 68 | 53.4 Ų | 53.4 | 42% | 0.417 | 27% | 0.273 | S | S | . | . | trans | -150.1 | -178.7 | -173.1 | -168.3 | 0 | 0 | 0 | 0 | 109.8 | R294 L296 H302 D306 H307 A308 | R294-T304 PolarHBondContact O-OG1 3.38Å; L296-T304 PolarHBondContact O-OG1 3.2Å; H302-T304 PolarHBondContact O-N 2.86Å; T304-D306 PolarHBondContact O-N 3.4Å; T304-H307 PolarHBondContact O-N 3.17Å; T304-A308 PolarHBondContact O-N 3.2Å | ||
| 305 | G | 97.1 | Very high | 95 | Very high | 17 Ų | 17 | 54 Ų | 54 | 18% | 0.175 | 29% | 0.288 | C | S | . | . | G | 310 helix | trans | 59.3 | -127.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | R294 H307 A308 | R294-G305 WeakPolarHBondContact O-CA 3.31Å; R294-G305 PolarHBondContact O-N 3.5Å; G305-H307 PolarHBondContact O-N 3.39Å; G305-H307 VanDerWaalsContact O-N 3.13Å; G305-A308 VanDerWaalsContact O-CB 3.26Å; G305-A308 WeakPolarHBondContact O-CB 3.49Å; G305-A308 PolarHBondContact O-N 3.38Å; G305-A308 VanDerWaalsContact O-N 3.09Å |
| 306 | D | 97.5 | Very high | 95 | Very high | 60 Ų | 60 | 57.6 Ų | 57.6 | 32% | 0.321 | 30% | 0.296 | S | S | . | . | G | 310 helix | trans | -56.2 | -27.5 | 179.8 | -68.2 | 26.9 | 0 | 0 | 0 | 113.5 | R287 V288 R294 T304 | R287-D306 HydrophobicContact CB-CB 4.21Å; R287-D306 VanDerWaalsContact CD-OD2 3.31Å; R287-D306 WeakPolarHBondContact CD-OD2 3.49Å; R287-D306 HydrophobicContact CG-CB 4.32Å; V288-D306 PolarHBondContact N-O 2.89Å; R294-D306 IonicContact CZ-OD1 2.79Å; R294-D306 IonicContact NH1-OD1 2.99Å; R294-D306 PolarHBondContact NH1-OD1 3.22Å; R294-D306 IonicContact NH2-OD1 2.74Å; R294-D306 PolarHBondContact NH2-OD1 3.02Å; T304-D306 PolarHBondContact O-N 3.4Å |
| 307 | H | 96.6 | Very high | 94.8 | Very high | 142 Ų | 142 | 61.5 Ų | 61.5 | 66% | 0.657 | 32% | 0.322 | S | S | * | . | G | 310 helix | trans | -107.6 | 10.2 | -177.8 | -55 | -49.8 | 0 | 0 | 0 | 113.4 | T304 G305 H309 | T304-H307 PolarHBondContact O-N 3.17Å; G305-H307 PolarHBondContact O-N 3.39Å; G305-H307 VanDerWaalsContact O-N 3.13Å; H307-H309 PolarHBondContact O-ND1 3.05Å |
| 308 | A | 97.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 66.9 Ų | 66.9 | 0% | 0 | 33% | 0.334 | C | S | . | . | trans | -58.3 | 146.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | V288 L293 T304 G305 | V288-A308 VanDerWaalsContact CG2-O 3.32Å; V288-A308 WeakPolarHBondContact CG2-O 3.19Å; L293-A308 HydrophobicContact CG-CB 4.24Å; L293-A308 WeakPolarHBondContact O-CB 3.23Å; T304-A308 PolarHBondContact O-N 3.2Å; G305-A308 VanDerWaalsContact O-CB 3.26Å; G305-A308 WeakPolarHBondContact O-CB 3.49Å; G305-A308 PolarHBondContact O-N 3.38Å; G305-A308 VanDerWaalsContact O-N 3.09Å | ||
