| 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 | 46 | Very low | 48.5 | Very low | 229 Ų | 229 | 161.8 Ų | 161.8 | 100% | 1.128 | 84% | 0.84 | S | S | * | * | 0 | 117.4 | 0 | -75.1 | -173.5 | 158.8 | 0 | 0 | 108.5 | |||||
| 2 | F | 43.2 | Very low | 48.6 | Very low | 213 Ų | 213 | 162.1 Ų | 162.1 | 93% | 0.934 | 84% | 0.842 | S | S | * | * | trans | 173 | 123.7 | 137 | -84 | -59.8 | 0 | 0 | 0 | 107 | ||||
| 3 | I | 49.7 | Very low | 48.3 | Very low | 154 Ų | 154 | 162.8 Ų | 162.8 | 79% | 0.79 | 85% | 0.846 | S | S | * | * | trans | -95.5 | 121.1 | -160.3 | -48.6 | 160.2 | 0 | 0 | 0 | 107.4 | ||||
| 4 | S | 45.7 | Very low | 47.7 | Very low | 108 Ų | 108 | 160.3 Ų | 160.3 | 76% | 0.755 | 85% | 0.847 | S | S | * | * | trans | -73.6 | 122.2 | 167 | 50.2 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 5 | R | 54.9 | Low | 47.2 | Very low | 240 Ų | 240 | 165 Ų | 165 | 91% | 0.906 | 85% | 0.849 | S | S | * | * | trans | -99.1 | 112.9 | 170 | -73.8 | -168 | 175.7 | -174.6 | -0.2 | 109.4 | ||||
| 6 | V | 48.3 | Very low | 46.8 | Very low | 132 Ų | 132 | 160.4 Ų | 160.4 | 80% | 0.8 | 84% | 0.843 | S | S | * | * | trans | -89.5 | 156.7 | 170.8 | 173.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 7 | A | 50.4 | Low | 46.3 | Very low | 86 Ų | 86 | 158.1 Ų | 158.1 | 71% | 0.711 | 84% | 0.837 | S | S | * | * | trans | 103.5 | 157.6 | 153.8 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 8 | P | 50.9 | Low | 45.5 | Very low | 127 Ų | 127 | 153.8 Ų | 153.8 | 83% | 0.825 | 84% | 0.837 | S | S | * | * | -135.8 | 180 | -50.1 | 36.4 | -19.9 | 0 | 0 | 0 | 112.8 | |||||
| 9 | R | 50.5 | Low | 45 | Very low | 235 Ų | 235 | 151.1 Ų | 151.1 | 89% | 0.887 | 84% | 0.837 | S | S | * | * | trans | -64.8 | 163.1 | 177.2 | -57.8 | -176.4 | 172.4 | -176.4 | -1.6 | 113.1 | ||||
| 10 | L | 49.3 | Very low | 44.7 | Very low | 162 Ų | 162 | 151.5 Ų | 151.5 | 85% | 0.848 | 84% | 0.837 | S | S | * | * | trans | 176.8 | 105.7 | 135.1 | -90.7 | 176.1 | 0 | 0 | 0 | 108.6 | ||||
| 11 | S | 44.3 | Very low | 44.3 | Very low | 94 Ų | 94 | 153.4 Ų | 153.4 | 66% | 0.657 | 84% | 0.84 | S | S | * | * | 69.4 | 113.4 | 104.5 | 70.4 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 12 | L | 50.1 | Low | 43.9 | Very low | 165 Ų | 165 | 148.7 Ų | 148.7 | 86% | 0.864 | 82% | 0.824 | S | S | * | * | trans | -167.1 | 100.4 | 134.8 | -102.1 | 153.7 | 0 | 0 | 0 | 109.8 | ||||
| 13 | L | 44.9 | Very low | 44.3 | Very low | 171 Ų | 171 | 144 Ų | 144 | 90% | 0.895 | 82% | 0.815 | S | S | * | * | trans | -78 | 123 | 161.2 | -71.3 | 163.1 | 0 | 0 | 0 | 107.3 | ||||
| 14 | C | 39.3 | Very low | 43.6 | Very low | 128 Ų | 128 | 143.1 Ų | 143.1 | 87% | 0.865 | 82% | 0.817 | S | S | * | * | trans | -109.6 | 111.1 | 160.1 | -79.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 15 | R | 41.2 | Very low | 43.2 | Very low | 231 Ų | 231 | 146.8 Ų | 146.8 | 87% | 0.872 | 82% | 0.822 | S | S | * | * | trans | -109.6 | 125.1 | 175 | -169.4 | -173.4 | -153.1 | 178.3 | 5.6 | 106.9 | ||||
| 16 | A | 39.5 | Very low | 42.4 | Very low | 91 Ų | 91 | 140.3 Ų | 140.3 | 75% | 0.752 | 81% | 0.814 | S | S | * | * | trans | -156.4 | 96.2 | 158.5 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 17 | T | 39.3 | Very low | 41.9 | Very low | 122 Ų | 122 | 141.9 Ų | 141.9 | 75% | 0.748 | 82% | 0.817 | S | S | * | * | 53.5 | 112.4 | 78.4 | 62.8 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 18 | G | 32.1 | Very low | 41.2 | Very low | 80 Ų | 80 | 149.9 Ų | 149.9 | 83% | 0.825 | 83% | 0.828 | S | S | * | * | trans | 84.2 | 152.3 | 147 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 19 | A | 35 | Very low | 40.5 | Very low | 102 Ų | 102 | 147.4 Ų | 147.4 | 84% | 0.843 | 83% | 0.826 | S | S | * | * | cis | -171.5 | 169.2 | -12.6 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 20 | L | 39.7 | Very low | 40.1 | Very low | 159 Ų | 159 | 141.7 Ų | 141.7 | 83% | 0.832 | 82% | 0.822 | S | S | * | * | trans | -44.2 | 141.6 | -179.4 | -62.4 | 150 | 0 | 0 | 0 | 115.7 | ||||
| 21 | Q | 35.8 | Very low | 39.8 | Very low | 192 Ų | 192 | 141.9 Ų | 141.9 | 90% | 0.897 | 82% | 0.823 | S | S | * | * | 169.8 | 133 | 118.5 | -89.2 | 168 | 86.9 | 0 | 0 | 112.5 | |||||
| 22 | T | 38.6 | Very low | 40.1 | Very low | 131 Ų | 131 | 145.2 Ų | 145.2 | 80% | 0.804 | 83% | 0.833 | S | S | * | * | trans | -104.9 | 171.4 | 152.5 | 52.7 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 23 | P | 50.5 | Low | 39.7 | Very low | 114 Ų | 114 | 142.5 Ų | 142.5 | 74% | 0.74 | 83% | 0.825 | S | S | * | * | cis | -126.3 | 178.4 | -23.4 | 31 | -10.9 | 0 | 0 | 0 | 111.3 | ||||
| 24 | V | 34.8 | Very low | 39.5 | Very low | 136 Ų | 136 | 140.8 Ų | 140.8 | 82% | 0.824 | 82% | 0.821 | S | S | * | * | trans | 162.7 | 146.2 | 138.2 | 161.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 25 | Q | 38.9 | Very low | 39.7 | Very low | 184 Ų | 184 | 143.4 Ų | 143.4 | 86% | 0.86 | 82% | 0.818 | S | S | * | * | trans | -55.2 | 146.9 | -171.2 | -66 | 155.9 | -9.9 | 0 | 0 | 116.1 | ||||
| 26 | S | 36.5 | Very low | 39.8 | Very low | 105 Ų | 105 | 138.1 Ų | 138.1 | 73% | 0.734 | 81% | 0.814 | S | S | * | * | 140.4 | 145.5 | 117.9 | -162.2 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 27 | L | 38.9 | Very low | 39.8 | Very low | 165 Ų | 165 | 138.2 Ų | 138.2 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | trans | 99.4 | 123.5 | 163 | -59 | 170.8 | 0 | 0 | 0 | 119.3 | ||||
| 28 | R | 36 | Very low | 39.7 | Very low | 253 Ų | 253 | 138.4 Ų | 138.4 | 96% | 0.955 | 82% | 0.819 | S | S | * | * | trans | -44 | 142.2 | 171.5 | -73.9 | 177.4 | 162.8 | -150.9 | -1 | 113.1 | ||||
| 29 | G | 34.5 | Very low | 40 | Very low | 76 Ų | 76 | 140.3 Ų | 140.3 | 78% | 0.784 | 82% | 0.819 | S | S | * | * | trans | -178.9 | 95.3 | 163.5 | 0 | 0 | 0 | 0 | 0 | 111 | L31 | G29-L31 PolarHBondContact O-N 3.28Š| ||
| 30 | S | 43.3 | Very low | 40.4 | Very low | 115 Ų | 115 | 140.5 Ų | 140.5 | 80% | 0.804 | 81% | 0.814 | S | S | * | * | trans | -58.2 | 117.1 | 169.7 | 153.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 31 | L | 42.8 | Very low | 40.6 | Very low | 165 Ų | 165 | 138.1 Ų | 138.1 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | trans | -159.3 | 123.2 | 144.8 | -73.2 | -171.4 | 0 | 0 | 0 | 109.5 | G29 | G29-L31 PolarHBondContact O-N 3.28Š| ||
| 32 | L | 50.5 | Low | 41.1 | Very low | 165 Ų | 165 | 137 Ų | 137 | 86% | 0.864 | 81% | 0.81 | S | S | * | * | trans | -67.5 | 133.8 | 176.6 | -67.9 | 162.2 | 0 | 0 | 0 | 111 | V34 | L32-V34 PolarHBondContact O-N 3.41Š| ||
| 33 | P | 41.8 | Very low | 41.7 | Very low | 108 Ų | 108 | 138.5 Ų | 138.5 | 70% | 0.701 | 81% | 0.813 | S | S | * | * | trans | -82.4 | 107.9 | 164.6 | 28.9 | -26.8 | 0 | 0 | 0 | 110 | F35 | P33-F35 PolarHBondContact O-N 3.1Š| ||
| 34 | V | 41.3 | Very low | 41.4 | Very low | 134 Ų | 134 | 136.2 Ų | 136.2 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | trans | -60.6 | 119.1 | 165.4 | 173.4 | 0 | 0 | 0 | 0 | 108.7 | L32 | L32-V34 PolarHBondContact O-N 3.41Š| ||
| 35 | F | 42.7 | Very low | 42.2 | Very low | 184 Ų | 184 | 139.7 Ų | 139.7 | 81% | 0.807 | 81% | 0.814 | S | S | * | * | trans | -75.8 | 132.8 | 170.9 | -76.4 | -85.9 | 0 | 0 | 0 | 110 | P33 A37 | P33-F35 PolarHBondContact O-N 3.1Å; F35-A37 PolarHBondContact O-N 3.16Å | ||
| 36 | P | 43.4 | Very low | 42.7 | Very low | 119 Ų | 119 | 135.8 Ų | 135.8 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | -76.8 | 109.5 | 172.4 | 29.2 | -29.5 | 0 | 0 | 0 | 109.6 | C38 | P36-C38 PolarHBondContact O-N 3.03Å; P36-C38 VanDerWaalsContact O-N 3.14Å | ||
| 37 | A | 39.5 | Very low | 43.3 | Very low | 94 Ų | 94 | 140.7 Ų | 140.7 | 78% | 0.777 | 81% | 0.807 | S | S | * | * | trans | -72.9 | 97.2 | 167.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | F35 C39 | F35-A37 PolarHBondContact O-N 3.16Å; A37-C39 PolarHBondContact O-N 3.47Å | ||
| 38 | C | 37 | Very low | 43.7 | Very low | 125 Ų | 125 | 139.5 Ų | 139.5 | 85% | 0.845 | 80% | 0.802 | S | S | * | * | trans | -86.4 | 95.4 | 168.6 | -149.2 | 0 | 0 | 0 | 0 | 108.1 | P36 | P36-C38 PolarHBondContact O-N 3.03Å; P36-C38 VanDerWaalsContact O-N 3.14Å | ||
| 39 | C | 38.3 | Very low | 44.4 | Very low | 120 Ų | 120 | 136.6 Ų | 136.6 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | trans | -121.2 | 98.2 | 167.7 | -71.7 | 0 | 0 | 0 | 0 | 108 | A37 S41 | A37-C39 PolarHBondContact O-N 3.47Å; C39-S41 PolarHBondContact O-N 3.46Å | ||
| 40 | S | 43.3 | Very low | 45.2 | Very low | 107 Ų | 107 | 135.9 Ų | 135.9 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | trans | -68.3 | 112.7 | 166.9 | 38 | 0 | 0 | 0 | 0 | 109.2 | L42 | S40-L42 PolarHBondContact O-N 3.01Š| ||
| 41 | S | 44 | Very low | 45.8 | Very low | 108 Ų | 108 | 138.1 Ų | 138.1 | 76% | 0.755 | 79% | 0.794 | S | S | * | * | trans | -73.9 | 102.9 | 170.2 | 60.6 | 0 | 0 | 0 | 0 | 109.3 | C39 N43 | C39-S41 PolarHBondContact O-N 3.46Å; S41-N43 PolarHBondContact O-N 3.47Å | ||
| 42 | L | 46.7 | Very low | 46.5 | Very low | 168 Ų | 168 | 134 Ų | 134 | 88% | 0.88 | 78% | 0.784 | S | S | * | * | trans | -80.3 | 112.6 | 163.8 | -84.5 | 159.2 | 0 | 0 | 0 | 108.3 | S40 G44 | S40-L42 PolarHBondContact O-N 3.01Å; L42-G44 PolarHBondContact O-N 3.3Å; L42-G44 VanDerWaalsContact O-N 3.11Å | ||
| 43 | N | 50.9 | Low | 46.9 | Very low | 163 Ų | 163 | 130.3 Ų | 130.3 | 87% | 0.872 | 78% | 0.777 | S | S | * | * | trans | -57.7 | 107 | 174.2 | -74.3 | -35 | 0 | 0 | 0 | 111 | S41 | S41-N43 PolarHBondContact O-N 3.47Š| ||
| 44 | G | 43.8 | Very low | 47.5 | Very low | 66 Ų | 66 | 132.6 Ų | 132.6 | 68% | 0.68 | 78% | 0.783 | S | S | * | * | trans | -116.2 | 116.6 | 164.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | L42 P46 | L42-G44 PolarHBondContact O-N 3.3Å; L42-G44 VanDerWaalsContact O-N 3.11Å; G44-P46 WeakPolarHBondContact O-CD 3.5Å | ||
| 45 | K | 52.8 | Low | 48.5 | Very low | 210 Ų | 210 | 133.7 Ų | 133.7 | 91% | 0.913 | 78% | 0.784 | S | S | * | * | trans | -57.5 | 122.4 | 176.8 | -66.3 | 174.9 | 177.4 | -179.9 | 0 | 110.2 | R47 | K45-R47 PolarHBondContact O-N 2.95Š| ||
| 46 | P | 49.6 | Very low | 49.2 | Very low | 102 Ų | 102 | 130 Ų | 130 | 66% | 0.662 | 78% | 0.782 | S | S | * | * | trans | -78.8 | 120.2 | 169.2 | 30.6 | -30.5 | 0 | 0 | 0 | 109.5 | G44 N48 | G44-P46 WeakPolarHBondContact O-CD 3.5Å; P46-N48 PolarHBondContact O-N 3.42Å | ||
