| 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 | 39.8 | Very low | 37.2 | Very low | 245 Ų | 245 | 119.7 Ų | 119.7 | 100% | 1.207 | 71% | 0.71 | S | S | * | * | 0 | 19.2 | 0 | -142.4 | 164.2 | -169 | 0 | 0 | 113.6 | |||||
| 2 | A | 34.4 | Very low | 37.4 | Very low | 97 Ų | 97 | 123.9 Ų | 123.9 | 80% | 0.802 | 71% | 0.705 | S | S | * | * | trans | -112 | 33.2 | -171.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 3 | L | 33.2 | Very low | 38 | Very low | 176 Ų | 176 | 122 Ų | 122 | 92% | 0.921 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -120.6 | 8.2 | 179 | -86.4 | 166 | 0 | 0 | 0 | 113.9 | ||
| 4 | R | 32.1 | Very low | 38.1 | Very low | 238 Ų | 238 | 126.8 Ų | 126.8 | 90% | 0.898 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -103.6 | -11.7 | 176.7 | -85.8 | -170.6 | 172.1 | -164.8 | -2 | 115.3 | ||
| 5 | S | 38 | Very low | 38.2 | Very low | 105 Ų | 105 | 131.1 Ų | 131.1 | 73% | 0.734 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -86.3 | -17 | -177.3 | -53.2 | 0 | 0 | 0 | 0 | 114.8 | A7 | S5-A7 PolarHBondContact O-N 2.93Š|
| 6 | G | 35.4 | Very low | 38.5 | Very low | 57 Ų | 57 | 137.2 Ų | 137.2 | 59% | 0.588 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | -31.6 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | G8 C9 | G6-G8 PolarHBondContact O-N 2.81Å; G6-C9 PolarHBondContact O-N 3.35Å |
| 7 | A | 40.7 | Very low | 39.1 | Very low | 83 Ų | 83 | 136 Ų | 136 | 69% | 0.686 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -64.1 | -25.6 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | S5 G11 | S5-A7 PolarHBondContact O-N 2.93Å; A7-G11 PolarHBondContact O-N 3.12Å |
| 8 | G | 34.8 | Very low | 38.9 | Very low | 39 Ų | 39 | 132.7 Ų | 132.7 | 40% | 0.402 | 70% | 0.7 | S | S | . | * | H | α-helix | trans | -76.1 | -18.9 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | G6 R12 | G6-G8 PolarHBondContact O-N 2.81Å; G8-R12 PolarHBondContact O-NE 2.78Å; G8-R12 PolarHBondContact O-NH2 3.22Å |
| 9 | C | 42.4 | Very low | 38.8 | Very low | 80 Ų | 80 | 129.2 Ų | 129.2 | 54% | 0.541 | 70% | 0.699 | S | S | . | * | H | α-helix | trans | -87 | -45.7 | 174.6 | -81.3 | 0 | 0 | 0 | 0 | 111.7 | G6 G11 R12 V13 | G6-C9 PolarHBondContact O-N 3.35Å; C9-G11 VanDerWaalsContact C-N 3.32Å; C9-G11 PolarHBondContact O-N 3.43Å; C9-R12 PolarHBondContact O-N 3.36Å; C9-V13 PolarHBondContact O-N 3.5Å; C9-V13 VanDerWaalsContact O-N 3.08Å |
| 10 | F | 41.9 | Very low | 38.4 | Very low | 168 Ų | 168 | 132.6 Ų | 132.6 | 74% | 0.737 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -56.7 | -44.9 | 179.3 | -122.8 | -93.8 | 0 | 0 | 0 | 112.1 | R12 V13 W14 | F10-R12 PolarHBondContact O-N 2.81Å; F10-V13 PolarHBondContact O-N 2.56Å; F10-W14 PolarHBondContact O-N 3.32Å |
| 11 | G | 36.1 | Very low | 38.2 | Very low | 29 Ų | 29 | 131.9 Ų | 131.9 | 30% | 0.299 | 71% | 0.71 | S | S | . | * | H | α-helix | trans | -72.9 | -0.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | A7 C9 R15 | A7-G11 PolarHBondContact O-N 3.12Å; C9-G11 VanDerWaalsContact C-N 3.32Å; C9-G11 PolarHBondContact O-N 3.43Å; G11-R15 PolarHBondContact O-NE 3.28Å; G11-R15 PolarHBondContact O-NH2 3.07Å |
| 12 | R | 39.8 | Very low | 37.8 | Very low | 170 Ų | 170 | 128.5 Ų | 128.5 | 64% | 0.642 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -102.6 | -34.5 | 170.5 | -84.3 | -175.9 | -74.4 | -163.6 | 3.5 | 112.3 | G8 C9 F10 R16 | G8-R12 PolarHBondContact O-NE 2.78Å; G8-R12 PolarHBondContact O-NH2 3.22Å; C9-R12 PolarHBondContact O-N 3.36Å; F10-R12 PolarHBondContact O-N 2.81Å; R12-R16 PolarHBondContact O-N 3.35Å |
| 13 | V | 45.3 | Very low | 37.7 | Very low | 99 Ų | 99 | 127.7 Ų | 127.7 | 60% | 0.6 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -65.9 | -49 | 170.5 | 178.4 | 0 | 0 | 0 | 0 | 110.1 | C9 F10 R15 R16 V17 | C9-V13 PolarHBondContact O-N 3.5Å; C9-V13 VanDerWaalsContact O-N 3.08Å; F10-V13 PolarHBondContact O-N 2.56Å; V13-R15 VanDerWaalsContact C-N 3.31Å; V13-R15 PolarHBondContact O-N 3.34Å; V13-R16 WeakPolarHBondContact O-CB 3.29Å; V13-R16 PolarHBondContact O-N 3.35Å; V13-V17 PolarHBondContact O-N 2.94Å |
| 14 | W | 39.2 | Very low | 37.4 | Very low | 189 Ų | 189 | 131.2 Ų | 131.2 | 72% | 0.716 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -58.3 | -40.4 | 179.9 | -165.4 | -94.3 | 0 | 0 | 0 | 113.2 | F10 R16 V17 S18 | F10-W14 PolarHBondContact O-N 3.32Å; W14-R16 PolarHBondContact O-N 3.26Å; W14-V17 PolarHBondContact O-N 2.62Å; W14-S18 PolarHBondContact O-N 2.97Å |
| 15 | R | 40.6 | Very low | 37.3 | Very low | 191 Ų | 191 | 125 Ų | 125 | 72% | 0.721 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -70.6 | -11.4 | 176.8 | -95 | -172 | -76.5 | -161.2 | -5.7 | 114.9 | G11 V13 | G11-R15 PolarHBondContact O-NE 3.28Å; G11-R15 PolarHBondContact O-NH2 3.07Å; V13-R15 VanDerWaalsContact C-N 3.31Å; V13-R15 PolarHBondContact O-N 3.34Å |
| 16 | R | 43.1 | Very low | 37.2 | Very low | 229 Ų | 229 | 131.8 Ų | 131.8 | 86% | 0.864 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -89.5 | -22.2 | 173.2 | -131.2 | 178.6 | -161.7 | 172.5 | 3.7 | 112.6 | R12 V13 W14 | R12-R16 PolarHBondContact O-N 3.35Å; V13-R16 WeakPolarHBondContact O-CB 3.29Å; V13-R16 PolarHBondContact O-N 3.35Å; W14-R16 PolarHBondContact O-N 3.26Å |
| 17 | V | 48.5 | Very low | 36.8 | Very low | 117 Ų | 117 | 140.9 Ų | 140.9 | 71% | 0.709 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -87.5 | -30.9 | 179.6 | 178.3 | 0 | 0 | 0 | 0 | 111.7 | V13 W14 G19 | V13-V17 PolarHBondContact O-N 2.94Å; W14-V17 PolarHBondContact O-N 2.62Å; V17-G19 PolarHBondContact O-N 3.05Å |
| 18 | S | 34.7 | Very low | 36.2 | Very low | 77 Ų | 77 | 142.2 Ų | 142.2 | 54% | 0.538 | 71% | 0.713 | S | S | . | * | trans | -83 | 49.6 | -179.5 | 67.5 | 0 | 0 | 0 | 0 | 114 | W14 F20 | W14-S18 PolarHBondContact O-N 2.97Å; S18-F20 PolarHBondContact O-N 3.34Å | ||
| 19 | G | 37.1 | Very low | 35.8 | Very low | 66 Ų | 66 | 145.4 Ų | 145.4 | 68% | 0.68 | 73% | 0.729 | S | S | * | * | trans | -85 | 74.7 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | V17 | V17-G19 PolarHBondContact O-N 3.05Š| ||
| 20 | F | 32 | Very low | 35 | Very low | 196 Ų | 196 | 146.9 Ų | 146.9 | 86% | 0.86 | 74% | 0.74 | S | S | * | * | trans | -126.4 | 131.6 | 168 | -98.5 | -90.7 | 0 | 0 | 0 | 110.3 | S18 | S18-F20 PolarHBondContact O-N 3.34Š| ||
| 21 | P | 33.2 | Very low | 34.4 | Very low | 119 Ų | 119 | 146.1 Ų | 146.1 | 77% | 0.773 | 74% | 0.743 | S | S | * | * | trans | -80.9 | 130.6 | -179.4 | 30.4 | -33 | 0 | 0 | 0 | 112.7 | A23 | P21-A23 PolarHBondContact O-N 2.9Š| ||
| 22 | D | 32.2 | Very low | 34 | Very low | 173 Ų | 173 | 153.3 Ų | 153.3 | 93% | 0.925 | 77% | 0.774 | S | S | * | * | trans | -71.8 | 83.7 | 174.1 | -76.6 | -54.1 | 0 | 0 | 0 | 112.4 | ||||
| 23 | A | 32.8 | Very low | 33.4 | Very low | 81 Ų | 81 | 149.9 Ų | 149.9 | 67% | 0.669 | 78% | 0.775 | S | S | * | * | trans | -161.8 | 120.5 | 156.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | P21 | P21-A23 PolarHBondContact O-N 2.9Š| ||
| 24 | W | 26.4 | Very low | 32.5 | Very low | 250 Ų | 250 | 152.9 Ų | 152.9 | 95% | 0.947 | 79% | 0.787 | S | S | * | * | -167.9 | 146.6 | 128 | -114.1 | 49.3 | 0 | 0 | 0 | 111.8 | |||||
| 25 | P | 29.7 | Very low | 31.9 | Very low | 108 Ų | 108 | 148 Ų | 148 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | -88.8 | 164.7 | -173.1 | 35.6 | -35.7 | 0 | 0 | 0 | 113.6 | R27 | P25-R27 PolarHBondContact O-N 3.48Š| ||
| 26 | R | 34.9 | Very low | 31.4 | Very low | 246 Ų | 246 | 143.6 Ų | 143.6 | 93% | 0.928 | 79% | 0.786 | S | S | * | * | trans | -60 | 124.4 | 174.5 | -60.1 | 179.3 | -176.7 | -161.7 | 1 | 111.9 | ||||
| 27 | R | 27.1 | Very low | 30.6 | Very low | 248 Ų | 248 | 141.9 Ų | 141.9 | 94% | 0.936 | 79% | 0.785 | S | S | * | * | trans | -153.6 | 142.9 | 140.6 | -110.6 | 174.7 | -166.9 | -138.1 | 1.9 | 110.6 | P25 | P25-R27 PolarHBondContact O-N 3.48Š| ||
| 28 | S | 28.5 | Very low | 29.6 | Very low | 111 Ų | 111 | 140.4 Ų | 140.4 | 78% | 0.776 | 78% | 0.78 | S | S | * | * | trans | -82.1 | 164.3 | -173.4 | -53.6 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 29 | S | 26 | Very low | 29.3 | Very low | 107 Ų | 107 | 141.5 Ų | 141.5 | 75% | 0.748 | 79% | 0.794 | S | S | * | * | trans | 104.9 | 124.8 | 139.6 | -55.9 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 30 | S | 27.2 | Very low | 29 | Very low | 111 Ų | 111 | 147.1 Ų | 147.1 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | trans | 102.6 | 128.8 | 142.8 | -57.4 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 31 | L | 28.4 | Very low | 29.1 | Very low | 151 Ų | 151 | 142.9 Ų | 142.9 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | 78 | 80.9 | 156.1 | -59.3 | 162.6 | 0 | 0 | 0 | 118.6 | ||||
| 32 | L | 26.6 | Very low | 29.2 | Very low | 181 Ų | 181 | 140.5 Ų | 140.5 | 95% | 0.948 | 79% | 0.792 | S | S | * | * | trans | -126.2 | 98.6 | 134.9 | -87.3 | 172.8 | 0 | 0 | 0 | 109.4 | ||||
| 33 | C | 27.2 | Very low | 29.4 | Very low | 98 Ų | 98 | 138.8 Ų | 138.8 | 66% | 0.662 | 79% | 0.79 | S | S | * | * | trans | -80.8 | 150.8 | 163.8 | -77.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 34 | L | 26.4 | Very low | 29.6 | Very low | 162 Ų | 162 | 139.4 Ų | 139.4 | 85% | 0.848 | 80% | 0.795 | S | S | * | * | trans | 14.9 | 138.6 | 133.5 | -60.2 | 157.3 | 0 | 0 | 0 | 117.1 | ||||
| 35 | S | 27 | Very low | 30.1 | Very low | 86 Ų | 86 | 133.2 Ų | 133.2 | 60% | 0.601 | 79% | 0.787 | S | S | * | * | cis | -173.1 | 136.7 | 6.6 | 40 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 36 | A | 30.6 | Very low | 30.5 | Very low | 99 Ų | 99 | 134.2 Ų | 134.2 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | 35.8 | 89.8 | 96.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | |||||
| 37 | F | 25.7 | Very low | 30.5 | Very low | 192 Ų | 192 | 130.3 Ų | 130.3 | 84% | 0.842 | 79% | 0.79 | S | S | * | * | trans | -161.6 | 146.3 | 163.2 | -122.5 | -95.6 | 0 | 0 | 0 | 107.6 | ||||
| 38 | S | 27.7 | Very low | 31 | Very low | 86 Ų | 86 | 124.3 Ų | 124.3 | 60% | 0.601 | 78% | 0.783 | S | S | * | * | cis | -159.3 | 152.8 | -32.9 | -90.6 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 39 | A | 29.8 | Very low | 31.1 | Very low | 101 Ų | 101 | 130.8 Ų | 130.8 | 84% | 0.835 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -88.5 | 118.4 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||
