| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 36.2 | Very low | 37.7 | Very low | 242 Ų | 242 | 159.1 Ų | 159.1 | 100% | 1.192 | 84% | 0.84 | S | S | * | * | 0 | 103.9 | 0 | -60.9 | 162.8 | -176.6 | 0 | 0 | 105.5 | |||||
| 2 | A | 34.3 | Very low | 37.3 | Very low | 87 Ų | 87 | 159.2 Ų | 159.2 | 72% | 0.719 | 84% | 0.842 | S | S | * | * | cis | 90.7 | 102.7 | 39.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 3 | T | 37.5 | Very low | 37.4 | Very low | 145 Ų | 145 | 154.9 Ų | 154.9 | 89% | 0.89 | 83% | 0.833 | S | S | * | * | trans | 59.4 | 153.5 | 156 | 66.9 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 4 | T | 39.4 | Very low | 37.3 | Very low | 137 Ų | 137 | 155.4 Ų | 155.4 | 84% | 0.84 | 83% | 0.834 | S | S | * | * | cis | -152.4 | 178.9 | 13.2 | -162.5 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 5 | A | 35.7 | Very low | 38.4 | Very low | 82 Ų | 82 | 152.5 Ų | 152.5 | 68% | 0.678 | 83% | 0.826 | S | S | * | * | cis | -151.1 | -147.6 | 9.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 6 | Q | 42.1 | Very low | 38 | Very low | 179 Ų | 179 | 150.4 Ų | 150.4 | 84% | 0.836 | 83% | 0.827 | S | S | * | * | trans | -140.7 | 152.8 | 167.5 | -66.6 | -171 | -10.5 | 0 | 0 | 111.5 | ||||
| 7 | Y | 28 | Very low | 37.8 | Very low | 224 Ų | 224 | 150.6 Ų | 150.6 | 88% | 0.878 | 83% | 0.827 | S | S | * | * | trans | -159.3 | 149.1 | 148 | -142.8 | -101.3 | 0 | 0 | 0 | 113.4 | ||||
| 8 | I | 35.3 | Very low | 38.2 | Very low | 138 Ų | 138 | 147.9 Ų | 147.9 | 71% | 0.708 | 82% | 0.817 | S | S | * | * | trans | -159.2 | 169.5 | 174.3 | 0.8 | 174.1 | 0 | 0 | 0 | 106.4 | ||||
| 9 | P | 57.3 | Low | 37.9 | Very low | 111 Ų | 111 | 148.8 Ų | 148.8 | 72% | 0.721 | 82% | 0.82 | S | S | * | * | cis | -130.1 | -175.8 | -19.9 | 40.3 | -24.9 | 0 | 0 | 0 | 112.7 | ||||
| 10 | R | 32.9 | Very low | 37.7 | Very low | 244 Ų | 244 | 150 Ų | 150 | 92% | 0.921 | 82% | 0.821 | S | S | * | * | -175.1 | 162.2 | 127.7 | -108.3 | 175.1 | 174.2 | 172.3 | -1.3 | 115.5 | |||||
| 11 | N | 35.9 | Very low | 37.5 | Very low | 161 Ų | 161 | 150.6 Ų | 150.6 | 86% | 0.861 | 82% | 0.818 | S | S | * | * | trans | -62 | 162.5 | 178.9 | -58.3 | -1 | 0 | 0 | 0 | 113.6 | ||||
| 12 | N | 32.7 | Very low | 37.8 | Very low | 160 Ų | 160 | 144 Ų | 144 | 86% | 0.856 | 79% | 0.794 | S | S | * | * | trans | -138.4 | 161 | 148.5 | -156.7 | 11 | 0 | 0 | 0 | 110.9 | ||||
| 13 | S | 38.5 | Very low | 37.9 | Very low | 104 Ų | 104 | 147.9 Ų | 147.9 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | trans | -108.1 | 169.1 | -170.3 | 50.5 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 14 | L | 36.8 | Very low | 37.8 | Very low | 162 Ų | 162 | 146 Ų | 146 | 85% | 0.848 | 80% | 0.795 | S | S | * | * | trans | -54.1 | 171.1 | 171.7 | -58.4 | 171 | 0 | 0 | 0 | 113.1 | ||||
| 15 | P | 53 | Low | 37.5 | Very low | 111 Ų | 111 | 146.6 Ų | 146.6 | 72% | 0.721 | 79% | 0.793 | S | S | * | * | cis | -137.4 | 178 | 8.7 | 43 | -26.6 | 0 | 0 | 0 | 116.1 | ||||
| 16 | S | 31.8 | Very low | 37.8 | Very low | 119 Ų | 119 | 152 Ų | 152 | 83% | 0.832 | 80% | 0.796 | S | S | * | * | 167.4 | 141.9 | 126 | -74 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 17 | N | 35.7 | Very low | 37.7 | Very low | 154 Ų | 154 | 152.3 Ų | 152.3 | 82% | 0.824 | 80% | 0.799 | S | S | * | * | trans | -110.4 | 177.9 | 166.9 | -132 | 14.9 | 0 | 0 | 0 | 107.7 | ||||
| 18 | P | 44.6 | Very low | 38.4 | Very low | 102 Ų | 102 | 148.6 Ų | 148.6 | 66% | 0.662 | 79% | 0.79 | S | S | * | * | cis | -131.6 | 170.2 | 3.2 | 41.8 | -26.1 | 0 | 0 | 0 | 115.7 | ||||
| 19 | L | 31.7 | Very low | 38.8 | Very low | 165 Ų | 165 | 151 Ų | 151 | 86% | 0.864 | 80% | 0.798 | S | S | * | * | trans | -143.1 | 154.2 | 152.4 | -150.2 | 69.9 | 0 | 0 | 0 | 111.4 | ||||
| 20 | M | 35.1 | Very low | 38.1 | Very low | 173 Ų | 173 | 149.1 Ų | 149.1 | 85% | 0.852 | 80% | 0.798 | S | S | * | * | trans | -57.2 | 142 | -168.9 | -61.7 | -78.8 | 92.1 | 0 | 0 | 114.6 | ||||
| 21 | H | 33.9 | Very low | 39 | Very low | 163 Ų | 163 | 141.2 Ų | 141.2 | 76% | 0.755 | 78% | 0.778 | S | S | * | * | trans | -120.8 | 118.7 | 168.8 | -162.8 | -65.3 | 0 | 0 | 0 | 108 | ||||
| 22 | P | 41.7 | Very low | 40.4 | Very low | 104 Ų | 104 | 137.6 Ų | 137.6 | 68% | 0.675 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 160.1 | 170.3 | 32.1 | -33.8 | 0 | 0 | 0 | 110.5 | S24 | P22-S24 PolarHBondContact O-N 2.99Š|
| 23 | D | 37.3 | Very low | 41.2 | Very low | 167 Ų | 167 | 137.9 Ų | 137.9 | 89% | 0.893 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -59 | 130.3 | 173.9 | -73.2 | -89 | 0 | 0 | 0 | 112 | ||
| 24 | S | 33.9 | Very low | 41.9 | Very low | 107 Ų | 107 | 142.1 Ų | 142.1 | 75% | 0.748 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -99.2 | 123 | 163.2 | -85.5 | 0 | 0 | 0 | 0 | 108.5 | P22 | P22-S24 PolarHBondContact O-N 2.99Š|
| 25 | D | 32.9 | Very low | 42.9 | Very low | 149 Ų | 149 | 138.5 Ų | 138.5 | 80% | 0.797 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 154.3 | -162.6 | -147.9 | -37.7 | 0 | 0 | 0 | 114.1 | M27 | D25-M27 PolarHBondContact O-N 3.34Š|
| 26 | R | 43.1 | Very low | 43.5 | Very low | 196 Ų | 196 | 136.2 Ų | 136.2 | 74% | 0.74 | 71% | 0.714 | S | S | * | * | trans | -71.1 | 71.7 | 179.4 | -177.4 | -178.8 | 163.5 | -163.8 | -4.6 | 110.1 | H28 | R26-H28 PolarHBondContact O-N 3.48Å; R26-H28 PolarHBondContact O-ND1 3.22Å | ||
| 27 | M | 39.5 | Very low | 45.1 | Very low | 184 Ų | 184 | 136 Ų | 136 | 91% | 0.906 | 70% | 0.7 | S | S | * | * | trans | -55 | 112.4 | 173 | -74.6 | -156 | -66.8 | 0 | 0 | 110 | D25 | D25-M27 PolarHBondContact O-N 3.34Š| ||
| 28 | H | 43.3 | Very low | 46.6 | Very low | 146 Ų | 146 | 134.5 Ų | 134.5 | 68% | 0.676 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 137.3 | -179.5 | -72.7 | 47.3 | 0 | 0 | 0 | 109.3 | R26 G30 | R26-H28 PolarHBondContact O-N 3.48Å; R26-H28 PolarHBondContact O-ND1 3.22Å; H28-G30 PolarHBondContact O-N 3.27Å; H28-G30 VanDerWaalsContact O-N 3.12Å |
| 29 | Q | 42.5 | Very low | 47.5 | Very low | 190 Ų | 190 | 135.1 Ų | 135.1 | 89% | 0.888 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 118.9 | 171.3 | -67.1 | -179.3 | 1.8 | 0 | 0 | 108.3 | T31 | Q29-T31 PolarHBondContact O-N 3.36Š|
| 30 | G | 43.3 | Very low | 49.3 | Very low | 70 Ų | 70 | 133.7 Ų | 133.7 | 72% | 0.722 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -56 | 125.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | H28 T32 | H28-G30 PolarHBondContact O-N 3.27Å; H28-G30 VanDerWaalsContact O-N 3.12Å; G30-T32 PolarHBondContact O-N 2.94Å |
| 31 | T | 51.8 | Low | 50.7 | Low | 79 Ų | 79 | 131.3 Ų | 131.3 | 49% | 0.485 | 66% | 0.659 | S | S | . | * | P | Polyproline II helix | trans | -55.1 | 124.5 | 178.9 | 30.6 | 0 | 0 | 0 | 0 | 109.7 | Q29 E35 | Q29-T31 PolarHBondContact O-N 3.36Å; T31-E35 HydrophobicContact CG2-CG 4.34Å |
| 32 | T | 65.6 | Low | 51.5 | Low | 84 Ų | 84 | 129.5 Ų | 129.5 | 52% | 0.515 | 65% | 0.65 | S | S | . | * | P | Polyproline II helix | trans | -60.7 | 149.9 | -178 | 66.8 | 0 | 0 | 0 | 0 | 110 | G30 R34 E35 V36 | G30-T32 PolarHBondContact O-N 2.94Å; T32-R34 PolarHBondContact O-N 3.4Å; T32-E35 WeakPolarHBondContact O-CA 3.48Å; T32-E35 WeakPolarHBondContact O-CB 3.43Å; T32-E35 PolarHBondContact O-N 3.44Å; T32-V36 PolarHBondContact O-N 3.29Å; T32-V36 VanDerWaalsContact O-N 3.12Å |
| 33 | Y | 49.6 | Very low | 52.2 | Low | 166 Ų | 166 | 131 Ų | 131 | 65% | 0.651 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -49.8 | -37.7 | -178.9 | -177.7 | -83.3 | 0 | 0 | 0 | 112.9 | E35 Q37 | Y33-E35 PolarHBondContact O-N 2.96Å; Y33-Q37 WeakPolarHBondContact O-CB 3.48Å; Y33-Q37 PolarHBondContact O-N 3.43Å |
| 34 | R | 52.3 | Low | 53.5 | Low | 194 Ų | 194 | 130.8 Ų | 130.8 | 73% | 0.732 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -66.5 | -18.3 | 177.2 | -164.8 | 178 | -171.6 | -137 | -0.9 | 114.1 | T32 K38 | T32-R34 PolarHBondContact O-N 3.4Å; R34-K38 WeakPolarHBondContact O-CG 3.48Å |
| 35 | E | 59.5 | Low | 54.8 | Low | 86 Ų | 86 | 130.5 Ų | 130.5 | 40% | 0.402 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -94.2 | -46.2 | -179.5 | -158.2 | 131 | -114.8 | 0 | 0 | 110.8 | T31 T32 Y33 Q37 K38 M39 | T31-E35 HydrophobicContact CG2-CG 4.34Å; T32-E35 WeakPolarHBondContact O-CA 3.48Å; T32-E35 WeakPolarHBondContact O-CB 3.43Å; T32-E35 PolarHBondContact O-N 3.44Å; Y33-E35 PolarHBondContact O-N 2.96Å; E35-Q37 PolarHBondContact O-N 3Å; E35-K38 WeakPolarHBondContact O-CB 3.36Å; E35-K38 PolarHBondContact O-N 3.1Å; E35-M39 PolarHBondContact O-N 2.86Å |
| 36 | V | 64.4 | Low | 55.9 | Low | 62 Ų | 62 | 129.4 Ų | 129.4 | 38% | 0.376 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -53.4 | -44 | 168.9 | -177.5 | 0 | 0 | 0 | 0 | 110.5 | T32 K38 M39 M40 | T32-V36 PolarHBondContact O-N 3.29Å; T32-V36 VanDerWaalsContact O-N 3.12Å; V36-K38 VanDerWaalsContact C-N 3.3Å; V36-K38 PolarHBondContact O-N 2.61Å; V36-M39 PolarHBondContact O-N 3.36Å; V36-M40 WeakPolarHBondContact O-CG 3.49Å; V36-M40 PolarHBondContact O-N 2.92Å |
| 37 | Q | 65 | Low | 56.2 | Low | 114 Ų | 114 | 122 Ų | 122 | 53% | 0.533 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -69.2 | -22.4 | 179 | -161.9 | 170.4 | 46.3 | 0 | 0 | 113.9 | Y33 E35 | Y33-Q37 WeakPolarHBondContact O-CB 3.48Å; Y33-Q37 PolarHBondContact O-N 3.43Å; E35-Q37 PolarHBondContact O-N 3Å |
| 38 | K | 67.5 | Low | 56.8 | Low | 123 Ų | 123 | 118.6 Ų | 118.6 | 54% | 0.535 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -77.7 | -42.4 | 168 | -69.4 | 168.2 | -174.9 | 173.5 | 0 | 111.4 | R34 E35 V36 H41 H42 | R34-K38 WeakPolarHBondContact O-CG 3.48Å; E35-K38 WeakPolarHBondContact O-CB 3.36Å; E35-K38 PolarHBondContact O-N 3.1Å; V36-K38 VanDerWaalsContact C-N 3.3Å; V36-K38 PolarHBondContact O-N 2.61Å; K38-H41 PolarHBondContact O-N 3.3Å; K38-H41 VanDerWaalsContact O-N 3.16Å; K38-H42 PolarHBondContact O-N 2.9Å |
| 39 | M | 64.7 | Low | 57 | Low | 115 Ų | 115 | 115.6 Ų | 115.6 | 57% | 0.567 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -60 | -51.2 | -178.2 | -169 | 174.3 | -72.8 | 0 | 0 | 110.4 | E35 V36 H41 H42 E43 | E35-M39 PolarHBondContact O-N 2.86Å; V36-M39 PolarHBondContact O-N 3.36Å; M39-H41 VanDerWaalsContact C-N 3.29Å; M39-H41 PolarHBondContact O-N 3.5Å; M39-H42 PolarHBondContact O-N 3.29Å; M39-E43 PolarHBondContact O-N 3.43Å |
| 40 | M | 68.4 | Low | 57.2 | Low | 135 Ų | 135 | 110.5 Ų | 110.5 | 67% | 0.665 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -52 | -43.1 | 171.4 | -73.4 | -96.4 | -70.7 | 0 | 0 | 113.2 | V36 Y44 | V36-M40 WeakPolarHBondContact O-CG 3.49Å; V36-M40 PolarHBondContact O-N 2.92Å; M40-Y44 VanDerWaalsContact O-CB 3.27Å; M40-Y44 WeakPolarHBondContact O-CB 3.38Å; M40-Y44 PolarHBondContact O-N 3.25Å |
| 41 | H | 64.6 | Low | 57.3 | Low | 124 Ų | 124 | 112.8 Ų | 112.8 | 57% | 0.574 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -72.8 | -27.8 | -179.8 | -168.5 | -54.9 | 0 | 0 | 0 | 112.6 | K38 M39 L45 | K38-H41 PolarHBondContact O-N 3.3Å; K38-H41 VanDerWaalsContact O-N 3.16Å; M39-H41 VanDerWaalsContact C-N 3.29Å; M39-H41 PolarHBondContact O-N 3.5Å; H41-L45 PolarHBondContact O-N 3.49Å |
| 42 | H | 50.4 | Low | 56.5 | Low | 124 Ų | 124 | 115.6 Ų | 115.6 | 57% | 0.574 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -75.8 | -46.8 | 175.2 | -169.3 | 31.6 | 0 | 0 | 0 | 110.9 | K38 M39 Y44 L45 Q46 | K38-H42 PolarHBondContact O-N 2.9Å; M39-H42 PolarHBondContact O-N 3.29Å; H42-Y44 PolarHBondContact O-N 3.04Å; H42-L45 WeakPolarHBondContact O-CB 3.44Å; H42-L45 PolarHBondContact O-N 3.02Å; H42-L45 VanDerWaalsContact O-N 3.15Å; H42-Q46 PolarHBondContact O-N 2.91Å |
| 43 | E | 57.5 | Low | 55.5 | Low | 137 Ų | 137 | 119 Ų | 119 | 64% | 0.64 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -61.3 | -43.2 | 177.8 | -165.1 | 179 | 134.2 | 0 | 0 | 111.7 | M39 L45 Q46 G47 | M39-E43 PolarHBondContact O-N 3.43Å; E43-L45 VanDerWaalsContact C-N 3.33Å; E43-L45 PolarHBondContact O-N 3.15Å; E43-Q46 PolarHBondContact O-N 3.12Å; E43-Q46 VanDerWaalsContact O-N 3.14Å; E43-G47 PolarHBondContact O-N 3.38Å |
| 44 | Y | 63 | Low | 54.7 | Low | 161 Ų | 161 | 113.5 Ų | 113.5 | 63% | 0.631 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -59.8 | -39.7 | 173.4 | -178.6 | -101.8 | 0 | 0 | 0 | 113 | M40 H42 Q46 L48 | M40-Y44 VanDerWaalsContact O-CB 3.27Å; M40-Y44 WeakPolarHBondContact O-CB 3.38Å; M40-Y44 PolarHBondContact O-N 3.25Å; H42-Y44 PolarHBondContact O-N 3.04Å; Y44-Q46 VanDerWaalsContact C-N 3.34Å; Y44-L48 HydrophobicContact CD1-CD1 4.36Å; Y44-L48 HydrophobicContact CE1-CD1 3.91Å; Y44-L48 WeakPolarHBondContact O-CG 3.39Å |
| 45 | L | 62.8 | Low | 53.9 | Low | 102 Ų | 102 | 113.3 Ų | 113.3 | 53% | 0.534 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -67.7 | -35.3 | 175.5 | -120.9 | 74.9 | 0 | 0 | 0 | 112.2 | H41 H42 E43 | H41-L45 PolarHBondContact O-N 3.49Å; H42-L45 WeakPolarHBondContact O-CB 3.44Å; H42-L45 PolarHBondContact O-N 3.02Å; H42-L45 VanDerWaalsContact O-N 3.15Å; E43-L45 VanDerWaalsContact C-N 3.33Å; E43-L45 PolarHBondContact O-N 3.15Å |
| 46 | Q | 55.2 | Low | 53.2 | Low | 125 Ų | 125 | 114.7 Ų | 114.7 | 58% | 0.584 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -82.7 | -32 | -175.6 | -163.3 | 157.5 | 4.7 | 0 | 0 | 112.5 | H42 E43 Y44 L48 A49 A50 | H42-Q46 PolarHBondContact O-N 2.91Å; E43-Q46 PolarHBondContact O-N 3.12Å; E43-Q46 VanDerWaalsContact O-N 3.14Å; Y44-Q46 VanDerWaalsContact C-N 3.34Å; Q46-L48 VanDerWaalsContact C-N 3.31Å; Q46-L48 PolarHBondContact O-N 2.86Å; Q46-A49 WeakPolarHBondContact O-CB 3.32Å; Q46-A49 PolarHBondContact O-N 3.43Å; Q46-A49 VanDerWaalsContact O-N 3.09Å; Q46-A50 PolarHBondContact O-N 3.39Å |
| 47 | G | 49.4 | Very low | 51.7 | Low | 41 Ų | 41 | 120.8 Ų | 120.8 | 42% | 0.423 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -60.1 | -38.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | E43 A49 A50 | E43-G47 PolarHBondContact O-N 3.38Å; G47-A49 PolarHBondContact O-N 2.97Å; G47-A50 PolarHBondContact O-N 3.48Å; G47-A50 VanDerWaalsContact O-N 3.16Å |
| 48 | L | 51.8 | Low | 50.4 | Low | 112 Ų | 112 | 120.6 Ų | 120.6 | 59% | 0.586 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -65.3 | -18.6 | 174.8 | -70.9 | 170.6 | 0 | 0 | 0 | 113.9 | Y44 Q46 | Y44-L48 HydrophobicContact CD1-CD1 4.36Å; Y44-L48 HydrophobicContact CE1-CD1 3.91Å; Y44-L48 WeakPolarHBondContact O-CG 3.39Å; Q46-L48 VanDerWaalsContact C-N 3.31Å; Q46-L48 PolarHBondContact O-N 2.86Å |
| 49 | A | 47.5 | Very low | 48.9 | Very low | 84 Ų | 84 | 122.8 Ų | 122.8 | 69% | 0.694 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -90 | -15.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q46 G47 | Q46-A49 WeakPolarHBondContact O-CB 3.32Å; Q46-A49 PolarHBondContact O-N 3.43Å; Q46-A49 VanDerWaalsContact O-N 3.09Å; G47-A49 PolarHBondContact O-N 2.97Å |
| 50 | A | 46.8 | Very low | 47.6 | Very low | 82 Ų | 82 | 122.2 Ų | 122.2 | 68% | 0.678 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -88.5 | -19.2 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q46 G47 | Q46-A50 PolarHBondContact O-N 3.39Å; G47-A50 PolarHBondContact O-N 3.48Å; G47-A50 VanDerWaalsContact O-N 3.16Å |
| 51 | T | 46.2 | Very low | 46 | Very low | 118 Ų | 118 | 123.6 Ų | 123.6 | 72% | 0.724 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -113.8 | 60 | -170.1 | 62.9 | 0 | 0 | 0 | 0 | 113.2 | ||
| 52 | N | 34.8 | Very low | 44.6 | Very low | 139 Ų | 139 | 124.8 Ų | 124.8 | 74% | 0.743 | 69% | 0.694 | S | S | * | * | trans | -149.9 | 82.9 | 169.9 | -155.1 | -6.4 | 0 | 0 | 0 | 115.1 | ||||
| 53 | T | 44.2 | Very low | 43.8 | Very low | 156 Ų | 156 | 126 Ų | 126 | 96% | 0.957 | 70% | 0.7 | S | S | * | * | trans | -112.2 | 75.4 | 167.9 | 38.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 54 | G | 32.5 | Very low | 42.6 | Very low | 49 Ų | 49 | 130.8 Ų | 130.8 | 51% | 0.505 | 71% | 0.712 | S | S | . | * | S | Bend | trans | -176.4 | 83.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 55 | H | 35.9 | Very low | 41.4 | Very low | 191 Ų | 191 | 129.4 Ų | 129.4 | 88% | 0.884 | 72% | 0.715 | S | S | * | * | trans | 51.3 | 137.2 | 160.3 | -63.7 | -78.4 | 0 | 0 | 0 | 120.8 | ||||
| 56 | P | 43.9 | Very low | 40.3 | Very low | 115 Ų | 115 | 130.9 Ų | 130.9 | 75% | 0.747 | 73% | 0.731 | S | S | * | * | trans | -85.1 | 143.6 | -176.4 | 34.5 | -35 | 0 | 0 | 0 | 113.5 | ||||
| 57 | M | 34.1 | Very low | 39.3 | Very low | 190 Ų | 190 | 131.4 Ų | 131.4 | 94% | 0.936 | 74% | 0.742 | S | S | * | * | trans | -126.8 | 142.8 | 153.1 | -85.3 | -67.1 | 165.7 | 0 | 0 | 109.5 | ||||
| 58 | S | 38 | Very low | 38.5 | Very low | 109 Ų | 109 | 134.8 Ų | 134.8 | 76% | 0.762 | 76% | 0.76 | S | S | * | * | trans | -74.4 | 132.5 | -166.8 | -175.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 59 | L | 35 | Very low | 37.4 | Very low | 169 Ų | 169 | 136.3 Ų | 136.3 | 89% | 0.885 | 77% | 0.769 | S | S | * | * | trans | -145.6 | 121.8 | 152.3 | -152.9 | 71.2 | 0 | 0 | 0 | 111.2 | H61 | L59-H61 PolarHBondContact O-N 3.2Š| ||
| 60 | T | 37 | Very low | 36.7 | Very low | 103 Ų | 103 | 137.6 Ų | 137.6 | 63% | 0.632 | 77% | 0.768 | S | S | * | * | trans | -66.4 | 119 | -173.9 | -52.6 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 61 | H | 34.6 | Very low | 35.9 | Very low | 165 Ų | 165 | 140.6 Ų | 140.6 | 76% | 0.764 | 77% | 0.773 | S | S | * | * | trans | -85.3 | 114.5 | 176.3 | -167.4 | 100.2 | 0 | 0 | 0 | 111.5 | L59 Q63 | L59-H61 PolarHBondContact O-N 3.2Å; H61-Q63 PolarHBondContact O-N 3.4Å | ||
| 62 | H | 36.7 | Very low | 35.2 | Very low | 149 Ų | 149 | 145.6 Ų | 145.6 | 69% | 0.69 | 78% | 0.778 | S | S | * | * | trans | -81 | 95.6 | 178.5 | -43.5 | -64.4 | 0 | 0 | 0 | 111 | W64 | H62-W64 PolarHBondContact O-N 3.2Š| ||
| 63 | Q | 32.5 | Very low | 34.9 | Very low | 149 Ų | 149 | 143.7 Ų | 143.7 | 70% | 0.696 | 78% | 0.776 | S | S | * | * | trans | -80.4 | 117.1 | -172.4 | -167.1 | 169.5 | 25.2 | 0 | 0 | 112.8 | H61 | H61-Q63 PolarHBondContact O-N 3.4Š| ||
| 64 | W | 31.9 | Very low | 34.3 | Very low | 237 Ų | 237 | 141.6 Ų | 141.6 | 90% | 0.898 | 77% | 0.768 | S | S | * | * | trans | -119.2 | 88 | 171.9 | -72.8 | 98.5 | 0 | 0 | 0 | 111 | H62 | H62-W64 PolarHBondContact O-N 3.2Š| ||
| 65 | L | 39.3 | Very low | 34.1 | Very low | 133 Ų | 133 | 142.8 Ų | 142.8 | 70% | 0.696 | 78% | 0.78 | S | S | * | * | trans | -136.9 | 116.1 | 173.9 | -83 | 166.9 | 0 | 0 | 0 | 109.8 | ||||
| 66 | P | 39.1 | Very low | 33.8 | Very low | 132 Ų | 132 | 140.3 Ų | 140.3 | 86% | 0.857 | 78% | 0.778 | S | S | * | * | trans | -89.9 | 103.5 | 169.7 | 32.5 | -28.8 | 0 | 0 | 0 | 110.3 | ||||
| 67 | T | 34.5 | Very low | 33.2 | Very low | 136 Ų | 136 | 143 Ų | 143 | 83% | 0.834 | 78% | 0.78 | S | S | * | * | trans | -85.4 | 150.3 | 166.3 | 46.4 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 68 | S | 32.6 | Very low | 33 | Very low | 113 Ų | 113 | 141.4 Ų | 141.4 | 79% | 0.79 | 77% | 0.774 | S | S | * | * | trans | -83.9 | 173.7 | -177.7 | 51.8 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 69 | N | 29.1 | Very low | 32.5 | Very low | 144 Ų | 144 | 139.1 Ų | 139.1 | 77% | 0.77 | 77% | 0.768 | S | S | * | * | trans | 88.4 | 93.6 | 171.8 | -82.4 | 33.7 | 0 | 0 | 0 | 119.6 | ||||
| 70 | T | 32.4 | Very low | 32.2 | Very low | 110 Ų | 110 | 140.7 Ų | 140.7 | 68% | 0.675 | 77% | 0.771 | S | S | * | * | 42.8 | 138.1 | 117.6 | -11.2 | 0 | 0 | 0 | 0 | 122.8 | |||||
| 71 | D | 28.8 | Very low | 31.9 | Very low | 146 Ų | 146 | 144.4 Ų | 144.4 | 78% | 0.781 | 78% | 0.781 | S | S | * | * | trans | 58.8 | 110.2 | 154.8 | -65.9 | -36.7 | 0 | 0 | 0 | 120.4 | ||||