| 47 | R | 48.7 | Very low | 49.8 | Very low | 208 Ų | 208 | 131.7 Ų | 131.7 | 79% | 0.785 | 78% | 0.779 | S | S | * | * | trans | -80.5 | 96.6 | 169 | -161 | 177.3 | -170.2 | -176.5 | 3.6 | 107 | K45 Y49 | K45-R47 PolarHBondContact O-N 2.95Å; R47-Y49 HydrophobicContact CG-CE2 4.04Å; R47-Y49 PolarHBondContact NE-OH 3.29Å; R47-Y49 PolarHBondContact O-N 3.42Å | ||
| 48 | N | 46.7 | Very low | 50.8 | Low | 140 Ų | 140 | 132.5 Ų | 132.5 | 75% | 0.749 | 78% | 0.777 | S | S | * | * | trans | -78.3 | 113.3 | -179.6 | -63.1 | -29.1 | 0 | 0 | 0 | 109.5 | P46 | P46-N48 PolarHBondContact O-N 3.42Š| ||
| 49 | Y | 50.8 | Low | 51.6 | Low | 191 Ų | 191 | 131.9 Ų | 131.9 | 75% | 0.749 | 77% | 0.771 | S | S | * | * | trans | -102.7 | 95 | 156 | -70.4 | -83.7 | 0 | 0 | 0 | 106.2 | R47 | R47-Y49 HydrophobicContact CG-CE2 4.04Å; R47-Y49 PolarHBondContact NE-OH 3.29Å; R47-Y49 PolarHBondContact O-N 3.42Å | ||
| 50 | G | 51 | Low | 52.6 | Low | 61 Ų | 61 | 133.4 Ų | 133.4 | 63% | 0.629 | 77% | 0.767 | S | S | * | * | trans | -122.1 | 116.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | A52 | G50-A52 PolarHBondContact O-N 3.07Š| ||
| 51 | T | 57.2 | Low | 53 | Low | 162 Ų | 162 | 133.7 Ų | 133.7 | 99% | 0.994 | 77% | 0.766 | S | S | * | * | trans | -80.3 | 57.4 | 167.2 | -31.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 52 | A | 57.8 | Low | 53 | Low | 79 Ų | 79 | 140 Ų | 140 | 65% | 0.653 | 77% | 0.773 | S | S | * | * | trans | -110.9 | 124.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 108.1 | G50 D54 | G50-A52 PolarHBondContact O-N 3.07Å; A52-D54 PolarHBondContact O-N 3.16Å | ||
| 53 | A | 58.1 | Low | 53.4 | Low | 87 Ų | 87 | 138 Ų | 138 | 72% | 0.719 | 77% | 0.767 | S | S | * | * | trans | -59.6 | 131.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | N55 | A53-N55 PolarHBondContact O-N 3.07Å; A53-N55 VanDerWaalsContact O-N 3.13Å; A53-N55 PolarHBondContact O-ND2 3.38Å | ||
| 54 | D | 54.6 | Low | 53.8 | Low | 157 Ų | 157 | 134.6 Ų | 134.6 | 84% | 0.84 | 76% | 0.762 | S | S | * | * | trans | -66.7 | 106.6 | 178.5 | -83.4 | -33.4 | 0 | 0 | 0 | 110.1 | A52 S56 | A52-D54 PolarHBondContact O-N 3.16Å; D54-S56 PolarHBondContact O-N 3.46Å; D54-S56 VanDerWaalsContact O-N 3.13Å | ||
| 55 | N | 61.1 | Low | 54.4 | Low | 156 Ų | 156 | 136 Ų | 136 | 83% | 0.834 | 75% | 0.754 | S | S | * | * | trans | -82.1 | 33.9 | 170.5 | -63.5 | -68.2 | 0 | 0 | 0 | 111.7 | A53 Q57 | A53-N55 PolarHBondContact O-N 3.07Å; A53-N55 VanDerWaalsContact O-N 3.13Å; A53-N55 PolarHBondContact O-ND2 3.38Å; N55-Q57 PolarHBondContact O-N 3.06Å | ||
| 56 | S | 57.7 | Low | 54.4 | Low | 108 Ų | 108 | 132.2 Ų | 132.2 | 76% | 0.755 | 74% | 0.739 | S | S | * | * | trans | -76.9 | -7.6 | -174.4 | -173.4 | 0 | 0 | 0 | 0 | 113.5 | D54 | D54-S56 PolarHBondContact O-N 3.46Å; D54-S56 VanDerWaalsContact O-N 3.13Å | ||
| 57 | Q | 56.4 | Low | 54.9 | Low | 153 Ų | 153 | 131.6 Ų | 131.6 | 72% | 0.715 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -106.1 | 141.8 | 173.4 | -64.5 | -170.7 | -17.1 | 0 | 0 | 109.2 | N55 | N55-Q57 PolarHBondContact O-N 3.06Š|
| 58 | P | 59.9 | Low | 55.3 | Low | 111 Ų | 111 | 127 Ų | 127 | 72% | 0.721 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 143.4 | 168.3 | 25.8 | -31.9 | 0 | 0 | 0 | 108.6 | Q60 | P58-Q60 PolarHBondContact O-N 3.22Å; P58-Q60 VanDerWaalsContact O-N 3.09Å |
| 59 | P | 55.1 | Low | 55.6 | Low | 113 Ų | 113 | 125 Ų | 125 | 73% | 0.734 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 123.2 | 178 | 24.1 | -31.9 | 0 | 0 | 0 | 107.9 | ||
| 60 | Q | 58.7 | Low | 55.9 | Low | 152 Ų | 152 | 121.8 Ų | 121.8 | 71% | 0.71 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -49.5 | 129 | 167.1 | -70.3 | -76.4 | -22.4 | 0 | 0 | 106.7 | P58 W62 | P58-Q60 PolarHBondContact O-N 3.22Å; P58-Q60 VanDerWaalsContact O-N 3.09Å; Q60-W62 PolarHBondContact O-N 3.4Å |
| 61 | P | 51.1 | Low | 56.3 | Low | 113 Ų | 113 | 126.5 Ų | 126.5 | 73% | 0.734 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 116.7 | 171.2 | 19.4 | -23 | 0 | 0 | 0 | 105.6 | V63 | P61-V63 PolarHBondContact O-N 3.03Å; P61-V63 VanDerWaalsContact O-N 3.11Å |
| 62 | W | 45.3 | Very low | 56.3 | Low | 239 Ų | 239 | 127.3 Ų | 127.3 | 91% | 0.905 | 70% | 0.702 | S | S | * | * | trans | -38.8 | 122.9 | 176.4 | -59.2 | 79.3 | 0 | 0 | 0 | 107.6 | Q60 A64 | Q60-W62 PolarHBondContact O-N 3.4Å; W62-A64 PolarHBondContact O-N 3.41Å; W62-A64 VanDerWaalsContact O-N 3.08Å | ||
| 63 | V | 55 | Low | 56.3 | Low | 126 Ų | 126 | 129.4 Ų | 129.4 | 76% | 0.764 | 70% | 0.702 | S | S | * | * | trans | -37.4 | 122.8 | 170 | 173.9 | 0 | 0 | 0 | 0 | 106.7 | P61 L65 | P61-V63 PolarHBondContact O-N 3.03Å; P61-V63 VanDerWaalsContact O-N 3.11Å; V63-L65 VanDerWaalsContact C-N 3.31Å; V63-L65 PolarHBondContact O-N 3.48Å | ||
| 64 | A | 59.1 | Low | 56.1 | Low | 92 Ų | 92 | 128.3 Ų | 128.3 | 76% | 0.76 | 69% | 0.687 | S | S | * | * | trans | -50.2 | 103.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 107 | W62 E66 | W62-A64 PolarHBondContact O-N 3.41Å; W62-A64 VanDerWaalsContact O-N 3.08Å; A64-E66 PolarHBondContact O-N 3.2Å | ||
| 65 | L | 55.3 | Low | 56.3 | Low | 97 Ų | 97 | 125 Ų | 125 | 51% | 0.508 | 67% | 0.673 | S | S | . | * | trans | -69.7 | 132.5 | 176.5 | -132.5 | 79.3 | 0 | 0 | 0 | 104.7 | V63 L69 L73 | V63-L65 VanDerWaalsContact C-N 3.31Å; V63-L65 PolarHBondContact O-N 3.48Å; L65-L69 HydrophobicContact CD2-CB 4.24Å; L65-L73 HydrophobicContact CD2-CD1 3.98Å | ||
| 66 | E | 54.4 | Low | 56.2 | Low | 129 Ų | 129 | 127.8 Ų | 127.8 | 60% | 0.603 | 67% | 0.672 | S | S | * | * | trans | -47.9 | 128.3 | 174.6 | -70.6 | -68 | 146.3 | 0 | 0 | 109 | A64 D68 L69 | A64-E66 PolarHBondContact O-N 3.2Å; E66-D68 PolarHBondContact O-N 2.9Å; E66-L69 HydrophobicContact CB-CD1 4.45Å; E66-L69 PolarHBondContact O-N 2.86Å | ||
| 67 | P | 59.5 | Low | 56 | Low | 89 Ų | 89 | 129.7 Ų | 129.7 | 58% | 0.578 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -56.2 | -27.6 | -174.3 | 18.4 | -29 | 0 | 0 | 0 | 112.2 | L69 E70 | P67-L69 VanDerWaalsContact C-N 3.31Å; P67-L69 PolarHBondContact O-N 3.44Å; P67-E70 PolarHBondContact O-N 3.24Å |
| 68 | D | 56.2 | Low | 56 | Low | 112 Ų | 112 | 128.9 Ų | 128.9 | 60% | 0.599 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -63.6 | -31.4 | 176.4 | -62.5 | -3.3 | 0 | 0 | 0 | 112.9 | E66 F72 | E66-D68 PolarHBondContact O-N 2.9Å; D68-F72 WeakPolarHBondContact O-CD2 3.35Å; D68-F72 VanDerWaalsContact O-CE2 3.26Å; D68-F72 WeakPolarHBondContact O-CE2 3.36Å |
| 69 | L | 54.2 | Low | 55.8 | Low | 97 Ų | 97 | 127.8 Ų | 127.8 | 51% | 0.508 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -80.6 | -22.1 | 177.1 | -101 | 107.2 | 0 | 0 | 0 | 113.1 | L65 E66 P67 F72 L73 | L65-L69 HydrophobicContact CD2-CB 4.24Å; E66-L69 HydrophobicContact CB-CD1 4.45Å; E66-L69 PolarHBondContact O-N 2.86Å; P67-L69 VanDerWaalsContact C-N 3.31Å; P67-L69 PolarHBondContact O-N 3.44Å; L69-F72 PolarHBondContact O-N 3.43Å; L69-L73 WeakPolarHBondContact O-CG 3.17Å; L69-L73 PolarHBondContact O-N 2.93Å |
| 70 | E | 56.9 | Low | 55.9 | Low | 124 Ų | 124 | 125.2 Ų | 125.2 | 58% | 0.579 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -71.3 | -35 | -179.4 | -151.8 | 165.7 | -158.4 | 0 | 0 | 110.8 | P67 F72 L73 V74 | P67-E70 PolarHBondContact O-N 3.24Å; E70-F72 VanDerWaalsContact C-N 3.33Å; E70-F72 PolarHBondContact O-N 3.37Å; E70-L73 PolarHBondContact O-N 3.16Å; E70-V74 WeakPolarHBondContact O-CG2 3.21Å; E70-V74 PolarHBondContact O-N 2.99Å |
| 71 | E | 58.7 | Low | 56.2 | Low | 161 Ų | 161 | 120.3 Ų | 120.3 | 75% | 0.752 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -64.7 | -29.8 | 174.3 | -81 | -169.7 | 157.2 | 0 | 0 | 114.1 | ||
| 72 | F | 57.8 | Low | 56.7 | Low | 178 Ų | 178 | 120.3 Ų | 120.3 | 78% | 0.781 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -85 | -16.8 | 178.6 | -65.1 | -72.8 | 0 | 0 | 0 | 113.8 | D68 L69 E70 | D68-F72 WeakPolarHBondContact O-CD2 3.35Å; D68-F72 VanDerWaalsContact O-CE2 3.26Å; D68-F72 WeakPolarHBondContact O-CE2 3.36Å; L69-F72 PolarHBondContact O-N 3.43Å; E70-F72 VanDerWaalsContact C-N 3.33Å; E70-F72 PolarHBondContact O-N 3.37Å |
| 73 | L | 56.6 | Low | 57.3 | Low | 123 Ų | 123 | 115 Ų | 115 | 64% | 0.644 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -96 | -15.2 | -178.4 | -69.7 | 171.4 | 0 | 0 | 0 | 113.1 | L65 L69 E70 P75 | L65-L73 HydrophobicContact CD2-CD1 3.98Å; L69-L73 WeakPolarHBondContact O-CG 3.17Å; L69-L73 PolarHBondContact O-N 2.93Å; E70-L73 PolarHBondContact O-N 3.16Å; L73-P75 WeakPolarHBondContact O-CD 3.42Å |
| 74 | V | 54.7 | Low | 57.6 | Low | 65 Ų | 65 | 114 Ų | 114 | 39% | 0.394 | 61% | 0.609 | S | S | . | * | S | Bend | trans | -79 | 121.1 | 171 | 176.7 | 0 | 0 | 0 | 0 | 108.7 | E70 R76 L78 | E70-V74 WeakPolarHBondContact O-CG2 3.21Å; E70-V74 PolarHBondContact O-N 2.99Å; V74-R76 PolarHBondContact O-N 3.17Å; V74-L78 HydrophobicContact CG1-CB 3.76Å; V74-L78 HydrophobicContact CG1-CD1 4.24Å |
| 75 | P | 59.7 | Low | 57.7 | Low | 87 Ų | 87 | 112.3 Ų | 112.3 | 57% | 0.565 | 59% | 0.592 | S | S | * | * | trans | -53 | 121.1 | 171.1 | -24.5 | 34 | 0 | 0 | 0 | 109.1 | L73 N77 L78 | L73-P75 WeakPolarHBondContact O-CD 3.42Å; P75-N77 PolarHBondContact O-N 3.46Å; P75-L78 PolarHBondContact O-N 2.89Å | ||
| 76 | R | 57.4 | Low | 57.9 | Low | 215 Ų | 215 | 116.2 Ų | 116.2 | 81% | 0.811 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.1 | -3.8 | -176.4 | -136.6 | 174.2 | -172.1 | 138.5 | 0.6 | 116.1 | V74 S79 | V74-R76 PolarHBondContact O-N 3.17Å; R76-S79 PolarHBondContact O-OG 2.94Å; R76-S79 VanDerWaalsContact O-OG 3.09Å |
| 77 | N | 54.8 | Low | 58.1 | Low | 148 Ų | 148 | 114.5 Ų | 114.5 | 79% | 0.791 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | -2.2 | 173.2 | -59.7 | -25.5 | 0 | 0 | 0 | 113.3 | P75 | P75-N77 PolarHBondContact O-N 3.46Š|
| 78 | L | 55 | Low | 58.1 | Low | 135 Ų | 135 | 114.6 Ų | 114.6 | 71% | 0.707 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -104.1 | -9 | 172.4 | -63.5 | 178.6 | 0 | 0 | 0 | 112.9 | V74 P75 V80 | V74-L78 HydrophobicContact CG1-CB 3.76Å; V74-L78 HydrophobicContact CG1-CD1 4.24Å; P75-L78 PolarHBondContact O-N 2.89Å; L78-V80 VanDerWaalsContact C-N 3.34Å |
| 79 | S | 56.9 | Low | 58.1 | Low | 88 Ų | 88 | 115.7 Ų | 115.7 | 62% | 0.615 | 60% | 0.603 | S | S | * | * | S | Bend | trans | -90.4 | 3.7 | 176.4 | 61.5 | 0 | 0 | 0 | 0 | 113.6 | R76 | R76-S79 PolarHBondContact O-OG 2.94Å; R76-S79 VanDerWaalsContact O-OG 3.09Å |