| 40 | E | 29.6 | Very low | 31.5 | Very low | 183 Ų | 183 | 134.7 Ų | 134.7 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -81 | 129.1 | 174.2 | -89.2 | -84.4 | 104.4 | 0 | 0 | 111.1 | ||
| 41 | P | 34.3 | Very low | 31.9 | Very low | 108 Ų | 108 | 135 Ų | 135 | 70% | 0.701 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -93.6 | 143.7 | 168.9 | 34.9 | -30.5 | 0 | 0 | 0 | 112.3 | ||
| 42 | G | 34.7 | Very low | 32.8 | Very low | 69 Ų | 69 | 133.2 Ų | 133.2 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 165.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 43 | P | 37.5 | Very low | 33.1 | Very low | 136 Ų | 136 | 136.8 Ų | 136.8 | 88% | 0.883 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -79.7 | 150.6 | -163.5 | 31.6 | -36.8 | 0 | 0 | 0 | 115.1 | ||
| 44 | A | 35.9 | Very low | 33.2 | Very low | 94 Ų | 94 | 136 Ų | 136 | 78% | 0.777 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -101.9 | 154 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 45 | P | 36.9 | Very low | 33.4 | Very low | 120 Ų | 120 | 132 Ų | 132 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -81.1 | 164.8 | -175 | 33.4 | -36.7 | 0 | 0 | 0 | 114.2 | ||
| 46 | P | 38 | Very low | 33.6 | Very low | 129 Ų | 129 | 132 Ų | 132 | 84% | 0.838 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -81.2 | 154.6 | -171.1 | 32.2 | -36.4 | 0 | 0 | 0 | 115.6 | ||
| 47 | L | 36.1 | Very low | 33.6 | Very low | 165 Ų | 165 | 130.7 Ų | 130.7 | 86% | 0.864 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 151.1 | -179.8 | -73.5 | 157.7 | 0 | 0 | 0 | 114.4 | ||
| 48 | P | 36.5 | Very low | 33.7 | Very low | 121 Ų | 121 | 128.4 Ų | 128.4 | 79% | 0.786 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -83 | 155.8 | 164.6 | 34.4 | -33 | 0 | 0 | 0 | 112.9 | ||
| 49 | R | 31.1 | Very low | 33.9 | Very low | 248 Ų | 248 | 128.2 Ų | 128.2 | 94% | 0.936 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 152.9 | -176.1 | -63.3 | 171.5 | 172.5 | 169.1 | -4.3 | 113.2 | ||
| 50 | Q | 34.3 | Very low | 33.9 | Very low | 189 Ų | 189 | 127 Ų | 127 | 88% | 0.883 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -99.6 | 147.6 | 157.4 | -72.9 | -171.7 | -3.2 | 0 | 0 | 111.6 | ||
| 51 | P | 35.9 | Very low | 34.7 | Very low | 117 Ų | 117 | 123.9 Ų | 123.9 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -89.8 | 170.8 | 163 | 36.7 | -31.9 | 0 | 0 | 0 | 112.2 | ||
| 52 | P | 47.2 | Very low | 34.6 | Very low | 114 Ų | 114 | 124.5 Ų | 124.5 | 74% | 0.74 | 83% | 0.828 | S | S | * | * | trans | -119.4 | 161.2 | -145.3 | 41.4 | -33.6 | 0 | 0 | 0 | 118.7 | ||||
| 53 | R | 32.4 | Very low | 34.4 | Very low | 255 Ų | 255 | 125 Ų | 125 | 96% | 0.962 | 83% | 0.834 | S | S | * | * | trans | 72.4 | 137 | 141.9 | -81.5 | 178.1 | 178.3 | -166 | -0.3 | 122.4 | ||||
| 54 | G | 30.1 | Very low | 34.1 | Very low | 83 Ų | 83 | 122.4 Ų | 122.4 | 86% | 0.856 | 83% | 0.832 | S | S | * | * | trans | 116.8 | 130 | 162.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 55 | G | 30.6 | Very low | 34 | Very low | 78 Ų | 78 | 121.6 Ų | 121.6 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | cis | 165.4 | 141.4 | -8.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 56 | G | 31.3 | Very low | 34.3 | Very low | 86 Ų | 86 | 121.6 Ų | 121.6 | 89% | 0.887 | 83% | 0.833 | S | S | * | * | trans | 74.1 | 113.7 | 160.1 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 57 | G | 29.7 | Very low | 34.4 | Very low | 71 Ų | 71 | 121.6 Ų | 121.6 | 73% | 0.732 | 83% | 0.833 | S | S | * | * | 90.4 | 113.2 | 114.5 | 0 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 58 | C | 29.1 | Very low | 34.6 | Very low | 143 Ų | 143 | 122.3 Ų | 122.3 | 97% | 0.966 | 83% | 0.832 | S | S | * | * | trans | 75.2 | 135.2 | 138.6 | -58.6 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 59 | G | 31.2 | Very low | 34.7 | Very low | 82 Ų | 82 | 122.1 Ų | 122.1 | 85% | 0.845 | 83% | 0.83 | S | S | * | * | trans | 122.5 | 107.4 | 158.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 60 | G | 29.8 | Very low | 35.2 | Very low | 76 Ų | 76 | 116.4 Ų | 116.4 | 78% | 0.784 | 83% | 0.825 | S | S | * | * | trans | -96.6 | -163.3 | 153.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 61 | P | 45.3 | Very low | 35.3 | Very low | 117 Ų | 117 | 118.4 Ų | 118.4 | 76% | 0.76 | 83% | 0.825 | S | S | * | * | cis | -131.6 | -172.6 | -7.8 | 42.1 | -25.9 | 0 | 0 | 0 | 113.2 | ||||
| 62 | S | 33.7 | Very low | 35.3 | Very low | 121 Ų | 121 | 118.5 Ų | 118.5 | 85% | 0.846 | 83% | 0.825 | S | S | * | * | trans | 59.4 | 118.8 | 150.4 | -53.3 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 63 | G | 29.7 | Very low | 35 | Very low | 80 Ų | 80 | 118.6 Ų | 118.6 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | trans | 147.9 | 123.7 | 147.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 64 | G | 32.2 | Very low | 35.1 | Very low | 81 Ų | 81 | 111.7 Ų | 111.7 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | trans | 68.6 | 89.7 | 146 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 65 | G | 34.1 | Very low | 35.3 | Very low | 77 Ų | 77 | 113.8 Ų | 113.8 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 136.1 | 160.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 66 | P | 41.7 | Very low | 35.3 | Very low | 121 Ų | 121 | 121.8 Ų | 121.8 | 79% | 0.786 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 164.4 | 177.6 | 30.8 | -34.3 | 0 | 0 | 0 | 113.4 | ||
| 67 | P | 41.7 | Very low | 35.2 | Very low | 129 Ų | 129 | 123.3 Ų | 123.3 | 84% | 0.838 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -81.7 | 154.2 | -160.1 | 31.9 | -36.9 | 0 | 0 | 0 | 115.6 | ||
| 68 | Q | 38.7 | Very low | 35.2 | Very low | 180 Ų | 180 | 126.3 Ų | 126.3 | 84% | 0.841 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 146.7 | 171.7 | -65.1 | -176.3 | 6.6 | 0 | 0 | 112.2 | ||
| 69 | P | 39.2 | Very low | 35.2 | Very low | 116 Ų | 116 | 125.1 Ų | 125.1 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 154.6 | 172.5 | 30.9 | -34.7 | 0 | 0 | 0 | 112.6 | ||
| 70 | P | 40.8 | Very low | 35.2 | Very low | 128 Ų | 128 | 127 Ų | 127 | 83% | 0.831 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -76.3 | 149.6 | -170.5 | 30.2 | -35.8 | 0 | 0 | 0 | 114.1 | ||
| 71 | R | 36.5 | Very low | 35.2 | Very low | 231 Ų | 231 | 129.5 Ų | 129.5 | 87% | 0.872 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 147.9 | 174.5 | -63.2 | -176.8 | -179 | -154.4 | -0.1 | 111.7 | ||
| 72 | P | 36.4 | Very low | 34.5 | Very low | 119 Ų | 119 | 129.9 Ų | 129.9 | 77% | 0.773 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 150.3 | 174.9 | 30.5 | -35.1 | 0 | 0 | 0 | 112.3 | ||
| 73 | P | 40.3 | Very low | 34.3 | Very low | 117 Ų | 117 | 135.8 Ų | 135.8 | 76% | 0.76 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 155.2 | 179.1 | 32.4 | -35.4 | 0 | 0 | 0 | 112.8 | ||
| 74 | P | 35.7 | Very low | 34.2 | Very low | 110 Ų | 110 | 143.1 Ų | 143.1 | 71% | 0.714 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 154.8 | 178.8 | 30.9 | -35.6 | 0 | 0 | 0 | 112.8 | R76 | P74-R76 PolarHBondContact O-N 2.81Š|
| 75 | P | 34.4 | Very low | 34.1 | Very low | 127 Ų | 127 | 149.3 Ų | 149.3 | 83% | 0.825 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 131.3 | -178.5 | 28.5 | -34.5 | 0 | 0 | 0 | 111.7 | ||
| 76 | R | 30.7 | Very low | 33.9 | Very low | 245 Ų | 245 | 152.8 Ų | 152.8 | 93% | 0.925 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 124.6 | 175.2 | -69.8 | -175.8 | 172.1 | -153.7 | -2 | 110.8 | P74 | P74-R76 PolarHBondContact O-N 2.81Š|
| 77 | C | 28 | Very low | 33.2 | Very low | 119 Ų | 119 | 154.7 Ų | 154.7 | 80% | 0.804 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 130.4 | 166.6 | -64.3 | 0 | 0 | 0 | 0 | 110.8 | C79 | C77-C79 PolarHBondContact O-N 2.66Š|
| 78 | C | 29.2 | Very low | 32.7 | Very low | 133 Ų | 133 | 156.3 Ų | 156.3 | 90% | 0.899 | 83% | 0.825 | S | S | * | * | trans | -74.9 | 99.4 | 165.3 | -84 | 0 | 0 | 0 | 0 | 110 | ||||
| 79 | C | 30.8 | Very low | 32.2 | Very low | 118 Ų | 118 | 151.2 Ų | 151.2 | 80% | 0.797 | 82% | 0.821 | S | S | * | * | trans | -69.2 | 132.6 | 165.1 | -71 | 0 | 0 | 0 | 0 | 110.5 | C77 C81 | C77-C79 PolarHBondContact O-N 2.66Å; C79-C81 PolarHBondContact O-N 3.48Å | ||
| 80 | C | 30.6 | Very low | 31.8 | Very low | 121 Ų | 121 | 149.7 Ų | 149.7 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -62.1 | 132.9 | 172.3 | -67.8 | 0 | 0 | 0 | 0 | 111.4 | C82 | C80-C82 PolarHBondContact O-N 2.94Š| ||
| 81 | C | 29.9 | Very low | 31.3 | Very low | 130 Ų | 130 | 147.5 Ų | 147.5 | 88% | 0.878 | 83% | 0.827 | S | S | * | * | trans | -67.6 | 96.6 | 168.8 | -82.4 | 0 | 0 | 0 | 0 | 111.3 | C79 R83 | C79-C81 PolarHBondContact O-N 3.48Å; C81-R83 PolarHBondContact O-N 3.05Å | ||
| 82 | C | 29.7 | Very low | 31 | Very low | 125 Ų | 125 | 140.3 Ų | 140.3 | 85% | 0.845 | 83% | 0.825 | S | S | * | * | trans | -66.1 | 97.9 | 159.1 | -77.3 | 0 | 0 | 0 | 0 | 109.6 | C80 R84 | C80-C82 PolarHBondContact O-N 2.94Å; C82-R84 PolarHBondContact O-N 3.38Å; C82-R84 VanDerWaalsContact O-N 3.13Å | ||
| 83 | R | 29.5 | Very low | 30.8 | Very low | 245 Ų | 245 | 139 Ų | 139 | 93% | 0.925 | 83% | 0.833 | S | S | * | * | trans | -72.2 | 104.9 | 176.4 | -143.9 | 179.4 | -163.6 | -159.3 | 4.4 | 109.4 | C81 R85 | C81-R83 PolarHBondContact O-N 3.05Å; R83-R85 PolarHBondContact O-N 3.2Å | ||
| 84 | R | 29 | Very low | 30.3 | Very low | 234 Ų | 234 | 137.3 Ų | 137.3 | 88% | 0.883 | 84% | 0.836 | S | S | * | * | trans | -58.9 | 129.8 | 172.3 | -81.5 | -175.9 | 173.3 | -175.3 | -1.9 | 110 | C82 L86 | C82-R84 PolarHBondContact O-N 3.38Å; C82-R84 VanDerWaalsContact O-N 3.13Å; R84-L86 PolarHBondContact O-N 2.85Å | ||
| 85 | R | 29.3 | Very low | 30.1 | Very low | 211 Ų | 211 | 136.2 Ų | 136.2 | 80% | 0.796 | 85% | 0.846 | S | S | * | * | trans | -80.3 | 99.7 | 170.4 | -166.2 | -178.6 | -135.1 | -146.3 | 4.3 | 108.7 | R83 Q87 | R83-R85 PolarHBondContact O-N 3.2Å; R85-Q87 PolarHBondContact O-N 3.38Å | ||
| 86 | L | 28.9 | Very low | 29.9 | Very low | 150 Ų | 150 | 134 Ų | 134 | 79% | 0.785 | 85% | 0.845 | S | S | * | * | trans | -70 | 118.1 | 165.8 | -98.4 | 128.8 | 0 | 0 | 0 | 108.5 | R84 | R84-L86 PolarHBondContact O-N 2.85Š| ||