| 72 | W | 32.5 | Very low | 31.6 | Very low | 223 Ų | 223 | 144.6 Ų | 144.6 | 85% | 0.845 | 78% | 0.782 | S | S | * | * | -152.9 | 176.1 | 82.8 | 81.6 | -46.5 | 0 | 0 | 0 | 111.4 | |||||
| 73 | S | 29.2 | Very low | 31.3 | Very low | 98 Ų | 98 | 144.8 Ų | 144.8 | 69% | 0.685 | 78% | 0.783 | S | S | * | * | trans | -134.2 | 153.2 | 178.4 | -73.7 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 74 | S | 30.9 | Very low | 31.2 | Very low | 113 Ų | 113 | 146.8 Ų | 146.8 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | 70.2 | 123.8 | 169.1 | -56.4 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 75 | G | 27.7 | Very low | 31.1 | Very low | 73 Ų | 73 | 140.2 Ų | 140.2 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | trans | -179.1 | 97 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 76 | T | 30.3 | Very low | 30.5 | Very low | 139 Ų | 139 | 137.5 Ų | 137.5 | 85% | 0.853 | 79% | 0.79 | S | S | * | * | trans | -93.3 | 144.8 | 179.9 | 44.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 77 | H | 31.8 | Very low | 30.2 | Very low | 171 Ų | 171 | 138.3 Ų | 138.3 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | trans | 63 | 102.3 | 147 | -177 | -73.4 | 0 | 0 | 0 | 118.6 | ||||
| 78 | I | 28.4 | Very low | 30.1 | Very low | 157 Ų | 157 | 141 Ų | 141 | 81% | 0.805 | 80% | 0.795 | S | S | * | * | -150.8 | 162.1 | 125.8 | -153.5 | 62.5 | 0 | 0 | 0 | 108.6 | |||||
| 79 | G | 28.3 | Very low | 30 | Very low | 62 Ų | 62 | 140.3 Ų | 140.3 | 64% | 0.639 | 80% | 0.797 | S | S | * | * | trans | -148.5 | 166.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 80 | Q | 28.9 | Very low | 30 | Very low | 202 Ų | 202 | 139 Ų | 139 | 94% | 0.944 | 80% | 0.799 | S | S | * | * | trans | -148.8 | 153.8 | 168.7 | -108.7 | 171.4 | 8.6 | 0 | 0 | 110.2 | ||||
| 81 | Q | 31.3 | Very low | 30.1 | Very low | 181 Ų | 181 | 144.5 Ų | 144.5 | 85% | 0.846 | 81% | 0.807 | S | S | * | * | trans | -104.1 | 155.5 | 179.2 | -56.6 | 165.8 | -71.9 | 0 | 0 | 109.4 | ||||
| 82 | E | 26.9 | Very low | 30.4 | Very low | 169 Ų | 169 | 146.7 Ų | 146.7 | 79% | 0.79 | 81% | 0.813 | S | S | * | * | -156.8 | 129.4 | 127.8 | -88.9 | -133.8 | 37.3 | 0 | 0 | 110.5 | |||||
| 83 | H | 30.5 | Very low | 30.3 | Very low | 152 Ų | 152 | 142.4 Ų | 142.4 | 70% | 0.704 | 81% | 0.807 | S | S | * | * | trans | 31 | 144.9 | 131.4 | -61.9 | -54.7 | 0 | 0 | 0 | 122 | ||||
| 84 | K | 30.2 | Very low | 30.5 | Very low | 191 Ų | 191 | 145.2 Ų | 145.2 | 83% | 0.83 | 81% | 0.813 | S | S | * | * | cis | -174.5 | 169.4 | -3.2 | 170.7 | 174.5 | -180 | -177.6 | 0 | 109.6 | ||||
| 85 | A | 29.7 | Very low | 30.6 | Very low | 99 Ų | 99 | 144.7 Ų | 144.7 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | 84.8 | 132.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 86 | G | 27.6 | Very low | 30.8 | Very low | 77 Ų | 77 | 147.3 Ų | 147.3 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | cis | 127.2 | 74.8 | -12.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 87 | V | 33.6 | Very low | 30.7 | Very low | 148 Ų | 148 | 144.5 Ų | 144.5 | 90% | 0.897 | 81% | 0.811 | S | S | * | * | trans | -132.6 | 140.1 | 157.6 | -179.2 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 88 | Q | 30.9 | Very low | 30.7 | Very low | 192 Ų | 192 | 145.1 Ų | 145.1 | 90% | 0.897 | 81% | 0.812 | S | S | * | * | trans | -140.3 | 164.6 | -177.7 | -161.5 | -178.6 | 10.2 | 0 | 0 | 109.4 | ||||
| 89 | A | 30.2 | Very low | 31 | Very low | 100 Ų | 100 | 144.4 Ų | 144.4 | 83% | 0.826 | 80% | 0.804 | S | S | * | * | trans | 74.2 | 140.2 | -169.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 90 | S | 30.9 | Very low | 31.3 | Very low | 117 Ų | 117 | 149.8 Ų | 149.8 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | cis | -113.9 | 164.2 | 26.3 | -167.6 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 91 | R | 33.6 | Very low | 31.5 | Very low | 225 Ų | 225 | 150 Ų | 150 | 85% | 0.849 | 81% | 0.805 | S | S | * | * | trans | -65.6 | 169 | 154.5 | -115.7 | 172.6 | 171.6 | 159.8 | -6.4 | 109.2 | ||||
| 92 | E | 34.4 | Very low | 31.4 | Very low | 192 Ų | 192 | 147.1 Ų | 147.1 | 90% | 0.897 | 81% | 0.805 | S | S | * | * | -144.4 | -176.8 | 52 | -74.3 | 176.5 | 143.2 | 0 | 0 | 114.2 | |||||
| 93 | D | 29.9 | Very low | 31.7 | Very low | 133 Ų | 133 | 145 Ų | 145 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | trans | -119.5 | 159.4 | -170.6 | -166.6 | -23.8 | 0 | 0 | 0 | 109.8 | ||||
| 94 | L | 34 | Very low | 32 | Very low | 156 Ų | 156 | 146.2 Ų | 146.2 | 82% | 0.817 | 81% | 0.805 | S | S | * | * | trans | 175.3 | 86.6 | 143.3 | -95.4 | 166.5 | 0 | 0 | 0 | 113.7 | ||||
| 95 | T | 33.2 | Very low | 32.3 | Very low | 103 Ų | 103 | 143.1 Ų | 143.1 | 63% | 0.632 | 80% | 0.802 | S | S | * | * | 49.2 | 137.6 | 129.8 | 64.7 | 0 | 0 | 0 | 0 | 124.6 | |||||
| 96 | S | 31.5 | Very low | 32.6 | Very low | 128 Ų | 128 | 146.7 Ų | 146.7 | 90% | 0.895 | 80% | 0.801 | S | S | * | * | trans | 90.5 | 128.5 | 142.1 | -61.1 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 97 | G | 29.8 | Very low | 32.8 | Very low | 80 Ų | 80 | 151.1 Ų | 151.1 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | trans | 160.6 | 101.3 | 165.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 98 | F | 31.9 | Very low | 32.9 | Very low | 184 Ų | 184 | 151.5 Ų | 151.5 | 81% | 0.807 | 79% | 0.794 | S | S | * | * | trans | -78.3 | 136.5 | -176.2 | -94.3 | -145.3 | 0 | 0 | 0 | 115.3 | ||||
| 99 | H | 33.5 | Very low | 33 | Very low | 142 Ų | 142 | 149 Ų | 149 | 66% | 0.657 | 79% | 0.791 | S | S | * | * | trans | 56.2 | 169.1 | 149.5 | -48.1 | -34.8 | 0 | 0 | 0 | 118.6 | ||||
| 100 | H | 35 | Very low | 33.2 | Very low | 174 Ų | 174 | 152.1 Ų | 152.1 | 81% | 0.806 | 79% | 0.789 | S | S | * | * | cis | -132.3 | 164.5 | 3.4 | -87.5 | -80 | 0 | 0 | 0 | 112.4 | ||||
| 101 | R | 32.1 | Very low | 33.2 | Very low | 207 Ų | 207 | 152.7 Ų | 152.7 | 78% | 0.781 | 79% | 0.793 | S | S | * | * | trans | -89.3 | 114.2 | 175.8 | 169.1 | -171.1 | 175.4 | -115.7 | 6 | 111.7 | ||||
| 102 | S | 29.4 | Very low | 33.2 | Very low | 121 Ų | 121 | 145.9 Ų | 145.9 | 85% | 0.846 | 79% | 0.785 | S | S | * | * | trans | -106.8 | 141 | 167.6 | -79 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 103 | H | 34.2 | Very low | 33 | Very low | 124 Ų | 124 | 146 Ų | 146 | 57% | 0.574 | 79% | 0.785 | S | S | * | * | trans | -141 | 131.5 | -174 | 46.4 | -78.5 | 0 | 0 | 0 | 106.5 | ||||
| 104 | L | 36.8 | Very low | 33.1 | Very low | 177 Ų | 177 | 148.2 Ų | 148.2 | 93% | 0.927 | 79% | 0.79 | S | S | * | * | trans | -116.9 | 113.2 | -178 | -125.9 | 72.1 | 0 | 0 | 0 | 111.1 | ||||
| 105 | V | 35.9 | Very low | 32.9 | Very low | 127 Ų | 127 | 144.3 Ų | 144.3 | 77% | 0.77 | 79% | 0.788 | S | S | * | * | trans | -131.5 | 121.4 | 169.6 | 171.4 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 106 | H | 36.3 | Very low | 32.8 | Very low | 173 Ų | 173 | 144 Ų | 144 | 80% | 0.801 | 79% | 0.791 | S | S | * | * | trans | -156.5 | 106.6 | 167.4 | -139.4 | 75.2 | 0 | 0 | 0 | 105 | ||||
| 107 | Q | 32.3 | Very low | 33.1 | Very low | 171 Ų | 171 | 150.2 Ų | 150.2 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | cis | 73.8 | 139.4 | 49.9 | -160.2 | 162.9 | 56.1 | 0 | 0 | 113.9 | ||||
| 108 | Q | 34.8 | Very low | 33.6 | Very low | 156 Ų | 156 | 150.7 Ų | 150.7 | 73% | 0.729 | 79% | 0.791 | S | S | * | * | trans | -106.5 | 140.5 | -161.5 | 165.3 | -165.1 | 18.3 | 0 | 0 | 110.6 | ||||
| 109 | T | 32.9 | Very low | 34.7 | Very low | 139 Ų | 139 | 148.2 Ų | 148.2 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | trans | -136.6 | 157.5 | 158.9 | 47.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 110 | Q | 34.9 | Very low | 34.7 | Very low | 166 Ų | 166 | 145.6 Ų | 145.6 | 78% | 0.776 | 80% | 0.796 | S | S | * | * | trans | -110.5 | 152.6 | 179 | -53.1 | 171.1 | 17.8 | 0 | 0 | 109.5 | ||||
| 111 | S | 30.8 | Very low | 34.8 | Very low | 129 Ų | 129 | 143.2 Ų | 143.2 | 90% | 0.902 | 79% | 0.794 | S | S | * | * | trans | -176 | 158.8 | 139.8 | -84.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 112 | A | 32.7 | Very low | 34.8 | Very low | 82 Ų | 82 | 138.5 Ų | 138.5 | 68% | 0.678 | 79% | 0.788 | S | S | * | * | trans | -91.6 | 165.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 113 | H | 31.3 | Very low | 35.2 | Very low | 195 Ų | 195 | 140.7 Ų | 140.7 | 90% | 0.903 | 79% | 0.785 | S | S | * | * | -172.1 | 165.1 | 110.7 | -99.4 | -69.7 | 0 | 0 | 0 | 113.6 | |||||
| 114 | H | 31.2 | Very low | 35.4 | Very low | 178 Ų | 178 | 141.8 Ų | 141.8 | 82% | 0.824 | 79% | 0.79 | S | S | * | * | trans | -67.5 | 153.1 | -170.8 | -177.9 | -102.8 | 0 | 0 | 0 | 115.3 | ||||
| 115 | G | 31 | Very low | 35.3 | Very low | 75 Ų | 75 | 140.8 Ų | 140.8 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | trans | -174.4 | 89.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 116 | S | 30.8 | Very low | 35.2 | Very low | 97 Ų | 97 | 140 Ų | 140 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | trans | -102 | 146.7 | 177.2 | -174 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 117 | W | 38.3 | Very low | 36.1 | Very low | 258 Ų | 258 | 137.1 Ų | 137.1 | 98% | 0.977 | 78% | 0.781 | S | S | * | * | trans | -129.8 | 121.1 | 174.5 | -93.6 | 56.1 | 0 | 0 | 0 | 111.2 | ||||
| 118 | A | 39.3 | Very low | 36.3 | Very low | 90 Ų | 90 | 136.9 Ų | 136.9 | 74% | 0.744 | 79% | 0.785 | S | S | * | * | trans | -153 | 151.4 | 166.3 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 119 | P | 54.5 | Low | 36.4 | Very low | 131 Ų | 131 | 134.8 Ų | 134.8 | 85% | 0.851 | 79% | 0.787 | S | S | * | * | -144.2 | -167 | 86 | 42.9 | -26.2 | 0 | 0 | 0 | 110.9 | |||||
| 120 | A | 34.8 | Very low | 37.2 | Very low | 87 Ų | 87 | 134.3 Ų | 134.3 | 72% | 0.719 | 79% | 0.787 | S | S | * | * | cis | -144.8 | 178.4 | 4.9 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 121 | T | 36.4 | Very low | 37.2 | Very low | 124 Ų | 124 | 130.9 Ų | 130.9 | 76% | 0.761 | 79% | 0.786 | S | S | * | * | cis | -147.1 | 157.4 | 24.8 | 46.5 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 122 | T | 33.2 | Very low | 37.5 | Very low | 109 Ų | 109 | 130.5 Ų | 130.5 | 67% | 0.669 | 78% | 0.784 | S | S | * | * | trans | -3.2 | 144 | 153 | 36.6 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 123 | H | 37.3 | Very low | 37.6 | Very low | 166 Ų | 166 | 134.6 Ų | 134.6 | 77% | 0.769 | 79% | 0.794 | S | S | * | * | cis | -160 | 174.9 | 26.4 | -96.5 | -46.1 | 0 | 0 | 0 | 109.3 | ||||
| 124 | H | 37.6 | Very low | 37.7 | Very low | 147 Ų | 147 | 128.7 Ų | 128.7 | 68% | 0.681 | 79% | 0.786 | S | S | * | * | cis | -172 | 169.9 | -17.1 | 62 | -5.3 | 0 | 0 | 0 | 110.2 | ||||
| 125 | L | 35 | Very low | 37.9 | Very low | 156 Ų | 156 | 128.9 Ų | 128.9 | 82% | 0.817 | 79% | 0.787 | S | S | * | * | trans | 45.2 | 138.4 | 161 | -65 | 178.8 | 0 | 0 | 0 | 122.1 | ||||
| 126 | S | 33.2 | Very low | 38 | Very low | 112 Ų | 112 | 133.9 Ų | 133.9 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | trans | -118 | -178.7 | 164.4 | -48.1 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 127 | P | 55.3 | Low | 38.1 | Very low | 111 Ų | 111 | 135.4 Ų | 135.4 | 72% | 0.721 | 80% | 0.801 | S | S | * | * | cis | -143.7 | -160.6 | 13 | 33.7 | -7.2 | 0 | 0 | 0 | 115.5 | ||||
| 128 | L | 37 | Very low | 38 | Very low | 167 Ų | 167 | 130.2 Ų | 130.2 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | trans | 89.3 | 128.7 | 160.7 | -58.4 | 166.2 | 0 | 0 | 0 | 119.4 | ||||
| 129 | S | 37.2 | Very low | 37.8 | Very low | 111 Ų | 111 | 132.8 Ų | 132.8 | 78% | 0.776 | 80% | 0.797 | S | S | * | * | trans | -88.7 | 159.1 | 156.5 | -40.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 130 | P | 50.5 | Low | 36.7 | Very low | 130 Ų | 130 | 136.3 Ų | 136.3 | 84% | 0.844 | 80% | 0.795 | S | S | * | * | -144.9 | -171.6 | 86.7 | 39 | -21.9 | 0 | 0 | 0 | 114.6 | |||||
| 131 | A | 35 | Very low | 36.7 | Very low | 93 Ų | 93 | 136.1 Ų | 136.1 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | trans | -77.6 | 158.4 | -172.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 132 | S | 36.5 | Very low | 36.5 | Very low | 122 Ų | 122 | 138.4 Ų | 138.4 | 85% | 0.853 | 79% | 0.791 | S | S | * | * | 176 | 170.7 | 130 | 44.1 | 0 | 0 | 0 | 0 | 113 | |||||
| 133 | N | 33.8 | Very low | 36.8 | Very low | 168 Ų | 168 | 138.3 Ų | 138.3 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | trans | -62.9 | 158.3 | -178.1 | -56 | -18.2 | 0 | 0 | 0 | 113.8 | ||||
| 134 | G | 32.9 | Very low | 36.8 | Very low | 70 Ų | 70 | 133.2 Ų | 133.2 | 72% | 0.722 | 78% | 0.784 | S | S | * | * | trans | 162.4 | 51.5 | 157.6 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 135 | H | 35.4 | Very low | 36.8 | Very low | 183 Ų | 183 | 136.3 Ų | 136.3 | 85% | 0.847 | 79% | 0.791 | S | S | * | * | trans | 55.5 | 126 | 147.2 | -69.2 | -173.5 | 0 | 0 | 0 | 122.6 | ||||
| 136 | Q | 33.9 | Very low | 37 | Very low | 179 Ų | 179 | 134.6 Ų | 134.6 | 84% | 0.836 | 79% | 0.788 | S | S | * | * | trans | 65.3 | 105.6 | 137.6 | -56.3 | -72.6 | 37.6 | 0 | 0 | 121.2 | ||||
| 137 | S | 32.1 | Very low | 37.4 | Very low | 129 Ų | 129 | 136.6 Ų | 136.6 | 90% | 0.902 | 79% | 0.789 | S | S | * | * | -155.4 | 168.6 | 114.1 | -161.3 | 0 | 0 | 0 | 0 | 111 | |||||
| 138 | L | 37.4 | Very low | 36.6 | Very low | 150 Ų | 150 | 140 Ų | 140 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | trans | -122 | 127.1 | -156.1 | 177.2 | 75.1 | 0 | 0 | 0 | 113.6 | ||||
| 139 | V | 35.7 | Very low | 36.7 | Very low | 143 Ų | 143 | 139.6 Ų | 139.6 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | trans | -158.8 | 96.4 | 150 | -103.1 | 0 | 0 | 0 | 0 | 114 | ||||
| 140 | Y | 30.2 | Very low | 36.5 | Very low | 205 Ų | 205 | 138.4 Ų | 138.4 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | 63.6 | 136.5 | 127.2 | -154 | -113.3 | 0 | 0 | 0 | 124.8 | |||||
| 141 | S | 34.2 | Very low | 35.9 | Very low | 83 Ų | 83 | 140.3 Ų | 140.3 | 58% | 0.58 | 80% | 0.796 | S | S | * | * | trans | 67.3 | 135.3 | 169.1 | -74.1 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 142 | Q | 33.5 | Very low | 35.9 | Very low | 173 Ų | 173 | 143.2 Ų | 143.2 | 81% | 0.808 | 80% | 0.798 | S | S | * | * | cis | -147.7 | 158.5 | -3.8 | -96.6 | -99.3 | 0.9 | 0 | 0 | 109.2 | ||||
| 143 | P | 39.9 | Very low | 35.8 | Very low | 106 Ų | 106 | 142.7 Ų | 142.7 | 69% | 0.688 | 79% | 0.794 | S | S | * | * | trans | -108.1 | 168.9 | -164.1 | 39.6 | -31.6 | 0 | 0 | 0 | 117.3 | ||||
| 144 | G | 35.8 | Very low | 36.9 | Very low | 59 Ų | 59 | 140.3 Ų | 140.3 | 61% | 0.608 | 79% | 0.788 | S | S | * | * | trans | -74.5 | -164.3 | 160.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 145 | Y | 37.3 | Very low | 37.2 | Very low | 213 Ų | 213 | 145.8 Ų | 145.8 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | cis | -155.4 | 141 | 27.7 | -76.3 | -93.5 | 0 | 0 | 0 | 108.6 | ||||
| 146 | T | 40.7 | Very low | 37.9 | Very low | 120 Ų | 120 | 142.6 Ų | 142.6 | 74% | 0.736 | 79% | 0.79 | S | S | * | * | 51.7 | 131.2 | 82.4 | 72.3 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 147 | N | 41.9 | Very low | 37.9 | Very low | 154 Ų | 154 | 137.9 Ų | 137.9 | 82% | 0.824 | 79% | 0.789 | S | S | * | * | trans | -40.7 | 157 | 177.9 | -44 | -8.9 | 0 | 0 | 0 | 118.8 | ||||
| 148 | L | 37.7 | Very low | 38 | Very low | 182 Ų | 182 | 136 Ų | 136 | 95% | 0.953 | 78% | 0.781 | S | S | * | * | trans | -140.6 | 164.8 | 148.3 | -74.8 | -178.4 | 0 | 0 | 0 | 111.4 | ||||
| 149 | N | 38.5 | Very low | 37.9 | Very low | 159 Ų | 159 | 136.4 Ų | 136.4 | 85% | 0.85 | 78% | 0.783 | S | S | * | * | trans | -157.5 | 149.2 | -174.8 | -169.9 | 10 | 0 | 0 | 0 | 111.8 | ||||
| 150 | A | 32.7 | Very low | 38 | Very low | 86 Ų | 86 | 138.2 Ų | 138.2 | 71% | 0.711 | 78% | 0.782 | S | S | * | * | trans | 65.8 | 161.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 151 | M | 38.1 | Very low | 38.3 | Very low | 169 Ų | 169 | 137.1 Ų | 137.1 | 83% | 0.833 | 78% | 0.784 | S | S | * | * | cis | -160.7 | 172.7 | 2.8 | -153 | 177.6 | 176.8 | 0 | 0 | 112 | ||||
| 152 | L | 36.1 | Very low | 38.1 | Very low | 154 Ų | 154 | 136.5 Ų | 136.5 | 81% | 0.806 | 79% | 0.791 | S | S | * | * | trans | 93.5 | 164.5 | 158.9 | -59.9 | 163.4 | 0 | 0 | 0 | 120.3 | ||||
| 153 | S | 33.6 | Very low | 38.5 | Very low | 112 Ų | 112 | 137.2 Ų | 137.2 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | -154.8 | -170.2 | -165.8 | -49.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 154 | P | 58.3 | Low | 38.3 | Very low | 117 Ų | 117 | 143.9 Ų | 143.9 | 76% | 0.76 | 81% | 0.808 | S | S | * | * | cis | -142.8 | 164.5 | 0.1 | 42.6 | -23.6 | 0 | 0 | 0 | 119.3 | ||||
| 155 | Q | 37.7 | Very low | 38.2 | Very low | 186 Ų | 186 | 148.3 Ų | 148.3 | 87% | 0.869 | 82% | 0.818 | S | S | * | * | trans | 54.8 | 170.7 | 150.9 | -92.5 | -158.2 | -3.2 | 0 | 0 | 122.2 | ||||
| 156 | P | 51.4 | Low | 39.1 | Very low | 116 Ų | 116 | 143.3 Ų | 143.3 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | cis | -132.2 | 174.4 | -35.5 | 36.4 | -19.7 | 0 | 0 | 0 | 114.4 | ||||
| 157 | G | 33 | Very low | 38.9 | Very low | 79 Ų | 79 | 145 Ų | 145 | 81% | 0.814 | 82% | 0.815 | S | S | * | * | trans | -175.5 | 141.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 158 | A | 35.3 | Very low | 38.7 | Very low | 89 Ų | 89 | 145.8 Ų | 145.8 | 74% | 0.736 | 81% | 0.813 | S | S | * | * | trans | -66.9 | 140.1 | -171.4 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 159 | L | 34.1 | Very low | 38.6 | Very low | 159 Ų | 159 | 144 Ų | 144 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | 73.1 | 120.7 | 94.5 | -66.2 | 169.7 | 0 | 0 | 0 | 118.9 | |||||
| 160 | H | 37.7 | Very low | 38.5 | Very low | 182 Ų | 182 | 143.2 Ų | 143.2 | 84% | 0.843 | 80% | 0.796 | S | S | * | * | -171.6 | 166.8 | 124.3 | -122.9 | -104.4 | 0 | 0 | 0 | 116.6 | |||||
| 161 | H | 37 | Very low | 38.6 | Very low | 181 Ų | 181 | 144.9 Ų | 144.9 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | -90.8 | 173.8 | 169.4 | -64 | 40.3 | 0 | 0 | 0 | 110.7 | ||||
| 162 | G | 30.3 | Very low | 38.4 | Very low | 70 Ų | 70 | 140.1 Ų | 140.1 | 72% | 0.722 | 79% | 0.792 | S | S | * | * | cis | 144.5 | 135.9 | -5.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 163 | M | 41.1 | Very low | 38.3 | Very low | 188 Ų | 188 | 138.5 Ų | 138.5 | 93% | 0.926 | 79% | 0.793 | S | S | * | * | trans | 59.3 | 113.2 | 163 | -63.2 | -70 | -171 | 0 | 0 | 122.4 | ||||
| 164 | R | 35.8 | Very low | 38.6 | Very low | 247 Ų | 247 | 142.6 Ų | 142.6 | 93% | 0.932 | 80% | 0.799 | S | S | * | * | 155.8 | 146.5 | 122.9 | -90.6 | -179.7 | 155.1 | 176.8 | -8.3 | 117.8 | |||||
| 165 | D | 34.5 | Very low | 37.5 | Very low | 152 Ų | 152 | 143.7 Ų | 143.7 | 81% | 0.813 | 80% | 0.799 | S | S | * | * | trans | -63.3 | -179.7 | 166.7 | -71.6 | -85.6 | 0 | 0 | 0 | 115.8 | ||||
| 166 | P | 54.6 | Low | 37.5 | Very low | 108 Ų | 108 | 141 Ų | 141 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | cis | -156.6 | -172.7 | 27.1 | 46.8 | -24.7 | 0 | 0 | 0 | 122.2 | ||||
| 167 | L | 36.7 | Very low | 36.9 | Very low | 156 Ų | 156 | 142.3 Ų | 142.3 | 82% | 0.817 | 79% | 0.787 | S | S | * | * | trans | 108.6 | 145.6 | 143.4 | -80.3 | 169.3 | 0 | 0 | 0 | 124.3 | ||||
| 168 | H | 39.4 | Very low | 37.2 | Very low | 170 Ų | 170 | 145.9 Ų | 145.9 | 79% | 0.787 | 78% | 0.784 | S | S | * | * | trans | 66.3 | 132.2 | 176.5 | -72.3 | 150.6 | 0 | 0 | 0 | 118.5 | ||||