| 80 | V | 56.5 | Low | 58.1 | Low | 60 Ų | 60 | 117 Ų | 117 | 36% | 0.364 | 61% | 0.606 | S | S | . | * | S | Bend | trans | -105.8 | 127.9 | 176.8 | -175.1 | 0 | 0 | 0 | 0 | 107.3 | L78 E84 | L78-V80 VanDerWaalsContact C-N 3.34Å; V80-E84 HydrophobicContact CG1-CB 3.53Å |
| 81 | S | 65.9 | Low | 57.8 | Low | 49 Ų | 49 | 118.4 Ų | 118.4 | 34% | 0.343 | 61% | 0.607 | S | S | . | * | trans | -60.9 | 146.1 | 178 | 70.1 | 0 | 0 | 0 | 0 | 109.5 | L83 E84 S85 | S81-L83 PolarHBondContact O-N 3.21Å; S81-E84 PolarHBondContact N-OE2 3.24Å; S81-E84 VanDerWaalsContact N-OE2 3.11Å; S81-E84 PolarHBondContact O-N 3.35Å; S81-E84 WeakPolarHBondContact OG-CG 3.24Å; S81-E84 PolarHBondContact OG-OE2 3.04Å; S81-S85 PolarHBondContact O-N 3.06Å | ||
| 82 | P | 60.3 | Low | 57.8 | Low | 113 Ų | 113 | 116.3 Ų | 116.3 | 73% | 0.734 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -53.2 | -26.3 | -179.6 | -27.6 | 34.2 | 0 | 0 | 0 | 113.8 | W86 | P82-W86 PolarHBondContact O-N 3.03Å |
| 83 | L | 58.7 | Low | 57.7 | Low | 126 Ų | 126 | 114.5 Ų | 114.5 | 66% | 0.66 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -70.2 | -44.7 | 177.8 | -162.5 | 80.1 | 0 | 0 | 0 | 112.3 | S81 W86 L87 | S81-L83 PolarHBondContact O-N 3.21Å; L83-W86 PolarHBondContact O-N 3.29Å; L83-L87 HydrophobicContact CG-CD1 4.35Å; L83-L87 WeakPolarHBondContact O-CG 3.49Å; L83-L87 PolarHBondContact O-N 3.38Å |
| 84 | E | 61.6 | Low | 57.5 | Low | 105 Ų | 105 | 113.6 Ų | 113.6 | 49% | 0.491 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -71 | -34.3 | -178.7 | -70.2 | 163.2 | 150.8 | 0 | 0 | 111.9 | V80 S81 W86 S88 | V80-E84 HydrophobicContact CG1-CB 3.53Å; S81-E84 PolarHBondContact N-OE2 3.24Å; S81-E84 VanDerWaalsContact N-OE2 3.11Å; S81-E84 PolarHBondContact O-N 3.35Å; S81-E84 WeakPolarHBondContact OG-CG 3.24Å; S81-E84 PolarHBondContact OG-OE2 3.04Å; E84-W86 VanDerWaalsContact C-N 3.34Å; E84-S88 WeakPolarHBondContact O-CB 3.43Å; E84-S88 PolarHBondContact O-N 2.89Å; E84-S88 PolarHBondContact O-OG 3.47Å |
| 85 | S | 60.3 | Low | 57.3 | Low | 58 Ų | 58 | 116.2 Ų | 116.2 | 41% | 0.406 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -63 | -40.4 | 172.5 | -178.1 | 0 | 0 | 0 | 0 | 111.8 | S81 L89 | S81-S85 PolarHBondContact O-N 3.06Å; S85-L89 PolarHBondContact O-N 3.43Å |
| 86 | W | 60.2 | Low | 56.7 | Low | 178 Ų | 178 | 119.8 Ų | 119.8 | 67% | 0.674 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -72 | -41.4 | 177.6 | -104 | 63.4 | 0 | 0 | 0 | 113.2 | P82 L83 E84 S88 L89 H90 | P82-W86 PolarHBondContact O-N 3.03Å; L83-W86 PolarHBondContact O-N 3.29Å; E84-W86 VanDerWaalsContact C-N 3.34Å; W86-S88 VanDerWaalsContact C-N 3.31Å; W86-S88 PolarHBondContact O-N 2.91Å; W86-L89 PolarHBondContact O-N 3.02Å; W86-H90 PolarHBondContact O-CD2 3.18Å; W86-H90 PolarHBondContact O-N 3.34Å |
| 87 | L | 58.7 | Low | 56.2 | Low | 94 Ų | 94 | 117.2 Ų | 117.2 | 49% | 0.492 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -65.8 | -35.3 | 177.5 | -68.6 | 172.1 | 0 | 0 | 0 | 111.7 | L83 L89 H90 Y91 | L83-L87 HydrophobicContact CG-CD1 4.35Å; L83-L87 WeakPolarHBondContact O-CG 3.49Å; L83-L87 PolarHBondContact O-N 3.38Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-L89 PolarHBondContact O-N 3Å; L87-H90 PolarHBondContact O-N 3Å; L87-Y91 HydrophobicContact CD2-CD2 4.46Å; L87-Y91 HydrophobicContact CD2-CE2 4.12Å; L87-Y91 WeakPolarHBondContact O-CD2 3.44Å; L87-Y91 PolarHBondContact O-N 3.48Å |
| 88 | S | 58.1 | Low | 55.6 | Low | 91 Ų | 91 | 119 Ų | 119 | 64% | 0.636 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -67.7 | -30.2 | 176.8 | -57.4 | 0 | 0 | 0 | 0 | 113.4 | E84 W86 | E84-S88 WeakPolarHBondContact O-CB 3.43Å; E84-S88 PolarHBondContact O-N 2.89Å; E84-S88 PolarHBondContact O-OG 3.47Å; W86-S88 VanDerWaalsContact C-N 3.31Å; W86-S88 PolarHBondContact O-N 2.91Å |
| 89 | L | 57.7 | Low | 55 | Low | 135 Ų | 135 | 116.9 Ų | 116.9 | 71% | 0.707 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -78.3 | -22.8 | 178.4 | -87.8 | 167.5 | 0 | 0 | 0 | 113.6 | S85 W86 L87 | S85-L89 PolarHBondContact O-N 3.43Å; W86-L89 PolarHBondContact O-N 3.02Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-L89 PolarHBondContact O-N 3Å |
| 90 | H | 53.9 | Low | 54 | Low | 125 Ų | 125 | 118.7 Ų | 118.7 | 58% | 0.579 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -103.4 | -8.8 | -176.4 | -77 | -72.4 | 0 | 0 | 0 | 114.5 | W86 L87 | W86-H90 PolarHBondContact O-CD2 3.18Å; W86-H90 PolarHBondContact O-N 3.34Å; L87-H90 PolarHBondContact O-N 3Å |
| 91 | Y | 50.8 | Low | 53 | Low | 152 Ų | 152 | 124.8 Ų | 124.8 | 60% | 0.596 | 68% | 0.683 | S | S | * | * | trans | -135 | 78.6 | 179 | -59.8 | -80.8 | 0 | 0 | 0 | 110.7 | L87 L93 | L87-Y91 HydrophobicContact CD2-CD2 4.46Å; L87-Y91 HydrophobicContact CD2-CE2 4.12Å; L87-Y91 WeakPolarHBondContact O-CD2 3.44Å; L87-Y91 PolarHBondContact O-N 3.48Å; Y91-L93 PolarHBondContact O-N 3.21Å | ||
| 92 | S | 58.1 | Low | 51.8 | Low | 118 Ų | 118 | 127.6 Ų | 127.6 | 83% | 0.825 | 70% | 0.699 | S | S | * | * | trans | -70.6 | 74.7 | 148.6 | 60.2 | 0 | 0 | 0 | 0 | 107.5 | P94 | S92-P94 WeakPolarHBondContact O-CD 3.42Š| ||
| 93 | L | 54.8 | Low | 50.7 | Low | 139 Ų | 139 | 127.7 Ų | 127.7 | 73% | 0.728 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -63 | 125.4 | 170.7 | -95.4 | 151.4 | 0 | 0 | 0 | 107.6 | Y91 | Y91-L93 PolarHBondContact O-N 3.21Š|
| 94 | P | 54.2 | Low | 49.5 | Very low | 105 Ų | 105 | 129.1 Ų | 129.1 | 68% | 0.682 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 141.7 | 170.2 | -23.2 | 33.4 | 0 | 0 | 0 | 109.6 | S92 L96 | S92-P94 WeakPolarHBondContact O-CD 3.42Å; P94-L96 PolarHBondContact O-N 3.43Å |
| 95 | P | 50.6 | Low | 48.2 | Very low | 120 Ų | 120 | 132.9 Ų | 132.9 | 78% | 0.779 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -51 | 130 | 177.6 | -24.7 | 33 | 0 | 0 | 0 | 110.4 | L97 | P95-L97 VanDerWaalsContact C-N 3.32Å; P95-L97 PolarHBondContact O-N 2.94Å |
| 96 | L | 46.2 | Very low | 47.1 | Very low | 162 Ų | 162 | 133.7 Ų | 133.7 | 85% | 0.848 | 74% | 0.738 | S | S | * | * | trans | -62.4 | 93.4 | 178.1 | -163.3 | 154.5 | 0 | 0 | 0 | 107.9 | P94 E98 | P94-L96 PolarHBondContact O-N 3.43Å; L96-E98 PolarHBondContact O-N 3.35Å | ||
| 97 | L | 46.8 | Very low | 45.7 | Very low | 161 Ų | 161 | 132.9 Ų | 132.9 | 84% | 0.843 | 75% | 0.747 | S | S | * | * | trans | -60.3 | 127.7 | 167.4 | -73.7 | 170.5 | 0 | 0 | 0 | 107.3 | P95 A99 | P95-L97 VanDerWaalsContact C-N 3.32Å; P95-L97 PolarHBondContact O-N 2.94Å; L97-A99 PolarHBondContact O-N 3.42Å | ||
| 98 | E | 41.6 | Very low | 45.1 | Very low | 185 Ų | 185 | 134.4 Ų | 134.4 | 86% | 0.864 | 76% | 0.76 | S | S | * | * | trans | -44 | 125 | 178.4 | -73.7 | 171.3 | 137.5 | 0 | 0 | 111.3 | L96 | L96-E98 PolarHBondContact O-N 3.35Š| ||
| 99 | A | 42.1 | Very low | 44.1 | Very low | 91 Ų | 91 | 138.5 Ų | 138.5 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 131.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | L97 | L97-A99 PolarHBondContact O-N 3.42Š|
| 100 | P | 37.4 | Very low | 43.4 | Very low | 126 Ų | 126 | 138.2 Ų | 138.2 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 125.6 | 155.9 | 1.7 | 17.2 | 0 | 0 | 0 | 109.1 | ||
| 101 | Q | 35.5 | Very low | 43.1 | Very low | 188 Ų | 188 | 138 Ų | 138 | 88% | 0.879 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 166.3 | 166 | -115.6 | -169.4 | -40 | 0 | 0 | 111 | ||
| 102 | P | 40.9 | Very low | 42.7 | Very low | 107 Ų | 107 | 136.9 Ų | 136.9 | 70% | 0.695 | 79% | 0.787 | S | S | * | * | -105.8 | 177.1 | -126.8 | 38.6 | -24.6 | 0 | 0 | 0 | 113.9 | |||||
| 103 | P | 36.2 | Very low | 42.2 | Very low | 115 Ų | 115 | 139.2 Ų | 139.2 | 75% | 0.747 | 78% | 0.783 | S | S | * | * | trans | -130.5 | 134.1 | 136.6 | 33.2 | -20.7 | 0 | 0 | 0 | 114 | ||||
| 104 | E | 33 | Very low | 41.9 | Very low | 156 Ų | 156 | 139.1 Ų | 139.1 | 73% | 0.729 | 79% | 0.788 | S | S | * | * | trans | 59.1 | 108.9 | 137.1 | -51.2 | -57.2 | 137.9 | 0 | 0 | 121 | ||||
| 105 | E | 36 | Very low | 41.6 | Very low | 184 Ų | 184 | 141.2 Ų | 141.2 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | 36.5 | 117.8 | 132 | -58.1 | -170.7 | 169.9 | 0 | 0 | 120.9 | ||||
| 106 | G | 35.2 | Very low | 41.5 | Very low | 75 Ų | 75 | 140.9 Ų | 140.9 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | trans | 98.1 | 82.5 | 142.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 107 | D | 32.6 | Very low | 41.6 | Very low | 161 Ų | 161 | 138.7 Ų | 138.7 | 86% | 0.861 | 79% | 0.785 | S | S | * | * | -167.1 | 137.2 | 115.6 | -117.4 | -21.7 | 0 | 0 | 0 | 112.5 | M109 | D107-M109 PolarHBondContact O-N 2.89Š| |||
| 108 | V | 45.8 | Very low | 41.5 | Very low | 126 Ų | 126 | 140.7 Ų | 140.7 | 76% | 0.764 | 79% | 0.788 | S | S | * | * | trans | -72.3 | 103.8 | 176.1 | 172.4 | 0 | 0 | 0 | 0 | 108.2 | V110 | V108-V110 HydrophobicContact CG1-CG2 4.36Š| ||
| 109 | M | 36.7 | Very low | 41.6 | Very low | 177 Ų | 177 | 136.2 Ų | 136.2 | 87% | 0.872 | 78% | 0.782 | S | S | * | * | trans | -126.8 | 88.7 | 158.5 | -78.7 | -165 | 163.2 | 0 | 0 | 109.5 | D107 D111 | D107-M109 PolarHBondContact O-N 2.89Å; M109-D111 PolarHBondContact O-N 3.02Å | ||
| 110 | V | 43.1 | Very low | 42.2 | Very low | 130 Ų | 130 | 137.5 Ų | 137.5 | 79% | 0.788 | 78% | 0.781 | S | S | * | * | trans | -64.7 | 84.1 | 160.6 | 179.1 | 0 | 0 | 0 | 0 | 107.2 | V108 | V108-V110 HydrophobicContact CG1-CG2 4.36Š| ||
| 111 | D | 47.9 | Very low | 42.7 | Very low | 120 Ų | 120 | 137.1 Ų | 137.1 | 64% | 0.642 | 78% | 0.778 | S | S | * | * | trans | -111.9 | 62 | 166.2 | -161.6 | 23.9 | 0 | 0 | 0 | 108.8 | M109 K113 | M109-D111 PolarHBondContact O-N 3.02Å; D111-K113 PolarHBondContact O-N 3.2Å | ||
| 112 | T | 42.3 | Very low | 43.3 | Very low | 128 Ų | 128 | 135.9 Ų | 135.9 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | trans | -82.5 | 81.6 | 167.5 | -46.4 | 0 | 0 | 0 | 0 | 107.8 | V114 | T112-V114 PolarHBondContact O-N 2.89Š| ||
| 113 | K | 46.6 | Very low | 43.7 | Very low | 167 Ų | 167 | 138.1 Ų | 138.1 | 73% | 0.726 | 78% | 0.782 | S | S | * | * | trans | -19.9 | 112.8 | 161 | -88.7 | 149.2 | 174.6 | 159.1 | 0 | 112.9 | D111 L115 | D111-K113 PolarHBondContact O-N 3.2Å; K113-L115 PolarHBondContact O-N 2.93Å | ||
| 114 | V | 48.6 | Very low | 44.1 | Very low | 138 Ų | 138 | 141.1 Ų | 141.1 | 84% | 0.836 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 119.8 | 158.8 | 176.3 | 0 | 0 | 0 | 0 | 108 | T112 | T112-V114 PolarHBondContact O-N 2.89Š|