| 87 | Q | 28.3 | Very low | 29.9 | Very low | 160 Ų | 160 | 126.4 Ų | 126.4 | 75% | 0.748 | 84% | 0.843 | S | S | * | * | trans | -110.4 | 84.9 | 177.9 | -145.9 | 167.3 | -1.1 | 0 | 0 | 108.3 | R85 G89 | R85-Q87 PolarHBondContact O-N 3.38Å; Q87-G89 PolarHBondContact O-N 2.93Å | ||
| 88 | L | 30.8 | Very low | 30.1 | Very low | 163 Ų | 163 | 124.9 Ų | 124.9 | 85% | 0.853 | 85% | 0.848 | S | S | * | * | trans | -82.3 | 86.6 | 171.1 | -79.5 | 166.8 | 0 | 0 | 0 | 108.8 | G90 | L88-G90 PolarHBondContact O-N 3.39Š| ||
| 89 | G | 29.1 | Very low | 30.2 | Very low | 74 Ų | 74 | 122.6 Ų | 122.6 | 76% | 0.763 | 85% | 0.847 | S | S | * | * | trans | -79.9 | 92.5 | 169.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q87 G91 | Q87-G89 PolarHBondContact O-N 2.93Å; G89-G91 PolarHBondContact O-N 3.04Å | ||
| 90 | G | 30.7 | Very low | 30.2 | Very low | 83 Ų | 83 | 121.2 Ų | 121.2 | 86% | 0.856 | 85% | 0.852 | S | S | * | * | trans | -72.2 | 111.4 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | L88 | L88-G90 PolarHBondContact O-N 3.39Š| ||
| 91 | G | 29.7 | Very low | 30.1 | Very low | 83 Ų | 83 | 119.3 Ų | 119.3 | 86% | 0.856 | 85% | 0.854 | S | S | * | * | trans | -82.5 | 146.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | G89 | G89-G91 PolarHBondContact O-N 3.04Š| ||
| 92 | G | 30.6 | Very low | 30.4 | Very low | 80 Ų | 80 | 124.6 Ų | 124.6 | 83% | 0.825 | 86% | 0.855 | S | S | * | * | trans | -161 | 117.3 | 170.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 93 | G | 30.5 | Very low | 30.2 | Very low | 91 Ų | 91 | 130 Ų | 130 | 94% | 0.938 | 86% | 0.858 | S | S | * | * | trans | 86.4 | 72.1 | 158.8 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 94 | G | 31.3 | Very low | 30.2 | Very low | 81 Ų | 81 | 122.9 Ų | 122.9 | 84% | 0.835 | 85% | 0.851 | S | S | * | * | trans | -160.4 | 92.6 | 163.4 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 95 | G | 30.9 | Very low | 30.2 | Very low | 88 Ų | 88 | 119.9 Ų | 119.9 | 91% | 0.907 | 85% | 0.852 | S | S | * | * | trans | -89.6 | 152.3 | -169.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 96 | G | 31 | Very low | 29.9 | Very low | 79 Ų | 79 | 118.4 Ų | 118.4 | 81% | 0.814 | 85% | 0.854 | S | S | * | * | trans | 145.1 | 99.8 | 163 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 97 | G | 30.9 | Very low | 29.9 | Very low | 86 Ų | 86 | 122.6 Ų | 122.6 | 89% | 0.887 | 86% | 0.86 | S | S | * | * | trans | 62.4 | 130.9 | 161.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 98 | G | 30.8 | Very low | 29.8 | Very low | 87 Ų | 87 | 120 Ų | 120 | 90% | 0.897 | 85% | 0.851 | S | S | * | * | cis | 118 | 112.2 | 21.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 99 | G | 31.5 | Very low | 30.1 | Very low | 86 Ų | 86 | 117 Ų | 117 | 89% | 0.887 | 85% | 0.849 | S | S | * | * | trans | 139.9 | 103.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 100 | G | 30.6 | Very low | 30.2 | Very low | 88 Ų | 88 | 123.6 Ų | 123.6 | 91% | 0.907 | 85% | 0.851 | S | S | * | * | trans | -91.2 | 158.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 101 | G | 30 | Very low | 30.1 | Very low | 82 Ų | 82 | 123.3 Ų | 123.3 | 85% | 0.845 | 85% | 0.848 | S | S | * | * | trans | -165.5 | 119.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 102 | R | 34.4 | Very low | 30 | Very low | 240 Ų | 240 | 125.8 Ų | 125.8 | 91% | 0.906 | 85% | 0.851 | S | S | * | * | trans | -81.6 | 140.6 | 174.6 | -53.1 | 179.6 | -165.2 | -161.5 | 3.7 | 110.5 | ||||
| 103 | R | 27.3 | Very low | 30 | Very low | 240 Ų | 240 | 130.9 Ų | 130.9 | 91% | 0.906 | 85% | 0.853 | S | S | * | * | trans | -174.4 | 113.8 | 145.1 | -105.6 | 167.3 | -82.3 | -159.7 | 1.3 | 107.9 | ||||
| 104 | A | 28.3 | Very low | 30.3 | Very low | 95 Ų | 95 | 132.5 Ų | 132.5 | 79% | 0.785 | 85% | 0.847 | S | S | * | * | 79.8 | 112.1 | 88.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 105 | L | 28.4 | Very low | 30.6 | Very low | 171 Ų | 171 | 132.7 Ų | 132.7 | 90% | 0.895 | 84% | 0.841 | S | S | * | * | trans | -68.8 | 128.9 | 177.5 | -76.3 | 150.3 | 0 | 0 | 0 | 110.2 | ||||
| 106 | Q | 24.5 | Very low | 30.6 | Very low | 180 Ų | 180 | 132.1 Ų | 132.1 | 84% | 0.841 | 83% | 0.834 | S | S | * | * | trans | -127.1 | 118 | 166.4 | -170.3 | 154.6 | 1.2 | 0 | 0 | 109.2 | ||||
| 107 | W | 27.2 | Very low | 31 | Very low | 238 Ų | 238 | 137 Ų | 137 | 90% | 0.902 | 84% | 0.836 | S | S | * | * | trans | -81.2 | 131.7 | 171.1 | -83.4 | 75.6 | 0 | 0 | 0 | 108.9 | ||||
| 108 | D | 26.8 | Very low | 31.3 | Very low | 106 Ų | 106 | 137 Ų | 137 | 57% | 0.567 | 83% | 0.827 | S | S | * | * | trans | -122.8 | 99.7 | 176.6 | -154.4 | 40.8 | 0 | 0 | 0 | 109 | R110 | D108-R110 IonicContact OD2-CZ 2.56Å; D108-R110 IonicContact OD2-NE 2.63Å; D108-R110 PolarHBondContact OD2-NE 3.28Å; D108-R110 IonicContact OD2-NH2 3.22Å; D108-R110 PolarHBondContact OD2-NH2 2.98Å | ||
| 109 | A | 38 | Very low | 31.8 | Very low | 98 Ų | 98 | 138.9 Ų | 138.9 | 81% | 0.81 | 82% | 0.824 | S | S | * | * | trans | -86.2 | 110.5 | -178.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 110 | R | 30.7 | Very low | 32.2 | Very low | 214 Ų | 214 | 145.2 Ų | 145.2 | 81% | 0.808 | 82% | 0.821 | S | S | * | * | trans | -127.7 | 103.5 | 173.2 | -73.5 | -170.1 | -121 | -165.4 | 1.1 | 112.6 | D108 | D108-R110 IonicContact OD2-CZ 2.56Å; D108-R110 IonicContact OD2-NE 2.63Å; D108-R110 PolarHBondContact OD2-NE 3.28Å; D108-R110 IonicContact OD2-NH2 3.22Å; D108-R110 PolarHBondContact OD2-NH2 2.98Å | ||
| 111 | G | 29.5 | Very low | 32.7 | Very low | 76 Ų | 76 | 145.3 Ų | 145.3 | 78% | 0.784 | 81% | 0.813 | S | S | * | * | trans | 44.6 | 107.1 | 145.3 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 112 | C | 27.5 | Very low | 33.3 | Very low | 136 Ų | 136 | 143.8 Ų | 143.8 | 92% | 0.919 | 80% | 0.797 | S | S | * | * | trans | -78.5 | 111.9 | 150 | -74.1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 113 | E | 30.1 | Very low | 33.9 | Very low | 187 Ų | 187 | 136.2 Ų | 136.2 | 87% | 0.874 | 78% | 0.781 | S | S | * | * | trans | -84.3 | 135.5 | 156.7 | -78.6 | -159.5 | 99.9 | 0 | 0 | 110.4 | A115 | E113-A115 PolarHBondContact O-N 3.47Š| ||
| 114 | P | 36.6 | Very low | 34.8 | Very low | 125 Ų | 125 | 131.7 Ų | 131.7 | 81% | 0.812 | 77% | 0.774 | S | S | * | * | trans | -81.1 | 102.8 | 176.9 | 31.6 | -32 | 0 | 0 | 0 | 110.9 | G116 | P114-G116 PolarHBondContact O-N 3.38Š| ||
| 115 | A | 36.7 | Very low | 35.7 | Very low | 85 Ų | 85 | 133.4 Ų | 133.4 | 70% | 0.702 | 77% | 0.769 | S | S | * | * | trans | -65.8 | 95.5 | 172 | 0 | 0 | 0 | 0 | 0 | 111.2 | E113 H117 | E113-A115 PolarHBondContact O-N 3.47Å; A115-H117 PolarHBondContact O-N 2.84Å; A115-H117 VanDerWaalsContact O-N 3.08Å; A115-H117 PolarHBondContact O-ND1 3.27Å; A115-H117 VanDerWaalsContact O-ND1 3.17Å | ||
| 116 | G | 32.4 | Very low | 36.8 | Very low | 75 Ų | 75 | 129.4 Ų | 129.4 | 77% | 0.773 | 76% | 0.761 | S | S | * | * | trans | -56.2 | 110.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | P114 A118 | P114-G116 PolarHBondContact O-N 3.38Å; G116-A118 PolarHBondContact O-N 3.31Å | ||
| 117 | H | 38.7 | Very low | 38.1 | Very low | 182 Ų | 182 | 125 Ų | 125 | 84% | 0.843 | 76% | 0.756 | S | S | * | * | trans | -77.8 | 88.6 | 171.3 | -83.7 | 54 | 0 | 0 | 0 | 110.2 | A115 | A115-H117 PolarHBondContact O-N 2.84Å; A115-H117 VanDerWaalsContact O-N 3.08Å; A115-H117 PolarHBondContact O-ND1 3.27Å; A115-H117 VanDerWaalsContact O-ND1 3.17Å | ||
| 118 | A | 37.9 | Very low | 39.8 | Very low | 86 Ų | 86 | 117 Ų | 117 | 71% | 0.711 | 73% | 0.729 | S | S | * | * | trans | -63.5 | 125.2 | 160.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | G116 R120 | G116-A118 PolarHBondContact O-N 3.31Å; A118-R120 PolarHBondContact O-N 3Å | ||
| 119 | P | 41 | Very low | 42 | Very low | 127 Ų | 127 | 117.5 Ų | 117.5 | 83% | 0.825 | 73% | 0.726 | S | S | * | * | trans | -67.8 | 110.1 | 178.2 | 27 | -32.5 | 0 | 0 | 0 | 109.2 | A121 | P119-A121 PolarHBondContact O-N 2.9Š| ||
| 120 | R | 40.3 | Very low | 43.8 | Very low | 218 Ų | 218 | 123.2 Ų | 123.2 | 82% | 0.823 | 73% | 0.727 | S | S | * | * | trans | -60.7 | 103.9 | 174.3 | -90 | 179.9 | 162.6 | 172.4 | -4.9 | 109.9 | A118 G122 S123 | A118-R120 PolarHBondContact O-N 3Å; R120-G122 PolarHBondContact O-N 3.03Å; R120-S123 PolarHBondContact O-N 3.41Å; R120-S123 PolarHBondContact O-OG 2.74Å; R120-S123 VanDerWaalsContact O-OG 3.13Å | ||
| 121 | A | 40.8 | Very low | 45.6 | Very low | 90 Ų | 90 | 115.4 Ų | 115.4 | 74% | 0.744 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.6 | -16.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | P119 S123 | P119-A121 PolarHBondContact O-N 2.9Å; A121-S123 VanDerWaalsContact C-N 3.31Å; A121-S123 PolarHBondContact O-N 3.17Å |
| 122 | G | 41.4 | Very low | 48.2 | Very low | 50 Ų | 50 | 115.6 Ų | 115.6 | 52% | 0.515 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -71.8 | -9.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | R120 | R120-G122 PolarHBondContact O-N 3.03Å |
| 123 | S | 47.2 | Very low | 51 | Low | 82 Ų | 82 | 112.4 Ų | 112.4 | 57% | 0.573 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -79.2 | -29.2 | -179.3 | 56.7 | 0 | 0 | 0 | 0 | 114.1 | R120 A121 A126 | R120-S123 PolarHBondContact O-N 3.41Å; R120-S123 PolarHBondContact O-OG 2.74Å; R120-S123 VanDerWaalsContact O-OG 3.13Å; A121-S123 VanDerWaalsContact C-N 3.31Å; A121-S123 PolarHBondContact O-N 3.17Å; S123-A126 PolarHBondContact O-N 2.89Å |
| 124 | L | 45.8 | Very low | 53.6 | Low | 144 Ų | 144 | 106.3 Ų | 106.3 | 75% | 0.754 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -71.9 | -40 | 178.5 | -95.8 | 160.4 | 0 | 0 | 0 | 112.5 | A126 A127 | L124-A126 VanDerWaalsContact C-N 3.31Å; L124-A126 PolarHBondContact O-N 3.2Å; L124-A127 PolarHBondContact O-N 3.46Å |
| 125 | L | 48.5 | Very low | 56 | Low | 131 Ų | 131 | 103.5 Ų | 103.5 | 69% | 0.686 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67.5 | -30.1 | 174.4 | -82.8 | 162.4 | 0 | 0 | 0 | 112.8 | A127 | L125-A127 VanDerWaalsContact C-N 3.28Å; L125-A127 PolarHBondContact O-N 2.97Å |
| 126 | A | 50.2 | Low | 58.6 | Low | 88 Ų | 88 | 103.6 Ų | 103.6 | 73% | 0.727 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | -15 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | S123 L124 | S123-A126 PolarHBondContact O-N 2.89Å; L124-A126 VanDerWaalsContact C-N 3.31Å; L124-A126 PolarHBondContact O-N 3.2Å |