| 169 | D | 34.2 | Very low | 37.1 | Very low | 145 Ų | 145 | 149.5 Ų | 149.5 | 78% | 0.775 | 79% | 0.785 | S | S | * | * | cis | 81.2 | 140.2 | 15 | -140.4 | -145.8 | 0 | 0 | 0 | 115.1 | ||||
| 170 | E | 36.4 | Very low | 37.1 | Very low | 141 Ų | 141 | 146.2 Ų | 146.2 | 66% | 0.659 | 78% | 0.776 | S | S | * | * | cis | -153.5 | -179.4 | 19.1 | -157.9 | -102.9 | 108.6 | 0 | 0 | 112 | ||||
| 171 | T | 36 | Very low | 37.8 | Very low | 122 Ų | 122 | 143.3 Ų | 143.3 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | trans | 68.3 | 149.2 | 174.7 | 71.2 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 172 | G | 32.9 | Very low | 38 | Very low | 69 Ų | 69 | 143.2 Ų | 143.2 | 71% | 0.711 | 77% | 0.773 | S | S | * | * | cis | 166.8 | 140 | -11.2 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 173 | S | 33.8 | Very low | 38.2 | Very low | 119 Ų | 119 | 149.3 Ų | 149.3 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | trans | 68 | 112.2 | 162.6 | -59.7 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 174 | H | 40.4 | Very low | 38 | Very low | 198 Ų | 198 | 144.8 Ų | 144.8 | 92% | 0.917 | 78% | 0.776 | S | S | * | * | -168.3 | 136.4 | 111.5 | -115.4 | -78.4 | 0 | 0 | 0 | 112 | |||||
| 175 | D | 35.9 | Very low | 38.3 | Very low | 141 Ų | 141 | 142.8 Ų | 142.8 | 75% | 0.754 | 77% | 0.774 | S | S | * | * | trans | -135.5 | 146 | 176.2 | -178.4 | -82.6 | 0 | 0 | 0 | 110.1 | ||||
| 176 | N | 36.2 | Very low | 38.3 | Very low | 129 Ų | 129 | 141.1 Ų | 141.1 | 69% | 0.69 | 77% | 0.774 | S | S | * | * | trans | -169.1 | 115.5 | 145.7 | -143.1 | 28.2 | 0 | 0 | 0 | 112.7 | ||||
| 177 | Q | 39.3 | Very low | 37.6 | Very low | 144 Ų | 144 | 143.6 Ų | 143.6 | 67% | 0.673 | 78% | 0.776 | S | S | * | * | trans | 48.4 | 148.1 | 135.5 | -63.6 | 179.7 | 17.2 | 0 | 0 | 121.3 | ||||
| 178 | M | 39.1 | Very low | 38 | Very low | 153 Ų | 153 | 144.9 Ų | 144.9 | 75% | 0.754 | 78% | 0.778 | S | S | * | * | cis | -159.2 | 167 | 11.4 | -154.7 | 51.6 | 152.4 | 0 | 0 | 112.9 | ||||
| 179 | E | 34.4 | Very low | 38 | Very low | 165 Ų | 165 | 144.4 Ų | 144.4 | 77% | 0.771 | 78% | 0.776 | S | S | * | * | trans | -40.7 | 169.7 | 159.8 | -88.8 | -169.9 | 58.7 | 0 | 0 | 117.6 | ||||
| 180 | S | 34.1 | Very low | 38.1 | Very low | 90 Ų | 90 | 143.5 Ų | 143.5 | 63% | 0.629 | 77% | 0.771 | S | S | * | * | cis | -174.1 | -171.6 | 2.2 | -113.3 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 181 | P | 51.2 | Low | 38.4 | Very low | 122 Ų | 122 | 146.3 Ų | 146.3 | 79% | 0.792 | 78% | 0.784 | S | S | * | * | cis | -129.9 | -164.3 | -35.4 | 36.9 | -17.4 | 0 | 0 | 0 | 113.1 | ||||
| 182 | Q | 42.4 | Very low | 38.8 | Very low | 178 Ų | 178 | 143.8 Ų | 143.8 | 83% | 0.832 | 77% | 0.771 | S | S | * | * | trans | -77.3 | 148.7 | -163.1 | -61.1 | 158.3 | -23.7 | 0 | 0 | 118.6 | ||||
| 183 | Q | 34.6 | Very low | 39.3 | Very low | 198 Ų | 198 | 148.3 Ų | 148.3 | 93% | 0.925 | 78% | 0.779 | S | S | * | * | trans | -175.6 | 154.7 | 144 | -102.7 | 148.2 | 104.6 | 0 | 0 | 108.8 | ||||
| 184 | A | 36.3 | Very low | 40 | Very low | 94 Ų | 94 | 150.3 Ų | 150.3 | 78% | 0.777 | 78% | 0.775 | S | S | * | * | cis | -150 | -165.6 | -4.7 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 185 | F | 42 | Very low | 40.9 | Very low | 205 Ų | 205 | 148.7 Ų | 148.7 | 90% | 0.899 | 77% | 0.773 | S | S | * | * | trans | -77.4 | 136.2 | -178.1 | -68.4 | -97.2 | 0 | 0 | 0 | 115.4 | ||||
| 186 | S | 34.1 | Very low | 42.1 | Very low | 117 Ų | 117 | 145.4 Ų | 145.4 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | trans | -170.8 | 160.5 | 134.6 | -86.8 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 187 | H | 39.5 | Very low | 43.7 | Very low | 159 Ų | 159 | 141 Ų | 141 | 74% | 0.736 | 74% | 0.744 | S | S | * | * | trans | -13.5 | 130.1 | 174.8 | -78.6 | 68.9 | 0 | 0 | 0 | 116.8 | ||||
| 188 | H | 45.5 | Very low | 45.8 | Very low | 184 Ų | 184 | 136.4 Ų | 136.4 | 85% | 0.852 | 73% | 0.728 | S | S | * | * | cis | 50.2 | 68.4 | 40.1 | -90.6 | 70.5 | 0 | 0 | 0 | 113.5 | ||||
| 189 | Q | 39.8 | Very low | 48 | Very low | 159 Ų | 159 | 132.8 Ų | 132.8 | 74% | 0.743 | 72% | 0.718 | S | S | * | * | trans | -140.2 | 120.7 | 147 | -156.9 | 75.6 | 51 | 0 | 0 | 109.6 | ||||
| 190 | D | 35.4 | Very low | 50.6 | Low | 127 Ų | 127 | 129.9 Ų | 129.9 | 68% | 0.679 | 71% | 0.707 | S | S | * | * | trans | -63.5 | 126.2 | -177.1 | -167 | -112.8 | 0 | 0 | 0 | 112.2 | S192 | D190-S192 PolarHBondContact O-N 3.36Å; D190-S192 WeakPolarHBondContact OD1-CB 3.26Å; D190-S192 PolarHBondContact OD1-OG 3.44Å | ||
| 191 | H | 42.5 | Very low | 53.4 | Low | 199 Ų | 199 | 127.9 Ų | 127.9 | 92% | 0.921 | 69% | 0.69 | S | S | * | * | trans | -90.3 | 69 | 176.7 | -81.4 | -61.3 | 0 | 0 | 0 | 111.2 | ||||
| 192 | S | 45.7 | Very low | 55.4 | Low | 70 Ų | 70 | 122.3 Ų | 122.3 | 49% | 0.49 | 65% | 0.653 | S | S | . | * | trans | -107.5 | 125.7 | 180 | -73.9 | 0 | 0 | 0 | 0 | 114 | D190 E194 | D190-S192 PolarHBondContact O-N 3.36Å; D190-S192 WeakPolarHBondContact OD1-CB 3.26Å; D190-S192 PolarHBondContact OD1-OG 3.44Å; S192-E194 VanDerWaalsContact C-N 3.31Å; S192-E194 PolarHBondContact O-N 3.07Å | ||
| 193 | D | 43.1 | Very low | 57.9 | Low | 164 Ų | 164 | 116.8 Ų | 116.8 | 88% | 0.877 | 63% | 0.628 | S | S | * | * | trans | 47.6 | 21.9 | 148.7 | -87.2 | -56.1 | 0 | 0 | 0 | 120.8 | D195 | D193-D195 PolarHBondContact O-N 3.29Š| ||
| 194 | E | 48 | Very low | 60.8 | Low | 161 Ų | 161 | 113.2 Ų | 113.2 | 75% | 0.752 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.3 | 34.1 | -179.1 | -101 | -84.2 | 96.8 | 0 | 0 | 116 | S192 | S192-E194 VanDerWaalsContact C-N 3.31Å; S192-E194 PolarHBondContact O-N 3.07Å |
| 195 | D | 60.2 | Low | 63.7 | Low | 163 Ų | 163 | 109.3 Ų | 109.3 | 87% | 0.872 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.4 | 0.5 | 177 | -128.3 | -31.7 | 0 | 0 | 0 | 113 | D193 | D193-D195 PolarHBondContact O-N 3.29Š|
| 196 | A | 60 | Low | 66.4 | Low | 72 Ų | 72 | 99.7 Ų | 99.7 | 60% | 0.595 | 54% | 0.535 | S | S | * | . | S | Bend | trans | -119.1 | 103.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | S198 | A196-S198 PolarHBondContact O-N 3.19Š|
| 197 | P | 71.6 | Confident | 69.3 | Low | 37 Ų | 37 | 100 Ų | 100 | 24% | 0.24 | 52% | 0.521 | C | S | . | . | trans | -62.4 | 133 | -170.9 | 24.5 | -34.9 | 0 | 0 | 0 | 112.7 | D201 F250 K257 | P197-D201 WeakPolarHBondContact CA-OD2 3.21Å; P197-D201 HydrophobicContact CB-CB 4.35Å; P197-F250 WeakPolarHBondContact O-CZ 3.3Å; P197-K257 HydrophobicContact CB-CD 4.11Å; P197-K257 VanDerWaalsContact CB-NZ 3.32Å; P197-K257 HydrophobicContact CG-CD 4.14Å | ||
| 198 | S | 82.6 | Confident | 72 | Confident | 47 Ų | 47 | 96.2 Ų | 96.2 | 33% | 0.329 | 50% | 0.504 | S | S | . | . | trans | -63.1 | 163.6 | -176.7 | -176.7 | 0 | 0 | 0 | 0 | 112.9 | A196 D200 D201 L202 | A196-S198 PolarHBondContact O-N 3.19Å; S198-D200 PolarHBondContact O-N 2.82Å; S198-D200 PolarHBondContact OG-N 2.92Å; S198-D201 PolarHBondContact N-OD2 3.33Å; S198-D201 PolarHBondContact O-N 3.18Å; S198-L202 PolarHBondContact O-N 3.44Å | ||
| 199 | S | 85.6 | Confident | 74.5 | Confident | 78 Ų | 78 | 87.4 Ų | 87.4 | 55% | 0.545 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -57.6 | -40.1 | 170.1 | -169.9 | 0 | 0 | 0 | 0 | 111.2 | L202 E203 | S199-L202 PolarHBondContact O-N 2.94Å; S199-E203 PolarHBondContact O-N 3.11Å; S199-E203 VanDerWaalsContact O-N 3.09Å |
| 200 | D | 88.9 | Confident | 77.2 | Confident | 103 Ų | 103 | 84.3 Ų | 84.3 | 55% | 0.551 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -68.8 | -37.4 | 179.1 | -60.1 | -76.7 | 0 | 0 | 0 | 112 | S198 L202 E203 Q204 | S198-D200 PolarHBondContact O-N 2.82Å; S198-D200 PolarHBondContact OG-N 2.92Å; D200-L202 VanDerWaalsContact C-N 3.26Å; D200-L202 PolarHBondContact O-N 3.46Å; D200-E203 PolarHBondContact O-N 3.38Å; D200-Q204 WeakPolarHBondContact O-CB 3.31Å; D200-Q204 VanDerWaalsContact O-CG 3.29Å; D200-Q204 WeakPolarHBondContact O-CG 3.36Å; D200-Q204 PolarHBondContact O-N 2.85Å; D200-Q204 PolarHBondContact O-NE2 3.39Å |
| 201 | D | 92.7 | Very high | 80 | Confident | 49 Ų | 49 | 85 Ų | 85 | 26% | 0.262 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -64.1 | -33.7 | 174.5 | -50.9 | -17.4 | 0 | 0 | 0 | 112.1 | P197 S198 F205 | P197-D201 WeakPolarHBondContact CA-OD2 3.21Å; P197-D201 HydrophobicContact CB-CB 4.35Å; S198-D201 PolarHBondContact N-OD2 3.33Å; S198-D201 PolarHBondContact O-N 3.18Å; D201-F205 WeakPolarHBondContact O-CB 3.36Å; D201-F205 PolarHBondContact O-N 3.26Å |
| 202 | L | 93.8 | Very high | 82.4 | Confident | 5 Ų | 5 | 79.4 Ų | 79.4 | 3% | 0.026 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -72.2 | -35.7 | 176.4 | -75.2 | 171.8 | 0 | 0 | 0 | 111.3 | S198 S199 D200 A206 F250 M253 K257 | S198-L202 PolarHBondContact O-N 3.44Å; S199-L202 PolarHBondContact O-N 2.94Å; D200-L202 VanDerWaalsContact C-N 3.26Å; D200-L202 PolarHBondContact O-N 3.46Å; L202-A206 WeakPolarHBondContact O-CB 3.36Å; L202-A206 PolarHBondContact O-N 3.24Å; L202-F250 HydrophobicContact CD1-CD2 3.77Å; L202-F250 HydrophobicContact CD1-CE2 3.6Å; L202-F250 HydrophobicContact CD1-CZ 4.38Å; L202-M253 HydrophobicContact CD1-CB 3.73Å; L202-M253 HydrophobicContact CD2-CB 4.06Å; L202-M253 HydrophobicContact CG-CB 4.45Å; L202-K257 HydrophobicContact CD2-CB 3.93Å; L202-K257 HydrophobicContact CD2-CD 3.77Å; L202-K257 HydrophobicContact CD2-CG 4.04Å |
| 203 | E | 94.9 | Very high | 84.8 | Confident | 62 Ų | 62 | 77 Ų | 77 | 29% | 0.29 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -67.6 | -47.4 | 171.6 | 177.2 | 156.7 | 161.1 | 0 | 0 | 111.8 | S199 D200 A206 K207 L246 | S199-E203 PolarHBondContact O-N 3.11Å; S199-E203 VanDerWaalsContact O-N 3.09Å; D200-E203 PolarHBondContact O-N 3.38Å; E203-A206 PolarHBondContact O-N 3.16Å; E203-K207 HydrophobicContact CG-CD 4.14Å; E203-K207 VanDerWaalsContact CG-CE 3.47Å; E203-K207 VanDerWaalsContact O-CG 3.3Å; E203-K207 WeakPolarHBondContact O-CG 3.48Å; E203-K207 PolarHBondContact O-N 3.43Å; E203-K207 WeakPolarHBondContact OE1-CE 3.46Å; E203-K207 IonicContact OE1-NZ 2.71Å; E203-K207 PolarHBondContact OE1-NZ 2.6Å; E203-L246 HydrophobicContact CB-CD1 3.82Å; E203-L246 HydrophobicContact CG-CD1 3.85Å |
| 204 | Q | 95.8 | Very high | 87.1 | Confident | 123 Ų | 123 | 73.9 Ų | 73.9 | 58% | 0.575 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -59 | -48.3 | 175.2 | -71.7 | 177.5 | 70.4 | 0 | 0 | 111.5 | D200 K207 Q208 | D200-Q204 WeakPolarHBondContact O-CB 3.31Å; D200-Q204 VanDerWaalsContact O-CG 3.29Å; D200-Q204 WeakPolarHBondContact O-CG 3.36Å; D200-Q204 PolarHBondContact O-N 2.85Å; D200-Q204 PolarHBondContact O-NE2 3.39Å; Q204-K207 PolarHBondContact O-N 3.09Å; Q204-Q208 WeakPolarHBondContact O-CB 3.45Å; Q204-Q208 PolarHBondContact O-N 2.78Å |
| 205 | F | 96.7 | Very high | 89.2 | Confident | 11 Ų | 11 | 75.1 Ų | 75.1 | 5% | 0.048 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.3 | -44.2 | 177.4 | 178 | -94.7 | 0 | 0 | 0 | 112 | D201 K207 Q208 F209 F243 K257 L260 N261 | D201-F205 WeakPolarHBondContact O-CB 3.36Å; D201-F205 PolarHBondContact O-N 3.26Å; F205-K207 VanDerWaalsContact C-N 3.31Å; F205-K207 PolarHBondContact O-N 3.24Å; F205-Q208 PolarHBondContact O-N 3.37Å; F205-F209 HydrophobicContact CE1-CB 4.13Å; F205-F209 HydrophobicContact CE1-CD2 4.42Å; F205-F209 HydrophobicContact CE1-CG 4.43Å; F205-F209 HydrophobicContact CZ-CB 4.2Å; F205-F209 HydrophobicContact CZ-CD2 4.1Å; F205-F209 HydrophobicContact CZ-CG 4.46Å; F205-F209 WeakPolarHBondContact O-CB 3.49Å; F205-F209 PolarHBondContact O-N 3.14Å; F205-F243 AromaticContact CD1-CE1 3.63Å; F205-F243 HydrophobicContact CD1-CE1 3.63Å; F205-F243 AromaticContact CD1-CZ 3.57Å; F205-F243 HydrophobicContact CD1-CZ 3.57Å; F205-F243 AromaticContact CE1-CE1 3.55Å; F205-F243 HydrophobicContact CE1-CE1 3.55Å; F205-F243 AromaticContact CE1-CZ 3.56Å; F205-F243 HydrophobicContact CE1-CZ 3.56Å; F205-K257 HydrophobicContact CD1-CG 3.85Å; F205-K257 HydrophobicContact CD2-CG 4.39Å; F205-K257 HydrophobicContact CE1-CG 4.13Å; F205-K257 HydrophobicContact CG-CG 3.99Å; F205-L260 HydrophobicContact CE1-CB 3.91Å; F205-L260 HydrophobicContact CZ-CB 3.84Å; F205-N261 HydrophobicContact CE2-CB 3.7Å; F205-N261 WeakPolarHBondContact CE2-OD1 3.18Å; F205-N261 HydrophobicContact CZ-CB 3.89Å |
| 206 | A | 97.2 | Very high | 90.5 | Very high | 3 Ų | 3 | 69.7 Ų | 69.7 | 3% | 0.025 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -62.1 | -38.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | L202 E203 K210 F243 L246 | L202-A206 WeakPolarHBondContact O-CB 3.36Å; L202-A206 PolarHBondContact O-N 3.24Å; E203-A206 PolarHBondContact O-N 3.16Å; A206-K210 VanDerWaalsContact O-CB 3.24Å; A206-K210 WeakPolarHBondContact O-CB 3.15Å; A206-K210 PolarHBondContact O-N 2.99Å; A206-K210 VanDerWaalsContact O-N 3.08Å; A206-F243 HydrophobicContact CB-CD1 4.45Å; A206-F243 HydrophobicContact CB-CE1 4.17Å; A206-L246 HydrophobicContact CB-CD2 3.64Å |
| 207 | K | 96.5 | Very high | 91.8 | Very high | 124 Ų | 124 | 69.3 Ų | 69.3 | 54% | 0.539 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.7 | -52.2 | 172.9 | -71.6 | 168.8 | -177.2 | 170.2 | 0 | 111.6 | E203 Q204 F205 K210 Q211 | E203-K207 HydrophobicContact CG-CD 4.14Å; E203-K207 VanDerWaalsContact CG-CE 3.47Å; E203-K207 VanDerWaalsContact O-CG 3.3Å; E203-K207 WeakPolarHBondContact O-CG 3.48Å; E203-K207 PolarHBondContact O-N 3.43Å; E203-K207 WeakPolarHBondContact OE1-CE 3.46Å; E203-K207 IonicContact OE1-NZ 2.71Å; E203-K207 PolarHBondContact OE1-NZ 2.6Å; Q204-K207 PolarHBondContact O-N 3.09Å; F205-K207 VanDerWaalsContact C-N 3.31Å; F205-K207 PolarHBondContact O-N 3.24Å; K207-K210 PolarHBondContact O-N 3.15Å; K207-Q211 WeakPolarHBondContact O-CB 3.37Å; K207-Q211 PolarHBondContact O-N 3.48Å |
| 208 | Q | 96.1 | Very high | 92.6 | Very high | 79 Ų | 79 | 69.1 Ų | 69.1 | 37% | 0.369 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -61.3 | -47.1 | -179.5 | -174.2 | -170.3 | 87 | 0 | 0 | 111.7 | Q204 F205 K210 Q211 R212 | Q204-Q208 WeakPolarHBondContact O-CB 3.45Å; Q204-Q208 PolarHBondContact O-N 2.78Å; F205-Q208 PolarHBondContact O-N 3.37Å; Q208-K210 PolarHBondContact O-N 2.84Å; Q208-Q211 PolarHBondContact O-N 2.7Å; Q208-R212 PolarHBondContact O-N 3.16Å |
| 209 | F | 96.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 70.1 Ų | 70.1 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -56.1 | -50.4 | 176.6 | 175.8 | -89 | 0 | 0 | 0 | 111.3 | F205 Q211 R212 R213 V223 I240 E244 L260 W263 L264 | F205-F209 HydrophobicContact CE1-CB 4.13Å; F205-F209 HydrophobicContact CE1-CD2 4.42Å; F205-F209 HydrophobicContact CE1-CG 4.43Å; F205-F209 HydrophobicContact CZ-CB 4.2Å; F205-F209 HydrophobicContact CZ-CD2 4.1Å; F205-F209 HydrophobicContact CZ-CG 4.46Å; F205-F209 WeakPolarHBondContact O-CB 3.49Å; F205-F209 PolarHBondContact O-N 3.14Å; F209-Q211 VanDerWaalsContact C-N 3.34Å; F209-Q211 PolarHBondContact O-N 3.35Å; F209-R212 PolarHBondContact O-N 2.96Å; F209-R213 VanDerWaalsContact O-CB 3.31Å; F209-R213 WeakPolarHBondContact O-CB 3.26Å; F209-R213 PolarHBondContact O-N 3.28Å; F209-V223 HydrophobicContact CZ-CG1 3.88Å; F209-V223 HydrophobicContact CZ-CG2 4.3Å; F209-I240 HydrophobicContact CE1-CG2 4.01Å; F209-E244 HydrophobicContact CD1-CG 4.3Å; F209-E244 HydrophobicContact CE1-CG 4.49Å; F209-L260 HydrophobicContact CD2-CB 3.98Å; F209-L260 HydrophobicContact CD2-CD2 4.48Å; F209-L260 HydrophobicContact CE1-CD2 4.24Å; F209-L260 HydrophobicContact CE2-CB 3.84Å; F209-L260 HydrophobicContact CE2-CD2 3.68Å; F209-L260 HydrophobicContact CE2-CG 4.31Å; F209-L260 HydrophobicContact CZ-CD2 3.57Å; F209-W263 AromaticContact CE2-CE3 3.72Å; F209-W263 HydrophobicContact CE2-CE3 3.72Å; F209-W263 AromaticContact CE2-CZ3 3.8Å; F209-W263 HydrophobicContact CE2-CZ3 3.8Å; F209-W263 HydrophobicContact CZ-CE3 4.21Å; F209-W263 HydrophobicContact CZ-CZ3 4.04Å; F209-L264 HydrophobicContact CD2-CD1 4.12Å; F209-L264 HydrophobicContact CD2-CD2 4.26Å; F209-L264 HydrophobicContact CE2-CD1 4.29Å |
| 210 | K | 96.7 | Very high | 93.5 | Very high | 93 Ų | 93 | 68 Ų | 68 | 40% | 0.404 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -59.6 | -44.6 | 177.6 | -176.5 | -179.7 | -174.5 | -176.6 | 0 | 111.5 | A206 K207 Q208 I214 E244 | A206-K210 VanDerWaalsContact O-CB 3.24Å; A206-K210 WeakPolarHBondContact O-CB 3.15Å; A206-K210 PolarHBondContact O-N 2.99Å; A206-K210 VanDerWaalsContact O-N 3.08Å; K207-K210 PolarHBondContact O-N 3.15Å; Q208-K210 PolarHBondContact O-N 2.84Å; K210-I214 HydrophobicContact CG-CD1 3.93Å; K210-I214 WeakPolarHBondContact O-CD1 3.35Å; K210-I214 VanDerWaalsContact O-CG1 3.25Å; K210-I214 WeakPolarHBondContact O-CG1 3.42Å; K210-I214 PolarHBondContact O-N 3.4Å; K210-I214 VanDerWaalsContact O-N 3.09Å; K210-E244 HydrophobicContact CB-CG 4.03Å; K210-E244 HydrophobicContact CD-CB 4.27Å; K210-E244 HydrophobicContact CD-CG 4.45Å; K210-E244 HydrophobicContact CG-CG 4.2Å |
| 211 | Q | 95.4 | Very high | 93.6 | Very high | 141 Ų | 141 | 65.1 Ų | 65.1 | 66% | 0.659 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -63.8 | -49.5 | 179.8 | -172.3 | -175.8 | 13.9 | 0 | 0 | 111.7 | K207 Q208 F209 I214 K215 | K207-Q211 WeakPolarHBondContact O-CB 3.37Å; K207-Q211 PolarHBondContact O-N 3.48Å; Q208-Q211 PolarHBondContact O-N 2.7Å; F209-Q211 VanDerWaalsContact C-N 3.34Å; F209-Q211 PolarHBondContact O-N 3.35Å; Q211-I214 PolarHBondContact O-N 2.98Å; Q211-K215 WeakPolarHBondContact O-CB 3.47Å; Q211-K215 PolarHBondContact O-N 2.82Å |
| 212 | R | 93.3 | Very high | 93.5 | Very high | 82 Ų | 82 | 65.3 Ų | 65.3 | 31% | 0.309 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -64.5 | -44.6 | 177.8 | -72.5 | -157.8 | -159.2 | 148.3 | 7.9 | 111.7 | Q208 F209 I214 K215 L216 L264 D268 | Q208-R212 PolarHBondContact O-N 3.16Å; F209-R212 PolarHBondContact O-N 2.96Å; R212-I214 VanDerWaalsContact C-N 3.3Å; R212-I214 PolarHBondContact O-N 3.45Å; R212-K215 PolarHBondContact O-N 3.12Å; R212-K215 VanDerWaalsContact O-N 3.14Å; R212-L216 HydrophobicContact CB-CD1 4.49Å; R212-L216 WeakPolarHBondContact O-CB 3.33Å; R212-L216 WeakPolarHBondContact O-CD1 3.28Å; R212-L216 VanDerWaalsContact O-CG 3.24Å; R212-L216 WeakPolarHBondContact O-CG 3.17Å; R212-L216 PolarHBondContact O-N 2.99Å; R212-L264 HydrophobicContact CB-CD1 3.81Å; R212-L264 HydrophobicContact CB-CD2 4.32Å; R212-L264 HydrophobicContact CB-CG 4.39Å; R212-D268 WeakPolarHBondContact CD-OD2 3.39Å; R212-D268 IonicContact CZ-OD2 3.2Å; R212-D268 IonicContact NE-OD2 3.86Å; R212-D268 IonicContact NH1-OD2 2.68Å; R212-D268 PolarHBondContact NH1-OD2 3.37Å |
| 213 | R | 94.3 | Very high | 93.4 | Very high | 21 Ų | 21 | 65 Ų | 65 | 8% | 0.079 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -52.8 | -47.6 | 175 | -175.5 | -169.1 | 55.6 | 67.8 | -2.8 | 111.8 | F209 L216 G217 F218 V223 E244 | F209-R213 VanDerWaalsContact O-CB 3.31Å; F209-R213 WeakPolarHBondContact O-CB 3.26Å; F209-R213 PolarHBondContact O-N 3.28Å; R213-L216 PolarHBondContact O-N 3.08Å; R213-G217 PolarHBondContact O-N 2.82Å; R213-F218 HydrophobicContact CG-CB 3.72Å; R213-F218 WeakPolarHBondContact CG-O 3.27Å; R213-F218 PolarHBondContact NH1-O 3.02Å; R213-F218 PolarHBondContact O-N 2.97Å; R213-F218 VanDerWaalsContact O-N 3.16Å; R213-V223 VanDerWaalsContact CD-CG2 3.47Å; R213-V223 HydrophobicContact CG-CG2 3.83Å; R213-E244 IonicContact CZ-OE1 3.27Å; R213-E244 IonicContact NE-OE1 3.7Å; R213-E244 PolarHBondContact NE-OE1 2.91Å; R213-E244 IonicContact NH2-OE1 2.7Å; R213-E244 PolarHBondContact NH2-OE1 3.13Å; R213-E244 IonicContact NH2-OE2 3.02Å; R213-E244 PolarHBondContact NH2-OE2 3.5Å |