| 115 | L | 48.5 | Very low | 44.8 | Very low | 149 Ų | 149 | 143.3 Ų | 143.3 | 78% | 0.78 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 134.3 | 174.7 | -68.8 | 166.8 | 0 | 0 | 0 | 109.1 | K113 | K113-L115 PolarHBondContact O-N 2.93Š|
| 116 | P | 47.8 | Very low | 45.1 | Very low | 112 Ų | 112 | 137.7 Ų | 137.7 | 73% | 0.727 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 131.5 | 170.9 | 25.4 | -30.4 | 0 | 0 | 0 | 107.7 | F118 | P116-F118 PolarHBondContact O-N 3.25Š|
| 117 | P | 48.8 | Very low | 45.7 | Very low | 116 Ų | 116 | 142.7 Ų | 142.7 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 133 | 175.3 | 20.8 | -30.2 | 0 | 0 | 0 | 108.5 | A119 | P117-A119 VanDerWaalsContact C-N 3.35Å; P117-A119 PolarHBondContact O-N 3Å |
| 118 | F | 43.8 | Very low | 46.4 | Very low | 204 Ų | 204 | 137.7 Ų | 137.7 | 90% | 0.895 | 78% | 0.783 | S | S | * | * | trans | -40.7 | 94.7 | -179.8 | -148.3 | -94.7 | 0 | 0 | 0 | 110.2 | P116 V120 | P116-F118 PolarHBondContact O-N 3.25Å; F118-V120 VanDerWaalsContact C-N 3.3Å; F118-V120 PolarHBondContact O-N 2.96Å | ||
| 119 | A | 43.7 | Very low | 46.5 | Very low | 90 Ų | 90 | 137.2 Ų | 137.2 | 74% | 0.744 | 79% | 0.785 | S | S | * | * | trans | -71.5 | 95 | 178.7 | 0 | 0 | 0 | 0 | 0 | 106.6 | P117 P121 | P117-A119 VanDerWaalsContact C-N 3.35Å; P117-A119 PolarHBondContact O-N 3Å; A119-P121 WeakPolarHBondContact O-CD 3.42Å | ||
| 120 | V | 56.4 | Low | 47.5 | Very low | 119 Ų | 119 | 135 Ų | 135 | 72% | 0.721 | 78% | 0.781 | S | S | * | * | trans | -44.6 | 123.5 | 157.7 | -179.9 | 0 | 0 | 0 | 0 | 106.2 | F118 L122 | F118-V120 VanDerWaalsContact C-N 3.3Å; F118-V120 PolarHBondContact O-N 2.96Å; V120-L122 PolarHBondContact O-N 3.48Å | ||
| 121 | P | 47.3 | Very low | 48.5 | Very low | 117 Ų | 117 | 134 Ų | 134 | 76% | 0.76 | 78% | 0.776 | S | S | * | * | trans | -56.7 | 109.3 | 179.5 | -24.9 | 33.6 | 0 | 0 | 0 | 109.2 | A119 L123 | A119-P121 WeakPolarHBondContact O-CD 3.42Å; P121-L123 VanDerWaalsContact C-N 3.34Å; P121-L123 PolarHBondContact O-N 2.91Å | ||
| 122 | L | 48.5 | Very low | 49.1 | Very low | 162 Ų | 162 | 133.7 Ų | 133.7 | 85% | 0.848 | 78% | 0.78 | S | S | * | * | trans | -58 | 103.7 | 162.2 | 176.2 | 65.1 | 0 | 0 | 0 | 105.4 | V120 E124 | V120-L122 PolarHBondContact O-N 3.48Å; L122-E124 VanDerWaalsContact C-N 3.33Å; L122-E124 PolarHBondContact O-N 3.38Å | ||
| 123 | L | 48.2 | Very low | 49.9 | Very low | 155 Ų | 155 | 134.2 Ų | 134.2 | 81% | 0.812 | 78% | 0.778 | S | S | * | * | trans | -67.1 | 96.7 | 178 | -157.9 | 157.6 | 0 | 0 | 0 | 105.9 | P121 E125 | P121-L123 VanDerWaalsContact C-N 3.34Å; P121-L123 PolarHBondContact O-N 2.91Å; L123-E125 PolarHBondContact O-N 3.36Å | ||
| 124 | E | 45 | Very low | 50.7 | Low | 177 Ų | 177 | 129.1 Ų | 129.1 | 83% | 0.827 | 76% | 0.763 | S | S | * | * | trans | -55.5 | 122.7 | 169 | -82.7 | -152.2 | 156 | 0 | 0 | 108.5 | L122 G126 | L122-E124 VanDerWaalsContact C-N 3.33Å; L122-E124 PolarHBondContact O-N 3.38Å; E124-G126 PolarHBondContact O-N 2.72Å | ||
| 125 | E | 47 | Very low | 51.5 | Low | 203 Ų | 203 | 126.7 Ų | 126.7 | 95% | 0.949 | 75% | 0.751 | S | S | * | * | trans | -70.7 | 79.6 | 178.8 | -159 | 168 | -154.3 | 0 | 0 | 108.2 | L123 | L123-E125 PolarHBondContact O-N 3.36Š| ||
| 126 | G | 43.9 | Very low | 52.8 | Low | 65 Ų | 65 | 127.3 Ų | 127.3 | 67% | 0.67 | 75% | 0.747 | S | S | * | * | trans | -113.2 | 112.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | E124 | E124-G126 PolarHBondContact O-N 2.72Š| ||
| 127 | D | 46.2 | Very low | 54.6 | Low | 180 Ų | 180 | 126.5 Ų | 126.5 | 96% | 0.963 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -3.9 | 113.2 | 173.5 | -91.3 | -36.2 | 0 | 0 | 0 | 118.3 | ||
| 128 | G | 47.6 | Very low | 56.6 | Low | 56 Ų | 56 | 124 Ų | 124 | 58% | 0.577 | 72% | 0.719 | S | S | * | * | S | Bend | trans | 136.6 | 100.8 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | V130 | G128-V130 PolarHBondContact O-N 2.98Š|
| 129 | S | 48 | Very low | 59 | Low | 116 Ų | 116 | 118.2 Ų | 118.2 | 81% | 0.811 | 70% | 0.697 | S | S | * | * | trans | -56.4 | 82.8 | 174.1 | 58.4 | 0 | 0 | 0 | 0 | 110.9 | T131 | S129-T131 PolarHBondContact O-N 2.9Å; S129-T131 PolarHBondContact O-OG1 3.3Å | ||
| 130 | V | 58.8 | Low | 61.5 | Low | 130 Ų | 130 | 117.3 Ų | 117.3 | 79% | 0.788 | 68% | 0.678 | S | S | * | * | trans | -77.3 | 68.1 | 164.6 | -171.7 | 0 | 0 | 0 | 0 | 105.3 | G128 P132 | G128-V130 PolarHBondContact O-N 2.98Å; V130-P132 WeakPolarHBondContact O-CD 3.29Å | ||
| 131 | T | 63.3 | Low | 63.3 | Low | 110 Ų | 110 | 116.9 Ų | 116.9 | 68% | 0.675 | 67% | 0.67 | S | S | * | * | trans | -45.5 | 121.1 | 155.9 | 4.4 | 0 | 0 | 0 | 0 | 105.3 | S129 L133 | S129-T131 PolarHBondContact O-N 2.9Å; S129-T131 PolarHBondContact O-OG1 3.3Å; T131-L133 PolarHBondContact O-N 3.32Å | ||
| 132 | P | 60.8 | Low | 65.7 | Low | 114 Ų | 114 | 119.3 Ų | 119.3 | 74% | 0.74 | 66% | 0.664 | S | S | * | * | trans | -56.4 | 108 | 179.8 | 21.1 | -31.1 | 0 | 0 | 0 | 105.8 | V130 S134 | V130-P132 WeakPolarHBondContact O-CD 3.29Å; P132-S134 VanDerWaalsContact C-N 3.33Å; P132-S134 PolarHBondContact O-N 2.88Å | ||
| 133 | L | 60.1 | Low | 68 | Low | 139 Ų | 139 | 118.1 Ų | 118.1 | 73% | 0.728 | 65% | 0.648 | S | S | * | * | trans | -53.9 | 102.6 | -173.9 | -96.6 | 162.8 | 0 | 0 | 0 | 105.9 | T131 C135 | T131-L133 PolarHBondContact O-N 3.32Å; L133-C135 VanDerWaalsContact C-N 3.33Å; L133-C135 PolarHBondContact O-N 2.64Å; L133-C135 PolarHBondContact O-SG 2.99Å | ||
| 134 | S | 62.7 | Low | 70.4 | Confident | 59 Ų | 59 | 118.7 Ų | 118.7 | 41% | 0.413 | 64% | 0.64 | S | S | . | * | trans | -66.1 | 104.5 | -175.9 | 86.2 | 0 | 0 | 0 | 0 | 105.8 | P132 K136 N137 | P132-S134 VanDerWaalsContact C-N 3.33Å; P132-S134 PolarHBondContact O-N 2.88Å; S134-K136 PolarHBondContact O-N 3.49Å; S134-N137 PolarHBondContact O-N 3.27Å; S134-N137 PolarHBondContact OG-ND2 2.96Å | ||
| 135 | C | 66.1 | Low | 72.9 | Confident | 87 Ų | 87 | 117.9 Ų | 117.9 | 59% | 0.588 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -58.2 | -18.2 | -173 | -66.7 | 0 | 0 | 0 | 0 | 111.6 | L133 N137 V138 L139 | L133-C135 VanDerWaalsContact C-N 3.33Å; L133-C135 PolarHBondContact O-N 2.64Å; L133-C135 PolarHBondContact O-SG 2.99Å; C135-N137 VanDerWaalsContact C-N 3.33Å; C135-N137 PolarHBondContact O-N 3.45Å; C135-V138 PolarHBondContact O-N 3.21Å; C135-L139 WeakPolarHBondContact O-CB 3.4Å; C135-L139 WeakPolarHBondContact O-CG 3.26Å; C135-L139 PolarHBondContact O-N 2.76Å |
| 136 | K | 75.5 | Confident | 75.4 | Confident | 162 Ų | 162 | 112.8 Ų | 112.8 | 70% | 0.704 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -51.1 | -48.1 | 168.8 | -64.6 | -178 | -179.3 | 177.1 | 0 | 111.6 | S134 E140 | S134-K136 PolarHBondContact O-N 3.49Å; K136-E140 WeakPolarHBondContact O-CB 3.48Å; K136-E140 VanDerWaalsContact O-CG 3.31Å; K136-E140 WeakPolarHBondContact O-CG 3.45Å; K136-E140 PolarHBondContact O-N 3.38Å |
| 137 | N | 84.5 | Confident | 78 | Confident | 95 Ų | 95 | 114.8 Ų | 114.8 | 51% | 0.508 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -66.8 | -41.9 | 179.1 | -73.7 | -21.5 | 0 | 0 | 0 | 112.1 | S134 C135 E140 I141 | S134-N137 PolarHBondContact O-N 3.27Å; S134-N137 PolarHBondContact OG-ND2 2.96Å; C135-N137 VanDerWaalsContact C-N 3.33Å; C135-N137 PolarHBondContact O-N 3.45Å; N137-E140 PolarHBondContact O-N 2.88Å; N137-I141 WeakPolarHBondContact O-CB 3.33Å; N137-I141 WeakPolarHBondContact O-CD1 3.47Å; N137-I141 WeakPolarHBondContact O-CG1 3.48Å; N137-I141 PolarHBondContact O-N 2.9Å |
| 138 | V | 91.7 | Very high | 80.5 | Confident | 64 Ų | 64 | 113.5 Ų | 113.5 | 39% | 0.388 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -67.6 | -42.6 | 179.7 | 179.3 | 0 | 0 | 0 | 0 | 111.7 | C135 I141 R142 | C135-V138 PolarHBondContact O-N 3.21Å; V138-I141 PolarHBondContact O-N 2.88Å; V138-R142 WeakPolarHBondContact O-CG 3.4Å; V138-R142 PolarHBondContact O-N 3.39Å |
| 139 | L | 93.5 | Very high | 82.9 | Confident | 83 Ų | 83 | 115.3 Ų | 115.3 | 44% | 0.435 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -66.3 | -38.6 | 176.6 | -69.9 | 177.3 | 0 | 0 | 0 | 111.7 | C135 R142 R143 | C135-L139 WeakPolarHBondContact O-CB 3.4Å; C135-L139 WeakPolarHBondContact O-CG 3.26Å; C135-L139 PolarHBondContact O-N 2.76Å; L139-R142 PolarHBondContact O-N 2.73Å; L139-R143 WeakPolarHBondContact O-CB 3.46Å; L139-R143 WeakPolarHBondContact O-CG 3.5Å; L139-R143 PolarHBondContact O-N 3.34Å |
| 140 | E | 95.6 | Very high | 85.3 | Confident | 70 Ų | 70 | 116.1 Ų | 116.1 | 33% | 0.327 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61 | -45.7 | 170.6 | -79.5 | -171 | -150.5 | 0 | 0 | 112.4 | K136 N137 R143 R144 | K136-E140 WeakPolarHBondContact O-CB 3.48Å; K136-E140 VanDerWaalsContact O-CG 3.31Å; K136-E140 WeakPolarHBondContact O-CG 3.45Å; K136-E140 PolarHBondContact O-N 3.38Å; N137-E140 PolarHBondContact O-N 2.88Å; E140-R143 VanDerWaalsContact CG-NH2 3.34Å; E140-R143 PolarHBondContact O-N 2.88Å; E140-R144 WeakPolarHBondContact O-CB 3.43Å; E140-R144 VanDerWaalsContact O-CG 3.29Å; E140-R144 WeakPolarHBondContact O-CG 3.24Å; E140-R144 PolarHBondContact O-N 3.44Å; E140-R144 IonicContact OE2-CZ 3.8Å; E140-R144 IonicContact OE2-NH2 2.9Å; E140-R144 PolarHBondContact OE2-NH2 3.3Å |
| 141 | I | 95.5 | Very high | 87.2 | Confident | 110 Ų | 110 | 115.2 Ų | 115.2 | 56% | 0.564 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.3 | -46.1 | 177.1 | -69.7 | 162.1 | 0 | 0 | 0 | 110.4 | N137 V138 R143 R144 K145 | N137-I141 WeakPolarHBondContact O-CB 3.33Å; N137-I141 WeakPolarHBondContact O-CD1 3.47Å; N137-I141 WeakPolarHBondContact O-CG1 3.48Å; N137-I141 PolarHBondContact O-N 2.9Å; V138-I141 PolarHBondContact O-N 2.88Å; I141-R143 PolarHBondContact O-N 2.99Å; I141-R144 PolarHBondContact O-N 2.86Å; I141-K145 VanDerWaalsContact O-CB 3.27Å; I141-K145 WeakPolarHBondContact O-CB 3.29Å; I141-K145 PolarHBondContact O-N 3.28Å |
| 142 | R | 96.8 | Very high | 88.9 | Confident | 168 Ų | 168 | 114.6 Ų | 114.6 | 63% | 0.634 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -62.2 | -40.3 | 177.1 | -72.7 | 177.9 | 72 | -173.5 | 2.9 | 112 | V138 L139 M146 | V138-R142 WeakPolarHBondContact O-CG 3.4Å; V138-R142 PolarHBondContact O-N 3.39Å; L139-R142 PolarHBondContact O-N 2.73Å; R142-M146 WeakPolarHBondContact O-CB 3.36Å; R142-M146 PolarHBondContact O-N 3.41Å |