| 127 | A | 53.7 | Low | 61.3 | Low | 87 Ų | 87 | 103.1 Ų | 103.1 | 72% | 0.719 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | 1.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | L124 L125 | L124-A127 PolarHBondContact O-N 3.46Å; L125-A127 VanDerWaalsContact C-N 3.28Å; L125-A127 PolarHBondContact O-N 2.97Å |
| 128 | M | 61.3 | Low | 63.8 | Low | 70 Ų | 70 | 99.3 Ų | 99.3 | 35% | 0.345 | 57% | 0.567 | S | S | . | * | S | Bend | trans | -83.4 | 128 | 179.2 | -65.6 | -172.5 | 70.2 | 0 | 0 | 111.4 | N132 V133 L136 | M128-N132 HydrophobicContact CE-CB 3.97Å; M128-V133 HydrophobicContact CB-CG2 3.67Å; M128-L136 HydrophobicContact CE-CD2 4.09Å |
| 129 | K | 74.1 | Confident | 66.5 | Low | 116 Ų | 116 | 100.1 Ų | 100.1 | 50% | 0.504 | 56% | 0.558 | S | S | . | * | trans | -53.6 | 141.9 | 169.4 | -67.3 | -177.4 | 178.5 | 179.6 | 0 | 110 | Q131 N132 V133 | K129-Q131 PolarHBondContact O-N 3.18Å; K129-Q131 VanDerWaalsContact O-N 3.1Å; K129-N132 WeakPolarHBondContact O-CB 3.43Å; K129-N132 PolarHBondContact O-N 3.36Å; K129-V133 PolarHBondContact O-N 2.94Å; K129-V133 VanDerWaalsContact O-N 3.1Å | ||
| 130 | R | 74.5 | Confident | 69.1 | Low | 219 Ų | 219 | 97.9 Ų | 97.9 | 83% | 0.826 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -51.8 | -37.6 | 178.7 | -69.1 | 179.9 | 179.8 | -89.9 | 0.6 | 112.3 | V133 R134 | R130-V133 PolarHBondContact O-N 3.49Å; R130-R134 WeakPolarHBondContact O-CB 3.41Å; R130-R134 PolarHBondContact O-N 3.28Å |
| 131 | Q | 69.9 | Low | 71.7 | Confident | 49 Ų | 49 | 90.8 Ų | 90.8 | 23% | 0.229 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -61 | -47.2 | 173.2 | -175.1 | -180 | 3.6 | 0 | 0 | 113.4 | K129 V133 R134 T135 E381 | K129-Q131 PolarHBondContact O-N 3.18Å; K129-Q131 VanDerWaalsContact O-N 3.1Å; Q131-V133 VanDerWaalsContact C-N 3.27Å; Q131-V133 PolarHBondContact O-N 2.84Å; Q131-R134 WeakPolarHBondContact O-CB 3.41Å; Q131-R134 PolarHBondContact O-N 3.27Å; Q131-R134 VanDerWaalsContact O-N 3.12Å; Q131-T135 PolarHBondContact O-N 3.02Å; Q131-T135 PolarHBondContact O-OG1 3.41Å; Q131-E381 PolarHBondContact NE2-OE1 2.96Å |
| 132 | N | 83.4 | Confident | 74.3 | Confident | 81 Ų | 81 | 90.5 Ų | 90.5 | 43% | 0.433 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.4 | -37.7 | 177.7 | -66.3 | 6.6 | 0 | 0 | 0 | 111 | M128 K129 L136 | M128-N132 HydrophobicContact CE-CB 3.97Å; K129-N132 WeakPolarHBondContact O-CB 3.43Å; K129-N132 PolarHBondContact O-N 3.36Å; N132-L136 WeakPolarHBondContact O-CB 3.2Å; N132-L136 PolarHBondContact O-N 3.37Å |
| 133 | V | 86.6 | Confident | 77 | Confident | 69 Ų | 69 | 94.2 Ų | 94.2 | 42% | 0.418 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.9 | -43 | 173.7 | -179.9 | 0 | 0 | 0 | 0 | 110.9 | M128 K129 R130 Q131 S137 | M128-V133 HydrophobicContact CB-CG2 3.67Å; K129-V133 PolarHBondContact O-N 2.94Å; K129-V133 VanDerWaalsContact O-N 3.1Å; R130-V133 PolarHBondContact O-N 3.49Å; Q131-V133 VanDerWaalsContact C-N 3.27Å; Q131-V133 PolarHBondContact O-N 2.84Å; V133-S137 WeakPolarHBondContact O-CB 3.27Å; V133-S137 PolarHBondContact O-N 3.49Å |
| 134 | R | 84.9 | Confident | 79.4 | Confident | 58 Ų | 58 | 93.7 Ų | 93.7 | 22% | 0.219 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -63.1 | -47.5 | 176.9 | -177 | 177.3 | 174.7 | -176.9 | -9.1 | 112.2 | R130 Q131 S137 L138 F373 D380 | R130-R134 WeakPolarHBondContact O-CB 3.41Å; R130-R134 PolarHBondContact O-N 3.28Å; Q131-R134 WeakPolarHBondContact O-CB 3.41Å; Q131-R134 PolarHBondContact O-N 3.27Å; Q131-R134 VanDerWaalsContact O-N 3.12Å; R134-S137 PolarHBondContact O-N 3.33Å; R134-L138 WeakPolarHBondContact O-CG 3.41Å; R134-L138 PolarHBondContact O-N 2.94Å; R134-F373 PolarHBondContact NH2-O 2.86Å; R134-D380 IonicContact NH1-OD2 2.66Å; R134-D380 PolarHBondContact NH1-OD2 2.88Å |
| 135 | T | 86.9 | Confident | 81.8 | Confident | 66 Ų | 66 | 95.6 Ų | 95.6 | 41% | 0.405 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.5 | -45.2 | 178.2 | -57.9 | 0 | 0 | 0 | 0 | 111.6 | Q131 S137 L138 I139 | Q131-T135 PolarHBondContact O-N 3.02Å; Q131-T135 PolarHBondContact O-OG1 3.41Å; T135-S137 VanDerWaalsContact C-N 3.33Å; T135-S137 PolarHBondContact O-N 3.5Å; T135-L138 PolarHBondContact O-N 3Å; T135-I139 HydrophobicContact CG2-CD1 4.08Å; T135-I139 WeakPolarHBondContact O-CG1 3.47Å; T135-I139 PolarHBondContact O-N 2.88Å |
| 136 | L | 90.1 | Very high | 84.2 | Confident | 88 Ų | 88 | 94.5 Ų | 94.5 | 46% | 0.461 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.8 | -41.1 | 176.3 | -176.5 | 64.1 | 0 | 0 | 0 | 111.6 | M128 N132 I139 V140 | M128-L136 HydrophobicContact CE-CD2 4.09Å; N132-L136 WeakPolarHBondContact O-CB 3.2Å; N132-L136 PolarHBondContact O-N 3.37Å; L136-I139 PolarHBondContact O-N 2.93Å; L136-V140 HydrophobicContact CD1-CG2 4.47Å; L136-V140 WeakPolarHBondContact O-CG2 3.49Å; L136-V140 PolarHBondContact O-N 2.95Å |
| 137 | S | 90.6 | Very high | 86.5 | Confident | 65 Ų | 65 | 95.1 Ų | 95.1 | 46% | 0.455 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -45.4 | 174.7 | -177.5 | 0 | 0 | 0 | 0 | 111.7 | V133 R134 T135 I139 V140 C141 | V133-S137 WeakPolarHBondContact O-CB 3.27Å; V133-S137 PolarHBondContact O-N 3.49Å; R134-S137 PolarHBondContact O-N 3.33Å; T135-S137 VanDerWaalsContact C-N 3.33Å; T135-S137 PolarHBondContact O-N 3.5Å; S137-I139 PolarHBondContact O-N 3.11Å; S137-V140 PolarHBondContact O-N 3.39Å; S137-C141 VanDerWaalsContact O-CB 3.31Å; S137-C141 WeakPolarHBondContact O-CB 3.43Å; S137-C141 PolarHBondContact O-N 3.03Å; S137-C141 PolarHBondContact O-SG 2.94Å |
| 138 | L | 90.4 | Very high | 88.6 | Confident | 102 Ų | 102 | 95.5 Ų | 95.5 | 53% | 0.534 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.2 | -43.2 | 174.9 | -73.4 | 170.9 | 0 | 0 | 0 | 112.4 | R134 T135 C141 T142 | R134-L138 WeakPolarHBondContact O-CG 3.41Å; R134-L138 PolarHBondContact O-N 2.94Å; T135-L138 PolarHBondContact O-N 3Å; L138-C141 PolarHBondContact O-N 3.32Å; L138-T142 WeakPolarHBondContact O-CB 3.44Å; L138-T142 PolarHBondContact O-N 2.72Å; L138-T142 PolarHBondContact O-OG1 2.99Å; L138-T142 VanDerWaalsContact O-OG1 3.06Å |
| 139 | I | 93.9 | Very high | 90.3 | Very high | 103 Ų | 103 | 93.2 Ų | 93.2 | 53% | 0.528 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.4 | -47.8 | 176.9 | -67.8 | 164.5 | 0 | 0 | 0 | 110.8 | T135 L136 S137 T142 F143 | T135-I139 HydrophobicContact CG2-CD1 4.08Å; T135-I139 WeakPolarHBondContact O-CG1 3.47Å; T135-I139 PolarHBondContact O-N 2.88Å; L136-I139 PolarHBondContact O-N 2.93Å; S137-I139 PolarHBondContact O-N 3.11Å; I139-T142 PolarHBondContact O-N 3.02Å; I139-F143 WeakPolarHBondContact O-CB 3.28Å; I139-F143 PolarHBondContact O-N 3.46Å |
| 140 | V | 96.3 | Very high | 91.5 | Very high | 79 Ų | 79 | 90.6 Ų | 90.6 | 48% | 0.479 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.9 | -45.1 | 178.6 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | L136 S137 F143 T144 | L136-V140 HydrophobicContact CD1-CG2 4.47Å; L136-V140 WeakPolarHBondContact O-CG2 3.49Å; L136-V140 PolarHBondContact O-N 2.95Å; S137-V140 PolarHBondContact O-N 3.39Å; V140-F143 PolarHBondContact O-N 2.91Å; V140-T144 HydrophobicContact CG1-CG2 4.48Å; V140-T144 WeakPolarHBondContact O-CG2 3.38Å; V140-T144 PolarHBondContact O-N 3.18Å; V140-T144 PolarHBondContact O-OG1 3.48Å; V140-T144 VanDerWaalsContact O-OG1 3.12Å |
| 141 | C | 96 | Very high | 92.6 | Very high | 69 Ų | 69 | 83 Ų | 83 | 47% | 0.466 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 176.4 | -74.3 | 0 | 0 | 0 | 0 | 112.6 | S137 L138 T144 Y145 | S137-C141 VanDerWaalsContact O-CB 3.31Å; S137-C141 WeakPolarHBondContact O-CB 3.43Å; S137-C141 PolarHBondContact O-N 3.03Å; S137-C141 PolarHBondContact O-SG 2.94Å; L138-C141 PolarHBondContact O-N 3.32Å; C141-T144 PolarHBondContact O-OG1 3.1Å; C141-T144 VanDerWaalsContact O-OG1 3.07Å; C141-Y145 VanDerWaalsContact O-CB 3.26Å; C141-Y145 WeakPolarHBondContact O-CB 3.4Å; C141-Y145 PolarHBondContact O-N 2.96Å |
| 142 | T | 95.3 | Very high | 93.9 | Very high | 84 Ų | 84 | 84.2 Ų | 84.2 | 52% | 0.515 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.3 | -41.8 | 176.6 | -61.8 | 0 | 0 | 0 | 0 | 111.3 | L138 I139 Y145 L146 | L138-T142 WeakPolarHBondContact O-CB 3.44Å; L138-T142 PolarHBondContact O-N 2.72Å; L138-T142 PolarHBondContact O-OG1 2.99Å; L138-T142 VanDerWaalsContact O-OG1 3.06Å; I139-T142 PolarHBondContact O-N 3.02Å; T142-Y145 PolarHBondContact O-N 3.27Å; T142-L146 HydrophobicContact CG2-CD1 4.38Å; T142-L146 WeakPolarHBondContact O-CG 3.26Å; T142-L146 PolarHBondContact O-N 2.66Å |
| 143 | F | 97.4 | Very high | 94.6 | Very high | 129 Ų | 129 | 86.8 Ų | 86.8 | 57% | 0.566 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.5 | -43 | 177.9 | -171.5 | -103.4 | 0 | 0 | 0 | 112.3 | I139 V140 Y145 L146 L147 | I139-F143 WeakPolarHBondContact O-CB 3.28Å; I139-F143 PolarHBondContact O-N 3.46Å; V140-F143 PolarHBondContact O-N 2.91Å; F143-Y145 VanDerWaalsContact C-N 3.34Å; F143-Y145 PolarHBondContact O-N 2.92Å; F143-L146 PolarHBondContact O-N 3Å; F143-L147 HydrophobicContact CD1-CD1 3.95Å; F143-L147 HydrophobicContact CD1-CG 4.4Å; F143-L147 HydrophobicContact CE1-CD1 3.6Å; F143-L147 HydrophobicContact CE1-CG 4.12Å; F143-L147 HydrophobicContact CZ-CD1 4.31Å; F143-L147 HydrophobicContact CZ-CD2 4.46Å; F143-L147 HydrophobicContact CZ-CG 4.44Å; F143-L147 WeakPolarHBondContact O-CG 3.47Å; F143-L147 PolarHBondContact O-N 3.38Å |
| 144 | T | 97.5 | Very high | 95.2 | Very high | 71 Ų | 71 | 88.3 Ų | 88.3 | 44% | 0.436 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.2 | -34.5 | 174.9 | 56.3 | 0 | 0 | 0 | 0 | 112.3 | V140 C141 L147 V148 | V140-T144 HydrophobicContact CG1-CG2 4.48Å; V140-T144 WeakPolarHBondContact O-CG2 3.38Å; V140-T144 PolarHBondContact O-N 3.18Å; V140-T144 PolarHBondContact O-OG1 3.48Å; V140-T144 VanDerWaalsContact O-OG1 3.12Å; C141-T144 PolarHBondContact O-OG1 3.1Å; C141-T144 VanDerWaalsContact O-OG1 3.07Å; T144-L147 PolarHBondContact O-N 2.91Å; T144-V148 WeakPolarHBondContact O-CG2 3.43Å; T144-V148 PolarHBondContact O-N 3.08Å |