| 214 | I | 92.5 | Very high | 93.2 | Very high | 98 Ų | 98 | 62.1 Ų | 62.1 | 50% | 0.503 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -67.3 | -43.3 | 179 | -67.1 | 167.8 | 0 | 0 | 0 | 111.1 | K210 Q211 R212 L216 G217 | K210-I214 HydrophobicContact CG-CD1 3.93Å; K210-I214 WeakPolarHBondContact O-CD1 3.35Å; K210-I214 VanDerWaalsContact O-CG1 3.25Å; K210-I214 WeakPolarHBondContact O-CG1 3.42Å; K210-I214 PolarHBondContact O-N 3.4Å; K210-I214 VanDerWaalsContact O-N 3.09Å; Q211-I214 PolarHBondContact O-N 2.98Å; R212-I214 VanDerWaalsContact C-N 3.3Å; R212-I214 PolarHBondContact O-N 3.45Å; I214-L216 PolarHBondContact O-N 3.03Å; I214-G217 PolarHBondContact O-N 3.17Å |
| 215 | K | 91.6 | Very high | 92.8 | Very high | 187 Ų | 187 | 59.6 Ų | 59.6 | 81% | 0.813 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -59.6 | -33.7 | 176.3 | -173.8 | -175.7 | 176.7 | -171 | 0 | 112.6 | Q211 R212 G217 | Q211-K215 WeakPolarHBondContact O-CB 3.47Å; Q211-K215 PolarHBondContact O-N 2.82Å; R212-K215 PolarHBondContact O-N 3.12Å; R212-K215 VanDerWaalsContact O-N 3.14Å; K215-G217 VanDerWaalsContact C-N 3.32Å |
| 216 | L | 87.3 | Confident | 92.2 | Very high | 48 Ų | 48 | 59.4 Ų | 59.4 | 25% | 0.251 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | 3.7 | 177.7 | -65.1 | 164.6 | 0 | 0 | 0 | 113.4 | R212 R213 I214 F218 T267 T271 | R212-L216 HydrophobicContact CB-CD1 4.49Å; R212-L216 WeakPolarHBondContact O-CB 3.33Å; R212-L216 WeakPolarHBondContact O-CD1 3.28Å; R212-L216 VanDerWaalsContact O-CG 3.24Å; R212-L216 WeakPolarHBondContact O-CG 3.17Å; R212-L216 PolarHBondContact O-N 2.99Å; R213-L216 PolarHBondContact O-N 3.08Å; I214-L216 PolarHBondContact O-N 3.03Å; L216-F218 HydrophobicContact CB-CD2 3.72Å; L216-F218 HydrophobicContact CB-CE2 4.13Å; L216-F218 PolarHBondContact O-N 3.17Å; L216-T267 HydrophobicContact CD1-CG2 3.86Å; L216-T271 HydrophobicContact CD2-CG2 3.58Å |
| 217 | G | 87.8 | Confident | 91.8 | Very high | 65 Ų | 65 | 59.3 Ų | 59.3 | 67% | 0.67 | 30% | 0.303 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.9 | -5.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | R213 I214 K215 | R213-G217 PolarHBondContact O-N 2.82Å; I214-G217 PolarHBondContact O-N 3.17Å; K215-G217 VanDerWaalsContact C-N 3.32Å |
| 218 | F | 89.3 | Confident | 91.3 | Very high | 32 Ų | 32 | 53.9 Ų | 53.9 | 14% | 0.14 | 28% | 0.283 | C | S | . | . | trans | -68.2 | 137.2 | -177 | -76.5 | -77.8 | 0 | 0 | 0 | 113 | R213 L216 D222 V223 W263 T267 L277 | R213-F218 HydrophobicContact CG-CB 3.72Å; R213-F218 WeakPolarHBondContact CG-O 3.27Å; R213-F218 PolarHBondContact NH1-O 3.02Å; R213-F218 PolarHBondContact O-N 2.97Å; R213-F218 VanDerWaalsContact O-N 3.16Å; L216-F218 HydrophobicContact CB-CD2 3.72Å; L216-F218 HydrophobicContact CB-CE2 4.13Å; L216-F218 PolarHBondContact O-N 3.17Å; F218-D222 HydrophobicContact CD1-CB 3.83Å; F218-V223 HydrophobicContact CB-CG2 4.37Å; F218-W263 HydrophobicContact CB-CH2 4.37Å; F218-W263 HydrophobicContact CD1-CZ2 4.22Å; F218-W263 AromaticContact CD2-CH2 3.86Å; F218-W263 HydrophobicContact CD2-CH2 3.86Å; F218-W263 AromaticContact CD2-CZ2 3.9Å; F218-W263 HydrophobicContact CD2-CZ2 3.9Å; F218-W263 HydrophobicContact CE1-CZ2 4.31Å; F218-W263 HydrophobicContact CE2-CH2 4.32Å; F218-W263 HydrophobicContact CE2-CZ2 4.01Å; F218-W263 HydrophobicContact CG-CH2 4.08Å; F218-W263 AromaticContact CG-CZ2 4Å; F218-W263 HydrophobicContact CG-CZ2 4Å; F218-W263 HydrophobicContact CZ-CZ2 4.19Å; F218-T267 HydrophobicContact CD2-CG2 4.38Å; F218-T267 HydrophobicContact CE2-CG2 3.51Å; F218-T267 HydrophobicContact CZ-CG2 4.12Å; F218-L277 HydrophobicContact CE2-CD2 4.04Å; F218-L277 HydrophobicContact CZ-CD1 3.95Å; F218-L277 HydrophobicContact CZ-CD2 3.7Å; F218-L277 HydrophobicContact CZ-CG 3.8Å | ||
| 219 | T | 93.6 | Very high | 90.6 | Very high | 69 Ų | 69 | 53.9 Ų | 53.9 | 42% | 0.423 | 29% | 0.288 | S | S | . | . | trans | -79.1 | 162.9 | 165.8 | 80.1 | 0 | 0 | 0 | 0 | 111.3 | A221 D222 V223 | T219-A221 PolarHBondContact O-N 3.37Å; T219-A221 PolarHBondContact OG1-N 2.92Å; T219-A221 VanDerWaalsContact OG1-N 3.15Å; T219-D222 WeakPolarHBondContact CA-OD2 3.42Å; T219-D222 WeakPolarHBondContact CB-OD2 3.44Å; T219-D222 VanDerWaalsContact CG2-OD2 3.3Å; T219-D222 WeakPolarHBondContact CG2-OD2 3.28Å; T219-D222 PolarHBondContact N-OD2 2.88Å; T219-D222 PolarHBondContact O-N 2.94Å; T219-D222 PolarHBondContact OG1-N 3.21Å; T219-D222 PolarHBondContact OG1-OD1 3.39Å; T219-D222 PolarHBondContact OG1-OD2 2.91Å; T219-V223 PolarHBondContact O-N 3.43Å | ||
| 220 | Q | 92.9 | Very high | 89.4 | Confident | 34 Ų | 34 | 57.4 Ų | 57.4 | 16% | 0.159 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.2 | -18.2 | 170.8 | -70.1 | 172.7 | -14.7 | 0 | 0 | 113.3 | Q237 I240 E244 | Q220-Q237 HydrophobicContact CB-CB 4.44Å; Q220-Q237 HydrophobicContact CB-CG 3.84Å; Q220-I240 HydrophobicContact CB-CB 4.16Å; Q220-I240 HydrophobicContact CB-CG2 4.19Å; Q220-I240 HydrophobicContact CG-CB 4.41Å; Q220-I240 HydrophobicContact CG-CG2 4.07Å; Q220-I240 WeakPolarHBondContact O-CG1 3.43Å; Q220-E244 PolarHBondContact NE2-OE2 3.3Å |
| 221 | A | 90 | Very high | 88.7 | Confident | 41 Ų | 41 | 56 Ų | 56 | 34% | 0.339 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -79.2 | -42.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | T219 G224 L225 Q237 | T219-A221 PolarHBondContact O-N 3.37Å; T219-A221 PolarHBondContact OG1-N 2.92Å; T219-A221 VanDerWaalsContact OG1-N 3.15Å; A221-G224 CarbonylContact O-C 3.56Å; A221-G224 WeakPolarHBondContact O-CA 3.44Å; A221-G224 PolarHBondContact O-N 2.92Å; A221-L225 WeakPolarHBondContact O-CG 3.41Å; A221-L225 PolarHBondContact O-N 2.79Å; A221-Q237 HydrophobicContact CB-CB 4.41Å |
| 222 | D | 90.6 | Very high | 87.8 | Confident | 53 Ų | 53 | 52.3 Ų | 52.3 | 28% | 0.283 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -66.1 | -41.2 | -176.4 | -48.1 | -41.2 | 0 | 0 | 0 | 111.6 | F218 T219 G224 L225 A226 | F218-D222 HydrophobicContact CD1-CB 3.83Å; T219-D222 WeakPolarHBondContact CA-OD2 3.42Å; T219-D222 WeakPolarHBondContact CB-OD2 3.44Å; T219-D222 VanDerWaalsContact CG2-OD2 3.3Å; T219-D222 WeakPolarHBondContact CG2-OD2 3.28Å; T219-D222 PolarHBondContact N-OD2 2.88Å; T219-D222 PolarHBondContact O-N 2.94Å; T219-D222 PolarHBondContact OG1-N 3.21Å; T219-D222 PolarHBondContact OG1-OD1 3.39Å; T219-D222 PolarHBondContact OG1-OD2 2.91Å; D222-G224 VanDerWaalsContact C-N 3.29Å; D222-G224 PolarHBondContact O-N 3.44Å; D222-L225 PolarHBondContact O-N 2.8Å; D222-A226 WeakPolarHBondContact O-CB 3.39Å; D222-A226 PolarHBondContact O-N 3.12Å |
| 223 | V | 92.1 | Very high | 87.2 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -54.2 | -47.7 | 168.2 | 172.9 | 0 | 0 | 0 | 0 | 111 | F209 R213 F218 T219 L225 A226 L227 I240 L260 W263 | F209-V223 HydrophobicContact CZ-CG1 3.88Å; F209-V223 HydrophobicContact CZ-CG2 4.3Å; R213-V223 VanDerWaalsContact CD-CG2 3.47Å; R213-V223 HydrophobicContact CG-CG2 3.83Å; F218-V223 HydrophobicContact CB-CG2 4.37Å; T219-V223 PolarHBondContact O-N 3.43Å; V223-L225 VanDerWaalsContact C-N 3.25Å; V223-L225 PolarHBondContact O-N 3.11Å; V223-A226 PolarHBondContact O-N 3.44Å; V223-L227 HydrophobicContact CG1-CD1 3.76Å; V223-L227 HydrophobicContact CG1-CG 4.3Å; V223-L227 WeakPolarHBondContact O-CB 3.29Å; V223-L227 VanDerWaalsContact O-CG 3.23Å; V223-L227 WeakPolarHBondContact O-CG 3.27Å; V223-L227 PolarHBondContact O-N 3.27Å; V223-I240 HydrophobicContact CB-CG1 4.43Å; V223-I240 HydrophobicContact CG1-CD1 3.81Å; V223-I240 HydrophobicContact CG1-CG1 4.12Å; V223-I240 HydrophobicContact CG1-CG2 4.37Å; V223-L260 HydrophobicContact CG1-CD2 4.05Å; V223-W263 HydrophobicContact CG2-CE3 4.47Å; V223-W263 HydrophobicContact CG2-CH2 3.57Å; V223-W263 HydrophobicContact CG2-CZ2 3.83Å; V223-W263 HydrophobicContact CG2-CZ3 3.91Å |
| 224 | G | 91.1 | Very high | 86.7 | Confident | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63.4 | -31.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | A221 D222 G228 V234 F235 | A221-G224 CarbonylContact O-C 3.56Å; A221-G224 WeakPolarHBondContact O-CA 3.44Å; A221-G224 PolarHBondContact O-N 2.92Å; D222-G224 VanDerWaalsContact C-N 3.29Å; D222-G224 PolarHBondContact O-N 3.44Å; G224-G228 PolarHBondContact O-N 3.19Å; G224-V234 WeakPolarHBondContact O-CA 3.46Å; G224-F235 CarbonylContact C-O 3.59Å; G224-F235 WeakPolarHBondContact CA-O 3.25Å; G224-F235 PolarHBondContact O-N 3.14Å |
| 225 | L | 86.3 | Confident | 86.6 | Confident | 70 Ų | 70 | 53 Ų | 53 | 37% | 0.366 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -75.8 | -49.5 | 174.1 | -68.5 | 168.3 | 0 | 0 | 0 | 111.9 | A221 D222 V223 L227 G228 T229 V234 | A221-L225 WeakPolarHBondContact O-CG 3.41Å; A221-L225 PolarHBondContact O-N 2.79Å; D222-L225 PolarHBondContact O-N 2.8Å; V223-L225 VanDerWaalsContact C-N 3.25Å; V223-L225 PolarHBondContact O-N 3.11Å; L225-L227 PolarHBondContact O-N 3.45Å; L225-G228 CarbonylContact O-C 3.57Å; L225-G228 VanDerWaalsContact O-CA 3.28Å; L225-G228 WeakPolarHBondContact O-CA 3.37Å; L225-G228 PolarHBondContact O-N 3.4Å; L225-T229 PolarHBondContact O-N 3Å; L225-T229 PolarHBondContact O-OG1 3Å; L225-V234 HydrophobicContact CD2-CG1 4.04Å |
| 226 | A | 86 | Confident | 86.4 | Confident | 7 Ų | 7 | 45 Ų | 45 | 6% | 0.058 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.3 | -43.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | D222 V223 G228 T229 L230 I280 | D222-A226 WeakPolarHBondContact O-CB 3.39Å; D222-A226 PolarHBondContact O-N 3.12Å; V223-A226 PolarHBondContact O-N 3.44Å; A226-G228 PolarHBondContact O-N 3.39Å; A226-T229 WeakPolarHBondContact O-CB 3.41Å; A226-T229 PolarHBondContact O-N 3.4Å; A226-T229 VanDerWaalsContact O-N 3.09Å; A226-L230 WeakPolarHBondContact O-CG 3.5Å; A226-L230 PolarHBondContact O-N 3.18Å; A226-I280 HydrophobicContact CB-CG2 4.06Å |
| 227 | L | 88.2 | Confident | 86.7 | Confident | 1 Ų | 1 | 46.5 Ų | 46.5 | 1% | 0.005 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -60 | -30.7 | 170.7 | -69.1 | 172.1 | 0 | 0 | 0 | 112.7 | V223 L225 Y231 F235 I240 L259 L260 W263 | V223-L227 HydrophobicContact CG1-CD1 3.76Å; V223-L227 HydrophobicContact CG1-CG 4.3Å; V223-L227 WeakPolarHBondContact O-CB 3.29Å; V223-L227 VanDerWaalsContact O-CG 3.23Å; V223-L227 WeakPolarHBondContact O-CG 3.27Å; V223-L227 PolarHBondContact O-N 3.27Å; L225-L227 PolarHBondContact O-N 3.45Å; L227-Y231 HydrophobicContact CB-CD2 4.37Å; L227-Y231 HydrophobicContact CD2-CD2 3.81Å; L227-Y231 HydrophobicContact CD2-CE2 3.66Å; L227-Y231 WeakPolarHBondContact O-CB 3.39Å; L227-Y231 WeakPolarHBondContact O-CD2 3.17Å; L227-Y231 PolarHBondContact O-N 2.92Å; L227-F235 HydrophobicContact CB-CD2 3.74Å; L227-F235 HydrophobicContact CB-CE2 4.18Å; L227-F235 HydrophobicContact CD1-CD2 3.63Å; L227-F235 HydrophobicContact CD1-CE2 4.16Å; L227-F235 HydrophobicContact CG-CD2 4.32Å; L227-I240 HydrophobicContact CD1-CD1 4.16Å; L227-L259 WeakPolarHBondContact CD2-O 3.36Å; L227-L260 HydrophobicContact CD1-CD2 3.73Å; L227-W263 HydrophobicContact CD2-CB 3.61Å; L227-W263 HydrophobicContact CD2-CG 4.1Å |
| 228 | G | 85.1 | Confident | 87 | Confident | 10 Ų | 10 | 46.5 Ų | 46.5 | 10% | 0.103 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -69.2 | -34.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | G224 L225 A226 G232 | G224-G228 PolarHBondContact O-N 3.19Å; L225-G228 CarbonylContact O-C 3.57Å; L225-G228 VanDerWaalsContact O-CA 3.28Å; L225-G228 WeakPolarHBondContact O-CA 3.37Å; L225-G228 PolarHBondContact O-N 3.4Å; A226-G228 PolarHBondContact O-N 3.39Å; G228-G232 CarbonylContact O-C 3.47Å; G228-G232 WeakPolarHBondContact O-CA 3.37Å; G228-G232 PolarHBondContact O-N 3.04Å |
| 229 | T | 80.9 | Confident | 87.3 | Confident | 79 Ų | 79 | 46.6 Ų | 46.6 | 49% | 0.485 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -70.1 | -42.2 | 172.7 | -55.4 | 0 | 0 | 0 | 0 | 111.4 | L225 A226 | L225-T229 PolarHBondContact O-N 3Å; L225-T229 PolarHBondContact O-OG1 3Å; A226-T229 WeakPolarHBondContact O-CB 3.41Å; A226-T229 PolarHBondContact O-N 3.4Å; A226-T229 VanDerWaalsContact O-N 3.09Å |
| 230 | L | 73.4 | Confident | 87.4 | Confident | 75 Ų | 75 | 43.4 Ų | 43.4 | 39% | 0.393 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -77.3 | -36.9 | -176.9 | -66.5 | 165.2 | 0 | 0 | 0 | 114 | A226 E266 | A226-L230 WeakPolarHBondContact O-CG 3.5Å; A226-L230 PolarHBondContact O-N 3.18Å; L230-E266 WeakPolarHBondContact CD1-OE2 3.39Å; L230-E266 WeakPolarHBondContact CD2-OE2 3.38Å |
| 231 | Y | 80.3 | Confident | 87.6 | Confident | 62 Ų | 62 | 44 Ų | 44 | 24% | 0.243 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -123.7 | 14.3 | -170.8 | -53.1 | -73.9 | 0 | 0 | 0 | 113.6 | L227 N233 L259 K262 | L227-Y231 HydrophobicContact CB-CD2 4.37Å; L227-Y231 HydrophobicContact CD2-CD2 3.81Å; L227-Y231 HydrophobicContact CD2-CE2 3.66Å; L227-Y231 WeakPolarHBondContact O-CB 3.39Å; L227-Y231 WeakPolarHBondContact O-CD2 3.17Å; L227-Y231 PolarHBondContact O-N 2.92Å; Y231-N233 PolarHBondContact O-N 2.92Å; Y231-N233 PolarHBondContact O-ND2 3.27Å; Y231-L259 HydrophobicContact CD1-CD2 3.89Å; Y231-L259 HydrophobicContact CD2-CD2 4.31Å; Y231-L259 HydrophobicContact CE1-CD2 4.08Å; Y231-L259 HydrophobicContact CG-CD2 4.03Å; Y231-K262 WeakPolarHBondContact OH-CD 3.41Å; Y231-K262 WeakPolarHBondContact OH-CE 3.39Å; Y231-K262 VanDerWaalsContact OH-CG 3.25Å; Y231-K262 WeakPolarHBondContact OH-CG 3.36Å |
| 232 | G | 78 | Confident | 87.9 | Confident | 65 Ų | 65 | 48 Ų | 48 | 67% | 0.67 | 27% | 0.27 | S | S | * | . | S | Bend | trans | 68.4 | -4.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | G228 | G228-G232 CarbonylContact O-C 3.47Å; G228-G232 WeakPolarHBondContact O-CA 3.37Å; G228-G232 PolarHBondContact O-N 3.04Å |
| 233 | N | 80.9 | Confident | 88.2 | Confident | 116 Ų | 116 | 45.5 Ų | 45.5 | 62% | 0.62 | 26% | 0.256 | S | S | * | . | trans | -126 | 100.5 | -174.8 | -77.1 | -76.1 | 0 | 0 | 0 | 111.4 | Y231 F235 | Y231-N233 PolarHBondContact O-N 2.92Å; Y231-N233 PolarHBondContact O-ND2 3.27Å; N233-F235 PolarHBondContact O-N 3.16Å; N233-F235 VanDerWaalsContact O-N 3.13Å | ||
| 234 | V | 83.4 | Confident | 88.5 | Confident | 53 Ų | 53 | 46.4 Ų | 46.4 | 32% | 0.321 | 26% | 0.26 | S | S | . | . | trans | -62.2 | 112.9 | 176.5 | 175.5 | 0 | 0 | 0 | 0 | 110.3 | G224 L225 R287 | G224-V234 WeakPolarHBondContact O-CA 3.46Å; L225-V234 HydrophobicContact CD2-CG1 4.04Å; V234-R287 HydrophobicContact CG1-CB 4.14Å; V234-R287 HydrophobicContact CG1-CG 4.22Å | ||
| 235 | F | 89.1 | Confident | 88.7 | Confident | 46 Ų | 46 | 48.7 Ų | 48.7 | 20% | 0.202 | 28% | 0.279 | C | S | . | . | trans | -76.3 | 155.9 | 171.5 | -67.6 | -73 | 0 | 0 | 0 | 110.8 | G224 L227 N233 T239 I240 L256 L259 | G224-F235 CarbonylContact C-O 3.59Å; G224-F235 WeakPolarHBondContact CA-O 3.25Å; G224-F235 PolarHBondContact O-N 3.14Å; L227-F235 HydrophobicContact CB-CD2 3.74Å; L227-F235 HydrophobicContact CB-CE2 4.18Å; L227-F235 HydrophobicContact CD1-CD2 3.63Å; L227-F235 HydrophobicContact CD1-CE2 4.16Å; L227-F235 HydrophobicContact CG-CD2 4.32Å; N233-F235 PolarHBondContact O-N 3.16Å; N233-F235 VanDerWaalsContact O-N 3.13Å; F235-T239 HydrophobicContact CD1-CG2 4.01Å; F235-I240 HydrophobicContact CB-CD1 4.22Å; F235-L256 HydrophobicContact CD1-CD2 4.22Å; F235-L256 HydrophobicContact CE1-CD2 3.62Å; F235-L256 HydrophobicContact CE2-CD2 4.41Å; F235-L256 HydrophobicContact CZ-CD2 3.73Å; F235-L259 HydrophobicContact CE2-CD1 4.02Å; F235-L259 HydrophobicContact CZ-CD1 3.77Å | ||
| 236 | S | 88.9 | Confident | 89.2 | Confident | 20 Ų | 20 | 48.6 Ų | 48.6 | 14% | 0.14 | 28% | 0.279 | C | S | . | . | trans | -88.5 | 150.6 | 175.8 | 73.5 | 0 | 0 | 0 | 0 | 111.1 | T238 T239 I240 R287 | S236-T238 PolarHBondContact O-N 3.49Å; S236-T238 VanDerWaalsContact O-N 3.1Å; S236-T238 PolarHBondContact OG-N 2.98Å; S236-T239 PolarHBondContact N-OG1 3.35Å; S236-T239 WeakPolarHBondContact O-CA 3.27Å; S236-T239 WeakPolarHBondContact O-CB 3.39Å; S236-T239 PolarHBondContact O-N 3.17Å; S236-T239 PolarHBondContact O-OG1 3.01Å; S236-T239 PolarHBondContact OG-N 2.94Å; S236-T239 PolarHBondContact OG-OG1 3.29Å; S236-I240 PolarHBondContact O-N 2.85Å; S236-I240 VanDerWaalsContact O-N 3.17Å; S236-R287 VanDerWaalsContact CB-NH2 3.29Å | ||
| 237 | Q | 92.3 | Very high | 89.6 | Confident | 78 Ų | 78 | 54.6 Ų | 54.6 | 36% | 0.364 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -44.3 | -42 | 164.7 | 171 | -79 | -23.8 | 0 | 0 | 111.4 | Q220 A221 T239 I240 C241 | Q220-Q237 HydrophobicContact CB-CB 4.44Å; Q220-Q237 HydrophobicContact CB-CG 3.84Å; A221-Q237 HydrophobicContact CB-CB 4.41Å; Q237-T239 VanDerWaalsContact C-N 3.27Å; Q237-T239 PolarHBondContact O-N 3.03Å; Q237-I240 PolarHBondContact O-N 3.06Å; Q237-C241 VanDerWaalsContact O-CB 3.27Å; Q237-C241 WeakPolarHBondContact O-CB 3.37Å; Q237-C241 PolarHBondContact O-N 3.48Å |
| 238 | T | 95.3 | Very high | 89.9 | Confident | 66 Ų | 66 | 56.3 Ų | 56.3 | 41% | 0.405 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -69.4 | -23.6 | -179.6 | -40.5 | 0 | 0 | 0 | 0 | 112.8 | S236 R242 | S236-T238 PolarHBondContact O-N 3.49Å; S236-T238 VanDerWaalsContact O-N 3.1Å; S236-T238 PolarHBondContact OG-N 2.98Å; T238-R242 WeakPolarHBondContact O-CB 3.27Å; T238-R242 WeakPolarHBondContact O-CD 3.29Å; T238-R242 WeakPolarHBondContact O-CG 3.22Å; T238-R242 PolarHBondContact O-N 3.02Å |
| 239 | T | 95.4 | Very high | 90.3 | Very high | 34 Ų | 34 | 59.1 Ų | 59.1 | 21% | 0.209 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -70.8 | -51.7 | 170.5 | -47.9 | 0 | 0 | 0 | 0 | 109.9 | F235 S236 Q237 R242 F243 L256 | F235-T239 HydrophobicContact CD1-CG2 4.01Å; S236-T239 PolarHBondContact N-OG1 3.35Å; S236-T239 WeakPolarHBondContact O-CA 3.27Å; S236-T239 WeakPolarHBondContact O-CB 3.39Å; S236-T239 PolarHBondContact O-N 3.17Å; S236-T239 PolarHBondContact O-OG1 3.01Å; S236-T239 PolarHBondContact OG-N 2.94Å; S236-T239 PolarHBondContact OG-OG1 3.29Å; Q237-T239 VanDerWaalsContact C-N 3.27Å; Q237-T239 PolarHBondContact O-N 3.03Å; T239-R242 PolarHBondContact O-N 3.38Å; T239-F243 PolarHBondContact O-N 2.75Å; T239-L256 HydrophobicContact CG2-CD1 3.98Å |
| 240 | I | 95.3 | Very high | 90.8 | Very high | 2 Ų | 2 | 60.9 Ų | 60.9 | 1% | 0.01 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.5 | -45.4 | -179.9 | -49.9 | -54.3 | 0 | 0 | 0 | 110.4 | F209 Q220 V223 L227 F235 S236 Q237 R242 F243 E244 L260 | F209-I240 HydrophobicContact CE1-CG2 4.01Å; Q220-I240 HydrophobicContact CB-CB 4.16Å; Q220-I240 HydrophobicContact CB-CG2 4.19Å; Q220-I240 HydrophobicContact CG-CB 4.41Å; Q220-I240 HydrophobicContact CG-CG2 4.07Å; Q220-I240 WeakPolarHBondContact O-CG1 3.43Å; V223-I240 HydrophobicContact CB-CG1 4.43Å; V223-I240 HydrophobicContact CG1-CD1 3.81Å; V223-I240 HydrophobicContact CG1-CG1 4.12Å; V223-I240 HydrophobicContact CG1-CG2 4.37Å; L227-I240 HydrophobicContact CD1-CD1 4.16Å; F235-I240 HydrophobicContact CB-CD1 4.22Å; S236-I240 PolarHBondContact O-N 2.85Å; S236-I240 VanDerWaalsContact O-N 3.17Å; Q237-I240 PolarHBondContact O-N 3.06Å; I240-R242 VanDerWaalsContact C-N 3.32Å; I240-R242 PolarHBondContact O-N 3.12Å; I240-F243 WeakPolarHBondContact O-CB 3.44Å; I240-F243 PolarHBondContact O-N 3.27Å; I240-F243 VanDerWaalsContact O-N 3.11Å; I240-E244 HydrophobicContact CG2-CG 4.5Å; I240-E244 WeakPolarHBondContact O-CG 3.19Å; I240-E244 PolarHBondContact O-N 3.01Å; I240-L260 HydrophobicContact CD1-CD2 3.96Å |