| 309 | H | 95.4 | Very high | 93.4 | Very high | 14 Ų | 14 | 74.6 Ų | 74.6 | 7% | 0.065 | 37% | 0.37 | C | S | . | . | trans | -162.4 | 152.7 | 176.7 | 53 | -90.6 | 0 | 0 | 0 | 110.2 | C298 C301 H307 C314 | C298-H309 VanDerWaalsContact SG-CD2 3.51Å; C298-H309 PolarHBondContact SG-NE2 3.33Å; C301-H309 VanDerWaalsContact SG-CE1 3.55Å; C301-H309 PolarHBondContact SG-NE2 3.32Å; C301-H309 VanDerWaalsContact SG-NE2 3.35Å; H307-H309 PolarHBondContact O-ND1 3.05Å; H309-C314 VanDerWaalsContact CD2-CA 3.48Å; H309-C314 WeakPolarHBondContact CD2-CA 3.42Å; H309-C314 WeakPolarHBondContact NE2-CA 3.19Å | ||
| 310 | T | 93.9 | Very high | 91.8 | Very high | 7 Ų | 7 | 80.5 Ų | 80.5 | 4% | 0.043 | 40% | 0.398 | C | S | . | . | trans | -73.4 | 156.4 | 169.6 | 71.2 | 0 | 0 | 0 | 0 | 110.1 | F265 L293 L296 R312 Y313 | F265-T310 HydrophobicContact CE2-CG2 3.82Å; F265-T310 HydrophobicContact CZ-CG2 4.32Å; L293-T310 HydrophobicContact CD1-CG2 4.33Å; L296-T310 HydrophobicContact CD2-CG2 3.79Å; T310-R312 PolarHBondContact O-N 3.04Å; T310-Y313 PolarHBondContact O-N 3.1Å; T310-Y313 WeakPolarHBondContact OG1-CD2 3.36Å | ||
| 311 | I | 93.2 | Very high | 91.7 | Very high | 24 Ų | 24 | 83.8 Ų | 83.8 | 12% | 0.123 | 41% | 0.414 | C | S | . | . | G | 310 helix | trans | -50.2 | -26.2 | 177.5 | -172.3 | 174.1 | 0 | 0 | 0 | 114.5 | Q156 P299 Y313 L320 | Q156-I311 HydrophobicContact CG-CG2 4.2Å; Q156-I311 VanDerWaalsContact OE1-N 3.15Å; P299-I311 HydrophobicContact CG-CB 4.22Å; P299-I311 HydrophobicContact CG-CD1 4.18Å; P299-I311 HydrophobicContact CG-CG1 4.48Å; I311-Y313 VanDerWaalsContact C-N 3.25Å; I311-Y313 PolarHBondContact O-N 2.6Å; I311-L320 HydrophobicContact CD1-CD1 3.65Å |
| 312 | R | 92.6 | Very high | 91.5 | Very high | 127 Ų | 127 | 86.5 Ų | 86.5 | 48% | 0.479 | 42% | 0.424 | S | S | . | . | G | 310 helix | trans | -65.5 | -26.3 | 176.6 | -177.2 | 172.3 | 177.2 | 170.9 | -4.6 | 113.2 | Q153 T310 | Q153-R312 PolarHBondContact O-NH1 3Å; T310-R312 PolarHBondContact O-N 3.04Å |