| 145 | Y | 97.3 | Very high | 95.7 | Very high | 183 Ų | 183 | 89.3 Ų | 89.3 | 72% | 0.718 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.1 | -42.2 | 172.8 | -174.7 | -96.4 | 0 | 0 | 0 | 112.1 | C141 T142 F143 V148 G149 | C141-Y145 VanDerWaalsContact O-CB 3.26Å; C141-Y145 WeakPolarHBondContact O-CB 3.4Å; C141-Y145 PolarHBondContact O-N 2.96Å; T142-Y145 PolarHBondContact O-N 3.27Å; F143-Y145 VanDerWaalsContact C-N 3.34Å; F143-Y145 PolarHBondContact O-N 2.92Å; Y145-V148 PolarHBondContact O-N 3.07Å; Y145-G149 PolarHBondContact O-N 3.04Å |
| 146 | L | 98 | Very high | 96.2 | Very high | 109 Ų | 109 | 91.4 Ų | 91.4 | 57% | 0.571 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.3 | -43 | 174.1 | -71.7 | 170.9 | 0 | 0 | 0 | 112.3 | T142 F143 G149 A150 | T142-L146 HydrophobicContact CG2-CD1 4.38Å; T142-L146 WeakPolarHBondContact O-CG 3.26Å; T142-L146 PolarHBondContact O-N 2.66Å; F143-L146 PolarHBondContact O-N 3Å; L146-G149 PolarHBondContact O-N 2.94Å; L146-A150 WeakPolarHBondContact O-CB 3.28Å; L146-A150 PolarHBondContact O-N 3.26Å |
| 147 | L | 98.1 | Very high | 96.5 | Very high | 101 Ų | 101 | 92.2 Ų | 92.2 | 53% | 0.529 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.3 | -42.4 | 176.3 | -71.2 | 177.6 | 0 | 0 | 0 | 112.5 | F143 T144 A151 | F143-L147 HydrophobicContact CD1-CD1 3.95Å; F143-L147 HydrophobicContact CD1-CG 4.4Å; F143-L147 HydrophobicContact CE1-CD1 3.6Å; F143-L147 HydrophobicContact CE1-CG 4.12Å; F143-L147 HydrophobicContact CZ-CD1 4.31Å; F143-L147 HydrophobicContact CZ-CD2 4.46Å; F143-L147 HydrophobicContact CZ-CG 4.44Å; F143-L147 WeakPolarHBondContact O-CG 3.47Å; F143-L147 PolarHBondContact O-N 3.38Å; T144-L147 PolarHBondContact O-N 2.91Å; L147-A151 WeakPolarHBondContact O-CB 3.5Å; L147-A151 PolarHBondContact O-N 3.17Å |
| 148 | V | 98.3 | Very high | 96.8 | Very high | 95 Ų | 95 | 90.8 Ų | 90.8 | 58% | 0.576 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.4 | -42 | 175.3 | 171.2 | 0 | 0 | 0 | 0 | 110.6 | T144 Y145 A151 V152 | T144-V148 WeakPolarHBondContact O-CG2 3.43Å; T144-V148 PolarHBondContact O-N 3.08Å; Y145-V148 PolarHBondContact O-N 3.07Å; V148-A151 PolarHBondContact O-N 2.96Å; V148-V152 WeakPolarHBondContact O-CB 3.27Å; V148-V152 VanDerWaalsContact O-CG2 3.3Å; V148-V152 WeakPolarHBondContact O-CG2 3.34Å; V148-V152 PolarHBondContact O-N 2.99Å |
| 149 | G | 97.6 | Very high | 97 | Very high | 22 Ų | 22 | 90.6 Ų | 90.6 | 23% | 0.227 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -58.7 | -50.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y145 L146 A151 V152 F153 | Y145-G149 PolarHBondContact O-N 3.04Å; L146-G149 PolarHBondContact O-N 2.94Å; G149-A151 PolarHBondContact O-N 3.03Å; G149-V152 PolarHBondContact O-N 3.49Å; G149-V152 VanDerWaalsContact O-N 3.14Å; G149-F153 WeakPolarHBondContact O-CD2 3.28Å; G149-F153 PolarHBondContact O-N 3.21Å |
| 150 | A | 98 | Very high | 97 | Very high | 60 Ų | 60 | 89.6 Ų | 89.6 | 50% | 0.496 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -57.5 | -46.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L146 V152 F153 D154 | L146-A150 WeakPolarHBondContact O-CB 3.28Å; L146-A150 PolarHBondContact O-N 3.26Å; A150-V152 VanDerWaalsContact C-N 3.29Å; A150-V152 PolarHBondContact O-N 3.13Å; A150-F153 PolarHBondContact O-N 3Å; A150-D154 VanDerWaalsContact O-CB 3.28Å; A150-D154 WeakPolarHBondContact O-CB 3.39Å; A150-D154 PolarHBondContact O-N 3.13Å |
| 151 | A | 98.1 | Very high | 97 | Very high | 60 Ų | 60 | 92.3 Ų | 92.3 | 50% | 0.496 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.9 | -29 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | L147 V148 G149 A155 | L147-A151 WeakPolarHBondContact O-CB 3.5Å; L147-A151 PolarHBondContact O-N 3.17Å; V148-A151 PolarHBondContact O-N 2.96Å; G149-A151 PolarHBondContact O-N 3.03Å; A151-A155 VanDerWaalsContact O-CB 3.29Å; A151-A155 WeakPolarHBondContact O-CB 3.32Å; A151-A155 PolarHBondContact O-N 3.43Å |
| 152 | V | 98.2 | Very high | 96.9 | Very high | 75 Ų | 75 | 94.6 Ų | 94.6 | 46% | 0.455 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -78 | -42.1 | 175.4 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | V148 G149 A150 A155 L156 | V148-V152 WeakPolarHBondContact O-CB 3.27Å; V148-V152 VanDerWaalsContact O-CG2 3.3Å; V148-V152 WeakPolarHBondContact O-CG2 3.34Å; V148-V152 PolarHBondContact O-N 2.99Å; G149-V152 PolarHBondContact O-N 3.49Å; G149-V152 VanDerWaalsContact O-N 3.14Å; A150-V152 VanDerWaalsContact C-N 3.29Å; A150-V152 PolarHBondContact O-N 3.13Å; V152-A155 PolarHBondContact O-N 2.88Å; V152-L156 HydrophobicContact CG1-CD1 3.76Å; V152-L156 WeakPolarHBondContact O-CB 3.33Å; V152-L156 VanDerWaalsContact O-CG 3.23Å; V152-L156 WeakPolarHBondContact O-CG 3.19Å; V152-L156 PolarHBondContact O-N 3.3Å |
| 153 | F | 97.8 | Very high | 97 | Very high | 135 Ų | 135 | 95.9 Ų | 95.9 | 59% | 0.592 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -66.6 | -42.6 | 176.4 | -73.8 | -60.6 | 0 | 0 | 0 | 111.9 | G149 A150 A155 L156 E157 | G149-F153 WeakPolarHBondContact O-CD2 3.28Å; G149-F153 PolarHBondContact O-N 3.21Å; A150-F153 PolarHBondContact O-N 3Å; F153-A155 VanDerWaalsContact C-N 3.32Å; F153-A155 PolarHBondContact O-N 3.09Å; F153-L156 PolarHBondContact O-N 3.48Å; F153-L156 VanDerWaalsContact O-N 3.11Å; F153-E157 WeakPolarHBondContact O-CB 3.42Å; F153-E157 PolarHBondContact O-N 3.24Å |
| 154 | D | 97.8 | Very high | 96.8 | Very high | 101 Ų | 101 | 94.1 Ų | 94.1 | 54% | 0.54 | 50% | 0.503 | S | S | . | . | I | π-helix | trans | -56.8 | -45.7 | 173.9 | 178.2 | 43.6 | 0 | 0 | 0 | 111.6 | A150 L156 S158 | A150-D154 VanDerWaalsContact O-CB 3.28Å; A150-D154 WeakPolarHBondContact O-CB 3.39Å; A150-D154 PolarHBondContact O-N 3.13Å; D154-L156 PolarHBondContact O-N 2.85Å; D154-S158 WeakPolarHBondContact CA-OG 3.42Å; D154-S158 VanDerWaalsContact O-CB 3.29Å; D154-S158 WeakPolarHBondContact O-CB 3.45Å; D154-S158 PolarHBondContact O-N 3.01Å; D154-S158 PolarHBondContact O-OG 2.65Å; D154-S158 VanDerWaalsContact O-OG 3.11Å; D154-S158 WeakPolarHBondContact OD1-CB 3.35Å; D154-S158 PolarHBondContact OD1-OG 3.09Å |
| 155 | A | 97.4 | Very high | 96.6 | Very high | 79 Ų | 79 | 95.6 Ų | 95.6 | 65% | 0.653 | 51% | 0.505 | S | S | * | . | I | π-helix | trans | -71.4 | -10.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | A151 V152 F153 | A151-A155 VanDerWaalsContact O-CB 3.29Å; A151-A155 WeakPolarHBondContact O-CB 3.32Å; A151-A155 PolarHBondContact O-N 3.43Å; V152-A155 PolarHBondContact O-N 2.88Å; F153-A155 VanDerWaalsContact C-N 3.32Å; F153-A155 PolarHBondContact O-N 3.09Å |
| 156 | L | 96.3 | Very high | 96.5 | Very high | 110 Ų | 110 | 92.8 Ų | 92.8 | 58% | 0.576 | 50% | 0.498 | S | S | * | . | I | π-helix | trans | -109.2 | -42.8 | -179.5 | -70.7 | 174.2 | 0 | 0 | 0 | 112.6 | V152 F153 D154 | V152-L156 HydrophobicContact CG1-CD1 3.76Å; V152-L156 WeakPolarHBondContact O-CB 3.33Å; V152-L156 VanDerWaalsContact O-CG 3.23Å; V152-L156 WeakPolarHBondContact O-CG 3.19Å; V152-L156 PolarHBondContact O-N 3.3Å; F153-L156 PolarHBondContact O-N 3.48Å; F153-L156 VanDerWaalsContact O-N 3.11Å; D154-L156 PolarHBondContact O-N 2.85Å |
| 157 | E | 96.8 | Very high | 96.4 | Very high | 104 Ų | 104 | 93.8 Ų | 93.8 | 49% | 0.486 | 50% | 0.498 | S | S | . | . | I | π-helix | trans | -104.4 | -36.3 | -167.2 | -55.7 | -58.3 | 156.3 | 0 | 0 | 113.7 | F153 D159 H160 E161 | F153-E157 WeakPolarHBondContact O-CB 3.42Å; F153-E157 PolarHBondContact O-N 3.24Å; E157-D159 PolarHBondContact O-N 2.95Å; E157-H160 CarbonylContact O-C 3.57Å; E157-H160 WeakPolarHBondContact O-CA 3.47Å; E157-H160 VanDerWaalsContact O-CB 3.31Å; E157-H160 WeakPolarHBondContact O-CB 3.44Å; E157-H160 PolarHBondContact O-N 3.42Å; E157-E161 PolarHBondContact O-N 3.1Å |
| 158 | S | 95.8 | Very high | 96.2 | Very high | 36 Ų | 36 | 94.9 Ų | 94.9 | 25% | 0.252 | 50% | 0.504 | S | S | . | . | I | π-helix | trans | -56.9 | -41.1 | -174.5 | -57.8 | 0 | 0 | 0 | 0 | 112.4 | D154 H160 E161 M162 | D154-S158 WeakPolarHBondContact CA-OG 3.42Å; D154-S158 VanDerWaalsContact O-CB 3.29Å; D154-S158 WeakPolarHBondContact O-CB 3.45Å; D154-S158 PolarHBondContact O-N 3.01Å; D154-S158 PolarHBondContact O-OG 2.65Å; D154-S158 VanDerWaalsContact O-OG 3.11Å; D154-S158 WeakPolarHBondContact OD1-CB 3.35Å; D154-S158 PolarHBondContact OD1-OG 3.09Å; S158-H160 VanDerWaalsContact C-N 3.29Å; S158-H160 PolarHBondContact O-N 3.48Å; S158-E161 PolarHBondContact O-N 3.42Å; S158-M162 WeakPolarHBondContact O-CG 3.31Å; S158-M162 PolarHBondContact O-N 2.71Å; S158-M162 VanDerWaalsContact O-N 3.09Å |
| 159 | D | 95.8 | Very high | 96 | Very high | 97 Ų | 97 | 94.8 Ų | 94.8 | 52% | 0.519 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -65.2 | -32.3 | 177.2 | -136.3 | 53.7 | 0 | 0 | 0 | 111.8 | E157 R163 | E157-D159 PolarHBondContact O-N 2.95Å; D159-R163 VanDerWaalsContact C-CZ 3.5Å; D159-R163 VanDerWaalsContact C-NH2 3.26Å; D159-R163 WeakPolarHBondContact O-CG 3.44Å; D159-R163 PolarHBondContact O-NE 3.41Å; D159-R163 PolarHBondContact O-NH1 2.98Å; D159-R163 PolarHBondContact O-NH2 3.23Å; D159-R163 VanDerWaalsContact O-NH2 3.08Å; D159-R163 IonicContact OD2-CZ 3.21Å; D159-R163 IonicContact OD2-NH1 2.94Å; D159-R163 PolarHBondContact OD2-NH1 3Å; D159-R163 IonicContact OD2-NH2 2.66Å; D159-R163 PolarHBondContact OD2-NH2 3.03Å |
| 160 | H | 94.4 | Very high | 95.8 | Very high | 82 Ų | 82 | 96.6 Ų | 96.6 | 38% | 0.38 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -76.9 | -48.5 | 176.2 | -173.1 | -93.4 | 0 | 0 | 0 | 111.5 | E157 S158 M162 R163 E164 | E157-H160 CarbonylContact O-C 3.57Å; E157-H160 WeakPolarHBondContact O-CA 3.47Å; E157-H160 VanDerWaalsContact O-CB 3.31Å; E157-H160 WeakPolarHBondContact O-CB 3.44Å; E157-H160 PolarHBondContact O-N 3.42Å; S158-H160 VanDerWaalsContact C-N 3.29Å; S158-H160 PolarHBondContact O-N 3.48Å; H160-M162 PolarHBondContact O-N 3.24Å; H160-R163 PolarHBondContact O-N 2.63Å; H160-R163 VanDerWaalsContact O-N 3.1Å; H160-E164 IonicContact CE1-OE1 3.6Å; H160-E164 IonicContact CE1-OE2 3.33Å; H160-E164 PolarHBondContact CE1-OE2 3.38Å; H160-E164 IonicContact ND1-OE2 3.62Å; H160-E164 PolarHBondContact ND1-OE2 3.48Å; H160-E164 PolarHBondContact O-N 2.96Å |
| 161 | E | 94.7 | Very high | 95.6 | Very high | 137 Ų | 137 | 97.5 Ų | 97.5 | 64% | 0.64 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -53.8 | -50.6 | 178 | -177.8 | 177.4 | -150.2 | 0 | 0 | 111.4 | E157 S158 R163 E164 E165 | E157-E161 PolarHBondContact O-N 3.1Å; S158-E161 PolarHBondContact O-N 3.42Å; E161-R163 VanDerWaalsContact C-N 3.3Å; E161-R163 PolarHBondContact O-N 3.17Å; E161-E164 PolarHBondContact O-N 3.5Å; E161-E164 VanDerWaalsContact O-N 3.09Å; E161-E165 PolarHBondContact O-N 2.88Å |