| 241 | C | 96.9 | Very high | 91.7 | Very high | 46 Ų | 46 | 64.5 Ų | 64.5 | 31% | 0.311 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -58.9 | -38.9 | 176.6 | -171.2 | 0 | 0 | 0 | 0 | 113.3 | Q237 A245 | Q237-C241 VanDerWaalsContact O-CB 3.27Å; Q237-C241 WeakPolarHBondContact O-CB 3.37Å; Q237-C241 PolarHBondContact O-N 3.48Å; C241-A245 VanDerWaalsContact O-CB 3.29Å; C241-A245 WeakPolarHBondContact O-CB 3.32Å; C241-A245 PolarHBondContact O-N 3.31Å |
| 242 | R | 96.9 | Very high | 92.4 | Very high | 126 Ų | 126 | 65.2 Ų | 65.2 | 48% | 0.475 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -74.4 | -29.9 | 176.5 | -74.4 | 175.1 | -178.7 | -150.8 | -1.7 | 112.6 | T238 T239 I240 L246 Q247 L248 | T238-R242 WeakPolarHBondContact O-CB 3.27Å; T238-R242 WeakPolarHBondContact O-CD 3.29Å; T238-R242 WeakPolarHBondContact O-CG 3.22Å; T238-R242 PolarHBondContact O-N 3.02Å; T239-R242 PolarHBondContact O-N 3.38Å; I240-R242 VanDerWaalsContact C-N 3.32Å; I240-R242 PolarHBondContact O-N 3.12Å; R242-L246 PolarHBondContact O-N 3.22Å; R242-Q247 HydrophobicContact CB-CB 4.19Å; R242-Q247 HydrophobicContact CG-CB 4.23Å; R242-Q247 PolarHBondContact O-N 3.14Å; R242-L248 HydrophobicContact CB-CD1 4.45Å; R242-L248 HydrophobicContact CB-CD2 3.63Å; R242-L248 HydrophobicContact CB-CG 3.83Å; R242-L248 HydrophobicContact CG-CD2 4.46Å |
| 243 | F | 97.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 62.5 Ų | 62.5 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -67.1 | -50.9 | 171.8 | -173.2 | -84.1 | 0 | 0 | 0 | 110.9 | F205 A206 T239 I240 A245 L246 L248 M253 L256 L260 | F205-F243 AromaticContact CD1-CE1 3.63Å; F205-F243 HydrophobicContact CD1-CE1 3.63Å; F205-F243 AromaticContact CD1-CZ 3.57Å; F205-F243 HydrophobicContact CD1-CZ 3.57Å; F205-F243 AromaticContact CE1-CE1 3.55Å; F205-F243 HydrophobicContact CE1-CE1 3.55Å; F205-F243 AromaticContact CE1-CZ 3.56Å; F205-F243 HydrophobicContact CE1-CZ 3.56Å; A206-F243 HydrophobicContact CB-CD1 4.45Å; A206-F243 HydrophobicContact CB-CE1 4.17Å; T239-F243 PolarHBondContact O-N 2.75Å; I240-F243 WeakPolarHBondContact O-CB 3.44Å; I240-F243 PolarHBondContact O-N 3.27Å; I240-F243 VanDerWaalsContact O-N 3.11Å; F243-A245 PolarHBondContact O-N 3.25Å; F243-A245 VanDerWaalsContact O-N 3.11Å; F243-L246 PolarHBondContact O-N 2.93Å; F243-L248 HydrophobicContact CB-CD1 4.12Å; F243-L248 HydrophobicContact CD2-CD1 4.37Å; F243-M253 HydrophobicContact CB-SD 4.46Å; F243-M253 HydrophobicContact CD1-CE 4.22Å; F243-M253 HydrophobicContact CD2-CE 3.52Å; F243-M253 HydrophobicContact CD2-SD 3.46Å; F243-M253 WeakPolarHBondContact CD2-SD 3.48Å; F243-M253 HydrophobicContact CE1-CE 4.13Å; F243-M253 HydrophobicContact CE2-CB 4.47Å; F243-M253 HydrophobicContact CE2-CE 3.42Å; F243-M253 VanDerWaalsContact CE2-CE 3.42Å; F243-M253 HydrophobicContact CE2-SD 3.82Å; F243-M253 HydrophobicContact CG-CE 3.93Å; F243-M253 HydrophobicContact CG-SD 4.08Å; F243-M253 HydrophobicContact CZ-CE 3.74Å; F243-L256 HydrophobicContact CD2-CB 3.61Å; F243-L256 HydrophobicContact CD2-CD1 3.92Å; F243-L256 HydrophobicContact CD2-CG 4.44Å; F243-L256 HydrophobicContact CE2-CB 3.61Å; F243-L260 HydrophobicContact CB-CD1 4.41Å; F243-L260 HydrophobicContact CD1-CD1 3.47Å; F243-L260 VanDerWaalsContact CD1-CD1 3.47Å; F243-L260 HydrophobicContact CD2-CD1 3.67Å; F243-L260 HydrophobicContact CE1-CD1 3.5Å; F243-L260 VanDerWaalsContact CE1-CD1 3.5Å; F243-L260 HydrophobicContact CE2-CD1 3.69Å; F243-L260 HydrophobicContact CG-CD1 3.56Å; F243-L260 HydrophobicContact CZ-CD1 3.61Å |
| 244 | E | 97.3 | Very high | 93.8 | Very high | 19 Ų | 19 | 58.7 Ų | 58.7 | 9% | 0.089 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -58.4 | -23.5 | 175.9 | -73.3 | -176.7 | -173 | 0 | 0 | 114.4 | F209 K210 R213 Q220 I240 | F209-E244 HydrophobicContact CD1-CG 4.3Å; F209-E244 HydrophobicContact CE1-CG 4.49Å; K210-E244 HydrophobicContact CB-CG 4.03Å; K210-E244 HydrophobicContact CD-CB 4.27Å; K210-E244 HydrophobicContact CD-CG 4.45Å; K210-E244 HydrophobicContact CG-CG 4.2Å; R213-E244 IonicContact CZ-OE1 3.27Å; R213-E244 IonicContact NE-OE1 3.7Å; R213-E244 PolarHBondContact NE-OE1 2.91Å; R213-E244 IonicContact NH2-OE1 2.7Å; R213-E244 PolarHBondContact NH2-OE1 3.13Å; R213-E244 IonicContact NH2-OE2 3.02Å; R213-E244 PolarHBondContact NH2-OE2 3.5Å; Q220-E244 PolarHBondContact NE2-OE2 3.3Å; I240-E244 HydrophobicContact CG2-CG 4.5Å; I240-E244 WeakPolarHBondContact O-CG 3.19Å; I240-E244 PolarHBondContact O-N 3.01Å |
| 245 | A | 96.5 | Very high | 94.2 | Very high | 48 Ų | 48 | 63 Ų | 63 | 40% | 0.397 | 32% | 0.321 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.1 | 5.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | C241 F243 Q247 | C241-A245 VanDerWaalsContact O-CB 3.29Å; C241-A245 WeakPolarHBondContact O-CB 3.32Å; C241-A245 PolarHBondContact O-N 3.31Å; F243-A245 PolarHBondContact O-N 3.25Å; F243-A245 VanDerWaalsContact O-N 3.11Å; A245-Q247 HydrophobicContact CB-CG 3.88Å; A245-Q247 WeakPolarHBondContact O-CG 3.4Å; A245-Q247 PolarHBondContact O-N 3.16Å |
| 246 | L | 95.8 | Very high | 94.4 | Very high | 67 Ų | 67 | 61.5 Ų | 61.5 | 35% | 0.351 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 57.3 | 26 | -176 | -52 | 177.4 | 0 | 0 | 0 | 114.2 | E203 A206 R242 F243 L248 M253 | E203-L246 HydrophobicContact CB-CD1 3.82Å; E203-L246 HydrophobicContact CG-CD1 3.85Å; A206-L246 HydrophobicContact CB-CD2 3.64Å; R242-L246 PolarHBondContact O-N 3.22Å; F243-L246 PolarHBondContact O-N 2.93Å; L246-L248 VanDerWaalsContact C-N 3.33Å; L246-L248 PolarHBondContact O-N 2.89Å; L246-M253 HydrophobicContact CD2-CE 3.56Å |
| 247 | Q | 95.6 | Very high | 94.6 | Very high | 133 Ų | 133 | 62.7 Ų | 62.7 | 62% | 0.621 | 32% | 0.317 | S | S | * | . | trans | -93.9 | 27.2 | -176.7 | -62.9 | -179 | 9.1 | 0 | 0 | 113.6 | R242 A245 | R242-Q247 HydrophobicContact CB-CB 4.19Å; R242-Q247 HydrophobicContact CG-CB 4.23Å; R242-Q247 PolarHBondContact O-N 3.14Å; A245-Q247 HydrophobicContact CB-CG 3.88Å; A245-Q247 WeakPolarHBondContact O-CG 3.4Å; A245-Q247 PolarHBondContact O-N 3.16Å | ||
| 248 | L | 93.9 | Very high | 94.6 | Very high | 37 Ų | 37 | 62.6 Ų | 62.6 | 19% | 0.194 | 32% | 0.324 | C | S | . | . | S | Bend | trans | -117.2 | 156 | 172.3 | -58.2 | 176 | 0 | 0 | 0 | 109.1 | R242 F243 L246 N252 M253 L256 | R242-L248 HydrophobicContact CB-CD1 4.45Å; R242-L248 HydrophobicContact CB-CD2 3.63Å; R242-L248 HydrophobicContact CB-CG 3.83Å; R242-L248 HydrophobicContact CG-CD2 4.46Å; F243-L248 HydrophobicContact CB-CD1 4.12Å; F243-L248 HydrophobicContact CD2-CD1 4.37Å; L246-L248 VanDerWaalsContact C-N 3.33Å; L246-L248 PolarHBondContact O-N 2.89Å; L248-N252 HydrophobicContact CB-CB 4.11Å; L248-M253 HydrophobicContact CB-CG 4.02Å; L248-M253 HydrophobicContact CB-SD 3.78Å; L248-M253 HydrophobicContact CD1-SD 4.05Å; L248-M253 HydrophobicContact CG-SD 4.23Å; L248-L256 HydrophobicContact CD1-CD1 3.49Å; L248-L256 VanDerWaalsContact CD1-CD1 3.49Å |
| 249 | S | 93.8 | Very high | 94.5 | Very high | 70 Ų | 70 | 61.7 Ų | 61.7 | 49% | 0.49 | 32% | 0.316 | S | S | . | . | trans | -62.2 | 147.9 | 170.7 | 50.7 | 0 | 0 | 0 | 0 | 110.5 | K251 N252 M253 | S249-K251 VanDerWaalsContact C-N 3.31Å; S249-K251 PolarHBondContact O-N 2.85Å; S249-N252 WeakPolarHBondContact O-CA 3.17Å; S249-N252 WeakPolarHBondContact O-CB 3.39Å; S249-N252 PolarHBondContact O-N 3.14Å; S249-M253 PolarHBondContact O-N 3.24Å | ||
| 250 | F | 91.7 | Very high | 94.4 | Very high | 115 Ų | 115 | 60.1 Ų | 60.1 | 50% | 0.504 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -46.1 | -51 | 179 | -174.3 | -100.1 | 0 | 0 | 0 | 112.5 | P197 L202 N252 M253 C254 | P197-F250 WeakPolarHBondContact O-CZ 3.3Å; L202-F250 HydrophobicContact CD1-CD2 3.77Å; L202-F250 HydrophobicContact CD1-CE2 3.6Å; L202-F250 HydrophobicContact CD1-CZ 4.38Å; F250-N252 PolarHBondContact O-N 2.91Å; F250-N252 VanDerWaalsContact O-N 3.09Å; F250-M253 WeakPolarHBondContact O-CA 3.42Å; F250-M253 WeakPolarHBondContact O-CB 3.39Å; F250-M253 PolarHBondContact O-N 3.35Å; F250-C254 VanDerWaalsContact CE1-SG 3.5Å; F250-C254 PolarHBondContact O-N 3.45Å; F250-C254 PolarHBondContact O-SG 3.05Å |
| 251 | K | 92.1 | Very high | 94.3 | Very high | 152 Ų | 152 | 62.3 Ų | 62.3 | 66% | 0.661 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -59 | -25.2 | 176.2 | -169.6 | 166.5 | 74.8 | 177.3 | 0 | 115 | S249 K255 | S249-K251 VanDerWaalsContact C-N 3.31Å; S249-K251 PolarHBondContact O-N 2.85Å; K251-K255 VanDerWaalsContact O-CG 3.29Å; K251-K255 WeakPolarHBondContact O-CG 3.42Å |
| 252 | N | 93.6 | Very high | 94 | Very high | 77 Ų | 77 | 64.8 Ų | 64.8 | 41% | 0.412 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -83.8 | -34 | 172.2 | -74.3 | 2.7 | 0 | 0 | 0 | 111.9 | L248 S249 F250 K255 L256 | L248-N252 HydrophobicContact CB-CB 4.11Å; S249-N252 WeakPolarHBondContact O-CA 3.17Å; S249-N252 WeakPolarHBondContact O-CB 3.39Å; S249-N252 PolarHBondContact O-N 3.14Å; F250-N252 PolarHBondContact O-N 2.91Å; F250-N252 VanDerWaalsContact O-N 3.09Å; N252-K255 PolarHBondContact O-N 2.79Å; N252-L256 WeakPolarHBondContact O-CG 3.19Å; N252-L256 PolarHBondContact O-N 2.82Å |
| 253 | M | 94.4 | Very high | 93.7 | Very high | 8 Ų | 8 | 59.1 Ų | 59.1 | 4% | 0.039 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.3 | -51.6 | 172.3 | -67.4 | -63.9 | -64.7 | 0 | 0 | 110.8 | L202 F243 L246 L248 S249 F250 K255 L256 K257 | L202-M253 HydrophobicContact CD1-CB 3.73Å; L202-M253 HydrophobicContact CD2-CB 4.06Å; L202-M253 HydrophobicContact CG-CB 4.45Å; F243-M253 HydrophobicContact CB-SD 4.46Å; F243-M253 HydrophobicContact CD1-CE 4.22Å; F243-M253 HydrophobicContact CD2-CE 3.52Å; F243-M253 HydrophobicContact CD2-SD 3.46Å; F243-M253 WeakPolarHBondContact CD2-SD 3.48Å; F243-M253 HydrophobicContact CE1-CE 4.13Å; F243-M253 HydrophobicContact CE2-CB 4.47Å; F243-M253 HydrophobicContact CE2-CE 3.42Å; F243-M253 VanDerWaalsContact CE2-CE 3.42Å; F243-M253 HydrophobicContact CE2-SD 3.82Å; F243-M253 HydrophobicContact CG-CE 3.93Å; F243-M253 HydrophobicContact CG-SD 4.08Å; F243-M253 HydrophobicContact CZ-CE 3.74Å; L246-M253 HydrophobicContact CD2-CE 3.56Å; L248-M253 HydrophobicContact CB-CG 4.02Å; L248-M253 HydrophobicContact CB-SD 3.78Å; L248-M253 HydrophobicContact CD1-SD 4.05Å; L248-M253 HydrophobicContact CG-SD 4.23Å; S249-M253 PolarHBondContact O-N 3.24Å; F250-M253 WeakPolarHBondContact O-CA 3.42Å; F250-M253 WeakPolarHBondContact O-CB 3.39Å; F250-M253 PolarHBondContact O-N 3.35Å; M253-K255 PolarHBondContact O-N 3.03Å; M253-L256 PolarHBondContact O-N 2.81Å; M253-K257 PolarHBondContact O-N 3.1Å |
| 254 | C | 93.6 | Very high | 93.4 | Very high | 36 Ų | 36 | 59.1 Ų | 59.1 | 24% | 0.243 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -56.8 | -35.7 | 176.8 | -52 | 0 | 0 | 0 | 0 | 112.6 | F250 L256 P258 | F250-C254 VanDerWaalsContact CE1-SG 3.5Å; F250-C254 PolarHBondContact O-N 3.45Å; F250-C254 PolarHBondContact O-SG 3.05Å; C254-L256 VanDerWaalsContact C-N 3.33Å; C254-L256 PolarHBondContact O-N 3.46Å; C254-P258 WeakPolarHBondContact O-CD 3.25Å |
| 255 | K | 92.2 | Very high | 93.1 | Very high | 143 Ų | 143 | 62.8 Ų | 62.8 | 62% | 0.622 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -73.1 | -20.4 | 176.6 | -78.9 | -178.4 | 175.2 | -124.7 | 0 | 114.6 | K251 N252 M253 | K251-K255 VanDerWaalsContact O-CG 3.29Å; K251-K255 WeakPolarHBondContact O-CG 3.42Å; N252-K255 PolarHBondContact O-N 2.79Å; M253-K255 PolarHBondContact O-N 3.03Å |
| 256 | L | 93.4 | Very high | 92.5 | Very high | 15 Ų | 15 | 64 Ų | 64 | 8% | 0.079 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -99.3 | -29.5 | 179.6 | -70.9 | 172.2 | 0 | 0 | 0 | 112.4 | F235 T239 F243 L248 N252 M253 C254 L259 L260 | F235-L256 HydrophobicContact CD1-CD2 4.22Å; F235-L256 HydrophobicContact CE1-CD2 3.62Å; F235-L256 HydrophobicContact CE2-CD2 4.41Å; F235-L256 HydrophobicContact CZ-CD2 3.73Å; T239-L256 HydrophobicContact CG2-CD1 3.98Å; F243-L256 HydrophobicContact CD2-CB 3.61Å; F243-L256 HydrophobicContact CD2-CD1 3.92Å; F243-L256 HydrophobicContact CD2-CG 4.44Å; F243-L256 HydrophobicContact CE2-CB 3.61Å; L248-L256 HydrophobicContact CD1-CD1 3.49Å; L248-L256 VanDerWaalsContact CD1-CD1 3.49Å; N252-L256 WeakPolarHBondContact O-CG 3.19Å; N252-L256 PolarHBondContact O-N 2.82Å; M253-L256 PolarHBondContact O-N 2.81Å; C254-L256 VanDerWaalsContact C-N 3.33Å; C254-L256 PolarHBondContact O-N 3.46Å; L256-L259 PolarHBondContact O-N 3.02Å; L256-L260 HydrophobicContact CB-CD1 3.93Å; L256-L260 WeakPolarHBondContact O-CB 3.47Å; L256-L260 WeakPolarHBondContact O-CG 3.24Å; L256-L260 PolarHBondContact O-N 2.71Å |
| 257 | K | 94.1 | Very high | 91.9 | Very high | 44 Ų | 44 | 61.2 Ų | 61.2 | 19% | 0.191 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -45.2 | -55.6 | 176.3 | -164.5 | -171.5 | -172.4 | -175.6 | 0 | 112.7 | P197 L202 F205 M253 L259 L260 N261 | P197-K257 HydrophobicContact CB-CD 4.11Å; P197-K257 VanDerWaalsContact CB-NZ 3.32Å; P197-K257 HydrophobicContact CG-CD 4.14Å; L202-K257 HydrophobicContact CD2-CB 3.93Å; L202-K257 HydrophobicContact CD2-CD 3.77Å; L202-K257 HydrophobicContact CD2-CG 4.04Å; F205-K257 HydrophobicContact CD1-CG 3.85Å; F205-K257 HydrophobicContact CD2-CG 4.39Å; F205-K257 HydrophobicContact CE1-CG 4.13Å; F205-K257 HydrophobicContact CG-CG 3.99Å; M253-K257 PolarHBondContact O-N 3.1Å; K257-L259 PolarHBondContact O-N 2.7Å; K257-L260 PolarHBondContact O-N 3.34Å; K257-N261 WeakPolarHBondContact O-CB 3.42Å; K257-N261 PolarHBondContact O-N 3.26Å |
| 258 | P | 92.7 | Very high | 91.2 | Very high | 76 Ų | 76 | 57 Ų | 57 | 49% | 0.494 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -68.1 | -36.9 | -176.3 | 26.8 | -35.1 | 0 | 0 | 0 | 113.6 | C254 N261 K262 | C254-P258 WeakPolarHBondContact O-CD 3.25Å; P258-N261 PolarHBondContact O-N 3.25Å; P258-K262 WeakPolarHBondContact O-CB 3.37Å; P258-K262 PolarHBondContact O-N 2.81Å |
| 259 | L | 92.6 | Very high | 90.3 | Very high | 48 Ų | 48 | 60 Ų | 60 | 25% | 0.251 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -67.1 | -41.7 | 178.9 | -59.9 | 177.9 | 0 | 0 | 0 | 111.4 | L227 Y231 F235 L256 K257 W263 | L227-L259 WeakPolarHBondContact CD2-O 3.36Å; Y231-L259 HydrophobicContact CD1-CD2 3.89Å; Y231-L259 HydrophobicContact CD2-CD2 4.31Å; Y231-L259 HydrophobicContact CE1-CD2 4.08Å; Y231-L259 HydrophobicContact CG-CD2 4.03Å; F235-L259 HydrophobicContact CE2-CD1 4.02Å; F235-L259 HydrophobicContact CZ-CD1 3.77Å; L256-L259 PolarHBondContact O-N 3.02Å; K257-L259 PolarHBondContact O-N 2.7Å; L259-W263 PolarHBondContact O-N 3.18Å |
| 260 | L | 93.9 | Very high | 88.8 | Confident | 1 Ų | 1 | 59.3 Ų | 59.3 | 1% | 0.005 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -72 | -37.4 | 177.3 | -68.9 | 166.4 | 0 | 0 | 0 | 111.7 | F205 F209 V223 L227 I240 F243 L256 K257 L264 | F205-L260 HydrophobicContact CE1-CB 3.91Å; F205-L260 HydrophobicContact CZ-CB 3.84Å; F209-L260 HydrophobicContact CD2-CB 3.98Å; F209-L260 HydrophobicContact CD2-CD2 4.48Å; F209-L260 HydrophobicContact CE1-CD2 4.24Å; F209-L260 HydrophobicContact CE2-CB 3.84Å; F209-L260 HydrophobicContact CE2-CD2 3.68Å; F209-L260 HydrophobicContact CE2-CG 4.31Å; F209-L260 HydrophobicContact CZ-CD2 3.57Å; V223-L260 HydrophobicContact CG1-CD2 4.05Å; L227-L260 HydrophobicContact CD1-CD2 3.73Å; I240-L260 HydrophobicContact CD1-CD2 3.96Å; F243-L260 HydrophobicContact CB-CD1 4.41Å; F243-L260 HydrophobicContact CD1-CD1 3.47Å; F243-L260 VanDerWaalsContact CD1-CD1 3.47Å; F243-L260 HydrophobicContact CD2-CD1 3.67Å; F243-L260 HydrophobicContact CE1-CD1 3.5Å; F243-L260 VanDerWaalsContact CE1-CD1 3.5Å; F243-L260 HydrophobicContact CE2-CD1 3.69Å; F243-L260 HydrophobicContact CG-CD1 3.56Å; F243-L260 HydrophobicContact CZ-CD1 3.61Å; L256-L260 HydrophobicContact CB-CD1 3.93Å; L256-L260 WeakPolarHBondContact O-CB 3.47Å; L256-L260 WeakPolarHBondContact O-CG 3.24Å; L256-L260 PolarHBondContact O-N 2.71Å; K257-L260 PolarHBondContact O-N 3.34Å; L260-L264 WeakPolarHBondContact O-CB 3.43Å; L260-L264 PolarHBondContact O-N 3.19Å |
| 261 | N | 93.1 | Very high | 87.2 | Confident | 47 Ų | 47 | 58.2 Ų | 58.2 | 25% | 0.251 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.7 | -51 | 178.3 | -172.2 | 81.4 | 0 | 0 | 0 | 110.9 | F205 K257 P258 W263 L264 E265 | F205-N261 HydrophobicContact CE2-CB 3.7Å; F205-N261 WeakPolarHBondContact CE2-OD1 3.18Å; F205-N261 HydrophobicContact CZ-CB 3.89Å; K257-N261 WeakPolarHBondContact O-CB 3.42Å; K257-N261 PolarHBondContact O-N 3.26Å; P258-N261 PolarHBondContact O-N 3.25Å; N261-W263 VanDerWaalsContact C-N 3.35Å; N261-W263 PolarHBondContact O-N 3.11Å; N261-L264 CarbonylContact O-C 3.6Å; N261-L264 WeakPolarHBondContact O-CA 3.46Å; N261-L264 VanDerWaalsContact O-CB 3.26Å; N261-L264 WeakPolarHBondContact O-CB 3.38Å; N261-L264 PolarHBondContact O-N 2.8Å; N261-E265 PolarHBondContact ND2-OE1 3.15Å; N261-E265 PolarHBondContact ND2-OE2 3.31Å; N261-E265 VanDerWaalsContact ND2-OE2 3.1Å; N261-E265 WeakPolarHBondContact O-CG 3.12Å; N261-E265 PolarHBondContact O-N 3.4Å |
| 262 | K | 90.6 | Very high | 85.2 | Confident | 99 Ų | 99 | 54.7 Ų | 54.7 | 43% | 0.43 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -63.4 | -38.2 | 179.8 | -179.4 | 173 | 158.3 | 176.8 | 0 | 112.8 | Y231 P258 L264 E265 E266 | Y231-K262 WeakPolarHBondContact OH-CD 3.41Å; Y231-K262 WeakPolarHBondContact OH-CE 3.39Å; Y231-K262 VanDerWaalsContact OH-CG 3.25Å; Y231-K262 WeakPolarHBondContact OH-CG 3.36Å; P258-K262 WeakPolarHBondContact O-CB 3.37Å; P258-K262 PolarHBondContact O-N 2.81Å; K262-L264 VanDerWaalsContact C-N 3.28Å; K262-L264 PolarHBondContact O-N 3.22Å; K262-E265 WeakPolarHBondContact CA-OE2 3.3Å; K262-E265 PolarHBondContact O-N 3.17Å; K262-E266 WeakPolarHBondContact CE-OE1 3.37Å; K262-E266 HydrophobicContact CG-CG 4.43Å; K262-E266 IonicContact NZ-OE1 3.43Å; K262-E266 WeakPolarHBondContact O-CB 3.36Å; K262-E266 VanDerWaalsContact O-CG 3.31Å; K262-E266 WeakPolarHBondContact O-CG 3.46Å; K262-E266 PolarHBondContact O-N 3.24Å |
| 263 | W | 90.1 | Very high | 82.7 | Confident | 7 Ų | 7 | 53.2 Ų | 53.2 | 3% | 0.027 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.5 | -37.7 | 170.9 | 173 | 80.3 | 0 | 0 | 0 | 112.3 | F209 F218 V223 L227 L259 N261 T267 | F209-W263 AromaticContact CE2-CE3 3.72Å; F209-W263 HydrophobicContact CE2-CE3 3.72Å; F209-W263 AromaticContact CE2-CZ3 3.8Å; F209-W263 HydrophobicContact CE2-CZ3 3.8Å; F209-W263 HydrophobicContact CZ-CE3 4.21Å; F209-W263 HydrophobicContact CZ-CZ3 4.04Å; F218-W263 HydrophobicContact CB-CH2 4.37Å; F218-W263 HydrophobicContact CD1-CZ2 4.22Å; F218-W263 AromaticContact CD2-CH2 3.86Å; F218-W263 HydrophobicContact CD2-CH2 3.86Å; F218-W263 AromaticContact CD2-CZ2 3.9Å; F218-W263 HydrophobicContact CD2-CZ2 3.9Å; F218-W263 HydrophobicContact CE1-CZ2 4.31Å; F218-W263 HydrophobicContact CE2-CH2 4.32Å; F218-W263 HydrophobicContact CE2-CZ2 4.01Å; F218-W263 HydrophobicContact CG-CH2 4.08Å; F218-W263 AromaticContact CG-CZ2 4Å; F218-W263 HydrophobicContact CG-CZ2 4Å; F218-W263 HydrophobicContact CZ-CZ2 4.19Å; V223-W263 HydrophobicContact CG2-CE3 4.47Å; V223-W263 HydrophobicContact CG2-CH2 3.57Å; V223-W263 HydrophobicContact CG2-CZ2 3.83Å; V223-W263 HydrophobicContact CG2-CZ3 3.91Å; L227-W263 HydrophobicContact CD2-CB 3.61Å; L227-W263 HydrophobicContact CD2-CG 4.1Å; L259-W263 PolarHBondContact O-N 3.18Å; N261-W263 VanDerWaalsContact C-N 3.35Å; N261-W263 PolarHBondContact O-N 3.11Å; W263-T267 HydrophobicContact CZ2-CG2 4.31Å; W263-T267 PolarHBondContact NE1-OG1 2.85Å; W263-T267 VanDerWaalsContact O-CB 3.26Å; W263-T267 WeakPolarHBondContact O-CB 3.41Å; W263-T267 PolarHBondContact O-N 2.81Å; W263-T267 PolarHBondContact O-OG1 3.06Å |