| 143 | R | 97.8 | Very high | 90.7 | Very high | 137 Ų | 137 | 114 Ų | 114 | 52% | 0.517 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.6 | -50.3 | 172.6 | -81 | -170.6 | -67.1 | -96.5 | 0.4 | 111.6 | L139 E140 I141 K145 M146 N147 | L139-R143 WeakPolarHBondContact O-CB 3.46Å; L139-R143 WeakPolarHBondContact O-CG 3.5Å; L139-R143 PolarHBondContact O-N 3.34Å; E140-R143 VanDerWaalsContact CG-NH2 3.34Å; E140-R143 PolarHBondContact O-N 2.88Å; I141-R143 PolarHBondContact O-N 2.99Å; R143-K145 VanDerWaalsContact C-N 3.34Å; R143-K145 PolarHBondContact O-N 3.4Å; R143-M146 PolarHBondContact O-N 3.35Å; R143-N147 WeakPolarHBondContact O-CB 3.36Å; R143-N147 VanDerWaalsContact O-CG 3.27Å; R143-N147 PolarHBondContact O-N 3.18Å |
| 144 | R | 97.7 | Very high | 92.5 | Very high | 168 Ų | 168 | 111.8 Ų | 111.8 | 63% | 0.634 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.5 | -41.6 | 178.5 | -69.1 | 176.2 | -165.3 | -170.1 | 9.2 | 111.5 | E140 I141 N147 R148 | E140-R144 WeakPolarHBondContact O-CB 3.43Å; E140-R144 VanDerWaalsContact O-CG 3.29Å; E140-R144 WeakPolarHBondContact O-CG 3.24Å; E140-R144 PolarHBondContact O-N 3.44Å; E140-R144 IonicContact OE2-CZ 3.8Å; E140-R144 IonicContact OE2-NH2 2.9Å; E140-R144 PolarHBondContact OE2-NH2 3.3Å; I141-R144 PolarHBondContact O-N 2.86Å; R144-N147 PolarHBondContact O-N 2.95Å; R144-R148 WeakPolarHBondContact O-CB 3.14Å; R144-R148 PolarHBondContact O-N 2.99Å |
| 145 | K | 98.3 | Very high | 94.2 | Very high | 159 Ų | 159 | 110.8 Ų | 110.8 | 69% | 0.691 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -56.2 | -53.4 | 173.2 | 178.4 | -163.6 | 177.9 | -179.4 | 0 | 110.5 | I141 R143 N147 R148 H149 | I141-K145 VanDerWaalsContact O-CB 3.27Å; I141-K145 WeakPolarHBondContact O-CB 3.29Å; I141-K145 PolarHBondContact O-N 3.28Å; R143-K145 VanDerWaalsContact C-N 3.34Å; R143-K145 PolarHBondContact O-N 3.4Å; K145-N147 PolarHBondContact O-N 2.91Å; K145-R148 PolarHBondContact O-N 2.92Å; K145-H149 WeakPolarHBondContact O-CB 3.44Å; K145-H149 PolarHBondContact O-N 3.39Å |
| 146 | M | 98.6 | Very high | 95.8 | Very high | 96 Ų | 96 | 114.7 Ų | 114.7 | 47% | 0.473 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.8 | -43.5 | -179 | -175 | 56.6 | 71.6 | 0 | 0 | 111.5 | R142 R143 R148 H149 K150 | R142-M146 WeakPolarHBondContact O-CB 3.36Å; R142-M146 PolarHBondContact O-N 3.41Å; R143-M146 PolarHBondContact O-N 3.35Å; M146-R148 PolarHBondContact O-N 3.37Å; M146-H149 WeakPolarHBondContact O-CB 3.48Å; M146-H149 PolarHBondContact O-N 3.46Å; M146-K150 HydrophobicContact CG-CD 4.28Å; M146-K150 HydrophobicContact CG-CG 4.47Å; M146-K150 WeakPolarHBondContact O-CB 3.17Å; M146-K150 WeakPolarHBondContact O-CG 3.43Å; M146-K150 PolarHBondContact O-N 2.89Å; M146-K150 HydrophobicContact SD-CD 4.45Å; M146-K150 HydrophobicContact SD-CG 4.2Å |
| 147 | N | 98.6 | Very high | 96.9 | Very high | 108 Ų | 108 | 116.2 Ų | 116.2 | 58% | 0.578 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61 | -46 | 177.2 | -73 | -7.4 | 0 | 0 | 0 | 111.8 | R143 R144 K145 H149 K150 Y151 | R143-N147 WeakPolarHBondContact O-CB 3.36Å; R143-N147 VanDerWaalsContact O-CG 3.27Å; R143-N147 PolarHBondContact O-N 3.18Å; R144-N147 PolarHBondContact O-N 2.95Å; K145-N147 PolarHBondContact O-N 2.91Å; N147-H149 VanDerWaalsContact C-N 3.34Å; N147-H149 PolarHBondContact O-N 2.92Å; N147-K150 PolarHBondContact O-N 3.47Å; N147-Y151 VanDerWaalsContact O-CB 3.28Å; N147-Y151 WeakPolarHBondContact O-CB 3.39Å; N147-Y151 PolarHBondContact O-N 2.91Å |
| 148 | R | 98.6 | Very high | 97.5 | Very high | 153 Ų | 153 | 113.5 Ų | 113.5 | 58% | 0.577 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -62.9 | -41.5 | 176.2 | -175.1 | 65 | -179.5 | -82.7 | -0.1 | 111.5 | R144 K145 M146 Y151 K152 | R144-R148 WeakPolarHBondContact O-CB 3.14Å; R144-R148 PolarHBondContact O-N 2.99Å; K145-R148 PolarHBondContact O-N 2.92Å; M146-R148 PolarHBondContact O-N 3.37Å; R148-Y151 PolarHBondContact O-N 3.49Å; R148-K152 WeakPolarHBondContact O-CB 3.25Å; R148-K152 VanDerWaalsContact O-CG 3.3Å; R148-K152 WeakPolarHBondContact O-CG 3.31Å; R148-K152 PolarHBondContact O-N 2.9Å |
| 149 | H | 98.7 | Very high | 97.8 | Very high | 93 Ų | 93 | 116.9 Ų | 116.9 | 43% | 0.431 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.6 | -50.9 | 176.8 | 179 | 82.5 | 0 | 0 | 0 | 111.6 | K145 M146 N147 Y151 K152 K153 | K145-H149 WeakPolarHBondContact O-CB 3.44Å; K145-H149 PolarHBondContact O-N 3.39Å; M146-H149 WeakPolarHBondContact O-CB 3.48Å; M146-H149 PolarHBondContact O-N 3.46Å; N147-H149 VanDerWaalsContact C-N 3.34Å; N147-H149 PolarHBondContact O-N 2.92Å; H149-Y151 PolarHBondContact O-N 3.27Å; H149-K152 PolarHBondContact O-N 3.47Å; H149-K153 VanDerWaalsContact NE2-CE 3.27Å; H149-K153 WeakPolarHBondContact NE2-CE 3.49Å; H149-K153 PolarHBondContact O-N 3.24Å |
| 150 | K | 98.8 | Very high | 98 | Very high | 134 Ų | 134 | 120.2 Ų | 120.2 | 58% | 0.583 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.6 | -45 | 176.6 | -73.3 | -176.7 | 177.5 | -177.4 | 0 | 111.4 | M146 N147 K152 K153 L154 | M146-K150 HydrophobicContact CG-CD 4.28Å; M146-K150 HydrophobicContact CG-CG 4.47Å; M146-K150 WeakPolarHBondContact O-CB 3.17Å; M146-K150 WeakPolarHBondContact O-CG 3.43Å; M146-K150 PolarHBondContact O-N 2.89Å; M146-K150 HydrophobicContact SD-CD 4.45Å; M146-K150 HydrophobicContact SD-CG 4.2Å; N147-K150 PolarHBondContact O-N 3.47Å; K150-K152 PolarHBondContact O-N 3.43Å; K150-K153 PolarHBondContact O-N 3.45Å; K150-L154 PolarHBondContact O-N 3.47Å |
| 151 | Y | 98.7 | Very high | 98.1 | Very high | 111 Ų | 111 | 121.9 Ų | 121.9 | 44% | 0.435 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.2 | -47.4 | 176.2 | 178.9 | -109 | 0 | 0 | 0 | 111.9 | N147 R148 H149 K153 L154 L155 R162 | N147-Y151 VanDerWaalsContact O-CB 3.28Å; N147-Y151 WeakPolarHBondContact O-CB 3.39Å; N147-Y151 PolarHBondContact O-N 2.91Å; R148-Y151 PolarHBondContact O-N 3.49Å; H149-Y151 PolarHBondContact O-N 3.27Å; Y151-K153 PolarHBondContact O-N 3.24Å; Y151-L154 WeakPolarHBondContact O-CB 3.47Å; Y151-L154 PolarHBondContact O-N 3.4Å; Y151-L155 HydrophobicContact CD1-CD1 4.16Å; Y151-L155 HydrophobicContact CD1-CD2 4.48Å; Y151-L155 HydrophobicContact CD1-CG 4.1Å; Y151-L155 HydrophobicContact CD2-CD2 4.11Å; Y151-L155 HydrophobicContact CE1-CD1 3.49Å; Y151-L155 VanDerWaalsContact CE1-CD1 3.49Å; Y151-L155 HydrophobicContact CE1-CD2 4.02Å; Y151-L155 HydrophobicContact CE1-CG 3.79Å; Y151-L155 HydrophobicContact CE2-CD2 3.61Å; Y151-L155 HydrophobicContact CE2-CG 4.25Å; Y151-L155 HydrophobicContact CG-CG 4.46Å; Y151-L155 VanDerWaalsContact O-CG 3.25Å; Y151-L155 WeakPolarHBondContact O-CG 3.39Å; Y151-L155 PolarHBondContact O-N 3.24Å; Y151-R162 PolarHBondContact OH-NH2 3.29Å |
| 152 | K | 98.6 | Very high | 98.2 | Very high | 97 Ų | 97 | 121.7 Ų | 121.7 | 42% | 0.422 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.7 | -39.7 | 176.8 | -72.6 | -71.8 | -172.1 | 172.9 | 0 | 112 | R148 H149 K150 L155 K156 | R148-K152 WeakPolarHBondContact O-CB 3.25Å; R148-K152 VanDerWaalsContact O-CG 3.3Å; R148-K152 WeakPolarHBondContact O-CG 3.31Å; R148-K152 PolarHBondContact O-N 2.9Å; H149-K152 PolarHBondContact O-N 3.47Å; K150-K152 PolarHBondContact O-N 3.43Å; K152-L155 PolarHBondContact O-N 3.11Å; K152-K156 WeakPolarHBondContact O-CG 3.36Å; K152-K156 PolarHBondContact O-N 2.86Å |
| 153 | K | 98.7 | Very high | 98.2 | Very high | 102 Ų | 102 | 121.2 Ų | 121.2 | 44% | 0.443 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61 | -45.2 | 172.9 | -81.4 | -160.3 | 171.4 | 178.3 | 0 | 111.5 | H149 K150 Y151 L155 K156 R157 | H149-K153 VanDerWaalsContact NE2-CE 3.27Å; H149-K153 WeakPolarHBondContact NE2-CE 3.49Å; H149-K153 PolarHBondContact O-N 3.24Å; K150-K153 PolarHBondContact O-N 3.45Å; Y151-K153 PolarHBondContact O-N 3.24Å; K153-L155 VanDerWaalsContact C-N 3.33Å; K153-L155 PolarHBondContact O-N 3.21Å; K153-K156 PolarHBondContact O-N 2.84Å; K153-R157 WeakPolarHBondContact O-CG 3.29Å; K153-R157 PolarHBondContact O-N 3.01Å |
| 154 | L | 98.6 | Very high | 98.1 | Very high | 91 Ų | 91 | 123.9 Ų | 123.9 | 48% | 0.476 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -59.2 | -43.9 | 174.8 | 178.6 | 63.4 | 0 | 0 | 0 | 111.6 | K150 Y151 K156 R157 T158 | K150-L154 PolarHBondContact O-N 3.47Å; Y151-L154 WeakPolarHBondContact O-CB 3.47Å; Y151-L154 PolarHBondContact O-N 3.4Å; L154-K156 VanDerWaalsContact C-N 3.31Å; L154-K156 PolarHBondContact O-N 3.45Å; L154-R157 PolarHBondContact O-N 3.28Å; L154-T158 HydrophobicContact CD1-CG2 3.87Å; L154-T158 PolarHBondContact O-N 2.91Å; L154-T158 PolarHBondContact O-OG1 2.92Å |
| 155 | L | 98.2 | Very high | 98.1 | Very high | 38 Ų | 38 | 119 Ų | 119 | 20% | 0.199 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -61.4 | -38.9 | 178.1 | -65 | -151.8 | 0 | 0 | 0 | 112.7 | Y151 K152 K153 K159 | Y151-L155 HydrophobicContact CD1-CD1 4.16Å; Y151-L155 HydrophobicContact CD1-CD2 4.48Å; Y151-L155 HydrophobicContact CD1-CG 4.1Å; Y151-L155 HydrophobicContact CD2-CD2 4.11Å; Y151-L155 HydrophobicContact CE1-CD1 3.49Å; Y151-L155 VanDerWaalsContact CE1-CD1 3.49Å; Y151-L155 HydrophobicContact CE1-CD2 4.02Å; Y151-L155 HydrophobicContact CE1-CG 3.79Å; Y151-L155 HydrophobicContact CE2-CD2 3.61Å; Y151-L155 HydrophobicContact CE2-CG 4.25Å; Y151-L155 HydrophobicContact CG-CG 4.46Å; Y151-L155 VanDerWaalsContact O-CG 3.25Å; Y151-L155 WeakPolarHBondContact O-CG 3.39Å; Y151-L155 PolarHBondContact O-N 3.24Å; K152-L155 PolarHBondContact O-N 3.11Å; K153-L155 VanDerWaalsContact C-N 3.33Å; K153-L155 PolarHBondContact O-N 3.21Å; L155-K159 WeakPolarHBondContact O-CA 3.49Å; L155-K159 PolarHBondContact O-N 3.39Å; L155-K159 VanDerWaalsContact O-N 3.11Å |
| 156 | K | 98.4 | Very high | 98 | Very high | 169 Ų | 169 | 115.5 Ų | 115.5 | 74% | 0.735 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.8 | -50.1 | 176.6 | -72.4 | -177.7 | 178.2 | -170.6 | 0 | 110.8 | K152 K153 L154 T158 K159 | K152-K156 WeakPolarHBondContact O-CG 3.36Å; K152-K156 PolarHBondContact O-N 2.86Å; K153-K156 PolarHBondContact O-N 2.84Å; L154-K156 VanDerWaalsContact C-N 3.31Å; L154-K156 PolarHBondContact O-N 3.45Å; K156-T158 VanDerWaalsContact C-N 3.32Å; K156-T158 PolarHBondContact O-N 2.77Å; K156-K159 WeakPolarHBondContact O-CB 3.43Å; K156-K159 PolarHBondContact O-N 3.45Å |
| 157 | R | 98.4 | Very high | 97.9 | Very high | 195 Ų | 195 | 115.3 Ų | 115.3 | 74% | 0.736 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.6 | -39.3 | 179.7 | -66.5 | 175.9 | -166.9 | 161.3 | -1.2 | 112.7 | K153 L154 | K153-R157 WeakPolarHBondContact O-CG 3.29Å; K153-R157 PolarHBondContact O-N 3.01Å; L154-R157 PolarHBondContact O-N 3.28Å |