| 162 | M | 95.4 | Very high | 95.3 | Very high | 116 Ų | 116 | 97.6 Ų | 97.6 | 57% | 0.571 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -56 | -43.5 | 176.5 | -73 | -176.5 | 65.4 | 0 | 0 | 112.5 | S158 H160 E164 E165 E166 | S158-M162 WeakPolarHBondContact O-CG 3.31Å; S158-M162 PolarHBondContact O-N 2.71Å; S158-M162 VanDerWaalsContact O-N 3.09Å; H160-M162 PolarHBondContact O-N 3.24Å; M162-E164 VanDerWaalsContact C-N 3.34Å; M162-E164 PolarHBondContact O-N 3.47Å; M162-E165 PolarHBondContact O-N 2.56Å; M162-E166 WeakPolarHBondContact O-CG 3.32Å; M162-E166 PolarHBondContact O-N 3.28Å |
| 163 | R | 95.6 | Very high | 95.1 | Very high | 111 Ų | 111 | 99.8 Ų | 99.8 | 42% | 0.419 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -71 | -26.5 | 179.1 | -73.8 | -175.3 | -69.2 | -100.6 | 0.2 | 113.3 | D159 H160 E161 K167 | D159-R163 VanDerWaalsContact C-CZ 3.5Å; D159-R163 VanDerWaalsContact C-NH2 3.26Å; D159-R163 WeakPolarHBondContact O-CG 3.44Å; D159-R163 PolarHBondContact O-NE 3.41Å; D159-R163 PolarHBondContact O-NH1 2.98Å; D159-R163 PolarHBondContact O-NH2 3.23Å; D159-R163 VanDerWaalsContact O-NH2 3.08Å; D159-R163 IonicContact OD2-CZ 3.21Å; D159-R163 IonicContact OD2-NH1 2.94Å; D159-R163 PolarHBondContact OD2-NH1 3Å; D159-R163 IonicContact OD2-NH2 2.66Å; D159-R163 PolarHBondContact OD2-NH2 3.03Å; H160-R163 PolarHBondContact O-N 2.63Å; H160-R163 VanDerWaalsContact O-N 3.1Å; E161-R163 VanDerWaalsContact C-N 3.3Å; E161-R163 PolarHBondContact O-N 3.17Å; R163-K167 VanDerWaalsContact O-CD 3.28Å; R163-K167 WeakPolarHBondContact O-CD 3.13Å; R163-K167 WeakPolarHBondContact O-CE 3.33Å; R163-K167 WeakPolarHBondContact O-CG 3.49Å; R163-K167 PolarHBondContact O-N 3.46Å |
| 164 | E | 94.1 | Very high | 94.9 | Very high | 93 Ų | 93 | 99.4 Ų | 99.4 | 44% | 0.435 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -77.9 | -41.5 | 172.5 | -69.5 | -157.7 | 118.6 | 0 | 0 | 111.4 | H160 E161 M162 E166 K167 L168 | H160-E164 IonicContact CE1-OE1 3.6Å; H160-E164 IonicContact CE1-OE2 3.33Å; H160-E164 PolarHBondContact CE1-OE2 3.38Å; H160-E164 IonicContact ND1-OE2 3.62Å; H160-E164 PolarHBondContact ND1-OE2 3.48Å; H160-E164 PolarHBondContact O-N 2.96Å; E161-E164 PolarHBondContact O-N 3.5Å; E161-E164 VanDerWaalsContact O-N 3.09Å; M162-E164 VanDerWaalsContact C-N 3.34Å; M162-E164 PolarHBondContact O-N 3.47Å; E164-E166 VanDerWaalsContact C-N 3.33Å; E164-E166 PolarHBondContact O-N 3.45Å; E164-K167 PolarHBondContact O-N 3.38Å; E164-L168 WeakPolarHBondContact O-CB 3.41Å; E164-L168 VanDerWaalsContact O-CG 3.31Å; E164-L168 WeakPolarHBondContact O-CG 3.3Å; E164-L168 PolarHBondContact O-N 3.11Å |
| 165 | E | 93.6 | Very high | 94.8 | Very high | 101 Ų | 101 | 96.8 Ų | 96.8 | 47% | 0.472 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -58.8 | -44 | 175.1 | -157.8 | -157.8 | -169.1 | 0 | 0 | 111.6 | E161 M162 K167 L168 K169 | E161-E165 PolarHBondContact O-N 2.88Å; M162-E165 PolarHBondContact O-N 2.56Å; E165-K167 PolarHBondContact O-N 3.27Å; E165-L168 PolarHBondContact O-N 2.91Å; E165-K169 VanDerWaalsContact CD-CE 3.47Å; E165-K169 HydrophobicContact CG-CD 4.31Å; E165-K169 WeakPolarHBondContact O-CB 3.45Å; E165-K169 WeakPolarHBondContact O-CG 3.46Å; E165-K169 PolarHBondContact O-N 3.32Å; E165-K169 WeakPolarHBondContact OE1-CE 3.3Å; E165-K169 IonicContact OE1-NZ 2.62Å; E165-K169 PolarHBondContact OE1-NZ 3.44Å; E165-K169 IonicContact OE2-NZ 3.35Å; E165-K169 PolarHBondContact OE2-NZ 3.09Å |
| 166 | E | 95.2 | Very high | 94.6 | Very high | 125 Ų | 125 | 94.7 Ų | 94.7 | 58% | 0.584 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -59.8 | -44.3 | 174.2 | -76.6 | -179.8 | 169 | 0 | 0 | 112.7 | M162 E164 A170 | M162-E166 WeakPolarHBondContact O-CG 3.32Å; M162-E166 PolarHBondContact O-N 3.28Å; E164-E166 VanDerWaalsContact C-N 3.33Å; E164-E166 PolarHBondContact O-N 3.45Å; E166-A170 WeakPolarHBondContact O-CB 3.42Å; E166-A170 PolarHBondContact O-N 2.88Å |
| 167 | K | 95.5 | Very high | 94.5 | Very high | 129 Ų | 129 | 92.3 Ų | 92.3 | 56% | 0.561 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -64.7 | -43.3 | 177.2 | -71.4 | 165.1 | -165.5 | 164.7 | 0 | 111.7 | R163 E164 E165 A170 E171 | R163-K167 VanDerWaalsContact O-CD 3.28Å; R163-K167 WeakPolarHBondContact O-CD 3.13Å; R163-K167 WeakPolarHBondContact O-CE 3.33Å; R163-K167 WeakPolarHBondContact O-CG 3.49Å; R163-K167 PolarHBondContact O-N 3.46Å; E164-K167 PolarHBondContact O-N 3.38Å; E165-K167 PolarHBondContact O-N 3.27Å; K167-A170 PolarHBondContact O-N 3.2Å; K167-E171 WeakPolarHBondContact O-CB 3.39Å; K167-E171 PolarHBondContact O-N 3.38Å |
| 168 | L | 94 | Very high | 94.5 | Very high | 124 Ų | 124 | 93.6 Ų | 93.6 | 65% | 0.649 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -64.6 | -44.4 | 179.7 | -71.3 | 171.2 | 0 | 0 | 0 | 111 | E164 E165 E171 E172 | E164-L168 WeakPolarHBondContact O-CB 3.41Å; E164-L168 VanDerWaalsContact O-CG 3.31Å; E164-L168 WeakPolarHBondContact O-CG 3.3Å; E164-L168 PolarHBondContact O-N 3.11Å; E165-L168 PolarHBondContact O-N 2.91Å; L168-E171 PolarHBondContact O-N 3.46Å; L168-E172 WeakPolarHBondContact O-CB 3.46Å; L168-E172 PolarHBondContact O-N 3.28Å |
| 169 | K | 93.4 | Very high | 94.4 | Very high | 94 Ų | 94 | 98.6 Ų | 98.6 | 41% | 0.409 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.3 | -41.5 | 173.9 | -73.1 | 169.9 | -179.6 | 167.6 | 0 | 112.4 | E165 E171 E172 I173 | E165-K169 VanDerWaalsContact CD-CE 3.47Å; E165-K169 HydrophobicContact CG-CD 4.31Å; E165-K169 WeakPolarHBondContact O-CB 3.45Å; E165-K169 WeakPolarHBondContact O-CG 3.46Å; E165-K169 PolarHBondContact O-N 3.32Å; E165-K169 WeakPolarHBondContact OE1-CE 3.3Å; E165-K169 IonicContact OE1-NZ 2.62Å; E165-K169 PolarHBondContact OE1-NZ 3.44Å; E165-K169 IonicContact OE2-NZ 3.35Å; E165-K169 PolarHBondContact OE2-NZ 3.09Å; K169-E171 VanDerWaalsContact C-N 3.34Å; K169-E172 PolarHBondContact O-N 3.22Å; K169-I173 WeakPolarHBondContact O-CD1 3.4Å; K169-I173 VanDerWaalsContact O-CG1 3.28Å; K169-I173 WeakPolarHBondContact O-CG1 3.29Å; K169-I173 PolarHBondContact O-N 3.5Å |
| 170 | A | 94.9 | Very high | 94.4 | Very high | 59 Ų | 59 | 101.2 Ų | 101.2 | 49% | 0.488 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | E166 K167 R174 | E166-A170 WeakPolarHBondContact O-CB 3.42Å; E166-A170 PolarHBondContact O-N 2.88Å; K167-A170 PolarHBondContact O-N 3.2Å; A170-R174 WeakPolarHBondContact O-CB 3.42Å; A170-R174 PolarHBondContact O-N 3.07Å |
| 171 | E | 92.9 | Very high | 94.4 | Very high | 80 Ų | 80 | 99.6 Ų | 99.6 | 37% | 0.374 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -71.5 | -38.3 | 178.3 | -173.7 | 62.3 | -170.7 | 0 | 0 | 112.4 | K167 L168 K169 R174 I175 | K167-E171 WeakPolarHBondContact O-CB 3.39Å; K167-E171 PolarHBondContact O-N 3.38Å; L168-E171 PolarHBondContact O-N 3.46Å; K169-E171 VanDerWaalsContact C-N 3.34Å; E171-R174 VanDerWaalsContact CD-NE 3.31Å; E171-R174 WeakPolarHBondContact O-CB 3.38Å; E171-R174 PolarHBondContact O-N 3.05Å; E171-R174 IonicContact OE1-CZ 2.66Å; E171-R174 VanDerWaalsContact OE1-CZ 3.28Å; E171-R174 IonicContact OE1-NE 2.74Å; E171-R174 PolarHBondContact OE1-NE 3.14Å; E171-R174 IonicContact OE1-NH2 2.72Å; E171-R174 PolarHBondContact OE1-NH2 3.4Å; E171-R174 IonicContact OE2-CZ 3.47Å; E171-R174 IonicContact OE2-NE 3.31Å; E171-R174 PolarHBondContact OE2-NE 3.28Å; E171-R174 IonicContact OE2-NH2 3.46Å; E171-I175 HydrophobicContact CG-CD1 4.05Å; E171-I175 WeakPolarHBondContact O-CB 3.15Å; E171-I175 VanDerWaalsContact O-CG1 3.31Å; E171-I175 WeakPolarHBondContact O-CG1 3.37Å; E171-I175 PolarHBondContact O-N 3.3Å |
| 172 | E | 92.1 | Very high | 94.4 | Very high | 61 Ų | 61 | 95.6 Ų | 95.6 | 29% | 0.285 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -55.5 | -52.4 | 169.9 | 172.8 | -173 | 167.6 | 0 | 0 | 110.9 | L168 K169 R174 I175 K176 Y186 | L168-E172 WeakPolarHBondContact O-CB 3.46Å; L168-E172 PolarHBondContact O-N 3.28Å; K169-E172 PolarHBondContact O-N 3.22Å; E172-R174 VanDerWaalsContact C-N 3.29Å; E172-R174 PolarHBondContact O-N 3.41Å; E172-I175 PolarHBondContact O-N 3.38Å; E172-K176 HydrophobicContact CG-CD 4Å; E172-K176 HydrophobicContact CG-CG 4.46Å; E172-K176 WeakPolarHBondContact O-CB 3.47Å; E172-K176 WeakPolarHBondContact O-CG 3.28Å; E172-K176 PolarHBondContact O-N 3.37Å; E172-K176 VanDerWaalsContact OE1-CE 3.26Å; E172-K176 WeakPolarHBondContact OE1-CE 3.19Å; E172-K176 IonicContact OE1-NZ 3.22Å; E172-K176 PolarHBondContact OE1-NZ 3.48Å; E172-Y186 HydrophobicContact CG-CD1 4.36Å; E172-Y186 HydrophobicContact CG-CE1 3.73Å; E172-Y186 HydrophobicContact CG-CE2 4.34Å |
| 173 | I | 93.1 | Very high | 94.2 | Very high | 121 Ų | 121 | 94.1 Ų | 94.1 | 62% | 0.621 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -59.7 | -42.4 | 178.6 | -68.1 | 165.3 | 0 | 0 | 0 | 110.4 | K169 I175 G177 | K169-I173 WeakPolarHBondContact O-CD1 3.4Å; K169-I173 VanDerWaalsContact O-CG1 3.28Å; K169-I173 WeakPolarHBondContact O-CG1 3.29Å; K169-I173 PolarHBondContact O-N 3.5Å; I173-I175 PolarHBondContact O-N 3.48Å; I173-G177 PolarHBondContact O-N 3.47Å |
| 174 | R | 95.1 | Very high | 94 | Very high | 128 Ų | 128 | 92.9 Ų | 92.9 | 48% | 0.483 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.1 | -43 | 177 | -167 | -171.5 | 73.9 | 88.8 | 2.6 | 112 | A170 E171 E172 K178 | A170-R174 WeakPolarHBondContact O-CB 3.42Å; A170-R174 PolarHBondContact O-N 3.07Å; E171-R174 VanDerWaalsContact CD-NE 3.31Å; E171-R174 WeakPolarHBondContact O-CB 3.38Å; E171-R174 PolarHBondContact O-N 3.05Å; E171-R174 IonicContact OE1-CZ 2.66Å; E171-R174 VanDerWaalsContact OE1-CZ 3.28Å; E171-R174 IonicContact OE1-NE 2.74Å; E171-R174 PolarHBondContact OE1-NE 3.14Å; E171-R174 IonicContact OE1-NH2 2.72Å; E171-R174 PolarHBondContact OE1-NH2 3.4Å; E171-R174 IonicContact OE2-CZ 3.47Å; E171-R174 IonicContact OE2-NE 3.31Å; E171-R174 PolarHBondContact OE2-NE 3.28Å; E171-R174 IonicContact OE2-NH2 3.46Å; E172-R174 VanDerWaalsContact C-N 3.29Å; E172-R174 PolarHBondContact O-N 3.41Å; R174-K178 WeakPolarHBondContact O-CB 3.42Å; R174-K178 PolarHBondContact O-N 3.37Å |