| 264 | L | 91.2 | Very high | 80.5 | Confident | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -67.1 | -44.4 | 178.4 | -157.6 | 68.7 | 0 | 0 | 0 | 111 | F209 R212 L260 N261 K262 T267 D268 | F209-L264 HydrophobicContact CD2-CD1 4.12Å; F209-L264 HydrophobicContact CD2-CD2 4.26Å; F209-L264 HydrophobicContact CE2-CD1 4.29Å; R212-L264 HydrophobicContact CB-CD1 3.81Å; R212-L264 HydrophobicContact CB-CD2 4.32Å; R212-L264 HydrophobicContact CB-CG 4.39Å; L260-L264 WeakPolarHBondContact O-CB 3.43Å; L260-L264 PolarHBondContact O-N 3.19Å; N261-L264 CarbonylContact O-C 3.6Å; N261-L264 WeakPolarHBondContact O-CA 3.46Å; N261-L264 VanDerWaalsContact O-CB 3.26Å; N261-L264 WeakPolarHBondContact O-CB 3.38Å; N261-L264 PolarHBondContact O-N 2.8Å; K262-L264 VanDerWaalsContact C-N 3.28Å; K262-L264 PolarHBondContact O-N 3.22Å; L264-T267 PolarHBondContact O-N 3.05Å; L264-D268 WeakPolarHBondContact O-CB 3.28Å; L264-D268 PolarHBondContact O-N 2.67Å |
| 265 | E | 89.7 | Confident | 78.4 | Confident | 95 Ų | 95 | 60.1 Ų | 60.1 | 44% | 0.444 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -61.7 | -47.4 | 175.8 | -69.4 | 165.2 | 157.2 | 0 | 0 | 112.4 | N261 K262 T267 S269 | N261-E265 PolarHBondContact ND2-OE1 3.15Å; N261-E265 PolarHBondContact ND2-OE2 3.31Å; N261-E265 VanDerWaalsContact ND2-OE2 3.1Å; N261-E265 WeakPolarHBondContact O-CG 3.12Å; N261-E265 PolarHBondContact O-N 3.4Å; K262-E265 WeakPolarHBondContact CA-OE2 3.3Å; K262-E265 PolarHBondContact O-N 3.17Å; E265-T267 VanDerWaalsContact C-N 3.3Å; E265-T267 PolarHBondContact O-N 3.43Å; E265-S269 VanDerWaalsContact O-CB 3.22Å; E265-S269 WeakPolarHBondContact O-CB 3.38Å; E265-S269 PolarHBondContact O-N 2.61Å; E265-S269 PolarHBondContact O-OG 3.28Å |
| 266 | E | 85.4 | Confident | 76.2 | Confident | 74 Ų | 74 | 56.9 Ų | 56.9 | 35% | 0.346 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -59.9 | -40.3 | 174.7 | -74.3 | 172.6 | 176.2 | 0 | 0 | 111.8 | L230 K262 N270 | L230-E266 WeakPolarHBondContact CD1-OE2 3.39Å; L230-E266 WeakPolarHBondContact CD2-OE2 3.38Å; K262-E266 WeakPolarHBondContact CE-OE1 3.37Å; K262-E266 HydrophobicContact CG-CG 4.43Å; K262-E266 IonicContact NZ-OE1 3.43Å; K262-E266 WeakPolarHBondContact O-CB 3.36Å; K262-E266 VanDerWaalsContact O-CG 3.31Å; K262-E266 WeakPolarHBondContact O-CG 3.46Å; K262-E266 PolarHBondContact O-N 3.24Å; E266-N270 WeakPolarHBondContact O-CB 3.42Å; E266-N270 PolarHBondContact O-N 3.21Å |
| 267 | T | 83.4 | Confident | 74.2 | Confident | 8 Ų | 8 | 58.9 Ų | 58.9 | 5% | 0.049 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -73.5 | -48.1 | -179 | -55.9 | 0 | 0 | 0 | 0 | 111.9 | L216 F218 W263 L264 E265 S269 N270 T271 | L216-T267 HydrophobicContact CD1-CG2 3.86Å; F218-T267 HydrophobicContact CD2-CG2 4.38Å; F218-T267 HydrophobicContact CE2-CG2 3.51Å; F218-T267 HydrophobicContact CZ-CG2 4.12Å; W263-T267 HydrophobicContact CZ2-CG2 4.31Å; W263-T267 PolarHBondContact NE1-OG1 2.85Å; W263-T267 VanDerWaalsContact O-CB 3.26Å; W263-T267 WeakPolarHBondContact O-CB 3.41Å; W263-T267 PolarHBondContact O-N 2.81Å; W263-T267 PolarHBondContact O-OG1 3.06Å; L264-T267 PolarHBondContact O-N 3.05Å; E265-T267 VanDerWaalsContact C-N 3.3Å; E265-T267 PolarHBondContact O-N 3.43Å; T267-S269 VanDerWaalsContact C-N 3.33Å; T267-S269 PolarHBondContact O-N 3.02Å; T267-N270 PolarHBondContact O-N 2.97Å; T267-T271 WeakPolarHBondContact O-CG2 3.23Å; T267-T271 PolarHBondContact O-N 3.17Å |
| 268 | D | 79.3 | Confident | 72.1 | Confident | 44 Ų | 44 | 62.5 Ų | 62.5 | 24% | 0.235 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -59.7 | -43.5 | 177.1 | -77.7 | -40.2 | 0 | 0 | 0 | 110.7 | R212 L264 N270 T271 | R212-D268 WeakPolarHBondContact CD-OD2 3.39Å; R212-D268 IonicContact CZ-OD2 3.2Å; R212-D268 IonicContact NE-OD2 3.86Å; R212-D268 IonicContact NH1-OD2 2.68Å; R212-D268 PolarHBondContact NH1-OD2 3.37Å; L264-D268 WeakPolarHBondContact O-CB 3.28Å; L264-D268 PolarHBondContact O-N 2.67Å; D268-N270 VanDerWaalsContact C-N 3.3Å; D268-N270 PolarHBondContact O-N 3.44Å; D268-T271 WeakPolarHBondContact O-CB 3.31Å; D268-T271 WeakPolarHBondContact O-CG2 3.37Å; D268-T271 PolarHBondContact O-N 3.13Å; D268-T271 PolarHBondContact O-OG1 2.89Å |
| 269 | S | 76.3 | Confident | 70.1 | Confident | 102 Ų | 102 | 64.8 Ų | 64.8 | 71% | 0.713 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -63.9 | -33.2 | 178.4 | -56.7 | 0 | 0 | 0 | 0 | 113.1 | E265 T267 | E265-S269 VanDerWaalsContact O-CB 3.22Å; E265-S269 WeakPolarHBondContact O-CB 3.38Å; E265-S269 PolarHBondContact O-N 2.61Å; E265-S269 PolarHBondContact O-OG 3.28Å; T267-S269 VanDerWaalsContact C-N 3.33Å; T267-S269 PolarHBondContact O-N 3.02Å |
| 270 | N | 61.5 | Low | 68.4 | Low | 55 Ų | 55 | 66 Ų | 66 | 29% | 0.294 | 38% | 0.378 | S | S | . | . | G | 310 helix | trans | -86.6 | -0.1 | -179.5 | -170.7 | 69.8 | 0 | 0 | 0 | 113.5 | E266 T267 D268 G272 S273 | E266-N270 WeakPolarHBondContact O-CB 3.42Å; E266-N270 PolarHBondContact O-N 3.21Å; T267-N270 PolarHBondContact O-N 2.97Å; D268-N270 VanDerWaalsContact C-N 3.3Å; D268-N270 PolarHBondContact O-N 3.44Å; N270-G272 PolarHBondContact O-N 3.11Å; N270-S273 PolarHBondContact O-N 3.01Å |
| 271 | T | 57.3 | Low | 66.4 | Low | 91 Ų | 91 | 69.1 Ų | 69.1 | 56% | 0.558 | 40% | 0.404 | S | S | * | . | G | 310 helix | trans | -60.5 | -17.9 | 178.2 | 55.3 | 0 | 0 | 0 | 0 | 114.4 | L216 T267 D268 S273 | L216-T271 HydrophobicContact CD2-CG2 3.58Å; T267-T271 WeakPolarHBondContact O-CG2 3.23Å; T267-T271 PolarHBondContact O-N 3.17Å; D268-T271 WeakPolarHBondContact O-CB 3.31Å; D268-T271 WeakPolarHBondContact O-CG2 3.37Å; D268-T271 PolarHBondContact O-N 3.13Å; D268-T271 PolarHBondContact O-OG1 2.89Å; T271-S273 PolarHBondContact O-N 2.93Å |
| 272 | G | 50.8 | Low | 64.4 | Low | 78 Ų | 78 | 70.8 Ų | 70.8 | 80% | 0.804 | 42% | 0.424 | S | S | * | . | G | 310 helix | trans | -69.1 | -10.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | N270 | N270-G272 PolarHBondContact O-N 3.11Š|
| 273 | S | 41.6 | Very low | 62.5 | Low | 47 Ų | 47 | 71.7 Ų | 71.7 | 33% | 0.329 | 43% | 0.43 | S | S | . | . | trans | -146.9 | 116 | 175 | -176.1 | 0 | 0 | 0 | 0 | 112.3 | N270 T271 T275 | N270-S273 PolarHBondContact O-N 3.01Å; T271-S273 PolarHBondContact O-N 2.93Å; S273-T275 PolarHBondContact O-N 2.98Å; S273-T275 VanDerWaalsContact O-N 3.17Å; S273-T275 PolarHBondContact OG-OG1 3.44Å | ||
| 274 | P | 48.6 | Very low | 61.1 | Low | 102 Ų | 102 | 74.4 Ų | 74.4 | 66% | 0.662 | 46% | 0.46 | S | S | * | . | G | 310 helix | trans | -68.5 | -16 | -175.7 | 26.9 | -34.3 | 0 | 0 | 0 | 113.9 | N276 | P274-N276 PolarHBondContact O-N 2.61Š|
| 275 | T | 49.6 | Very low | 59.3 | Low | 87 Ų | 87 | 83.7 Ų | 83.7 | 53% | 0.534 | 50% | 0.495 | S | S | . | . | G | 310 helix | trans | -79.7 | -3.7 | -162.4 | 60.4 | 0 | 0 | 0 | 0 | 116.5 | S273 K279 | S273-T275 PolarHBondContact O-N 2.98Å; S273-T275 VanDerWaalsContact O-N 3.17Å; S273-T275 PolarHBondContact OG-OG1 3.44Å; T275-K279 VanDerWaalsContact O-CE 3.23Å; T275-K279 WeakPolarHBondContact O-CE 3.43Å; T275-K279 PolarHBondContact O-NZ 3.22Å |
| 276 | N | 45.7 | Very low | 57.6 | Low | 75 Ų | 75 | 89.2 Ų | 89.2 | 40% | 0.401 | 52% | 0.518 | S | S | . | . | G | 310 helix | trans | -107.1 | -15.8 | 176.9 | -85.8 | -31.8 | 0 | 0 | 0 | 114.3 | P274 K279 | P274-N276 PolarHBondContact O-N 2.61Å; N276-K279 PolarHBondContact OD1-NZ 2.8Å |
| 277 | L | 51.1 | Low | 56.1 | Low | 57 Ų | 57 | 92.8 Ų | 92.8 | 30% | 0.298 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -77.3 | -40.3 | -169.1 | -151 | 59 | 0 | 0 | 0 | 112.2 | F218 K279 I280 A281 | F218-L277 HydrophobicContact CE2-CD2 4.04Å; F218-L277 HydrophobicContact CZ-CD1 3.95Å; F218-L277 HydrophobicContact CZ-CD2 3.7Å; F218-L277 HydrophobicContact CZ-CG 3.8Å; L277-K279 PolarHBondContact O-N 3.09Å; L277-I280 PolarHBondContact O-N 3.21Å; L277-A281 PolarHBondContact O-N 2.89Å |
| 278 | D | 50.3 | Low | 54.9 | Low | 120 Ų | 120 | 102.1 Ų | 102.1 | 64% | 0.642 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -56.4 | -34.3 | 176.3 | -59.4 | -54.8 | 0 | 0 | 0 | 112.9 | I280 A281 A282 | D278-I280 VanDerWaalsContact C-N 3.25Å; D278-I280 PolarHBondContact O-N 3.19Å; D278-A281 PolarHBondContact O-N 2.89Å; D278-A282 WeakPolarHBondContact O-CB 3.11Å; D278-A282 PolarHBondContact O-N 3.04Å |
| 279 | K | 51 | Low | 54.1 | Low | 123 Ų | 123 | 109.2 Ų | 109.2 | 54% | 0.535 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -66.5 | -27.5 | -179.8 | -58.8 | 174 | -168.9 | 159.3 | 0 | 112.3 | T275 N276 L277 | T275-K279 VanDerWaalsContact O-CE 3.23Å; T275-K279 WeakPolarHBondContact O-CE 3.43Å; T275-K279 PolarHBondContact O-NZ 3.22Å; N276-K279 PolarHBondContact OD1-NZ 2.8Å; L277-K279 PolarHBondContact O-N 3.09Å |
| 280 | I | 55 | Low | 53.9 | Low | 75 Ų | 75 | 115.1 Ų | 115.1 | 39% | 0.385 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -80 | -41.7 | 178.2 | -59.1 | 175.9 | 0 | 0 | 0 | 109.9 | A226 L277 D278 A282 | A226-I280 HydrophobicContact CB-CG2 4.06Å; L277-I280 PolarHBondContact O-N 3.21Å; D278-I280 VanDerWaalsContact C-N 3.25Å; D278-I280 PolarHBondContact O-N 3.19Å; I280-A282 VanDerWaalsContact C-N 3.34Å; I280-A282 PolarHBondContact O-N 3.41Å |
| 281 | A | 53.9 | Low | 54.8 | Low | 66 Ų | 66 | 116.1 Ų | 116.1 | 55% | 0.545 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -64.2 | -36 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | L277 D278 Q283 | L277-A281 PolarHBondContact O-N 2.89Å; D278-A281 PolarHBondContact O-N 2.89Å; A281-Q283 PolarHBondContact O-N 3.04Å |
| 282 | A | 50.1 | Low | 56 | Low | 82 Ų | 82 | 116.9 Ų | 116.9 | 68% | 0.678 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -17.6 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | D278 I280 G284 | D278-A282 WeakPolarHBondContact O-CB 3.11Å; D278-A282 PolarHBondContact O-N 3.04Å; I280-A282 VanDerWaalsContact C-N 3.34Å; I280-A282 PolarHBondContact O-N 3.41Å; A282-G284 PolarHBondContact O-N 3.28Å |
| 283 | Q | 50.8 | Low | 57.7 | Low | 117 Ų | 117 | 115.4 Ų | 115.4 | 55% | 0.547 | 59% | 0.594 | S | S | . | * | trans | -80.7 | 57.9 | -176 | -71.1 | -152.5 | 17.2 | 0 | 0 | 114.3 | A281 R285 | A281-Q283 PolarHBondContact O-N 3.04Å; Q283-R285 PolarHBondContact O-N 2.74Å | ||
| 284 | G | 60.8 | Low | 60 | Low | 65 Ų | 65 | 120.1 Ų | 120.1 | 67% | 0.67 | 61% | 0.611 | S | S | * | * | trans | -63.8 | 102.9 | 177 | 0 | 0 | 0 | 0 | 0 | 113.8 | A282 | A282-G284 PolarHBondContact O-N 3.28Š| ||
| 285 | R | 52.5 | Low | 62 | Low | 195 Ų | 195 | 121.4 Ų | 121.4 | 74% | 0.736 | 62% | 0.617 | S | S | * | * | trans | -121.1 | 151 | 164.7 | -80.4 | -172.8 | -86.9 | -148.1 | -4.1 | 112.3 | Q283 R287 | Q283-R285 PolarHBondContact O-N 2.74Å; R285-R287 PolarHBondContact O-N 3.16Å; R285-R287 VanDerWaalsContact O-N 3.17Å | ||
| 286 | K | 55.6 | Low | 63.9 | Low | 211 Ų | 211 | 120.1 Ų | 120.1 | 92% | 0.917 | 62% | 0.621 | S | S | * | * | trans | -69.6 | 109.2 | -154.4 | -68.1 | 175.1 | 179.5 | 172.5 | 0 | 113.6 | K288 | K286-K288 PolarHBondContact O-N 3.2Š| ||
| 287 | R | 52.3 | Low | 66.2 | Low | 149 Ų | 149 | 117.9 Ų | 117.9 | 56% | 0.562 | 61% | 0.61 | S | S | * | * | trans | -48.5 | 130.7 | 162.1 | 175.1 | 179 | 166.6 | -159.1 | -5.1 | 110.7 | V234 S236 R285 K289 | V234-R287 HydrophobicContact CG1-CB 4.14Å; V234-R287 HydrophobicContact CG1-CG 4.22Å; S236-R287 VanDerWaalsContact CB-NH2 3.29Å; R285-R287 PolarHBondContact O-N 3.16Å; R285-R287 VanDerWaalsContact O-N 3.17Å; R287-K289 PolarHBondContact O-N 3.4Å | ||
| 288 | K | 59.5 | Low | 68.2 | Low | 203 Ų | 203 | 119.2 Ų | 119.2 | 88% | 0.883 | 61% | 0.613 | S | S | * | * | trans | -60.9 | 111.4 | 177.5 | -169.2 | 165.1 | -176.9 | 171.6 | 0 | 110.1 | K286 | K286-K288 PolarHBondContact O-N 3.2Š| ||
| 289 | K | 61.5 | Low | 70.3 | Confident | 193 Ų | 193 | 114.8 Ų | 114.8 | 84% | 0.839 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 132.5 | 179.1 | -168.9 | 175.6 | -179.2 | -179.3 | 0 | 108.9 | R287 | R287-K289 PolarHBondContact O-N 3.4Š|
| 290 | R | 73.2 | Confident | 72.3 | Confident | 226 Ų | 226 | 110.8 Ų | 110.8 | 85% | 0.853 | 59% | 0.586 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 132.5 | 169.8 | 167 | -178.4 | -82.6 | -164.7 | -4.1 | 108.4 | S292 | R290-S292 PolarHBondContact O-N 2.82Š|
| 291 | T | 80.6 | Confident | 74.2 | Confident | 76 Ų | 76 | 107.2 Ų | 107.2 | 47% | 0.466 | 57% | 0.567 | S | S | . | * | P | Polyproline II helix | trans | -58.1 | 116.8 | 167.6 | -41.6 | 0 | 0 | 0 | 0 | 109.2 | V329 | T291-V329 HydrophobicContact CG2-CG1 4.23Å; T291-V329 HydrophobicContact CG2-CG2 4.08Å |
| 292 | S | 82.3 | Confident | 76.2 | Confident | 107 Ų | 107 | 106.8 Ų | 106.8 | 75% | 0.748 | 55% | 0.554 | S | S | * | * | P | Polyproline II helix | trans | -78 | 141.1 | 167.8 | -160.9 | 0 | 0 | 0 | 0 | 108.2 | R290 | R290-S292 PolarHBondContact O-N 2.82Š|
| 293 | I | 85.9 | Confident | 78.4 | Confident | 48 Ų | 48 | 108 Ų | 108 | 25% | 0.246 | 55% | 0.549 | C | S | . | . | trans | -111.7 | 123.4 | 174.1 | -60.9 | 170 | 0 | 0 | 0 | 106.2 | V297 K298 L301 V329 W333 | I293-V297 HydrophobicContact CG2-CB 3.99Å; I293-V297 HydrophobicContact CG2-CG1 3.77Å; I293-K298 HydrophobicContact CG2-CB 4.26Å; I293-L301 HydrophobicContact CG2-CD1 4.22Å; I293-V329 HydrophobicContact CD1-CG1 3.82Å; I293-V329 HydrophobicContact CG1-CG1 4.1Å; I293-W333 HydrophobicContact CD1-CB 4.41Å; I293-W333 HydrophobicContact CD1-CG 4.31Å | ||
| 294 | E | 90.5 | Very high | 80.5 | Confident | 146 Ų | 146 | 104.7 Ų | 104.7 | 68% | 0.682 | 53% | 0.534 | S | S | * | . | trans | -66.1 | 158.7 | -177.7 | -61.1 | -174.4 | 173.2 | 0 | 0 | 112.2 | G296 V297 K298 | E294-G296 PolarHBondContact O-N 3.29Å; E294-V297 HydrophobicContact CB-CB 4.48Å; E294-V297 HydrophobicContact CB-CG2 4.27Å; E294-V297 PolarHBondContact O-N 3.33Å; E294-K298 WeakPolarHBondContact O-CB 3.34Å; E294-K298 PolarHBondContact O-N 3.18Å | ||
| 295 | V | 89.9 | Confident | 82.1 | Confident | 129 Ų | 129 | 101.8 Ų | 101.8 | 78% | 0.782 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.4 | -41.7 | -174.6 | -175.7 | 0 | 0 | 0 | 0 | 111.7 | K298 G299 | V295-K298 PolarHBondContact O-N 2.89Å; V295-G299 PolarHBondContact O-N 3.44Å |
| 296 | G | 89.9 | Confident | 84.1 | Confident | 60 Ų | 60 | 98.8 Ų | 98.8 | 62% | 0.619 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.1 | -46.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | E294 K298 G299 A300 | E294-G296 PolarHBondContact O-N 3.29Å; G296-K298 VanDerWaalsContact C-N 3.33Å; G296-K298 PolarHBondContact O-N 3.38Å; G296-G299 PolarHBondContact O-N 3.44Å; G296-G299 VanDerWaalsContact O-N 3.1Å; G296-A300 PolarHBondContact O-N 3.06Å |
| 297 | V | 92.8 | Very high | 85.9 | Confident | 28 Ų | 28 | 97.5 Ų | 97.5 | 17% | 0.17 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -62.2 | -40.6 | 176.9 | 179.5 | 0 | 0 | 0 | 0 | 111.4 | I293 E294 A300 L301 L323 L325 | I293-V297 HydrophobicContact CG2-CB 3.99Å; I293-V297 HydrophobicContact CG2-CG1 3.77Å; E294-V297 HydrophobicContact CB-CB 4.48Å; E294-V297 HydrophobicContact CB-CG2 4.27Å; E294-V297 PolarHBondContact O-N 3.33Å; V297-A300 PolarHBondContact O-N 3.41Å; V297-L301 HydrophobicContact CG1-CD1 4.28Å; V297-L301 WeakPolarHBondContact O-CG 3.4Å; V297-L301 PolarHBondContact O-N 3.43Å; V297-L323 HydrophobicContact CG1-CB 4.03Å; V297-L323 HydrophobicContact CG1-CD1 4.25Å; V297-L323 HydrophobicContact CG1-CD2 4.38Å; V297-L323 HydrophobicContact CG1-CG 4.46Å; V297-L325 HydrophobicContact CG1-CD1 3.64Å; V297-L325 HydrophobicContact CG1-CG 4.1Å |
| 298 | K | 93.2 | Very high | 87.7 | Confident | 85 Ų | 85 | 92 Ų | 92 | 37% | 0.37 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -59.9 | -43.7 | 172.1 | 176.3 | -175.1 | 171.1 | -71.7 | 0 | 111.5 | I293 E294 V295 G296 L301 E302 | I293-K298 HydrophobicContact CG2-CB 4.26Å; E294-K298 WeakPolarHBondContact O-CB 3.34Å; E294-K298 PolarHBondContact O-N 3.18Å; V295-K298 PolarHBondContact O-N 2.89Å; G296-K298 VanDerWaalsContact C-N 3.33Å; G296-K298 PolarHBondContact O-N 3.38Å; K298-L301 PolarHBondContact O-N 3Å; K298-E302 VanDerWaalsContact CE-OE1 3.31Å; K298-E302 WeakPolarHBondContact CE-OE1 3.09Å; K298-E302 IonicContact NZ-OE1 2.86Å; K298-E302 PolarHBondContact NZ-OE1 2.92Å; K298-E302 IonicContact NZ-OE2 2.61Å; K298-E302 PolarHBondContact NZ-OE2 3.31Å; K298-E302 WeakPolarHBondContact O-CG 3.38Å; K298-E302 PolarHBondContact O-N 3.14Å |
| 299 | G | 93.9 | Very high | 89.2 | Confident | 27 Ų | 27 | 85 Ų | 85 | 28% | 0.278 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -61.4 | -42.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | V295 G296 L301 E302 N303 | V295-G299 PolarHBondContact O-N 3.44Å; G296-G299 PolarHBondContact O-N 3.44Å; G296-G299 VanDerWaalsContact O-N 3.1Å; G299-L301 PolarHBondContact O-N 3.3Å; G299-E302 PolarHBondContact O-N 3.39Å; G299-N303 WeakPolarHBondContact O-CB 3.45Å; G299-N303 PolarHBondContact O-N 3.09Å; G299-N303 PolarHBondContact O-ND2 2.96Å |
| 300 | A | 93.7 | Very high | 90.8 | Very high | 39 Ų | 39 | 83.7 Ų | 83.7 | 32% | 0.322 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.3 | -42 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G296 V297 N303 H304 L323 | G296-A300 PolarHBondContact O-N 3.06Å; V297-A300 PolarHBondContact O-N 3.41Å; A300-N303 PolarHBondContact O-N 2.89Å; A300-H304 PolarHBondContact O-N 2.99Å; A300-L323 HydrophobicContact CB-CD2 3.69Å |
| 301 | L | 95.7 | Very high | 91.8 | Very high | 0 Ų | 0 | 73.5 Ų | 73.5 | 0% | 0 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -64.6 | -39.3 | 174.6 | -70.7 | 168.1 | 0 | 0 | 0 | 112.4 | I293 V297 K298 G299 H304 F305 L323 L325 V330 W333 F334 | I293-L301 HydrophobicContact CG2-CD1 4.22Å; V297-L301 HydrophobicContact CG1-CD1 4.28Å; V297-L301 WeakPolarHBondContact O-CG 3.4Å; V297-L301 PolarHBondContact O-N 3.43Å; K298-L301 PolarHBondContact O-N 3Å; G299-L301 PolarHBondContact O-N 3.3Å; L301-H304 PolarHBondContact O-N 3.44Å; L301-F305 WeakPolarHBondContact O-CB 3.36Å; L301-F305 PolarHBondContact O-N 2.8Å; L301-L323 HydrophobicContact CD2-CD1 3.57Å; L301-L323 HydrophobicContact CG-CD1 3.73Å; L301-L325 HydrophobicContact CD1-CD1 4.13Å; L301-V330 HydrophobicContact CD2-CG1 4.11Å; L301-W333 VanDerWaalsContact C-CH2 3.45Å; L301-W333 HydrophobicContact CB-CD2 3.96Å; L301-W333 HydrophobicContact CB-CE3 3.87Å; L301-W333 HydrophobicContact CB-CH2 3.71Å; L301-W333 HydrophobicContact CB-CZ2 3.78Å; L301-W333 HydrophobicContact CB-CZ3 3.74Å; L301-W333 HydrophobicContact CD1-CD2 3.92Å; L301-W333 HydrophobicContact CD1-CE3 4.38Å; L301-W333 HydrophobicContact CD1-CG 3.96Å; L301-W333 HydrophobicContact CD2-CE3 4.31Å; L301-W333 HydrophobicContact CG-CD2 4.4Å; L301-W333 HydrophobicContact CG-CE3 4.42Å; L301-W333 WeakPolarHBondContact O-CH2 3.29Å; L301-W333 WeakPolarHBondContact O-CZ3 3.29Å; L301-F334 HydrophobicContact CD2-CE2 3.82Å; L301-F334 HydrophobicContact CD2-CZ 4.5Å |
| 302 | E | 95.4 | Very high | 92.6 | Very high | 57 Ų | 57 | 72.3 Ų | 72.3 | 27% | 0.266 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -68.2 | -39.4 | 175.9 | -72.1 | 176.4 | 153.5 | 0 | 0 | 112 | K298 G299 H304 F305 L306 W333 | K298-E302 VanDerWaalsContact CE-OE1 3.31Å; K298-E302 WeakPolarHBondContact CE-OE1 3.09Å; K298-E302 IonicContact NZ-OE1 2.86Å; K298-E302 PolarHBondContact NZ-OE1 2.92Å; K298-E302 IonicContact NZ-OE2 2.61Å; K298-E302 PolarHBondContact NZ-OE2 3.31Å; K298-E302 WeakPolarHBondContact O-CG 3.38Å; K298-E302 PolarHBondContact O-N 3.14Å; G299-E302 PolarHBondContact O-N 3.39Å; E302-H304 PolarHBondContact O-N 2.88Å; E302-F305 WeakPolarHBondContact O-CB 3.44Å; E302-F305 PolarHBondContact O-N 3.45Å; E302-L306 WeakPolarHBondContact O-CG 3.07Å; E302-L306 PolarHBondContact O-N 3.24Å; E302-L306 VanDerWaalsContact O-N 3.15Å; E302-W333 HydrophobicContact CG-CH2 3.81Å; E302-W333 HydrophobicContact CG-CZ2 3.58Å |