| 158 | T | 98.3 | Very high | 97.8 | Very high | 38 Ų | 38 | 111.7 Ų | 111.7 | 23% | 0.233 | 50% | 0.495 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -99.3 | 12.8 | -175.3 | 60.8 | 0 | 0 | 0 | 0 | 114 | L154 K156 F160 L161 R162 | L154-T158 HydrophobicContact CD1-CG2 3.87Å; L154-T158 PolarHBondContact O-N 2.91Å; L154-T158 PolarHBondContact O-OG1 2.92Å; K156-T158 VanDerWaalsContact C-N 3.32Å; K156-T158 PolarHBondContact O-N 2.77Å; T158-F160 VanDerWaalsContact C-N 3.33Å; T158-F160 PolarHBondContact O-N 2.85Å; T158-L161 PolarHBondContact O-N 3.28Å; T158-R162 WeakPolarHBondContact O-CG 3.37Å; T158-R162 PolarHBondContact O-N 3.45Å; T158-R162 WeakPolarHBondContact OG1-CD 3.38Å |
| 159 | K | 98.1 | Very high | 97.7 | Very high | 135 Ų | 135 | 112.7 Ų | 112.7 | 59% | 0.587 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -49.6 | -49.4 | -172.9 | -179.7 | -176.7 | 177.2 | -175.7 | 0 | 113 | L155 K156 R163 | L155-K159 WeakPolarHBondContact O-CA 3.49Å; L155-K159 PolarHBondContact O-N 3.39Å; L155-K159 VanDerWaalsContact O-N 3.11Å; K156-K159 WeakPolarHBondContact O-CB 3.43Å; K156-K159 PolarHBondContact O-N 3.45Å; K159-R163 WeakPolarHBondContact O-CB 3.27Å; K159-R163 PolarHBondContact O-N 3.48Å |
| 160 | F | 97.8 | Very high | 97.5 | Very high | 152 Ų | 152 | 114 Ų | 114 | 67% | 0.667 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -73.2 | -39.5 | -175.8 | -64.3 | -75.8 | 0 | 0 | 0 | 112.8 | T158 R163 R164 | T158-F160 VanDerWaalsContact C-N 3.33Å; T158-F160 PolarHBondContact O-N 2.85Å; F160-R163 WeakPolarHBondContact O-CB 3.3Å; F160-R163 PolarHBondContact O-N 2.89Å; F160-R164 PolarHBondContact O-N 2.86Å |
| 161 | L | 98 | Very high | 97.4 | Very high | 105 Ų | 105 | 112.4 Ų | 112.4 | 55% | 0.55 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -48.2 | 173.3 | 178.1 | 61.2 | 0 | 0 | 0 | 110.7 | T158 R163 R164 V165 | T158-L161 PolarHBondContact O-N 3.28Å; L161-R163 VanDerWaalsContact C-N 3.31Å; L161-R163 PolarHBondContact O-N 3.41Å; L161-R164 PolarHBondContact O-N 3.24Å; L161-V165 HydrophobicContact CD1-CG2 4.21Å; L161-V165 WeakPolarHBondContact O-CG2 3.44Å; L161-V165 PolarHBondContact O-N 3.44Å |
| 162 | R | 97.4 | Very high | 97.3 | Very high | 106 Ų | 106 | 114.1 Ų | 114.1 | 40% | 0.4 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61 | -39.8 | 177.4 | -67 | -177.7 | 97.4 | -148.6 | 12.9 | 111.6 | Y151 T158 V165 L166 | Y151-R162 PolarHBondContact OH-NH2 3.29Å; T158-R162 WeakPolarHBondContact O-CG 3.37Å; T158-R162 PolarHBondContact O-N 3.45Å; T158-R162 WeakPolarHBondContact OG1-CD 3.38Å; R162-V165 PolarHBondContact O-N 2.94Å; R162-L166 VanDerWaalsContact O-CB 3.29Å; R162-L166 WeakPolarHBondContact O-CB 3.44Å; R162-L166 VanDerWaalsContact O-CG 3.24Å; R162-L166 WeakPolarHBondContact O-CG 3.41Å; R162-L166 PolarHBondContact O-N 2.79Å |
| 163 | R | 96 | Very high | 97.2 | Very high | 158 Ų | 158 | 115.1 Ų | 115.1 | 60% | 0.596 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.5 | -49.2 | 174.7 | -175 | 177.3 | 177.5 | 172.7 | 0.3 | 111.4 | K159 F160 L161 L166 E167 | K159-R163 WeakPolarHBondContact O-CB 3.27Å; K159-R163 PolarHBondContact O-N 3.48Å; F160-R163 WeakPolarHBondContact O-CB 3.3Å; F160-R163 PolarHBondContact O-N 2.89Å; L161-R163 VanDerWaalsContact C-N 3.31Å; L161-R163 PolarHBondContact O-N 3.41Å; R163-L166 PolarHBondContact O-N 2.86Å; R163-E167 WeakPolarHBondContact O-CB 3.43Å; R163-E167 PolarHBondContact O-N 3.21Å |
| 164 | R | 96.4 | Very high | 97.1 | Very high | 194 Ų | 194 | 110.4 Ų | 110.4 | 73% | 0.732 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -59.9 | -46.9 | 177.8 | -173.2 | -174.2 | -66.6 | 175.9 | -1.4 | 111.8 | F160 L161 E167 G168 | F160-R164 PolarHBondContact O-N 2.86Å; L161-R164 PolarHBondContact O-N 3.24Å; R164-E167 PolarHBondContact O-N 2.89Å; R164-G168 PolarHBondContact O-N 3.23Å |
| 165 | V | 97.3 | Very high | 97 | Very high | 65 Ų | 65 | 112.6 Ų | 112.6 | 39% | 0.394 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64 | -44.8 | 179 | 172.4 | 0 | 0 | 0 | 0 | 111.4 | L161 R162 E167 G168 R169 | L161-V165 HydrophobicContact CD1-CG2 4.21Å; L161-V165 WeakPolarHBondContact O-CG2 3.44Å; L161-V165 PolarHBondContact O-N 3.44Å; R162-V165 PolarHBondContact O-N 2.94Å; V165-E167 VanDerWaalsContact C-N 3.34Å; V165-E167 PolarHBondContact O-N 2.72Å; V165-G168 PolarHBondContact O-N 3.04Å; V165-R169 HydrophobicContact CG1-CG 4.47Å; V165-R169 WeakPolarHBondContact O-CG 3.45Å; V165-R169 PolarHBondContact O-N 3.38Å |
| 166 | L | 96.1 | Very high | 97 | Very high | 85 Ų | 85 | 119.5 Ų | 119.5 | 45% | 0.445 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.8 | -40.4 | 177.5 | -76.9 | 171 | 0 | 0 | 0 | 111.9 | R162 R163 R169 R170 | R162-L166 VanDerWaalsContact O-CB 3.29Å; R162-L166 WeakPolarHBondContact O-CB 3.44Å; R162-L166 VanDerWaalsContact O-CG 3.24Å; R162-L166 WeakPolarHBondContact O-CG 3.41Å; R162-L166 PolarHBondContact O-N 2.79Å; R163-L166 PolarHBondContact O-N 2.86Å; L166-R169 PolarHBondContact O-N 2.86Å; L166-R170 WeakPolarHBondContact O-CG 3.38Å; L166-R170 PolarHBondContact O-N 3.43Å |
| 167 | E | 95.3 | Very high | 96.9 | Very high | 92 Ų | 92 | 114.1 Ų | 114.1 | 43% | 0.43 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.6 | -46 | 174.9 | -168.3 | -170.3 | 148.3 | 0 | 0 | 111.5 | R163 R164 V165 R169 R170 K171 | R163-E167 WeakPolarHBondContact O-CB 3.43Å; R163-E167 PolarHBondContact O-N 3.21Å; R164-E167 PolarHBondContact O-N 2.89Å; V165-E167 VanDerWaalsContact C-N 3.34Å; V165-E167 PolarHBondContact O-N 2.72Å; E167-R169 VanDerWaalsContact C-N 3.34Å; E167-R169 PolarHBondContact O-N 2.95Å; E167-R170 PolarHBondContact O-N 3.21Å; E167-K171 WeakPolarHBondContact O-CG 3.33Å; E167-K171 PolarHBondContact O-N 3.14Å; E167-K171 WeakPolarHBondContact OE1-CE 3.42Å; E167-K171 IonicContact OE1-NZ 2.72Å; E167-K171 PolarHBondContact OE1-NZ 3.35Å |
| 168 | G | 96.5 | Very high | 96.8 | Very high | 32 Ų | 32 | 107.8 Ų | 107.8 | 33% | 0.33 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -59.2 | -42.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | R164 V165 K171 K172 | R164-G168 PolarHBondContact O-N 3.23Å; V165-G168 PolarHBondContact O-N 3.04Å; G168-K171 PolarHBondContact O-N 3.31Å; G168-K172 WeakPolarHBondContact O-CG 3.43Å; G168-K172 PolarHBondContact O-N 3.35Å |
| 169 | R | 96.8 | Very high | 96.7 | Very high | 175 Ų | 175 | 112.4 Ų | 112.4 | 66% | 0.66 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -63 | -42 | 174.9 | -73 | 178.9 | -178.3 | -166.9 | -0.1 | 112 | V165 L166 E167 K172 K173 | V165-R169 HydrophobicContact CG1-CG 4.47Å; V165-R169 WeakPolarHBondContact O-CG 3.45Å; V165-R169 PolarHBondContact O-N 3.38Å; L166-R169 PolarHBondContact O-N 2.86Å; E167-R169 VanDerWaalsContact C-N 3.34Å; E167-R169 PolarHBondContact O-N 2.95Å; R169-K172 PolarHBondContact O-N 2.76Å; R169-K173 WeakPolarHBondContact O-CB 3.48Å; R169-K173 PolarHBondContact O-N 3.21Å |
| 170 | R | 95.8 | Very high | 96.6 | Very high | 119 Ų | 119 | 109.6 Ų | 109.6 | 45% | 0.449 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.5 | -44.4 | 175.8 | -75.9 | 175.6 | -172.8 | -179.7 | 0.3 | 112.3 | L166 E167 K172 K173 Q174 F203 | L166-R170 WeakPolarHBondContact O-CG 3.38Å; L166-R170 PolarHBondContact O-N 3.43Å; E167-R170 PolarHBondContact O-N 3.21Å; R170-K172 PolarHBondContact O-N 2.88Å; R170-K173 WeakPolarHBondContact O-CB 3.45Å; R170-K173 PolarHBondContact O-N 3.26Å; R170-Q174 PolarHBondContact O-N 3.22Å; R170-F203 WeakPolarHBondContact CB-O 3.35Å; R170-F203 WeakPolarHBondContact CD-O 3.26Å |
| 171 | K | 95.3 | Very high | 96.5 | Very high | 102 Ų | 102 | 104.2 Ų | 104.2 | 44% | 0.443 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -60 | -44.7 | 174.9 | -71.2 | 177.5 | -176.3 | 170.9 | 0 | 111.5 | E167 G168 K173 Q174 K175 | E167-K171 WeakPolarHBondContact O-CG 3.33Å; E167-K171 PolarHBondContact O-N 3.14Å; E167-K171 WeakPolarHBondContact OE1-CE 3.42Å; E167-K171 IonicContact OE1-NZ 2.72Å; E167-K171 PolarHBondContact OE1-NZ 3.35Å; G168-K171 PolarHBondContact O-N 3.31Å; K171-K173 VanDerWaalsContact C-N 3.33Å; K171-K173 PolarHBondContact O-N 3.22Å; K171-Q174 PolarHBondContact O-N 3.06Å; K171-K175 WeakPolarHBondContact O-CG 3.4Å; K171-K175 PolarHBondContact O-N 3.35Å |
| 172 | K | 96.9 | Very high | 96.3 | Very high | 147 Ų | 147 | 103.8 Ų | 103.8 | 64% | 0.639 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -62.3 | -39.7 | 174.8 | -72.1 | -178.6 | -178.3 | -173.8 | 0 | 112 | G168 R169 R170 K175 R176 | G168-K172 WeakPolarHBondContact O-CG 3.43Å; G168-K172 PolarHBondContact O-N 3.35Å; R169-K172 PolarHBondContact O-N 2.76Å; R170-K172 PolarHBondContact O-N 2.88Å; K172-K175 PolarHBondContact O-N 3.46Å; K172-R176 WeakPolarHBondContact O-CG 3.42Å; K172-R176 PolarHBondContact O-N 3.2Å |
| 173 | K | 96.9 | Very high | 96.2 | Very high | 118 Ų | 118 | 106.5 Ų | 106.5 | 51% | 0.513 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -63.9 | -43.9 | 176.9 | -166.8 | 175.8 | -177.4 | -176.2 | 0 | 111.8 | R169 R170 K171 R176 F177 F203 | R169-K173 WeakPolarHBondContact O-CB 3.48Å; R169-K173 PolarHBondContact O-N 3.21Å; R170-K173 WeakPolarHBondContact O-CB 3.45Å; R170-K173 PolarHBondContact O-N 3.26Å; K171-K173 VanDerWaalsContact C-N 3.33Å; K171-K173 PolarHBondContact O-N 3.22Å; K173-R176 PolarHBondContact O-N 3.43Å; K173-F177 PolarHBondContact O-N 3.26Å; K173-F203 HydrophobicContact CB-CD2 4.48Å; K173-F203 HydrophobicContact CB-CG 4.41Å; K173-F203 HydrophobicContact CD-CD1 3.68Å; K173-F203 HydrophobicContact CD-CD2 4.26Å; K173-F203 HydrophobicContact CD-CE1 3.83Å; K173-F203 HydrophobicContact CD-CE2 4.37Å; K173-F203 HydrophobicContact CD-CG 3.91Å; K173-F203 HydrophobicContact CD-CZ 4.17Å; K173-F203 HydrophobicContact CG-CD1 4.26Å; K173-F203 HydrophobicContact CG-CD2 3.92Å; K173-F203 HydrophobicContact CG-CE1 4.46Å; K173-F203 HydrophobicContact CG-CE2 4.12Å; K173-F203 HydrophobicContact CG-CG 3.99Å; K173-F203 HydrophobicContact CG-CZ 4.38Å |