| 175 | I | 94.4 | Very high | 94 | Very high | 46 Ų | 46 | 93 Ų | 93 | 24% | 0.236 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -70.5 | -48.4 | 179.3 | -70.4 | 170.1 | 0 | 0 | 0 | 110.6 | E171 E172 I173 G177 K178 Y179 I181 Y186 | E171-I175 HydrophobicContact CG-CD1 4.05Å; E171-I175 WeakPolarHBondContact O-CB 3.15Å; E171-I175 VanDerWaalsContact O-CG1 3.31Å; E171-I175 WeakPolarHBondContact O-CG1 3.37Å; E171-I175 PolarHBondContact O-N 3.3Å; E172-I175 PolarHBondContact O-N 3.38Å; I173-I175 PolarHBondContact O-N 3.48Å; I175-G177 VanDerWaalsContact C-N 3.33Å; I175-G177 PolarHBondContact O-N 3.43Å; I175-K178 PolarHBondContact O-N 3.31Å; I175-Y179 HydrophobicContact CG2-CD2 4.02Å; I175-Y179 HydrophobicContact CG2-CE2 4.49Å; I175-Y179 WeakPolarHBondContact O-CD2 3.28Å; I175-Y179 PolarHBondContact O-N 3.43Å; I175-I181 HydrophobicContact CG2-CD1 4.5Å; I175-Y186 HydrophobicContact CG2-CE2 4.18Å |
| 176 | K | 93.9 | Very high | 94 | Very high | 35 Ų | 35 | 90.4 Ų | 90.4 | 15% | 0.152 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -54.7 | -48 | 176.2 | -76.8 | 179.9 | 172.1 | 178.3 | 0 | 111.7 | E172 N180 I181 S183 Y186 | E172-K176 HydrophobicContact CG-CD 4Å; E172-K176 HydrophobicContact CG-CG 4.46Å; E172-K176 WeakPolarHBondContact O-CB 3.47Å; E172-K176 WeakPolarHBondContact O-CG 3.28Å; E172-K176 PolarHBondContact O-N 3.37Å; E172-K176 VanDerWaalsContact OE1-CE 3.26Å; E172-K176 WeakPolarHBondContact OE1-CE 3.19Å; E172-K176 IonicContact OE1-NZ 3.22Å; E172-K176 PolarHBondContact OE1-NZ 3.48Å; K176-N180 VanDerWaalsContact O-CA 3.27Å; K176-N180 WeakPolarHBondContact O-CA 3.31Å; K176-N180 PolarHBondContact O-N 3.18Å; K176-I181 PolarHBondContact O-N 3.23Å; K176-I181 VanDerWaalsContact O-N 3.07Å; K176-S183 PolarHBondContact NZ-OG 3.3Å; K176-Y186 HydrophobicContact CD-CD2 4.46Å; K176-Y186 HydrophobicContact CD-CG 4.3Å; K176-Y186 VanDerWaalsContact CE-CD1 3.45Å; K176-Y186 HydrophobicContact CG-CD2 3.79Å; K176-Y186 HydrophobicContact CG-CE2 4.33Å; K176-Y186 HydrophobicContact CG-CG 4.09Å |
| 177 | G | 93.9 | Very high | 93.8 | Very high | 60 Ų | 60 | 90.6 Ų | 90.6 | 62% | 0.619 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -66.7 | -44.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | I173 I175 Y179 | I173-G177 PolarHBondContact O-N 3.47Å; I175-G177 VanDerWaalsContact C-N 3.33Å; I175-G177 PolarHBondContact O-N 3.43Å; G177-Y179 VanDerWaalsContact C-N 3.33Å; G177-Y179 PolarHBondContact O-N 3.4Å |
| 178 | K | 95.8 | Very high | 93.7 | Very high | 130 Ų | 130 | 88.9 Ų | 88.9 | 57% | 0.565 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -63.8 | -35.6 | -178.4 | -178.4 | -177.7 | 176.1 | -158.3 | 0 | 113.3 | R174 I175 | R174-K178 WeakPolarHBondContact O-CB 3.42Å; R174-K178 PolarHBondContact O-N 3.37Å; I175-K178 PolarHBondContact O-N 3.31Å |
| 179 | Y | 95 | Very high | 93.6 | Very high | 141 Ų | 141 | 86.7 Ų | 86.7 | 55% | 0.553 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -108.3 | 3.7 | -175.8 | -64.5 | -76.3 | 0 | 0 | 0 | 113.5 | I175 G177 I181 | I175-Y179 HydrophobicContact CG2-CD2 4.02Å; I175-Y179 HydrophobicContact CG2-CE2 4.49Å; I175-Y179 WeakPolarHBondContact O-CD2 3.28Å; I175-Y179 PolarHBondContact O-N 3.43Å; G177-Y179 VanDerWaalsContact C-N 3.33Å; G177-Y179 PolarHBondContact O-N 3.4Å; Y179-I181 VanDerWaalsContact C-N 3.3Å; Y179-I181 PolarHBondContact O-N 3.21Å |
| 180 | N | 95.4 | Very high | 93.5 | Very high | 153 Ų | 153 | 86.8 Ų | 86.8 | 82% | 0.818 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.3 | 44.2 | -177.9 | -163.9 | 48.3 | 0 | 0 | 0 | 113.5 | K176 | K176-N180 VanDerWaalsContact O-CA 3.27Å; K176-N180 WeakPolarHBondContact O-CA 3.31Å; K176-N180 PolarHBondContact O-N 3.18Å |
| 181 | I | 94.6 | Very high | 93.2 | Very high | 48 Ų | 48 | 87.5 Ų | 87.5 | 25% | 0.246 | 44% | 0.437 | C | S | . | . | trans | -88.8 | 132.5 | -177 | -53.8 | 174.3 | 0 | 0 | 0 | 109.2 | I175 K176 Y179 D185 | I175-I181 HydrophobicContact CG2-CD1 4.5Å; K176-I181 PolarHBondContact O-N 3.23Å; K176-I181 VanDerWaalsContact O-N 3.07Å; Y179-I181 VanDerWaalsContact C-N 3.3Å; Y179-I181 PolarHBondContact O-N 3.21Å; I181-D185 HydrophobicContact CG2-CB 3.8Å | ||
| 182 | S | 94.1 | Very high | 93.2 | Very high | 53 Ų | 53 | 88 Ų | 88 | 37% | 0.371 | 45% | 0.445 | S | S | . | . | trans | -68.7 | 157.2 | 175.1 | 87.7 | 0 | 0 | 0 | 0 | 111.6 | E184 D185 Y186 | S182-E184 PolarHBondContact O-N 3.11Å; S182-E184 PolarHBondContact OG-N 3.31Å; S182-D185 VanDerWaalsContact CB-OD2 3.29Å; S182-D185 WeakPolarHBondContact CB-OD2 3.36Å; S182-D185 PolarHBondContact O-N 3.37Å; S182-D185 PolarHBondContact OG-N 3.08Å; S182-D185 VanDerWaalsContact OG-N 3.12Å; S182-D185 PolarHBondContact OG-OD2 3.42Å; S182-Y186 WeakPolarHBondContact O-CB 3.36Å; S182-Y186 PolarHBondContact O-N 3.11Å | ||
| 183 | S | 91.1 | Very high | 93.1 | Very high | 85 Ų | 85 | 88.4 Ų | 88.4 | 59% | 0.594 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -64.1 | -26.6 | 177.8 | -73.6 | 0 | 0 | 0 | 0 | 113.5 | K176 R187 | K176-S183 PolarHBondContact NZ-OG 3.3Å; S183-R187 PolarHBondContact O-N 2.72Å |
| 184 | E | 92.2 | Very high | 92.8 | Very high | 84 Ų | 84 | 87.8 Ų | 87.8 | 39% | 0.393 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -76.1 | -46.3 | 175.1 | -175.2 | 56.3 | -144.2 | 0 | 0 | 111.2 | S182 Y186 R187 Q188 | S182-E184 PolarHBondContact O-N 3.11Å; S182-E184 PolarHBondContact OG-N 3.31Å; E184-Y186 VanDerWaalsContact C-N 3.27Å; E184-Y186 PolarHBondContact O-N 3.46Å; E184-R187 WeakPolarHBondContact O-CB 3.43Å; E184-R187 PolarHBondContact O-N 3.3Å; E184-R187 IonicContact OE1-CZ 3.49Å; E184-R187 IonicContact OE1-NE 3.24Å; E184-R187 PolarHBondContact OE1-NE 3.05Å; E184-R187 IonicContact OE1-NH2 2.78Å; E184-R187 PolarHBondContact OE1-NH2 2.92Å; E184-R187 IonicContact OE2-CZ 3.31Å; E184-R187 VanDerWaalsContact OE2-CZ 3.31Å; E184-R187 IonicContact OE2-NE 3.28Å; E184-R187 PolarHBondContact OE2-NE 3.37Å; E184-R187 IonicContact OE2-NH2 2.81Å; E184-R187 PolarHBondContact OE2-NH2 3.33Å; E184-Q188 WeakPolarHBondContact O-CG 3.36Å; E184-Q188 PolarHBondContact O-N 3.36Å; E184-Q188 PolarHBondContact OE1-NE2 3.36Å |
| 185 | D | 93.9 | Very high | 92.4 | Very high | 97 Ų | 97 | 88.2 Ų | 88.2 | 52% | 0.519 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.9 | -37.4 | 178.2 | -60 | -51.2 | 0 | 0 | 0 | 111.5 | I181 S182 Q188 L189 | I181-D185 HydrophobicContact CG2-CB 3.8Å; S182-D185 VanDerWaalsContact CB-OD2 3.29Å; S182-D185 WeakPolarHBondContact CB-OD2 3.36Å; S182-D185 PolarHBondContact O-N 3.37Å; S182-D185 PolarHBondContact OG-N 3.08Å; S182-D185 VanDerWaalsContact OG-N 3.12Å; S182-D185 PolarHBondContact OG-OD2 3.42Å; D185-Q188 PolarHBondContact O-N 3.39Å; D185-L189 WeakPolarHBondContact O-CB 3.34Å; D185-L189 PolarHBondContact O-N 3.1Å |
| 186 | Y | 92.8 | Very high | 91.9 | Very high | 46 Ų | 46 | 87.9 Ų | 87.9 | 18% | 0.18 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -63.8 | -40.3 | 173.8 | -171.7 | -88 | 0 | 0 | 0 | 112 | E172 I175 K176 S182 E184 L189 E190 | E172-Y186 HydrophobicContact CG-CD1 4.36Å; E172-Y186 HydrophobicContact CG-CE1 3.73Å; E172-Y186 HydrophobicContact CG-CE2 4.34Å; I175-Y186 HydrophobicContact CG2-CE2 4.18Å; K176-Y186 HydrophobicContact CD-CD2 4.46Å; K176-Y186 HydrophobicContact CD-CG 4.3Å; K176-Y186 VanDerWaalsContact CE-CD1 3.45Å; K176-Y186 HydrophobicContact CG-CD2 3.79Å; K176-Y186 HydrophobicContact CG-CE2 4.33Å; K176-Y186 HydrophobicContact CG-CG 4.09Å; S182-Y186 WeakPolarHBondContact O-CB 3.36Å; S182-Y186 PolarHBondContact O-N 3.11Å; E184-Y186 VanDerWaalsContact C-N 3.27Å; E184-Y186 PolarHBondContact O-N 3.46Å; Y186-L189 WeakPolarHBondContact O-CB 3.32Å; Y186-L189 PolarHBondContact O-N 2.87Å; Y186-E190 WeakPolarHBondContact O-CB 3.43Å; Y186-E190 PolarHBondContact O-N 3.49Å |
| 187 | R | 91.3 | Very high | 91.2 | Very high | 129 Ų | 129 | 90.1 Ų | 90.1 | 49% | 0.487 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.4 | -38.6 | 175.7 | -172.8 | 176.5 | 69.1 | 146.3 | 1.2 | 111.8 | S183 E184 E190 L191 | S183-R187 PolarHBondContact O-N 2.72Å; E184-R187 WeakPolarHBondContact O-CB 3.43Å; E184-R187 PolarHBondContact O-N 3.3Å; E184-R187 IonicContact OE1-CZ 3.49Å; E184-R187 IonicContact OE1-NE 3.24Å; E184-R187 PolarHBondContact OE1-NE 3.05Å; E184-R187 IonicContact OE1-NH2 2.78Å; E184-R187 PolarHBondContact OE1-NH2 2.92Å; E184-R187 IonicContact OE2-CZ 3.31Å; E184-R187 VanDerWaalsContact OE2-CZ 3.31Å; E184-R187 IonicContact OE2-NE 3.28Å; E184-R187 PolarHBondContact OE2-NE 3.37Å; E184-R187 IonicContact OE2-NH2 2.81Å; E184-R187 PolarHBondContact OE2-NH2 3.33Å; R187-E190 PolarHBondContact O-N 2.93Å; R187-L191 WeakPolarHBondContact O-CB 3.33Å; R187-L191 VanDerWaalsContact O-CG 3.28Å; R187-L191 WeakPolarHBondContact O-CG 3.44Å; R187-L191 PolarHBondContact O-N 3.12Å |
| 188 | Q | 93.4 | Very high | 90.4 | Very high | 92 Ų | 92 | 90.5 Ų | 90.5 | 43% | 0.43 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65.5 | -41 | 173 | -62.4 | -56.9 | -35.6 | 0 | 0 | 111.6 | E184 D185 L191 V192 | E184-Q188 WeakPolarHBondContact O-CG 3.36Å; E184-Q188 PolarHBondContact O-N 3.36Å; E184-Q188 PolarHBondContact OE1-NE2 3.36Å; D185-Q188 PolarHBondContact O-N 3.39Å; Q188-L191 PolarHBondContact O-N 2.97Å; Q188-V192 WeakPolarHBondContact O-CG2 3.33Å; Q188-V192 PolarHBondContact O-N 3.38Å |
| 189 | L | 92.2 | Very high | 89.5 | Confident | 78 Ų | 78 | 91.3 Ų | 91.3 | 41% | 0.408 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -62.1 | -44.5 | 174.7 | 179 | 62 | 0 | 0 | 0 | 111.9 | D185 Y186 V192 I193 | D185-L189 WeakPolarHBondContact O-CB 3.34Å; D185-L189 PolarHBondContact O-N 3.1Å; Y186-L189 WeakPolarHBondContact O-CB 3.32Å; Y186-L189 PolarHBondContact O-N 2.87Å; L189-V192 PolarHBondContact O-N 2.86Å; L189-I193 HydrophobicContact CD1-CD1 4.12Å; L189-I193 HydrophobicContact CD1-CG1 4.4Å; L189-I193 HydrophobicContact CG-CD1 3.93Å; L189-I193 VanDerWaalsContact O-CG1 3.27Å; L189-I193 WeakPolarHBondContact O-CG1 3.24Å; L189-I193 PolarHBondContact O-N 2.95Å |
| 190 | E | 90.9 | Very high | 88.3 | Confident | 97 Ų | 97 | 92.6 Ų | 92.6 | 45% | 0.453 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -58.5 | -49 | 174.7 | 178.6 | 179.1 | -146.3 | 0 | 0 | 111.6 | Y186 R187 V192 I193 L194 | Y186-E190 WeakPolarHBondContact O-CB 3.43Å; Y186-E190 PolarHBondContact O-N 3.49Å; R187-E190 PolarHBondContact O-N 2.93Å; E190-V192 VanDerWaalsContact C-N 3.33Å; E190-V192 PolarHBondContact O-N 3.32Å; E190-I193 PolarHBondContact O-N 3.02Å; E190-L194 HydrophobicContact CG-CD1 3.98Å; E190-L194 HydrophobicContact CG-CG 4.49Å; E190-L194 WeakPolarHBondContact O-CG 3.41Å; E190-L194 PolarHBondContact O-N 3.32Å |