| 303 | N | 95.5 | Very high | 93.2 | Very high | 108 Ų | 108 | 71.1 Ų | 71.1 | 58% | 0.578 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -63.3 | -38.5 | 172.8 | -79.2 | -27.6 | 0 | 0 | 0 | 113 | G299 A300 | G299-N303 WeakPolarHBondContact O-CB 3.45Å; G299-N303 PolarHBondContact O-N 3.09Å; G299-N303 PolarHBondContact O-ND2 2.96Å; A300-N303 PolarHBondContact O-N 2.89Å |
| 304 | H | 94.8 | Very high | 93.7 | Very high | 47 Ų | 47 | 75.6 Ų | 75.6 | 22% | 0.218 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -71.8 | -35.5 | 173.7 | -164 | -69 | 0 | 0 | 0 | 112 | A300 L301 E302 L306 K307 C308 E315 L319 F334 | A300-H304 PolarHBondContact O-N 2.99Å; L301-H304 PolarHBondContact O-N 3.44Å; E302-H304 PolarHBondContact O-N 2.88Å; H304-L306 VanDerWaalsContact C-N 3.3Å; H304-L306 PolarHBondContact O-N 3.48Å; H304-K307 PolarHBondContact O-N 3.08Å; H304-K307 VanDerWaalsContact O-N 3.12Å; H304-C308 PolarHBondContact O-N 3.37Å; H304-E315 IonicContact CE1-OE1 3.65Å; H304-L319 HydrophobicContact CB-CD1 4.41Å; H304-L319 HydrophobicContact CB-CD2 4.4Å; H304-F334 HydrophobicContact CB-CZ 4.26Å; H304-F334 AromaticContact ND1-CZ 3.94Å |
| 305 | F | 95.6 | Very high | 93.9 | Very high | 4 Ų | 4 | 71.5 Ų | 71.5 | 2% | 0.018 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -60 | -38.9 | 177.5 | -175.3 | -84.2 | 0 | 0 | 0 | 112.5 | L301 E302 K307 C308 P309 W333 F334 R337 R338 E341 | L301-F305 WeakPolarHBondContact O-CB 3.36Å; L301-F305 PolarHBondContact O-N 2.8Å; E302-F305 WeakPolarHBondContact O-CB 3.44Å; E302-F305 PolarHBondContact O-N 3.45Å; F305-K307 VanDerWaalsContact C-N 3.27Å; F305-K307 PolarHBondContact O-N 2.93Å; F305-C308 CarbonylContact O-C 3.35Å; F305-C308 PolarHBondContact O-N 3.31Å; F305-P309 HydrophobicContact CE1-CB 4.18Å; F305-P309 HydrophobicContact CE1-CG 4.5Å; F305-P309 HydrophobicContact CE2-CB 4Å; F305-P309 HydrophobicContact CZ-CB 3.81Å; F305-P309 WeakPolarHBondContact O-CD 3.41Å; F305-P309 WeakPolarHBondContact O-CG 3.44Å; F305-W333 HydrophobicContact CB-CH2 4.03Å; F305-W333 HydrophobicContact CB-CZ3 4.06Å; F305-W333 HydrophobicContact CD2-CZ3 4.16Å; F305-W333 HydrophobicContact CG-CH2 4.48Å; F305-W333 HydrophobicContact CG-CZ3 4.47Å; F305-F334 HydrophobicContact CB-CE1 4.06Å; F305-F334 AromaticContact CD2-CD1 3.74Å; F305-F334 HydrophobicContact CD2-CD1 3.74Å; F305-F334 AromaticContact CD2-CE1 3.97Å; F305-F334 HydrophobicContact CD2-CE1 3.97Å; F305-F334 HydrophobicContact CE2-CD1 4.48Å; F305-R337 HydrophobicContact CB-CG 4.47Å; F305-R337 HydrophobicContact CD1-CG 4Å; F305-R337 HydrophobicContact CD2-CB 4.02Å; F305-R337 HydrophobicContact CD2-CG 3.43Å; F305-R337 VanDerWaalsContact CD2-CG 3.43Å; F305-R337 HydrophobicContact CE1-CG 4.11Å; F305-R337 HydrophobicContact CE2-CB 4Å; F305-R337 HydrophobicContact CE2-CG 3.54Å; F305-R337 HydrophobicContact CG-CG 3.68Å; F305-R337 HydrophobicContact CZ-CG 3.89Å; F305-R338 HydrophobicContact CE2-CB 4.1Å; F305-R338 HydrophobicContact CZ-CB 4.32Å; F305-E341 VanDerWaalsContact CE1-OE1 3.26Å; F305-E341 WeakPolarHBondContact CE1-OE1 3.2Å; F305-E341 WeakPolarHBondContact CE1-OE2 3.24Å; F305-E341 VanDerWaalsContact CZ-OE2 3.28Å; F305-E341 WeakPolarHBondContact CZ-OE2 3.37Å |
| 306 | L | 93.8 | Very high | 94.2 | Very high | 132 Ų | 132 | 66.4 Ų | 66.4 | 69% | 0.691 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -63.6 | -30.6 | 175.9 | -68.3 | 171.7 | 0 | 0 | 0 | 113.1 | E302 H304 | E302-L306 WeakPolarHBondContact O-CG 3.07Å; E302-L306 PolarHBondContact O-N 3.24Å; E302-L306 VanDerWaalsContact O-N 3.15Å; H304-L306 VanDerWaalsContact C-N 3.3Å; H304-L306 PolarHBondContact O-N 3.48Å |
| 307 | K | 93.6 | Very high | 94.5 | Very high | 184 Ų | 184 | 65.2 Ų | 65.2 | 80% | 0.8 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -84.2 | -40.1 | 176.7 | -61.7 | -177.9 | -179 | -174.4 | 0 | 112.5 | H304 F305 | H304-K307 PolarHBondContact O-N 3.08Å; H304-K307 VanDerWaalsContact O-N 3.12Å; F305-K307 VanDerWaalsContact C-N 3.27Å; F305-K307 PolarHBondContact O-N 2.93Å |
| 308 | C | 90.2 | Very high | 94.6 | Very high | 33 Ų | 33 | 67.4 Ų | 67.4 | 22% | 0.223 | 37% | 0.367 | C | S | . | . | trans | -144.7 | 97.6 | -177.5 | -174.4 | 0 | 0 | 0 | 0 | 110.4 | H304 F305 K310 P311 E315 | H304-C308 PolarHBondContact O-N 3.37Å; F305-C308 CarbonylContact O-C 3.35Å; F305-C308 PolarHBondContact O-N 3.31Å; C308-K310 PolarHBondContact O-N 3.39Å; C308-P311 WeakPolarHBondContact O-CD 3.38Å; C308-P311 VanDerWaalsContact SG-CA 3.59Å; C308-E315 PolarHBondContact SG-OE1 2.96Å; C308-E315 VanDerWaalsContact SG-OE1 3.37Å | ||
| 309 | P | 92.2 | Very high | 94.7 | Very high | 55 Ų | 55 | 64.4 Ų | 64.4 | 36% | 0.357 | 36% | 0.355 | S | S | . | . | S | Bend | trans | -72.1 | -7.2 | 177.8 | -21.6 | 33.5 | 0 | 0 | 0 | 115.2 | F305 R338 | F305-P309 HydrophobicContact CE1-CB 4.18Å; F305-P309 HydrophobicContact CE1-CG 4.5Å; F305-P309 HydrophobicContact CE2-CB 4Å; F305-P309 HydrophobicContact CZ-CB 3.81Å; F305-P309 WeakPolarHBondContact O-CD 3.41Å; F305-P309 WeakPolarHBondContact O-CG 3.44Å; P309-R338 PolarHBondContact O-NH1 3.37Å |
| 310 | K | 94.3 | Very high | 94.8 | Very high | 166 Ų | 166 | 63.4 Ų | 63.4 | 72% | 0.722 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -139 | 62.3 | -178.1 | -63 | 179.5 | -174.4 | 169.9 | 0 | 110.6 | C308 | C308-K310 PolarHBondContact O-N 3.39Š|
| 311 | P | 93.9 | Very high | 94.9 | Very high | 13 Ų | 13 | 64.2 Ų | 64.2 | 8% | 0.084 | 36% | 0.356 | C | S | . | . | trans | -61.3 | 143.5 | 179.6 | 28.5 | -36.1 | 0 | 0 | 0 | 111.2 | C308 E315 I316 F334 | C308-P311 WeakPolarHBondContact O-CD 3.38Å; C308-P311 VanDerWaalsContact SG-CA 3.59Å; P311-E315 HydrophobicContact CB-CB 3.72Å; P311-I316 HydrophobicContact CB-CG1 4.1Å; P311-I316 HydrophobicContact CG-CD1 4.24Å; P311-I316 HydrophobicContact CG-CG1 3.83Å; P311-I316 WeakPolarHBondContact O-CD1 3.43Å; P311-F334 VanDerWaalsContact CD-CD1 3.41Å; P311-F334 HydrophobicContact CG-CB 4.49Å; P311-F334 HydrophobicContact CG-CD1 3.56Å; P311-F334 HydrophobicContact CG-CD2 3.9Å; P311-F334 HydrophobicContact CG-CE1 3.62Å; P311-F334 HydrophobicContact CG-CE2 3.97Å; P311-F334 HydrophobicContact CG-CG 3.72Å; P311-F334 HydrophobicContact CG-CZ 3.83Å | ||
| 312 | S | 96.6 | Very high | 94.8 | Very high | 51 Ų | 51 | 69.4 Ų | 69.4 | 36% | 0.357 | 39% | 0.388 | S | S | . | . | trans | -64.4 | 166.4 | 174.2 | 65.6 | 0 | 0 | 0 | 0 | 112.5 | H314 E315 I316 | S312-H314 PolarHBondContact O-N 3.02Å; S312-E315 WeakPolarHBondContact CB-OE2 3.46Å; S312-E315 PolarHBondContact N-OE2 3.2Å; S312-E315 PolarHBondContact O-N 3.38Å; S312-E315 PolarHBondContact OG-N 2.91Å; S312-E315 PolarHBondContact OG-OE2 2.85Å; S312-I316 WeakPolarHBondContact O-CB 3.21Å; S312-I316 VanDerWaalsContact O-CG1 3.29Å; S312-I316 WeakPolarHBondContact O-CG1 3.32Å; S312-I316 PolarHBondContact O-N 2.84Å | ||
| 313 | A | 95.4 | Very high | 94.8 | Very high | 81 Ų | 81 | 68 Ų | 68 | 67% | 0.669 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -60.8 | -24.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | S317 | A313-S317 WeakPolarHBondContact O-CB 3.05Å; A313-S317 PolarHBondContact O-N 3.09Å; A313-S317 PolarHBondContact O-OG 3.3Å |
| 314 | H | 96 | Very high | 94.7 | Very high | 142 Ų | 142 | 71.8 Ų | 71.8 | 66% | 0.657 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -74.5 | -53.5 | 173.3 | -174.3 | 82.7 | 0 | 0 | 0 | 111 | S312 I316 S317 T318 | S312-H314 PolarHBondContact O-N 3.02Å; H314-I316 VanDerWaalsContact C-N 3.29Å; H314-I316 PolarHBondContact O-N 3.21Å; H314-S317 WeakPolarHBondContact O-CA 3.4Å; H314-S317 VanDerWaalsContact O-CB 3.28Å; H314-S317 WeakPolarHBondContact O-CB 3.26Å; H314-S317 PolarHBondContact O-N 3.17Å; H314-T318 PolarHBondContact O-N 3.38Å; H314-T318 PolarHBondContact O-OG1 3.41Å |
| 315 | E | 95.2 | Very high | 94.6 | Very high | 61 Ų | 61 | 71 Ų | 71 | 29% | 0.285 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -55.6 | -42.3 | 175.2 | -73 | 156.8 | 84.3 | 0 | 0 | 112.3 | H304 C308 P311 S312 S317 T318 L319 | H304-E315 IonicContact CE1-OE1 3.65Å; C308-E315 PolarHBondContact SG-OE1 2.96Å; C308-E315 VanDerWaalsContact SG-OE1 3.37Å; P311-E315 HydrophobicContact CB-CB 3.72Å; S312-E315 WeakPolarHBondContact CB-OE2 3.46Å; S312-E315 PolarHBondContact N-OE2 3.2Å; S312-E315 PolarHBondContact O-N 3.38Å; S312-E315 PolarHBondContact OG-N 2.91Å; S312-E315 PolarHBondContact OG-OE2 2.85Å; E315-S317 VanDerWaalsContact C-N 3.28Å; E315-S317 PolarHBondContact O-N 2.91Å; E315-T318 PolarHBondContact O-N 3.5Å; E315-L319 WeakPolarHBondContact O-CB 3.39Å; E315-L319 WeakPolarHBondContact O-CG 3.41Å; E315-L319 PolarHBondContact O-N 3.47Å |
| 316 | I | 96.2 | Very high | 94.5 | Very high | 21 Ų | 21 | 77 Ų | 77 | 11% | 0.108 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -60.8 | -37.8 | 174.6 | -70.1 | 169.1 | 0 | 0 | 0 | 111.2 | P311 S312 H314 A320 V330 R331 | P311-I316 HydrophobicContact CB-CG1 4.1Å; P311-I316 HydrophobicContact CG-CD1 4.24Å; P311-I316 HydrophobicContact CG-CG1 3.83Å; P311-I316 WeakPolarHBondContact O-CD1 3.43Å; S312-I316 WeakPolarHBondContact O-CB 3.21Å; S312-I316 VanDerWaalsContact O-CG1 3.29Å; S312-I316 WeakPolarHBondContact O-CG1 3.32Å; S312-I316 PolarHBondContact O-N 2.84Å; H314-I316 VanDerWaalsContact C-N 3.29Å; H314-I316 PolarHBondContact O-N 3.21Å; I316-A320 WeakPolarHBondContact O-CB 3.47Å; I316-A320 PolarHBondContact O-N 3.38Å; I316-V330 HydrophobicContact CG2-CB 4.22Å; I316-V330 HydrophobicContact CG2-CG1 4.09Å; I316-R331 HydrophobicContact CD1-CB 4.4Å; I316-R331 HydrophobicContact CD1-CG 4.23Å; I316-R331 HydrophobicContact CG2-CB 4.23Å |
| 317 | S | 96.5 | Very high | 94.6 | Very high | 36 Ų | 36 | 76.3 Ų | 76.3 | 25% | 0.252 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -68.7 | -40.9 | 176.3 | -65.6 | 0 | 0 | 0 | 0 | 112.3 | A313 H314 E315 G321 K327 | A313-S317 WeakPolarHBondContact O-CB 3.05Å; A313-S317 PolarHBondContact O-N 3.09Å; A313-S317 PolarHBondContact O-OG 3.3Å; H314-S317 WeakPolarHBondContact O-CA 3.4Å; H314-S317 VanDerWaalsContact O-CB 3.28Å; H314-S317 WeakPolarHBondContact O-CB 3.26Å; H314-S317 PolarHBondContact O-N 3.17Å; E315-S317 VanDerWaalsContact C-N 3.28Å; E315-S317 PolarHBondContact O-N 2.91Å; S317-G321 PolarHBondContact O-N 3.01Å; S317-K327 WeakPolarHBondContact OG-CE 3.45Å; S317-K327 PolarHBondContact OG-NZ 3.48Å |
| 318 | T | 96.1 | Very high | 94.6 | Very high | 73 Ų | 73 | 71.5 Ų | 71.5 | 45% | 0.448 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -67.7 | -48.3 | 178 | -54.9 | 0 | 0 | 0 | 0 | 111 | H314 E315 A320 G321 T322 | H314-T318 PolarHBondContact O-N 3.38Å; H314-T318 PolarHBondContact O-OG1 3.41Å; E315-T318 PolarHBondContact O-N 3.5Å; T318-A320 VanDerWaalsContact C-N 3.32Å; T318-A320 PolarHBondContact O-N 3.49Å; T318-G321 PolarHBondContact O-N 3.31Å; T318-G321 VanDerWaalsContact O-N 3.11Å; T318-T322 PolarHBondContact O-N 3.35Å; T318-T322 PolarHBondContact O-OG1 3.43Å |
| 319 | L | 95.2 | Very high | 94.9 | Very high | 23 Ų | 23 | 70.9 Ų | 70.9 | 12% | 0.12 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -58 | -42 | 174.6 | -76.5 | 170.8 | 0 | 0 | 0 | 112.5 | H304 E315 G321 T322 L323 V330 F334 | H304-L319 HydrophobicContact CB-CD1 4.41Å; H304-L319 HydrophobicContact CB-CD2 4.4Å; E315-L319 WeakPolarHBondContact O-CB 3.39Å; E315-L319 WeakPolarHBondContact O-CG 3.41Å; E315-L319 PolarHBondContact O-N 3.47Å; L319-G321 VanDerWaalsContact C-N 3.32Å; L319-G321 PolarHBondContact O-N 2.82Å; L319-T322 PolarHBondContact O-N 3.34Å; L319-L323 HydrophobicContact CD2-CD1 4.37Å; L319-L323 WeakPolarHBondContact O-CB 3.44Å; L319-L323 VanDerWaalsContact O-CG 3.26Å; L319-L323 WeakPolarHBondContact O-CG 3.38Å; L319-L323 PolarHBondContact O-N 3.38Å; L319-V330 HydrophobicContact CB-CG1 4.24Å; L319-F334 HydrophobicContact CD1-CE2 3.83Å; L319-F334 HydrophobicContact CD1-CZ 3.94Å |
| 320 | A | 95.9 | Very high | 95 | Very high | 5 Ų | 5 | 68.3 Ų | 68.3 | 4% | 0.041 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -58.8 | -43 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | I316 T318 Q324 L325 K327 V330 | I316-A320 WeakPolarHBondContact O-CB 3.47Å; I316-A320 PolarHBondContact O-N 3.38Å; T318-A320 VanDerWaalsContact C-N 3.32Å; T318-A320 PolarHBondContact O-N 3.49Å; A320-Q324 WeakPolarHBondContact O-CA 3.19Å; A320-Q324 PolarHBondContact O-N 3.49Å; A320-Q324 VanDerWaalsContact O-N 3.07Å; A320-L325 WeakPolarHBondContact CB-O 3.41Å; A320-L325 PolarHBondContact O-N 3Å; A320-K327 HydrophobicContact CB-CB 4.35Å; A320-K327 HydrophobicContact CB-CG 3.76Å; A320-V330 HydrophobicContact CB-CG2 4.05Å |
| 321 | G | 95.1 | Very high | 95.2 | Very high | 56 Ų | 56 | 65.9 Ų | 65.9 | 58% | 0.577 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -63.4 | -53.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113 | S317 T318 L319 L323 Q324 | S317-G321 PolarHBondContact O-N 3.01Å; T318-G321 PolarHBondContact O-N 3.31Å; T318-G321 VanDerWaalsContact O-N 3.11Å; L319-G321 VanDerWaalsContact C-N 3.32Å; L319-G321 PolarHBondContact O-N 2.82Å; G321-L323 VanDerWaalsContact C-N 3.29Å; G321-L323 PolarHBondContact O-N 3.48Å; G321-Q324 PolarHBondContact O-N 2.98Å |
| 322 | T | 94.4 | Very high | 95.2 | Very high | 110 Ų | 110 | 67.8 Ų | 67.8 | 68% | 0.675 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -62 | -34.7 | -178.6 | -52.3 | 0 | 0 | 0 | 0 | 113 | T318 L319 | T318-T322 PolarHBondContact O-N 3.35Å; T318-T322 PolarHBondContact O-OG1 3.43Å; L319-T322 PolarHBondContact O-N 3.34Å |
| 323 | L | 93.8 | Very high | 95.2 | Very high | 28 Ų | 28 | 66.9 Ų | 66.9 | 15% | 0.147 | 36% | 0.358 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.7 | 3.8 | -177 | -59.3 | 175.6 | 0 | 0 | 0 | 113.8 | V297 A300 L301 L319 G321 L325 | V297-L323 HydrophobicContact CG1-CB 4.03Å; V297-L323 HydrophobicContact CG1-CD1 4.25Å; V297-L323 HydrophobicContact CG1-CD2 4.38Å; V297-L323 HydrophobicContact CG1-CG 4.46Å; A300-L323 HydrophobicContact CB-CD2 3.69Å; L301-L323 HydrophobicContact CD2-CD1 3.57Å; L301-L323 HydrophobicContact CG-CD1 3.73Å; L319-L323 HydrophobicContact CD2-CD1 4.37Å; L319-L323 WeakPolarHBondContact O-CB 3.44Å; L319-L323 VanDerWaalsContact O-CG 3.26Å; L319-L323 WeakPolarHBondContact O-CG 3.38Å; L319-L323 PolarHBondContact O-N 3.38Å; G321-L323 VanDerWaalsContact C-N 3.29Å; G321-L323 PolarHBondContact O-N 3.48Å; L323-L325 HydrophobicContact CB-CD1 4.49Å; L323-L325 HydrophobicContact CB-CG 4.3Å; L323-L325 PolarHBondContact O-N 3.04Å |
| 324 | Q | 93.1 | Very high | 95.3 | Very high | 186 Ų | 186 | 63.1 Ų | 63.1 | 87% | 0.869 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.1 | 36.4 | -176.5 | -54.9 | -174 | 11.3 | 0 | 0 | 113.7 | A320 G321 | A320-Q324 WeakPolarHBondContact O-CA 3.19Å; A320-Q324 PolarHBondContact O-N 3.49Å; A320-Q324 VanDerWaalsContact O-N 3.07Å; G321-Q324 PolarHBondContact O-N 2.98Å |
| 325 | L | 93.8 | Very high | 95.2 | Very high | 30 Ų | 30 | 58.3 Ų | 58.3 | 16% | 0.157 | 31% | 0.308 | C | S | . | . | trans | -106.2 | 153.7 | 177.7 | -71 | -176 | 0 | 0 | 0 | 111.4 | V297 L301 A320 L323 V329 V330 | V297-L325 HydrophobicContact CG1-CD1 3.64Å; V297-L325 HydrophobicContact CG1-CG 4.1Å; L301-L325 HydrophobicContact CD1-CD1 4.13Å; A320-L325 WeakPolarHBondContact CB-O 3.41Å; A320-L325 PolarHBondContact O-N 3Å; L323-L325 HydrophobicContact CB-CD1 4.49Å; L323-L325 HydrophobicContact CB-CG 4.3Å; L323-L325 PolarHBondContact O-N 3.04Å; L325-V329 HydrophobicContact CD1-CG1 4.35Å; L325-V330 HydrophobicContact CB-CG2 3.76Å; L325-V330 HydrophobicContact CD1-CG2 3.96Å | ||
| 326 | E | 94.1 | Very high | 95.2 | Very high | 130 Ų | 130 | 59.6 Ų | 59.6 | 61% | 0.607 | 32% | 0.317 | S | S | * | . | trans | -63.4 | 137 | 166.8 | -174.5 | -175.4 | -174.3 | 0 | 0 | 110.5 | E328 V329 V330 | E326-E328 HydrophobicContact CG-CB 4.24Å; E326-E328 PolarHBondContact O-N 3.09Å; E326-E328 VanDerWaalsContact O-N 3.14Å; E326-V329 HydrophobicContact CB-CB 4.34Å; E326-V329 HydrophobicContact CB-CG2 3.95Å; E326-V329 WeakPolarHBondContact O-CB 3.33Å; E326-V329 PolarHBondContact O-N 3.06Å; E326-V330 PolarHBondContact O-N 2.88Å; E326-V330 VanDerWaalsContact O-N 3.16Å | ||
| 327 | K | 94.9 | Very high | 95.1 | Very high | 118 Ų | 118 | 60.9 Ų | 60.9 | 51% | 0.513 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -52.8 | -38 | 179.3 | -62.4 | -171.9 | 179.6 | -165.9 | 0 | 112.8 | S317 A320 V330 R331 | S317-K327 WeakPolarHBondContact OG-CE 3.45Å; S317-K327 PolarHBondContact OG-NZ 3.48Å; A320-K327 HydrophobicContact CB-CB 4.35Å; A320-K327 HydrophobicContact CB-CG 3.76Å; K327-V330 PolarHBondContact O-N 3.39Å; K327-R331 WeakPolarHBondContact O-CB 3.23Å; K327-R331 PolarHBondContact O-N 2.85Å |
| 328 | E | 94.6 | Very high | 95 | Very high | 83 Ų | 83 | 62.8 Ų | 62.8 | 39% | 0.388 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.7 | -38.5 | 177.2 | 178.4 | 58.9 | -172.1 | 0 | 0 | 112.3 | E326 R331 V332 | E326-E328 HydrophobicContact CG-CB 4.24Å; E326-E328 PolarHBondContact O-N 3.09Å; E326-E328 VanDerWaalsContact O-N 3.14Å; E328-R331 VanDerWaalsContact CD-NH2 3.28Å; E328-R331 PolarHBondContact O-N 3.47Å; E328-R331 IonicContact OE1-CZ 2.61Å; E328-R331 IonicContact OE1-NE 3.66Å; E328-R331 IonicContact OE1-NH2 3.55Å; E328-R331 PolarHBondContact OE1-NH2 2.88Å; E328-R331 IonicContact OE2-CZ 3.06Å; E328-R331 VanDerWaalsContact OE2-CZ 3.27Å; E328-R331 IonicContact OE2-NE 2.67Å; E328-R331 PolarHBondContact OE2-NE 3.05Å; E328-R331 IonicContact OE2-NH2 2.85Å; E328-R331 PolarHBondContact OE2-NH2 3.43Å; E328-V332 HydrophobicContact CG-CG2 4.31Å; E328-V332 VanDerWaalsContact O-CB 3.27Å; E328-V332 WeakPolarHBondContact O-CB 3.47Å; E328-V332 VanDerWaalsContact O-CG2 3.25Å; E328-V332 WeakPolarHBondContact O-CG2 3.41Å; E328-V332 PolarHBondContact O-N 2.68Å; E328-V332 WeakPolarHBondContact OE1-CG2 3.49Å |
| 329 | V | 95.1 | Very high | 94.7 | Very high | 21 Ų | 21 | 63.5 Ų | 63.5 | 13% | 0.127 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 176 | 174.4 | 0 | 0 | 0 | 0 | 110.5 | T291 I293 L325 E326 W333 | T291-V329 HydrophobicContact CG2-CG1 4.23Å; T291-V329 HydrophobicContact CG2-CG2 4.08Å; I293-V329 HydrophobicContact CD1-CG1 3.82Å; I293-V329 HydrophobicContact CG1-CG1 4.1Å; L325-V329 HydrophobicContact CD1-CG1 4.35Å; E326-V329 HydrophobicContact CB-CB 4.34Å; E326-V329 HydrophobicContact CB-CG2 3.95Å; E326-V329 WeakPolarHBondContact O-CB 3.33Å; E326-V329 PolarHBondContact O-N 3.06Å; V329-W333 VanDerWaalsContact O-CB 3.27Å; V329-W333 WeakPolarHBondContact O-CB 3.26Å; V329-W333 PolarHBondContact O-N 2.97Å |
| 330 | V | 96 | Very high | 94.5 | Very high | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -63.3 | -49.5 | 174.8 | 179.7 | 0 | 0 | 0 | 0 | 110.8 | L301 I316 L319 A320 L325 E326 K327 V332 W333 F334 | L301-V330 HydrophobicContact CD2-CG1 4.11Å; I316-V330 HydrophobicContact CG2-CB 4.22Å; I316-V330 HydrophobicContact CG2-CG1 4.09Å; L319-V330 HydrophobicContact CB-CG1 4.24Å; A320-V330 HydrophobicContact CB-CG2 4.05Å; L325-V330 HydrophobicContact CB-CG2 3.76Å; L325-V330 HydrophobicContact CD1-CG2 3.96Å; E326-V330 PolarHBondContact O-N 2.88Å; E326-V330 VanDerWaalsContact O-N 3.16Å; K327-V330 PolarHBondContact O-N 3.39Å; V330-V332 PolarHBondContact O-N 3.27Å; V330-W333 WeakPolarHBondContact O-CB 3.22Å; V330-W333 PolarHBondContact O-N 3.46Å; V330-W333 VanDerWaalsContact O-N 3.14Å; V330-F334 HydrophobicContact CG1-CD2 3.91Å; V330-F334 HydrophobicContact CG1-CE2 3.88Å; V330-F334 WeakPolarHBondContact O-CD2 3.31Å; V330-F334 PolarHBondContact O-N 3.19Å |