| 174 | Q | 96.6 | Very high | 96.2 | Very high | 3 Ų | 3 | 104.5 Ų | 104.5 | 1% | 0.014 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -61.6 | -45.9 | 175.2 | -175.8 | 64.8 | 31.7 | 0 | 0 | 111.9 | R170 K171 R176 F177 E178 P200 F203 I204 | R170-Q174 PolarHBondContact O-N 3.22Å; K171-Q174 PolarHBondContact O-N 3.06Å; Q174-R176 VanDerWaalsContact C-N 3.29Å; Q174-R176 PolarHBondContact O-N 3.11Å; Q174-F177 WeakPolarHBondContact O-CB 3.44Å; Q174-F177 PolarHBondContact O-N 3.47Å; Q174-E178 VanDerWaalsContact CG-OE1 3.29Å; Q174-E178 WeakPolarHBondContact CG-OE1 3.27Å; Q174-E178 PolarHBondContact NE2-OE1 2.89Å; Q174-E178 PolarHBondContact O-N 3.37Å; Q174-P200 PolarHBondContact NE2-O 3.09Å; Q174-F203 HydrophobicContact CB-CB 4.39Å; Q174-F203 VanDerWaalsContact OE1-N 3.14Å; Q174-I204 HydrophobicContact CB-CD1 4.05Å; Q174-I204 HydrophobicContact CB-CG1 4.03Å; Q174-I204 HydrophobicContact CG-CD1 3.85Å; Q174-I204 HydrophobicContact CG-CG1 4.15Å |
| 175 | K | 96.5 | Very high | 96.1 | Very high | 137 Ų | 137 | 97.2 Ų | 97.2 | 60% | 0.596 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -61.3 | -36.7 | 176.8 | -73.4 | -174 | 177.3 | -168 | 0 | 112.8 | K171 K172 K179 | K171-K175 WeakPolarHBondContact O-CG 3.4Å; K171-K175 PolarHBondContact O-N 3.35Å; K172-K175 PolarHBondContact O-N 3.46Å; K175-K179 WeakPolarHBondContact O-CB 3.49Å; K175-K179 VanDerWaalsContact O-CG 3.26Å; K175-K179 WeakPolarHBondContact O-CG 3.28Å; K175-K179 PolarHBondContact O-N 3.3Å |
| 176 | R | 97.4 | Very high | 96 | Very high | 182 Ų | 182 | 98.9 Ų | 98.9 | 69% | 0.687 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -64.8 | -46.7 | 175.4 | -75.1 | 178.7 | -178.5 | -173.6 | -2.1 | 110.9 | K172 K173 Q174 E178 K179 D180 | K172-R176 WeakPolarHBondContact O-CG 3.42Å; K172-R176 PolarHBondContact O-N 3.2Å; K173-R176 PolarHBondContact O-N 3.43Å; Q174-R176 VanDerWaalsContact C-N 3.29Å; Q174-R176 PolarHBondContact O-N 3.11Å; R176-E178 PolarHBondContact O-N 3.37Å; R176-K179 PolarHBondContact O-N 3.37Å; R176-D180 VanDerWaalsContact O-CG 3.3Å; R176-D180 PolarHBondContact O-N 3Å |
| 177 | F | 96.8 | Very high | 96 | Very high | 57 Ų | 57 | 105.8 Ų | 105.8 | 25% | 0.25 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -56.7 | -48.7 | 175.3 | 172.1 | -105.5 | 0 | 0 | 0 | 112.6 | K173 Q174 K179 D180 L181 T199 I202 F203 | K173-F177 PolarHBondContact O-N 3.26Å; Q174-F177 WeakPolarHBondContact O-CB 3.44Å; Q174-F177 PolarHBondContact O-N 3.47Å; F177-K179 PolarHBondContact O-N 3.19Å; F177-D180 PolarHBondContact O-N 3.31Å; F177-L181 HydrophobicContact CD1-CD1 4.25Å; F177-L181 HydrophobicContact CE1-CD1 3.65Å; F177-L181 HydrophobicContact CE2-CD1 4.11Å; F177-L181 HydrophobicContact CE2-CG 4.31Å; F177-L181 HydrophobicContact CZ-CD1 3.58Å; F177-L181 HydrophobicContact CZ-CG 4.27Å; F177-L181 WeakPolarHBondContact O-CG 3.42Å; F177-L181 PolarHBondContact O-N 2.91Å; F177-T199 HydrophobicContact CD1-CG2 4.24Å; F177-T199 HydrophobicContact CE1-CG2 3.78Å; F177-I202 HydrophobicContact CE1-CD1 4.11Å; F177-I202 HydrophobicContact CZ-CD1 3.87Å; F177-F203 HydrophobicContact CB-CD2 4.45Å; F177-F203 HydrophobicContact CB-CE2 4.08Å; F177-F203 HydrophobicContact CG-CE2 4.27Å |
| 178 | E | 95.9 | Very high | 96 | Very high | 62 Ų | 62 | 105.1 Ų | 105.1 | 29% | 0.29 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -61.2 | -41.7 | 177.3 | -75.1 | 164 | -167.2 | 0 | 0 | 112.4 | Q174 R176 L181 Q182 T199 | Q174-E178 VanDerWaalsContact CG-OE1 3.29Å; Q174-E178 WeakPolarHBondContact CG-OE1 3.27Å; Q174-E178 PolarHBondContact NE2-OE1 2.89Å; Q174-E178 PolarHBondContact O-N 3.37Å; R176-E178 PolarHBondContact O-N 3.37Å; E178-L181 PolarHBondContact O-N 3.06Å; E178-Q182 WeakPolarHBondContact O-CB 3.38Å; E178-Q182 PolarHBondContact O-N 3.07Å; E178-T199 HydrophobicContact CG-CG2 3.75Å |
| 179 | K | 96.4 | Very high | 95.9 | Very high | 135 Ų | 135 | 106.6 Ų | 106.6 | 59% | 0.587 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -66.6 | -35.5 | 176.6 | -77.1 | -178.1 | 177.4 | -163 | 0 | 113 | K175 R176 F177 Q182 R183 | K175-K179 WeakPolarHBondContact O-CB 3.49Å; K175-K179 VanDerWaalsContact O-CG 3.26Å; K175-K179 WeakPolarHBondContact O-CG 3.28Å; K175-K179 PolarHBondContact O-N 3.3Å; R176-K179 PolarHBondContact O-N 3.37Å; F177-K179 PolarHBondContact O-N 3.19Å; K179-Q182 PolarHBondContact O-N 3.43Å; K179-R183 WeakPolarHBondContact O-CB 3.39Å; K179-R183 PolarHBondContact O-N 3.45Å |
| 180 | D | 96.8 | Very high | 95.8 | Very high | 75 Ų | 75 | 102.4 Ų | 102.4 | 40% | 0.401 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -71 | -40.9 | 178.8 | -71.4 | -18.3 | 0 | 0 | 0 | 110.6 | R176 F177 Q182 R183 I184 | R176-D180 VanDerWaalsContact O-CG 3.3Å; R176-D180 PolarHBondContact O-N 3Å; F177-D180 PolarHBondContact O-N 3.31Å; D180-Q182 VanDerWaalsContact C-N 3.29Å; D180-Q182 PolarHBondContact O-N 3.3Å; D180-R183 WeakPolarHBondContact O-CB 3.5Å; D180-R183 PolarHBondContact O-N 3.5Å; D180-R183 IonicContact OD1-CZ 3.68Å; D180-R183 IonicContact OD1-NH2 3.16Å; D180-R183 PolarHBondContact OD1-NH2 3.01Å; D180-R183 VanDerWaalsContact OD1-NH2 3.16Å; D180-I184 WeakPolarHBondContact O-CG1 3.41Å; D180-I184 PolarHBondContact O-N 2.94Å; D180-I184 VanDerWaalsContact O-N 3.07Å |
| 181 | L | 94.9 | Very high | 95.5 | Very high | 39 Ų | 39 | 106 Ų | 106 | 20% | 0.204 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -59.6 | -42.8 | 169.3 | -68.2 | 178.9 | 0 | 0 | 0 | 111.6 | F177 E178 R183 I184 W185 T199 | F177-L181 HydrophobicContact CD1-CD1 4.25Å; F177-L181 HydrophobicContact CE1-CD1 3.65Å; F177-L181 HydrophobicContact CE2-CD1 4.11Å; F177-L181 HydrophobicContact CE2-CG 4.31Å; F177-L181 HydrophobicContact CZ-CD1 3.58Å; F177-L181 HydrophobicContact CZ-CG 4.27Å; F177-L181 WeakPolarHBondContact O-CG 3.42Å; F177-L181 PolarHBondContact O-N 2.91Å; E178-L181 PolarHBondContact O-N 3.06Å; L181-R183 VanDerWaalsContact C-N 3.3Å; L181-R183 PolarHBondContact O-N 2.77Å; L181-I184 PolarHBondContact O-N 3.29Å; L181-I184 VanDerWaalsContact O-N 3.16Å; L181-W185 HydrophobicContact CB-CZ3 4.13Å; L181-W185 VanDerWaalsContact O-CE3 3.23Å; L181-W185 PolarHBondContact O-N 2.71Å; L181-T199 HydrophobicContact CD1-CG2 3.64Å |
| 182 | Q | 94.6 | Very high | 95.3 | Very high | 96 Ų | 96 | 109.4 Ų | 109.4 | 45% | 0.449 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60 | -42.6 | 175.8 | 178.6 | 169.8 | 18.9 | 0 | 0 | 112.4 | E178 K179 D180 I184 W185 M186 | E178-Q182 WeakPolarHBondContact O-CB 3.38Å; E178-Q182 PolarHBondContact O-N 3.07Å; K179-Q182 PolarHBondContact O-N 3.43Å; D180-Q182 VanDerWaalsContact C-N 3.29Å; D180-Q182 PolarHBondContact O-N 3.3Å; Q182-I184 VanDerWaalsContact C-N 3.28Å; Q182-I184 PolarHBondContact O-N 2.84Å; Q182-W185 VanDerWaalsContact CA-CZ2 3.41Å; Q182-W185 HydrophobicContact CB-CD2 4.42Å; Q182-W185 HydrophobicContact CB-CH2 3.73Å; Q182-W185 HydrophobicContact CB-CZ2 3.37Å; Q182-W185 HydrophobicContact CB-CZ3 4.39Å; Q182-W185 HydrophobicContact CG-CH2 4.27Å; Q182-W185 HydrophobicContact CG-CZ2 3.41Å; Q182-W185 VanDerWaalsContact CG-CZ2 3.41Å; Q182-W185 PolarHBondContact O-N 3.09Å; Q182-W185 PolarHBondContact O-NE1 3.24Å; Q182-M186 HydrophobicContact CG-CG 4.19Å; Q182-M186 WeakPolarHBondContact O-CB 3.47Å; Q182-M186 WeakPolarHBondContact O-CG 3.42Å; Q182-M186 PolarHBondContact O-N 3.13Å |
| 183 | R | 96 | Very high | 95.1 | Very high | 163 Ų | 163 | 104.4 Ų | 104.4 | 62% | 0.615 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.9 | -39 | 177 | -168.7 | -175.3 | -55.5 | 163.9 | 15.7 | 111.8 | K179 D180 L181 R187 | K179-R183 WeakPolarHBondContact O-CB 3.39Å; K179-R183 PolarHBondContact O-N 3.45Å; D180-R183 WeakPolarHBondContact O-CB 3.5Å; D180-R183 PolarHBondContact O-N 3.5Å; D180-R183 IonicContact OD1-CZ 3.68Å; D180-R183 IonicContact OD1-NH2 3.16Å; D180-R183 PolarHBondContact OD1-NH2 3.01Å; D180-R183 VanDerWaalsContact OD1-NH2 3.16Å; L181-R183 VanDerWaalsContact C-N 3.3Å; L181-R183 PolarHBondContact O-N 2.77Å; R183-R187 WeakPolarHBondContact O-CB 3.33Å; R183-R187 PolarHBondContact O-N 3.39Å |
| 184 | I | 96.1 | Very high | 95 | Very high | 117 Ų | 117 | 101.8 Ų | 101.8 | 60% | 0.6 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.7 | -50.6 | -179.9 | -67.6 | 164.9 | 0 | 0 | 0 | 110.8 | D180 L181 Q182 M186 R187 A188 | D180-I184 WeakPolarHBondContact O-CG1 3.41Å; D180-I184 PolarHBondContact O-N 2.94Å; D180-I184 VanDerWaalsContact O-N 3.07Å; L181-I184 PolarHBondContact O-N 3.29Å; L181-I184 VanDerWaalsContact O-N 3.16Å; Q182-I184 VanDerWaalsContact C-N 3.28Å; Q182-I184 PolarHBondContact O-N 2.84Å; I184-M186 PolarHBondContact O-N 3.25Å; I184-R187 PolarHBondContact O-N 2.85Å; I184-A188 PolarHBondContact O-N 3.11Å |
| 185 | W | 93.9 | Very high | 94.8 | Very high | 41 Ų | 41 | 111.3 Ų | 111.3 | 16% | 0.155 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -68 | -36.7 | -178.8 | 69.3 | 61.9 | 0 | 0 | 0 | 112.2 | L181 Q182 R187 A188 G189 L190 A193 | L181-W185 HydrophobicContact CB-CZ3 4.13Å; L181-W185 VanDerWaalsContact O-CE3 3.23Å; L181-W185 PolarHBondContact O-N 2.71Å; Q182-W185 VanDerWaalsContact CA-CZ2 3.41Å; Q182-W185 HydrophobicContact CB-CD2 4.42Å; Q182-W185 HydrophobicContact CB-CH2 3.73Å; Q182-W185 HydrophobicContact CB-CZ2 3.37Å; Q182-W185 HydrophobicContact CB-CZ3 4.39Å; Q182-W185 HydrophobicContact CG-CH2 4.27Å; Q182-W185 HydrophobicContact CG-CZ2 3.41Å; Q182-W185 VanDerWaalsContact CG-CZ2 3.41Å; Q182-W185 PolarHBondContact O-N 3.09Å; Q182-W185 PolarHBondContact O-NE1 3.24Å; W185-R187 VanDerWaalsContact C-N 3.31Å; W185-R187 PolarHBondContact O-N 3.04Å; W185-A188 CarbonylContact O-C 3.55Å; W185-A188 PolarHBondContact O-N 2.8Å; W185-A188 VanDerWaalsContact O-N 3.16Å; W185-G189 PolarHBondContact O-N 3.13Å; W185-L190 HydrophobicContact CB-CB 4.24Å; W185-L190 HydrophobicContact CB-CD1 4.35Å; W185-L190 WeakPolarHBondContact O-CB 3.35Å; W185-L190 PolarHBondContact O-N 3.42Å; W185-A193 HydrophobicContact CE3-CB 4.34Å; W185-A193 HydrophobicContact CH2-CB 4.24Å; W185-A193 HydrophobicContact CZ3-CB 4.13Å |
| 186 | M | 94.4 | Very high | 94.6 | Very high | 100 Ų | 100 | 108.5 Ų | 108.5 | 49% | 0.493 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.9 | -38.4 | 177.3 | -68.8 | -62 | -61.3 | 0 | 0 | 110.8 | Q182 I184 A188 G189 L190 | Q182-M186 HydrophobicContact CG-CG 4.19Å; Q182-M186 WeakPolarHBondContact O-CB 3.47Å; Q182-M186 WeakPolarHBondContact O-CG 3.42Å; Q182-M186 PolarHBondContact O-N 3.13Å; I184-M186 PolarHBondContact O-N 3.25Å; M186-A188 VanDerWaalsContact C-N 3.28Å; M186-A188 PolarHBondContact O-N 3.35Å; M186-G189 PolarHBondContact O-N 3.4Å; M186-G189 VanDerWaalsContact O-N 3.1Å; M186-L190 VanDerWaalsContact SD-O 3.35Å |
| 187 | R | 96.4 | Very high | 94.3 | Very high | 229 Ų | 229 | 106.2 Ų | 106.2 | 86% | 0.864 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.7 | -30.8 | 174.9 | -173.8 | 177 | -179.9 | -174.8 | 0.1 | 112.1 | R183 I184 W185 G189 | R183-R187 WeakPolarHBondContact O-CB 3.33Å; R183-R187 PolarHBondContact O-N 3.39Å; I184-R187 PolarHBondContact O-N 2.85Å; W185-R187 VanDerWaalsContact C-N 3.31Å; W185-R187 PolarHBondContact O-N 3.04Å; R187-G189 PolarHBondContact O-N 3.3Å |