| 313 | Y | 92.6 | Very high | 91.2 | Very high | 145 Ų | 145 | 83.6 Ų | 83.6 | 57% | 0.569 | 41% | 0.412 | S | S | * | . | G | 310 helix | trans | -117 | 25.7 | -177 | -54.9 | -75.1 | 0 | 0 | 0 | 112.2 | T310 I311 | T310-Y313 PolarHBondContact O-N 3.1Å; T310-Y313 WeakPolarHBondContact OG1-CD2 3.36Å; I311-Y313 VanDerWaalsContact C-N 3.25Å; I311-Y313 PolarHBondContact O-N 2.6Å |
| 314 | C | 95.1 | Very high | 90.9 | Very high | 22 Ų | 22 | 86.9 Ų | 86.9 | 15% | 0.149 | 42% | 0.423 | C | S | . | . | trans | -68 | 129.7 | 172.7 | -162.1 | 0 | 0 | 0 | 0 | 110.5 | N300 C301 H309 Y316 | N300-C314 PolarHBondContact ND2-SG 3.3Å; C301-C314 PolarHBondContact SG-SG 2.9Å; H309-C314 VanDerWaalsContact CD2-CA 3.48Å; H309-C314 WeakPolarHBondContact CD2-CA 3.42Å; H309-C314 WeakPolarHBondContact NE2-CA 3.19Å; C314-Y316 PolarHBondContact O-N 2.88Å | ||
| 315 | P | 95.2 | Very high | 90.6 | Very high | 102 Ų | 102 | 88.1 Ų | 88.1 | 66% | 0.662 | 42% | 0.423 | S | S | * | . | S | Bend | trans | -77.2 | -13.1 | 176.7 | 31.6 | -34.6 | 0 | 0 | 0 | 112.8 | ||
| 316 | Y | 93.9 | Very high | 90.1 | Very high | 141 Ų | 141 | 92.8 Ų | 92.8 | 55% | 0.553 | 44% | 0.44 | S | S | * | . | S | Bend | trans | -91.7 | 147.6 | 176.7 | -58 | -84.9 | 0 | 0 | 0 | 110.7 | N300 C301 C314 | N300-Y316 PolarHBondContact ND2-O 3.34Å; C301-Y316 HydrophobicContact CB-CD2 3.3Å; C301-Y316 HydrophobicContact CB-CE2 3.65Å; C301-Y316 HydrophobicContact CB-CG 4.12Å; C314-Y316 PolarHBondContact O-N 2.88Å |
| 317 | P | 89.1 | Confident | 89.6 | Confident | 101 Ų | 101 | 95.1 Ų | 95.1 | 66% | 0.656 | 45% | 0.448 | S | S | * | . | P | Polyproline II helix | trans | -57.7 | 148.4 | 170.9 | 26.9 | -35.2 | 0 | 0 | 0 | 110.5 | N300 | N300-P317 PolarHBondContact ND2-O 2.86Š|
| 318 | R | 85 | Confident | 89.1 | Confident | 166 Ų | 166 | 91.5 Ų | 91.5 | 63% | 0.626 | 43% | 0.432 | S | S | * | . | P | Polyproline II helix | trans | -69.9 | 133.5 | 179.2 | -66.3 | -174.6 | -174 | 168.1 | 5.9 | 110.7 | N300 | N300-R318 WeakPolarHBondContact OD1-CA 3.14Š|
| 319 | Q | 74.6 | Confident | 88.4 | Confident | 162 Ų | 162 | 99.2 Ų | 99.2 | 76% | 0.757 | 47% | 0.468 | S | S | * | . | trans | -111.1 | 22.6 | 176.3 | -55.5 | -175.3 | 1.9 | 0 | 0 | 111.5 | N300 | N300-Q319 PolarHBondContact OD1-N 3.43Š| ||
| 320 | L | 60.4 | Low | 87.8 | Confident | 179 Ų | 179 | 106.9 Ų | 106.9 | 94% | 0.937 | 51% | 0.505 | S | S | * | . | trans | -111.8 | 0 | 175.7 | -62.4 | 174.8 | 0 | 0 | 0 | 109.6 | I311 | I311-L320 HydrophobicContact CD1-CD1 3.65Š|
Retrieved 320 of 320 residues in 211.7 ms
(Link to these results)