| 331 | R | 96.4 | Very high | 94.2 | Very high | 116 Ų | 116 | 70.7 Ų | 70.7 | 44% | 0.438 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -57.4 | -46.8 | 178.5 | -169.7 | -169.2 | 71.6 | 89.5 | 3.3 | 112.2 | I316 K327 E328 W333 F334 C335 | I316-R331 HydrophobicContact CD1-CB 4.4Å; I316-R331 HydrophobicContact CD1-CG 4.23Å; I316-R331 HydrophobicContact CG2-CB 4.23Å; K327-R331 WeakPolarHBondContact O-CB 3.23Å; K327-R331 PolarHBondContact O-N 2.85Å; E328-R331 VanDerWaalsContact CD-NH2 3.28Å; E328-R331 PolarHBondContact O-N 3.47Å; E328-R331 IonicContact OE1-CZ 2.61Å; E328-R331 IonicContact OE1-NE 3.66Å; E328-R331 IonicContact OE1-NH2 3.55Å; E328-R331 PolarHBondContact OE1-NH2 2.88Å; E328-R331 IonicContact OE2-CZ 3.06Å; E328-R331 VanDerWaalsContact OE2-CZ 3.27Å; E328-R331 IonicContact OE2-NE 2.67Å; E328-R331 PolarHBondContact OE2-NE 3.05Å; E328-R331 IonicContact OE2-NH2 2.85Å; E328-R331 PolarHBondContact OE2-NH2 3.43Å; R331-W333 VanDerWaalsContact C-N 3.35Å; R331-F334 PolarHBondContact O-N 3.24Å; R331-C335 PolarHBondContact O-N 3.17Å; R331-C335 VanDerWaalsContact O-N 3.11Å; R331-C335 PolarHBondContact O-SG 3.43Å |
| 332 | V | 95.7 | Very high | 93.8 | Very high | 52 Ų | 52 | 76.4 Ų | 76.4 | 32% | 0.315 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -66.7 | -36.4 | 177.6 | 168.8 | 0 | 0 | 0 | 0 | 111.1 | E328 V330 C335 N336 | E328-V332 HydrophobicContact CG-CG2 4.31Å; E328-V332 VanDerWaalsContact O-CB 3.27Å; E328-V332 WeakPolarHBondContact O-CB 3.47Å; E328-V332 VanDerWaalsContact O-CG2 3.25Å; E328-V332 WeakPolarHBondContact O-CG2 3.41Å; E328-V332 PolarHBondContact O-N 2.68Å; E328-V332 WeakPolarHBondContact OE1-CG2 3.49Å; V330-V332 PolarHBondContact O-N 3.27Å; V332-C335 PolarHBondContact O-N 3.3Å; V332-N336 WeakPolarHBondContact CG1-ND2 3.35Å; V332-N336 WeakPolarHBondContact O-CB 2.79Å; V332-N336 VanDerWaalsContact O-CG 3.25Å; V332-N336 PolarHBondContact O-N 2.96Å; V332-N336 PolarHBondContact O-ND2 2.69Å; V332-N336 VanDerWaalsContact O-ND2 3.14Å |
| 333 | W | 96 | Very high | 93.3 | Very high | 32 Ų | 32 | 79.9 Ų | 79.9 | 12% | 0.121 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -60.9 | -50 | 174 | -175.3 | 96.5 | 0 | 0 | 0 | 111.8 | I293 L301 E302 F305 V329 V330 R331 C335 N336 R337 | I293-W333 HydrophobicContact CD1-CB 4.41Å; I293-W333 HydrophobicContact CD1-CG 4.31Å; L301-W333 VanDerWaalsContact C-CH2 3.45Å; L301-W333 HydrophobicContact CB-CD2 3.96Å; L301-W333 HydrophobicContact CB-CE3 3.87Å; L301-W333 HydrophobicContact CB-CH2 3.71Å; L301-W333 HydrophobicContact CB-CZ2 3.78Å; L301-W333 HydrophobicContact CB-CZ3 3.74Å; L301-W333 HydrophobicContact CD1-CD2 3.92Å; L301-W333 HydrophobicContact CD1-CE3 4.38Å; L301-W333 HydrophobicContact CD1-CG 3.96Å; L301-W333 HydrophobicContact CD2-CE3 4.31Å; L301-W333 HydrophobicContact CG-CD2 4.4Å; L301-W333 HydrophobicContact CG-CE3 4.42Å; L301-W333 WeakPolarHBondContact O-CH2 3.29Å; L301-W333 WeakPolarHBondContact O-CZ3 3.29Å; E302-W333 HydrophobicContact CG-CH2 3.81Å; E302-W333 HydrophobicContact CG-CZ2 3.58Å; F305-W333 HydrophobicContact CB-CH2 4.03Å; F305-W333 HydrophobicContact CB-CZ3 4.06Å; F305-W333 HydrophobicContact CD2-CZ3 4.16Å; F305-W333 HydrophobicContact CG-CH2 4.48Å; F305-W333 HydrophobicContact CG-CZ3 4.47Å; V329-W333 VanDerWaalsContact O-CB 3.27Å; V329-W333 WeakPolarHBondContact O-CB 3.26Å; V329-W333 PolarHBondContact O-N 2.97Å; V330-W333 WeakPolarHBondContact O-CB 3.22Å; V330-W333 PolarHBondContact O-N 3.46Å; V330-W333 VanDerWaalsContact O-N 3.14Å; R331-W333 VanDerWaalsContact C-N 3.35Å; W333-C335 VanDerWaalsContact C-N 3.33Å; W333-C335 PolarHBondContact O-N 3.24Å; W333-N336 PolarHBondContact O-N 3Å; W333-N336 VanDerWaalsContact O-N 3.12Å; W333-R337 HydrophobicContact CD2-CB 4.44Å; W333-R337 HydrophobicContact CE3-CB 4.2Å; W333-R337 HydrophobicContact CH2-CB 3.81Å; W333-R337 HydrophobicContact CH2-CG 3.59Å; W333-R337 HydrophobicContact CZ2-CB 4.06Å; W333-R337 HydrophobicContact CZ2-CG 4.06Å; W333-R337 HydrophobicContact CZ3-CB 3.89Å; W333-R337 HydrophobicContact CZ3-CG 4.02Å; W333-R337 WeakPolarHBondContact O-CB 3.18Å; W333-R337 PolarHBondContact O-N 3.26Å |
| 334 | F | 96.4 | Very high | 92.2 | Very high | 3 Ų | 3 | 84.9 Ų | 84.9 | 1% | 0.013 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -61.9 | -40 | 178.4 | -87.1 | -87.2 | 0 | 0 | 0 | 112.3 | L301 H304 F305 P311 L319 V330 R331 R337 R338 | L301-F334 HydrophobicContact CD2-CE2 3.82Å; L301-F334 HydrophobicContact CD2-CZ 4.5Å; H304-F334 HydrophobicContact CB-CZ 4.26Å; H304-F334 AromaticContact ND1-CZ 3.94Å; F305-F334 HydrophobicContact CB-CE1 4.06Å; F305-F334 AromaticContact CD2-CD1 3.74Å; F305-F334 HydrophobicContact CD2-CD1 3.74Å; F305-F334 AromaticContact CD2-CE1 3.97Å; F305-F334 HydrophobicContact CD2-CE1 3.97Å; F305-F334 HydrophobicContact CE2-CD1 4.48Å; P311-F334 VanDerWaalsContact CD-CD1 3.41Å; P311-F334 HydrophobicContact CG-CB 4.49Å; P311-F334 HydrophobicContact CG-CD1 3.56Å; P311-F334 HydrophobicContact CG-CD2 3.9Å; P311-F334 HydrophobicContact CG-CE1 3.62Å; P311-F334 HydrophobicContact CG-CE2 3.97Å; P311-F334 HydrophobicContact CG-CG 3.72Å; P311-F334 HydrophobicContact CG-CZ 3.83Å; L319-F334 HydrophobicContact CD1-CE2 3.83Å; L319-F334 HydrophobicContact CD1-CZ 3.94Å; V330-F334 HydrophobicContact CG1-CD2 3.91Å; V330-F334 HydrophobicContact CG1-CE2 3.88Å; V330-F334 WeakPolarHBondContact O-CD2 3.31Å; V330-F334 PolarHBondContact O-N 3.19Å; R331-F334 PolarHBondContact O-N 3.24Å; F334-R337 PolarHBondContact O-N 3.37Å; F334-R338 WeakPolarHBondContact O-CB 3.25Å; F334-R338 PolarHBondContact O-N 2.97Å |
| 335 | C | 94.7 | Very high | 91 | Very high | 40 Ų | 40 | 80.9 Ų | 80.9 | 27% | 0.27 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -60.8 | -44.5 | 172.6 | -75.3 | 0 | 0 | 0 | 0 | 112.4 | R331 V332 W333 R338 Q339 | R331-C335 PolarHBondContact O-N 3.17Å; R331-C335 VanDerWaalsContact O-N 3.11Å; R331-C335 PolarHBondContact O-SG 3.43Å; V332-C335 PolarHBondContact O-N 3.3Å; W333-C335 VanDerWaalsContact C-N 3.33Å; W333-C335 PolarHBondContact O-N 3.24Å; C335-R338 PolarHBondContact SG-NH2 3.43Å; C335-Q339 WeakPolarHBondContact O-CG 3.42Å; C335-Q339 PolarHBondContact O-N 3.3Å |
| 336 | N | 94.8 | Very high | 89.1 | Confident | 88 Ų | 88 | 84.4 Ų | 84.4 | 47% | 0.471 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -68.7 | -39.6 | 177.8 | -73.7 | -32.6 | 0 | 0 | 0 | 112.8 | V332 W333 Q339 K340 | V332-N336 WeakPolarHBondContact CG1-ND2 3.35Å; V332-N336 WeakPolarHBondContact O-CB 2.79Å; V332-N336 VanDerWaalsContact O-CG 3.25Å; V332-N336 PolarHBondContact O-N 2.96Å; V332-N336 PolarHBondContact O-ND2 2.69Å; V332-N336 VanDerWaalsContact O-ND2 3.14Å; W333-N336 PolarHBondContact O-N 3Å; W333-N336 VanDerWaalsContact O-N 3.12Å; N336-Q339 PolarHBondContact O-N 3.24Å; N336-K340 PolarHBondContact O-N 2.98Å |
| 337 | R | 94.9 | Very high | 87.3 | Confident | 49 Ų | 49 | 85.8 Ų | 85.8 | 19% | 0.185 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -65.7 | -40.1 | 178.5 | 178 | 61.2 | -171.2 | 70.5 | 6.8 | 111.8 | F305 W333 F334 K340 E341 | F305-R337 HydrophobicContact CB-CG 4.47Å; F305-R337 HydrophobicContact CD1-CG 4Å; F305-R337 HydrophobicContact CD2-CB 4.02Å; F305-R337 HydrophobicContact CD2-CG 3.43Å; F305-R337 VanDerWaalsContact CD2-CG 3.43Å; F305-R337 HydrophobicContact CE1-CG 4.11Å; F305-R337 HydrophobicContact CE2-CB 4Å; F305-R337 HydrophobicContact CE2-CG 3.54Å; F305-R337 HydrophobicContact CG-CG 3.68Å; F305-R337 HydrophobicContact CZ-CG 3.89Å; W333-R337 HydrophobicContact CD2-CB 4.44Å; W333-R337 HydrophobicContact CE3-CB 4.2Å; W333-R337 HydrophobicContact CH2-CB 3.81Å; W333-R337 HydrophobicContact CH2-CG 3.59Å; W333-R337 HydrophobicContact CZ2-CB 4.06Å; W333-R337 HydrophobicContact CZ2-CG 4.06Å; W333-R337 HydrophobicContact CZ3-CB 3.89Å; W333-R337 HydrophobicContact CZ3-CG 4.02Å; W333-R337 WeakPolarHBondContact O-CB 3.18Å; W333-R337 PolarHBondContact O-N 3.26Å; F334-R337 PolarHBondContact O-N 3.37Å; R337-K340 PolarHBondContact O-N 2.81Å; R337-E341 IonicContact CZ-OE1 3.3Å; R337-E341 VanDerWaalsContact CZ-OE1 3.3Å; R337-E341 IonicContact NH1-OE1 2.7Å; R337-E341 PolarHBondContact NH1-OE1 3.45Å; R337-E341 IonicContact NH2-OE1 2.97Å; R337-E341 PolarHBondContact NH2-OE1 2.66Å; R337-E341 PolarHBondContact O-N 3.24Å; R337-E341 VanDerWaalsContact O-N 3.16Å |
| 338 | R | 93.9 | Very high | 85.2 | Confident | 75 Ų | 75 | 83.3 Ų | 83.3 | 28% | 0.283 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -70 | -33 | 173.5 | -171.3 | 169.6 | 59.1 | -105 | -4.7 | 112.9 | F305 P309 F334 C335 K342 | F305-R338 HydrophobicContact CE2-CB 4.1Å; F305-R338 HydrophobicContact CZ-CB 4.32Å; P309-R338 PolarHBondContact O-NH1 3.37Å; F334-R338 WeakPolarHBondContact O-CB 3.25Å; F334-R338 PolarHBondContact O-N 2.97Å; C335-R338 PolarHBondContact SG-NH2 3.43Å; R338-K342 PolarHBondContact O-N 3.1Å |
| 339 | Q | 89.8 | Confident | 82.9 | Confident | 88 Ų | 88 | 85.5 Ų | 85.5 | 41% | 0.411 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -69.4 | -36.7 | 169.8 | -77.5 | -175.4 | 32.3 | 0 | 0 | 112.9 | C335 N336 R343 | C335-Q339 WeakPolarHBondContact O-CG 3.42Å; C335-Q339 PolarHBondContact O-N 3.3Å; N336-Q339 PolarHBondContact O-N 3.24Å; Q339-R343 WeakPolarHBondContact O-CG 3.41Å; Q339-R343 PolarHBondContact O-N 2.89Å |
| 340 | K | 90.4 | Very high | 80.4 | Confident | 112 Ų | 112 | 90 Ų | 90 | 49% | 0.487 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.8 | -46.3 | 176.5 | -175.5 | -173.2 | 173 | -169.6 | 0 | 110.4 | N336 R337 K342 R343 M344 | N336-K340 PolarHBondContact O-N 2.98Å; R337-K340 PolarHBondContact O-N 2.81Å; K340-K342 PolarHBondContact O-N 3.41Å; K340-R343 CarbonylContact O-C 3.58Å; K340-R343 PolarHBondContact O-N 3.23Å; K340-M344 HydrophobicContact CD-SD 4.42Å; K340-M344 WeakPolarHBondContact CE-SD 3.35Å; K340-M344 HydrophobicContact CG-CG 4.27Å; K340-M344 HydrophobicContact CG-SD 4.14Å; K340-M344 WeakPolarHBondContact O-CG 3.22Å; K340-M344 PolarHBondContact O-N 2.75Å; K340-M344 VanDerWaalsContact O-N 3.13Å |
| 341 | E | 90.3 | Very high | 77.9 | Confident | 68 Ų | 68 | 97 Ų | 97 | 32% | 0.318 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -53.1 | -55.6 | 177.7 | -161.4 | 148.4 | -90 | 0 | 0 | 112.4 | F305 R337 R343 M344 T345 | F305-E341 VanDerWaalsContact CE1-OE1 3.26Å; F305-E341 WeakPolarHBondContact CE1-OE1 3.2Å; F305-E341 WeakPolarHBondContact CE1-OE2 3.24Å; F305-E341 VanDerWaalsContact CZ-OE2 3.28Å; F305-E341 WeakPolarHBondContact CZ-OE2 3.37Å; R337-E341 IonicContact CZ-OE1 3.3Å; R337-E341 VanDerWaalsContact CZ-OE1 3.3Å; R337-E341 IonicContact NH1-OE1 2.7Å; R337-E341 PolarHBondContact NH1-OE1 3.45Å; R337-E341 IonicContact NH2-OE1 2.97Å; R337-E341 PolarHBondContact NH2-OE1 2.66Å; R337-E341 PolarHBondContact O-N 3.24Å; R337-E341 VanDerWaalsContact O-N 3.16Å; E341-R343 PolarHBondContact O-N 2.95Å; E341-M344 PolarHBondContact O-N 2.84Å; E341-T345 PolarHBondContact O-N 2.88Å; E341-T345 VanDerWaalsContact O-N 3.08Å; E341-T345 PolarHBondContact O-OG1 2.68Å |
| 342 | K | 87 | Confident | 75.4 | Confident | 176 Ų | 176 | 96.4 Ų | 96.4 | 77% | 0.765 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | -7.6 | 176.7 | -69.3 | -164.3 | 170.4 | -152.8 | 0 | 115.3 | R338 K340 | R338-K342 PolarHBondContact O-N 3.1Å; K340-K342 PolarHBondContact O-N 3.41Å |
| 343 | R | 83.3 | Confident | 72.6 | Confident | 182 Ų | 182 | 98.9 Ų | 98.9 | 69% | 0.687 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.4 | -5.4 | 173.3 | -67.8 | 179.9 | -169.5 | 124.2 | 8.5 | 113.3 | Q339 K340 E341 | Q339-R343 WeakPolarHBondContact O-CG 3.41Å; Q339-R343 PolarHBondContact O-N 2.89Å; K340-R343 CarbonylContact O-C 3.58Å; K340-R343 PolarHBondContact O-N 3.23Å; E341-R343 PolarHBondContact O-N 2.95Å |
| 344 | M | 72.1 | Confident | 70.4 | Confident | 133 Ų | 133 | 104.3 Ų | 104.3 | 66% | 0.655 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.6 | -17.8 | -176.5 | -68.7 | -151.4 | 73.2 | 0 | 0 | 113.8 | K340 E341 P346 | K340-M344 HydrophobicContact CD-SD 4.42Å; K340-M344 WeakPolarHBondContact CE-SD 3.35Å; K340-M344 HydrophobicContact CG-CG 4.27Å; K340-M344 HydrophobicContact CG-SD 4.14Å; K340-M344 WeakPolarHBondContact O-CG 3.22Å; K340-M344 PolarHBondContact O-N 2.75Å; K340-M344 VanDerWaalsContact O-N 3.13Å; E341-M344 PolarHBondContact O-N 2.84Å; M344-P346 WeakPolarHBondContact O-CD 3.43Å |
| 345 | T | 66.6 | Low | 67.9 | Low | 102 Ų | 102 | 111 Ų | 111 | 63% | 0.626 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -82 | 114.7 | 164.2 | -45.9 | 0 | 0 | 0 | 0 | 109.4 | E341 | E341-T345 PolarHBondContact O-N 2.88Å; E341-T345 VanDerWaalsContact O-N 3.08Å; E341-T345 PolarHBondContact O-OG1 2.68Å |
| 346 | P | 54.3 | Low | 65.4 | Low | 104 Ų | 104 | 115.6 Ų | 115.6 | 68% | 0.675 | 61% | 0.608 | S | S | * | * | trans | -71.9 | 143.2 | 172.1 | -12.5 | 29.7 | 0 | 0 | 0 | 110.3 | M344 G348 | M344-P346 WeakPolarHBondContact O-CD 3.43Å; P346-G348 PolarHBondContact O-N 3.27Å | ||
| 347 | V | 56.4 | Low | 63.1 | Low | 160 Ų | 160 | 117.7 Ų | 117.7 | 97% | 0.97 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | 104.9 | 162.7 | 178.3 | 0 | 0 | 0 | 0 | 106.6 | ||
| 348 | G | 51.5 | Low | 60.6 | Low | 66 Ų | 66 | 125.5 Ų | 125.5 | 68% | 0.68 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 168.3 | -5.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 117.7 | P346 | P346-G348 PolarHBondContact O-N 3.27Š|
| 349 | V | 45.8 | Very low | 58 | Low | 128 Ų | 128 | 127 Ų | 127 | 78% | 0.776 | 68% | 0.677 | S | S | * | * | trans | -117.9 | 115.6 | 170.9 | -175 | 0 | 0 | 0 | 0 | 108.7 | H351 | V349-H351 PolarHBondContact O-N 2.56Š| ||
| 350 | P | 42.2 | Very low | 55.6 | Low | 117 Ų | 117 | 132.2 Ų | 132.2 | 76% | 0.76 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 117.1 | 167.5 | -17.4 | 31.1 | 0 | 0 | 0 | 108.7 | ||
| 351 | H | 44.5 | Very low | 53.3 | Low | 145 Ų | 145 | 131.2 Ų | 131.2 | 67% | 0.671 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 127 | 166 | -160.1 | -69.5 | 0 | 0 | 0 | 107.1 | V349 N353 M354 | V349-H351 PolarHBondContact O-N 2.56Å; H351-N353 PolarHBondContact O-N 3.19Å; H351-M354 VanDerWaalsContact CE1-SD 3.55Å |
| 352 | P | 43.6 | Very low | 50.9 | Low | 105 Ų | 105 | 137.1 Ų | 137.1 | 68% | 0.682 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 133.9 | 172.3 | 25.5 | -32.8 | 0 | 0 | 0 | 108.7 | M354 | P352-M354 PolarHBondContact O-N 2.92Š|
| 353 | N | 35.9 | Very low | 48.7 | Very low | 104 Ų | 104 | 135.2 Ų | 135.2 | 56% | 0.556 | 75% | 0.745 | S | S | * | * | trans | -79.3 | 108 | -172.8 | -151.6 | 61.7 | 0 | 0 | 0 | 109.6 | H351 E355 | H351-N353 PolarHBondContact O-N 3.19Å; N353-E355 PolarHBondContact ND2-OE2 3.25Å; N353-E355 PolarHBondContact O-N 3.3Å | ||
| 354 | M | 49.4 | Very low | 46.7 | Very low | 146 Ų | 146 | 132.3 Ų | 132.3 | 72% | 0.719 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | 30.3 | -173.1 | 54.8 | -90.8 | 178.7 | 0 | 0 | 114.5 | H351 P352 | H351-M354 VanDerWaalsContact CE1-SD 3.55Å; P352-M354 PolarHBondContact O-N 2.92Å |
| 355 | E | 43.7 | Very low | 45.3 | Very low | 143 Ų | 143 | 132 Ų | 132 | 67% | 0.668 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.6 | -18.2 | -177.2 | -72.5 | 171.7 | 105.1 | 0 | 0 | 114 | N353 V357 | N353-E355 PolarHBondContact ND2-OE2 3.25Å; N353-E355 PolarHBondContact O-N 3.3Å; E355-V357 VanDerWaalsContact C-N 3.32Å; E355-V357 PolarHBondContact O-N 3.07Å |
| 356 | D | 43.7 | Very low | 44.1 | Very low | 136 Ų | 136 | 135.7 Ų | 135.7 | 73% | 0.727 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.2 | 2.1 | -176.6 | -88.4 | -64.9 | 0 | 0 | 0 | 115.5 | ||
| 357 | V | 46.2 | Very low | 43.6 | Very low | 132 Ų | 132 | 138.7 Ų | 138.7 | 80% | 0.8 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.9 | -10.7 | -173 | -173.9 | 0 | 0 | 0 | 0 | 113.3 | E355 | E355-V357 VanDerWaalsContact C-N 3.32Å; E355-V357 PolarHBondContact O-N 3.07Å |
| 358 | Y | 42.8 | Very low | 42.8 | Very low | 214 Ų | 214 | 142.1 Ų | 142.1 | 84% | 0.839 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -111.8 | -2.5 | -171.6 | -124.8 | -86.4 | 0 | 0 | 0 | 115.9 | ||
| 359 | S | 38.9 | Very low | 42.1 | Very low | 106 Ų | 106 | 143.6 Ų | 143.6 | 74% | 0.741 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -100.7 | 9.8 | -170.9 | -59.2 | 0 | 0 | 0 | 0 | 115.1 | ||
| 360 | Q | 39.1 | Very low | 42 | Very low | 198 Ų | 198 | 145 Ų | 145 | 93% | 0.925 | 77% | 0.77 | S | S | * | * | trans | -127.1 | 59.1 | -176.5 | -165.9 | 169.4 | 78.7 | 0 | 0 | 112 | ||||
| 361 | A | 42.9 | Very low | 41.8 | Very low | 91 Ų | 91 | 147.6 Ų | 147.6 | 75% | 0.752 | 77% | 0.773 | S | S | * | * | trans | -141.5 | 19.4 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 362 | E | 38.5 | Very low | 41.6 | Very low | 192 Ų | 192 | 145.3 Ų | 145.3 | 90% | 0.897 | 77% | 0.773 | S | S | * | * | trans | -132.4 | 80.9 | 172.1 | -74.7 | -152.9 | 120.4 | 0 | 0 | 113.5 | ||||
| 363 | T | 40.7 | Very low | 42 | Very low | 135 Ų | 135 | 146.3 Ų | 146.3 | 83% | 0.828 | 78% | 0.779 | S | S | * | * | trans | -141.2 | 129.1 | 150.2 | 45.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 364 | P | 41.6 | Very low | 42.2 | Very low | 122 Ų | 122 | 147.3 Ų | 147.3 | 79% | 0.792 | 79% | 0.789 | S | S | * | * | trans | -79.3 | 156.6 | -178 | 30.9 | -34.2 | 0 | 0 | 0 | 112.8 | ||||
| 365 | P | 44 | Very low | 41.9 | Very low | 126 Ų | 126 | 153 Ų | 153 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -81.7 | 147.6 | -166.2 | 32 | -36.6 | 0 | 0 | 0 | 114.2 | ||||
| 366 | L | 39.9 | Very low | 41.8 | Very low | 179 Ų | 179 | 153.5 Ų | 153.5 | 94% | 0.937 | 82% | 0.821 | S | S | * | * | trans | -119.5 | 153.8 | 161.9 | -72.9 | -179.9 | 0 | 0 | 0 | 111.3 | ||||
| 367 | H | 44.3 | Very low | 41.7 | Very low | 167 Ų | 167 | 154.4 Ų | 154.4 | 77% | 0.773 | 83% | 0.826 | S | S | * | * | trans | -119.7 | 120.1 | -150.2 | 172.6 | -79.8 | 0 | 0 | 0 | 112.3 | ||||
| 368 | R | 39.5 | Very low | 41.5 | Very low | 232 Ų | 232 | 155.7 Ų | 155.7 | 88% | 0.875 | 83% | 0.828 | S | S | * | * | trans | -165.5 | 98.3 | 160.2 | -111.3 | 166.7 | -168.8 | -147.3 | 0.6 | 115.9 | ||||
| 369 | T | 37.8 | Very low | 41.4 | Very low | 97 Ų | 97 | 152.2 Ų | 152.2 | 60% | 0.595 | 83% | 0.827 | S | S | * | * | 37.2 | 127.5 | 124.7 | 60.5 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 370 | L | 41.8 | Very low | 41.6 | Very low | 157 Ų | 157 | 155.1 Ų | 155.1 | 82% | 0.822 | 83% | 0.832 | S | S | * | * | trans | 69.8 | 156.1 | 149.9 | -57.7 | 165.8 | 0 | 0 | 0 | 115.8 | ||||
| 371 | Q | 39 | Very low | 41.7 | Very low | 173 Ų | 173 | 152.3 Ų | 152.3 | 81% | 0.808 | 83% | 0.826 | S | S | * | * | cis | -148.1 | 164.7 | 10.4 | -152 | 161.3 | 2 | 0 | 0 | 111.3 | ||||
| 372 | S | 41 | Very low | 41.6 | Very low | 96 Ų | 96 | 156.6 Ų | 156.6 | 67% | 0.671 | 83% | 0.831 | S | S | * | * | trans | -73.9 | 156.7 | 167.5 | 179.8 | 0 | 0 | 0 | 0 | 111 | ||||
| 373 | P | 52.3 | Low | 41.9 | Very low | 126 Ų | 126 | 153.9 Ų | 153.9 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | -131.8 | 161.8 | 113.6 | 38.2 | -32.1 | 0 | 0 | 0 | 114.6 | |||||
| 374 | V | 38.5 | Very low | 42 | Very low | 126 Ų | 126 | 155.5 Ų | 155.5 | 76% | 0.764 | 83% | 0.826 | S | S | * | * | trans | -91.6 | 138.7 | 170.2 | 168.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 375 | Q | 44 | Very low | 42 | Very low | 265 Ų | 265 | 158.5 Ų | 158.5 | 100% | 1.238 | 83% | 0.829 | S | S | * | * | trans | -154.2 | 0 | 137 | -117.1 | 173.5 | 54.6 | 0 | 0 | 110.1 |
Retrieved 375 of 375 residues in 157.4 ms
(Link to these results)