| 188 | A | 95.9 | Very high | 94 | Very high | 78 Ų | 78 | 110.4 Ų | 110.4 | 65% | 0.645 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | 0.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | I184 W185 M186 | I184-A188 PolarHBondContact O-N 3.11Å; W185-A188 CarbonylContact O-C 3.55Å; W185-A188 PolarHBondContact O-N 2.8Å; W185-A188 VanDerWaalsContact O-N 3.16Å; M186-A188 VanDerWaalsContact C-N 3.28Å; M186-A188 PolarHBondContact O-N 3.35Å |
| 189 | G | 94.4 | Very high | 93.8 | Very high | 63 Ų | 63 | 109.6 Ų | 109.6 | 65% | 0.649 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 87 | 1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | W185 M186 R187 | W185-G189 PolarHBondContact O-N 3.13Å; M186-G189 PolarHBondContact O-N 3.4Å; M186-G189 VanDerWaalsContact O-N 3.1Å; R187-G189 PolarHBondContact O-N 3.3Å |
| 190 | L | 94.3 | Very high | 93.5 | Very high | 87 Ų | 87 | 106 Ų | 106 | 46% | 0.455 | 55% | 0.551 | S | S | . | * | trans | -79.4 | 127 | 176.2 | -62.5 | 173.7 | 0 | 0 | 0 | 110.4 | W185 M186 P194 | W185-L190 HydrophobicContact CB-CB 4.24Å; W185-L190 HydrophobicContact CB-CD1 4.35Å; W185-L190 WeakPolarHBondContact O-CB 3.35Å; W185-L190 PolarHBondContact O-N 3.42Å; M186-L190 VanDerWaalsContact SD-O 3.35Å; L190-P194 HydrophobicContact CD1-CG 4.31Å | ||
| 191 | K | 89.8 | Confident | 93.4 | Very high | 195 Ų | 195 | 108 Ų | 108 | 85% | 0.848 | 56% | 0.557 | S | S | * | * | S | Bend | trans | -76.4 | -24.9 | 176.3 | -66.8 | -178 | 179.8 | 176.6 | 0 | 113.2 | ||
| 192 | K | 91.1 | Very high | 93.3 | Very high | 174 Ų | 174 | 111.3 Ų | 111.3 | 76% | 0.757 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -126.9 | 164.7 | -177.9 | -65 | -177.7 | -178.5 | 176.9 | 0 | 109.7 | ||
| 193 | A | 92.8 | Very high | 93.2 | Very high | 41 Ų | 41 | 110 Ų | 110 | 34% | 0.339 | 57% | 0.566 | S | S | . | * | P | Polyproline II helix | trans | -58.3 | 149.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 110 | W185 | W185-A193 HydrophobicContact CE3-CB 4.34Å; W185-A193 HydrophobicContact CH2-CB 4.24Å; W185-A193 HydrophobicContact CZ3-CB 4.13Å |
| 194 | P | 94.1 | Very high | 92.9 | Very high | 64 Ų | 64 | 104.9 Ų | 104.9 | 42% | 0.416 | 55% | 0.551 | S | S | . | * | P | Polyproline II helix | trans | -52.4 | 145.7 | 172.6 | -25 | 34 | 0 | 0 | 0 | 111.6 | L190 G196 W197 | L190-P194 HydrophobicContact CD1-CG 4.31Å; P194-G196 PolarHBondContact O-N 3.43Å; P194-W197 HydrophobicContact CB-CB 4.25Å; P194-W197 WeakPolarHBondContact O-CB 3.41Å; P194-W197 PolarHBondContact O-N 2.94Å; P194-W197 VanDerWaalsContact O-N 3.07Å |
| 195 | E | 92.6 | Very high | 92.1 | Very high | 203 Ų | 203 | 105.1 Ų | 105.1 | 95% | 0.949 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.9 | 134.7 | -180 | -167 | 165.1 | -169.5 | 0 | 0 | 110.7 | W197 | E195-W197 VanDerWaalsContact C-N 3.26Å; E195-W197 PolarHBondContact O-N 3.31Å |
| 196 | G | 91.1 | Very high | 91.3 | Very high | 78 Ų | 78 | 108.9 Ų | 108.9 | 80% | 0.804 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 76.4 | -3.1 | -175.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | P194 N198 | P194-G196 PolarHBondContact O-N 3.43Å; G196-N198 PolarHBondContact O-N 3.39Å |
| 197 | W | 91.6 | Very high | 90.1 | Very high | 133 Ų | 133 | 111.9 Ų | 111.9 | 50% | 0.504 | 57% | 0.574 | S | S | . | * | trans | -85.1 | 112.1 | 179.8 | -173.8 | -102.8 | 0 | 0 | 0 | 113 | P194 E195 | P194-W197 HydrophobicContact CB-CB 4.25Å; P194-W197 WeakPolarHBondContact O-CB 3.41Å; P194-W197 PolarHBondContact O-N 2.94Å; P194-W197 VanDerWaalsContact O-N 3.07Å; E195-W197 VanDerWaalsContact C-N 3.26Å; E195-W197 PolarHBondContact O-N 3.31Å | ||
| 198 | N | 90.6 | Very high | 88.4 | Confident | 146 Ų | 146 | 109.5 Ų | 109.5 | 78% | 0.781 | 57% | 0.57 | S | S | * | * | trans | -106.8 | 115.1 | 171.4 | -79.2 | -45.5 | 0 | 0 | 0 | 110.8 | G196 P200 | G196-N198 PolarHBondContact O-N 3.39Å; N198-P200 VanDerWaalsContact O-CD 3.24Å; N198-P200 WeakPolarHBondContact O-CD 3Å | ||
| 199 | T | 91.2 | Very high | 86.3 | Confident | 44 Ų | 44 | 110 Ų | 110 | 27% | 0.27 | 57% | 0.569 | S | S | . | * | trans | -65.1 | 116.6 | -178.1 | -54.4 | 0 | 0 | 0 | 0 | 111.6 | F177 E178 L181 | F177-T199 HydrophobicContact CD1-CG2 4.24Å; F177-T199 HydrophobicContact CE1-CG2 3.78Å; E178-T199 HydrophobicContact CG-CG2 3.75Å; L181-T199 HydrophobicContact CD1-CG2 3.64Å | ||
| 200 | P | 91.7 | Very high | 84.5 | Confident | 59 Ų | 59 | 116.8 Ų | 116.8 | 38% | 0.383 | 58% | 0.58 | S | S | . | * | trans | -72.8 | 146 | -177.4 | 28.8 | -34.6 | 0 | 0 | 0 | 111.9 | Q174 N198 I202 | Q174-P200 PolarHBondContact NE2-O 3.09Å; N198-P200 VanDerWaalsContact O-CD 3.24Å; N198-P200 WeakPolarHBondContact O-CD 3Å; P200-I202 HydrophobicContact CB-CG1 4.16Å; P200-I202 HydrophobicContact CG-CD1 4.11Å; P200-I202 HydrophobicContact CG-CG1 4Å; P200-I202 PolarHBondContact O-N 3.43Å | ||
| 201 | K | 93.1 | Very high | 82.4 | Confident | 119 Ų | 119 | 123.9 Ų | 123.9 | 52% | 0.517 | 60% | 0.601 | S | S | . | * | trans | -87.1 | 77 | 175.1 | -69.3 | 179.3 | -178.2 | 170.8 | 0 | 111.1 | I204 | K201-I204 HydrophobicContact CB-CB 4.41Å; K201-I204 HydrophobicContact CD-CD1 4.4Å | ||
| 202 | I | 93.3 | Very high | 80.2 | Confident | 108 Ų | 108 | 121.6 Ų | 121.6 | 55% | 0.554 | 63% | 0.633 | S | S | * | * | trans | -74.9 | -38.9 | -173.8 | -51 | 170.9 | 0 | 0 | 0 | 111.8 | F177 P200 | F177-I202 HydrophobicContact CE1-CD1 4.11Å; F177-I202 HydrophobicContact CZ-CD1 3.87Å; P200-I202 HydrophobicContact CB-CG1 4.16Å; P200-I202 HydrophobicContact CG-CD1 4.11Å; P200-I202 HydrophobicContact CG-CG1 4Å; P200-I202 PolarHBondContact O-N 3.43Å | ||
| 203 | F | 92.2 | Very high | 79.7 | Confident | 67 Ų | 67 | 119 Ų | 119 | 29% | 0.294 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -89.9 | -10.8 | -174.6 | -61.8 | -64.1 | 0 | 0 | 0 | 114.2 | R170 K173 Q174 F177 | R170-F203 WeakPolarHBondContact CB-O 3.35Å; R170-F203 WeakPolarHBondContact CD-O 3.26Å; K173-F203 HydrophobicContact CB-CD2 4.48Å; K173-F203 HydrophobicContact CB-CG 4.41Å; K173-F203 HydrophobicContact CD-CD1 3.68Å; K173-F203 HydrophobicContact CD-CD2 4.26Å; K173-F203 HydrophobicContact CD-CE1 3.83Å; K173-F203 HydrophobicContact CD-CE2 4.37Å; K173-F203 HydrophobicContact CD-CG 3.91Å; K173-F203 HydrophobicContact CD-CZ 4.17Å; K173-F203 HydrophobicContact CG-CD1 4.26Å; K173-F203 HydrophobicContact CG-CD2 3.92Å; K173-F203 HydrophobicContact CG-CE1 4.46Å; K173-F203 HydrophobicContact CG-CE2 4.12Å; K173-F203 HydrophobicContact CG-CG 3.99Å; K173-F203 HydrophobicContact CG-CZ 4.38Å; Q174-F203 HydrophobicContact CB-CB 4.39Å; Q174-F203 VanDerWaalsContact OE1-N 3.14Å; F177-F203 HydrophobicContact CB-CD2 4.45Å; F177-F203 HydrophobicContact CB-CE2 4.08Å; F177-F203 HydrophobicContact CG-CE2 4.27Å |
| 204 | I | 90.1 | Very high | 79 | Confident | 57 Ų | 57 | 123.1 Ų | 123.1 | 29% | 0.292 | 64% | 0.642 | S | S | . | * | S | Bend | trans | -96 | 115.7 | 177.3 | -59 | 176.3 | 0 | 0 | 0 | 107.4 | Q174 K201 Q206 | Q174-I204 HydrophobicContact CB-CD1 4.05Å; Q174-I204 HydrophobicContact CB-CG1 4.03Å; Q174-I204 HydrophobicContact CG-CD1 3.85Å; Q174-I204 HydrophobicContact CG-CG1 4.15Å; K201-I204 HydrophobicContact CB-CB 4.41Å; K201-I204 HydrophobicContact CD-CD1 4.4Å; I204-Q206 PolarHBondContact O-N 3.21Å |
| 205 | K | 80.2 | Confident | 78.1 | Confident | 121 Ų | 121 | 126.3 Ų | 126.3 | 53% | 0.526 | 65% | 0.654 | S | S | . | * | trans | -67.2 | 105.7 | 177.3 | -173.2 | 173.3 | 179.3 | -174.5 | 0 | 109 | Y207 | K205-Y207 HydrophobicContact CD-CE1 4.03Å; K205-Y207 HydrophobicContact CD-CE2 3.92Å; K205-Y207 VanDerWaalsContact CE-CE1 3.4Å; K205-Y207 HydrophobicContact CG-CD2 4.4Å; K205-Y207 HydrophobicContact CG-CE2 4.14Å; K205-Y207 PolarHBondContact NZ-OH 3.37Å; K205-Y207 PolarHBondContact O-N 2.75Å | ||
| 206 | Q | 77.2 | Confident | 77.3 | Confident | 121 Ų | 121 | 121.8 Ų | 121.8 | 57% | 0.565 | 64% | 0.637 | S | S | * | * | trans | -78.6 | 106.9 | 168.4 | -59.8 | -164.2 | -3.1 | 0 | 0 | 107.4 | I204 K208 | I204-Q206 PolarHBondContact O-N 3.21Å; Q206-K208 VanDerWaalsContact C-N 3.27Å; Q206-K208 PolarHBondContact O-N 3.11Å | ||
| 207 | Y | 68.4 | Low | 76.4 | Confident | 162 Ų | 162 | 124.6 Ų | 124.6 | 64% | 0.635 | 63% | 0.626 | S | S | * | * | trans | -73.3 | 91.8 | 165.6 | -71.3 | -85.4 | 0 | 0 | 0 | 106.6 | K205 S209 | K205-Y207 HydrophobicContact CD-CE1 4.03Å; K205-Y207 HydrophobicContact CD-CE2 3.92Å; K205-Y207 VanDerWaalsContact CE-CE1 3.4Å; K205-Y207 HydrophobicContact CG-CD2 4.4Å; K205-Y207 HydrophobicContact CG-CE2 4.14Å; K205-Y207 PolarHBondContact NZ-OH 3.37Å; K205-Y207 PolarHBondContact O-N 2.75Å; Y207-S209 PolarHBondContact O-N 3.08Å | ||
| 208 | K | 59.7 | Low | 75.4 | Confident | 179 Ų | 179 | 124 Ų | 124 | 78% | 0.778 | 64% | 0.635 | S | S | * | * | trans | -68 | 97.1 | 158.4 | -68 | -169.5 | 179 | -173.8 | 0 | 105.3 | Q206 K210 | Q206-K208 VanDerWaalsContact C-N 3.27Å; Q206-K208 PolarHBondContact O-N 3.11Å; K208-K210 VanDerWaalsContact C-N 3.26Å; K208-K210 PolarHBondContact O-N 3.02Å | ||
| 209 | S | 53.3 | Low | 74.3 | Confident | 90 Ų | 90 | 122.4 Ų | 122.4 | 63% | 0.629 | 62% | 0.624 | S | S | * | * | trans | -59.2 | 100.9 | 160.4 | 164.2 | 0 | 0 | 0 | 0 | 104.8 | Y207 R211 | Y207-S209 PolarHBondContact O-N 3.08Å; S209-R211 PolarHBondContact O-N 2.88Å | ||
| 210 | K | 56.2 | Low | 73 | Confident | 204 Ų | 204 | 128.5 Ų | 128.5 | 89% | 0.887 | 65% | 0.651 | S | S | * | * | trans | -63.5 | 92.1 | 158 | -81.8 | -172.8 | 173.8 | -174 | 0 | 104.4 | K208 G212 | K208-K210 VanDerWaalsContact C-N 3.26Å; K208-K210 PolarHBondContact O-N 3.02Å; K210-G212 PolarHBondContact O-N 3.47Å | ||
| 211 | R | 49.3 | Very low | 71.4 | Confident | 236 Ų | 236 | 134.3 Ų | 134.3 | 89% | 0.891 | 67% | 0.674 | S | S | * | * | trans | -71.4 | 95 | 154.4 | -69.3 | -175.3 | -178.9 | 177.6 | -2.1 | 103.7 | S209 | S209-R211 PolarHBondContact O-N 2.88Š| ||
| 212 | G | 44.4 | Very low | 69.5 | Low | 147 Ų | 147 | 135.6 Ų | 135.6 | 100% | 1.515 | 69% | 0.688 | S | S | * | * | trans | -93.2 | 0 | 160.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | K210 | K210-G212 PolarHBondContact O-N 3.47Š|
Retrieved 212 of 212 residues in 314.1 ms
(Link to these results)