| 191 | L | 90.3 | Very high | 87.1 | Confident | 73 Ų | 73 | 86.4 Ų | 86.4 | 38% | 0.382 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -58.2 | -42.6 | 176 | -73.3 | 169.4 | 0 | 0 | 0 | 112.3 | R187 Q188 Q195 | R187-L191 WeakPolarHBondContact O-CB 3.33Å; R187-L191 VanDerWaalsContact O-CG 3.28Å; R187-L191 WeakPolarHBondContact O-CG 3.44Å; R187-L191 PolarHBondContact O-N 3.12Å; Q188-L191 PolarHBondContact O-N 2.97Å; L191-Q195 WeakPolarHBondContact O-CB 3.49Å; L191-Q195 VanDerWaalsContact O-CG 3.28Å; L191-Q195 WeakPolarHBondContact O-CG 3.29Å; L191-Q195 PolarHBondContact O-N 3.44Å |
| 192 | V | 91.9 | Very high | 86.2 | Confident | 91 Ų | 91 | 85.7 Ų | 85.7 | 55% | 0.552 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -65.8 | -41.1 | 176.4 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | Q188 L189 E190 Q195 S196 | Q188-V192 WeakPolarHBondContact O-CG2 3.33Å; Q188-V192 PolarHBondContact O-N 3.38Å; L189-V192 PolarHBondContact O-N 2.86Å; E190-V192 VanDerWaalsContact C-N 3.33Å; E190-V192 PolarHBondContact O-N 3.32Å; V192-Q195 PolarHBondContact O-N 2.82Å; V192-S196 VanDerWaalsContact O-CB 3.32Å; V192-S196 WeakPolarHBondContact O-CB 3.34Å; V192-S196 PolarHBondContact O-N 2.95Å |
| 193 | I | 90.4 | Very high | 85.5 | Confident | 70 Ų | 70 | 87.6 Ų | 87.6 | 36% | 0.359 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.3 | -52.8 | 176.3 | -71.4 | 165 | 0 | 0 | 0 | 109.9 | L189 E190 Q195 S196 E197 | L189-I193 HydrophobicContact CD1-CD1 4.12Å; L189-I193 HydrophobicContact CD1-CG1 4.4Å; L189-I193 HydrophobicContact CG-CD1 3.93Å; L189-I193 VanDerWaalsContact O-CG1 3.27Å; L189-I193 WeakPolarHBondContact O-CG1 3.24Å; L189-I193 PolarHBondContact O-N 2.95Å; E190-I193 PolarHBondContact O-N 3.02Å; I193-Q195 VanDerWaalsContact C-N 3.32Å; I193-Q195 PolarHBondContact O-N 2.86Å; I193-S196 WeakPolarHBondContact O-CA 3.2Å; I193-S196 WeakPolarHBondContact O-CB 3.45Å; I193-S196 PolarHBondContact O-N 2.91Å; I193-S196 PolarHBondContact O-OG 3.38Å; I193-E197 PolarHBondContact O-N 2.88Å; I193-E197 VanDerWaalsContact O-N 3.11Å |
| 194 | L | 87 | Confident | 85.1 | Confident | 107 Ų | 107 | 84.4 Ų | 84.4 | 56% | 0.56 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -58.3 | -40.4 | -179.9 | -69.7 | 170.9 | 0 | 0 | 0 | 112.5 | E190 S196 | E190-L194 HydrophobicContact CG-CD1 3.98Å; E190-L194 HydrophobicContact CG-CG 4.49Å; E190-L194 WeakPolarHBondContact O-CG 3.41Å; E190-L194 PolarHBondContact O-N 3.32Å; L194-S196 VanDerWaalsContact C-N 3.31Å; L194-S196 PolarHBondContact O-N 2.88Å |
| 195 | Q | 85.1 | Confident | 84.9 | Confident | 138 Ų | 138 | 86.3 Ų | 86.3 | 65% | 0.645 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -71.1 | -25 | 174.8 | -70.6 | 178.1 | 9.3 | 0 | 0 | 113.1 | L191 V192 I193 H199 | L191-Q195 WeakPolarHBondContact O-CB 3.49Å; L191-Q195 VanDerWaalsContact O-CG 3.28Å; L191-Q195 WeakPolarHBondContact O-CG 3.29Å; L191-Q195 PolarHBondContact O-N 3.44Å; V192-Q195 PolarHBondContact O-N 2.82Å; I193-Q195 VanDerWaalsContact C-N 3.32Å; I193-Q195 PolarHBondContact O-N 2.86Å; Q195-H199 PolarHBondContact O-CE1 2.89Å; Q195-H199 PolarHBondContact O-ND1 2.94Å |
| 196 | S | 84.1 | Confident | 84.6 | Confident | 38 Ų | 38 | 87.3 Ų | 87.3 | 27% | 0.266 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -80.1 | -26.2 | 178.3 | 80.6 | 0 | 0 | 0 | 0 | 113.9 | V192 I193 L194 H199 R200 | V192-S196 VanDerWaalsContact O-CB 3.32Å; V192-S196 WeakPolarHBondContact O-CB 3.34Å; V192-S196 PolarHBondContact O-N 2.95Å; I193-S196 WeakPolarHBondContact O-CA 3.2Å; I193-S196 WeakPolarHBondContact O-CB 3.45Å; I193-S196 PolarHBondContact O-N 2.91Å; I193-S196 PolarHBondContact O-OG 3.38Å; L194-S196 VanDerWaalsContact C-N 3.31Å; L194-S196 PolarHBondContact O-N 2.88Å; S196-H199 WeakPolarHBondContact O-CA 3.14Å; S196-H199 WeakPolarHBondContact O-CB 3.47Å; S196-H199 PolarHBondContact O-N 3.11Å; S196-R200 PolarHBondContact O-N 3.19Å |
| 197 | E | 80.9 | Confident | 84.4 | Confident | 83 Ų | 83 | 93.4 Ų | 93.4 | 39% | 0.388 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -52.8 | -49.6 | -174.5 | -77.3 | -56.6 | 138.6 | 0 | 0 | 114.3 | I193 H199 R200 | I193-E197 PolarHBondContact O-N 2.88Å; I193-E197 VanDerWaalsContact O-N 3.11Å; E197-H199 PolarHBondContact O-N 3.33Å; E197-R200 WeakPolarHBondContact O-CB 3.31Å; E197-R200 PolarHBondContact O-N 3.06Å; E197-R200 WeakPolarHBondContact OE1-CD 3.36Å; E197-R200 IonicContact OE1-CZ 3.11Å; E197-R200 IonicContact OE1-NE 3.61Å; E197-R200 PolarHBondContact OE1-NE 3.28Å; E197-R200 IonicContact OE1-NH1 3.33Å; E197-R200 PolarHBondContact OE1-NH1 2.99Å |
| 198 | P | 75.3 | Confident | 84.3 | Confident | 68 Ų | 68 | 88.3 Ų | 88.3 | 44% | 0.442 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60.3 | -22.6 | 178.3 | -23.7 | 34.9 | 0 | 0 | 0 | 114 | ||
| 199 | H | 77.4 | Confident | 84.1 | Confident | 146 Ų | 146 | 84.3 Ų | 84.3 | 68% | 0.676 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -87.6 | -19.4 | -180 | -55.1 | 93.8 | 0 | 0 | 0 | 112.6 | Q195 S196 E197 A201 G202 | Q195-H199 PolarHBondContact O-CE1 2.89Å; Q195-H199 PolarHBondContact O-ND1 2.94Å; S196-H199 WeakPolarHBondContact O-CA 3.14Å; S196-H199 WeakPolarHBondContact O-CB 3.47Å; S196-H199 PolarHBondContact O-N 3.11Å; E197-H199 PolarHBondContact O-N 3.33Å; H199-A201 PolarHBondContact O-N 2.72Å; H199-G202 PolarHBondContact O-N 3.43Å; H199-G202 VanDerWaalsContact O-N 3.09Å |
| 200 | R | 70.9 | Confident | 84.2 | Confident | 168 Ų | 168 | 82.8 Ų | 82.8 | 63% | 0.634 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -65.9 | -33.7 | -179.8 | -75.1 | -178 | 163.7 | -172.3 | -7.3 | 113.5 | S196 E197 G202 | S196-R200 PolarHBondContact O-N 3.19Å; E197-R200 WeakPolarHBondContact O-CB 3.31Å; E197-R200 PolarHBondContact O-N 3.06Å; E197-R200 WeakPolarHBondContact OE1-CD 3.36Å; E197-R200 IonicContact OE1-CZ 3.11Å; E197-R200 IonicContact OE1-NE 3.61Å; E197-R200 PolarHBondContact OE1-NE 3.28Å; E197-R200 IonicContact OE1-NH1 3.33Å; E197-R200 PolarHBondContact OE1-NH1 2.99Å; R200-G202 PolarHBondContact O-N 3.27Å |
| 201 | A | 68.9 | Low | 84.3 | Confident | 24 Ų | 24 | 82.7 Ų | 82.7 | 20% | 0.198 | 42% | 0.42 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.1 | -10 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | H199 Q204 Q336 | H199-A201 PolarHBondContact O-N 2.72Å; A201-Q204 VanDerWaalsContact CB-NE2 3.26Å; A201-Q336 HydrophobicContact CB-CB 4.11Å; A201-Q336 WeakPolarHBondContact CB-O 3.47Å |
| 202 | G | 76.6 | Confident | 84.4 | Confident | 32 Ų | 32 | 79.2 Ų | 79.2 | 33% | 0.33 | 40% | 0.402 | S | S | . | . | trans | 103 | -159.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | H199 R200 Q204 | H199-G202 PolarHBondContact O-N 3.43Å; H199-G202 VanDerWaalsContact O-N 3.09Å; R200-G202 PolarHBondContact O-N 3.27Å; G202-Q204 PolarHBondContact O-N 2.83Å | ||
| 203 | V | 79.7 | Confident | 84.5 | Confident | 93 Ų | 93 | 76.5 Ų | 76.5 | 56% | 0.564 | 38% | 0.383 | S | S | * | . | trans | -79.4 | 94.4 | -172.4 | -168 | 0 | 0 | 0 | 0 | 111.3 | K206 | V203-K206 HydrophobicContact CB-CG 4.41Å; V203-K206 HydrophobicContact CG1-CD 4.47Å; V203-K206 HydrophobicContact CG1-CG 3.79Å | ||
| 204 | Q | 81.6 | Confident | 84.8 | Confident | 18 Ų | 18 | 74.1 Ų | 74.1 | 8% | 0.084 | 37% | 0.374 | C | S | . | . | trans | -68 | -40.7 | 177.8 | -54.4 | -59.4 | -20.4 | 0 | 0 | 112.8 | A201 G202 K206 G209 A226 | A201-Q204 VanDerWaalsContact CB-NE2 3.26Å; G202-Q204 PolarHBondContact O-N 2.83Å; Q204-K206 VanDerWaalsContact C-N 3.25Å; Q204-K206 PolarHBondContact O-N 3.15Å; Q204-G209 CarbonylContact O-C 3.58Å; Q204-G209 VanDerWaalsContact O-CA 3.28Å; Q204-G209 WeakPolarHBondContact O-CA 3.35Å; Q204-A226 HydrophobicContact CB-CB 4.32Å; Q204-A226 HydrophobicContact CG-CB 4.46Å | ||
| 205 | W | 87.4 | Confident | 85.2 | Confident | 125 Ų | 125 | 69.3 Ų | 69.3 | 47% | 0.473 | 35% | 0.348 | S | S | . | . | S | Bend | trans | -86.4 | 51.1 | -172.7 | -62.2 | 106.8 | 0 | 0 | 0 | 114 | F213 A226 | W205-F213 HydrophobicContact CH2-CB 4.38Å; W205-F213 AromaticContact CH2-CD1 3.8Å; W205-F213 HydrophobicContact CH2-CD1 3.8Å; W205-F213 AromaticContact CH2-CD2 3.89Å; W205-F213 HydrophobicContact CH2-CD2 3.89Å; W205-F213 HydrophobicContact CH2-CE1 4.03Å; W205-F213 HydrophobicContact CH2-CE2 4.12Å; W205-F213 AromaticContact CH2-CG 3.74Å; W205-F213 HydrophobicContact CH2-CG 3.74Å; W205-F213 HydrophobicContact CH2-CZ 4.19Å; W205-F213 HydrophobicContact CZ3-CB 4.36Å; W205-F213 AromaticContact CZ3-CD1 3.91Å; W205-F213 HydrophobicContact CZ3-CD1 3.91Å; W205-F213 HydrophobicContact CZ3-CE1 4.41Å; W205-F213 HydrophobicContact CZ3-CG 4.04Å; W205-A226 HydrophobicContact CZ2-CB 4.31Å |
| 206 | K | 88.8 | Confident | 85.6 | Confident | 118 Ų | 118 | 63 Ų | 63 | 51% | 0.513 | 32% | 0.319 | S | S | . | . | S | Bend | trans | -112.2 | 164 | 163 | -67.7 | -66.6 | -178.3 | -180 | 0 | 109.1 | V203 Q204 A208 G209 S210 | V203-K206 HydrophobicContact CB-CG 4.41Å; V203-K206 HydrophobicContact CG1-CD 4.47Å; V203-K206 HydrophobicContact CG1-CG 3.79Å; Q204-K206 VanDerWaalsContact C-N 3.25Å; Q204-K206 PolarHBondContact O-N 3.15Å; K206-A208 VanDerWaalsContact C-N 3.28Å; K206-A208 PolarHBondContact O-N 3.36Å; K206-G209 PolarHBondContact O-N 3.21Å; K206-S210 PolarHBondContact O-N 3.28Å; K206-S210 PolarHBondContact O-OG 3.31Å |
| 207 | F | 89.2 | Confident | 86.3 | Confident | 173 Ų | 173 | 62.1 Ų | 62.1 | 76% | 0.759 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -43.4 | -47.5 | -172.9 | -178.4 | -98.2 | 0 | 0 | 0 | 114.7 | G209 S210 F211 | F207-G209 PolarHBondContact O-N 3.41Å; F207-S210 PolarHBondContact O-N 3.45Å; F207-F211 VanDerWaalsContact O-CB 3.25Å; F207-F211 WeakPolarHBondContact O-CB 3.46Å; F207-F211 PolarHBondContact O-N 3.35Å |
| 208 | A | 88.1 | Confident | 87 | Confident | 23 Ų | 23 | 59.9 Ų | 59.9 | 19% | 0.19 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -60.4 | -43.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | K206 Y212 L341 V348 F352 | K206-A208 VanDerWaalsContact C-N 3.28Å; K206-A208 PolarHBondContact O-N 3.36Å; A208-Y212 PolarHBondContact O-N 2.82Å; A208-L341 HydrophobicContact CB-CD1 4.33Å; A208-L341 HydrophobicContact CB-CG 4.29Å; A208-V348 HydrophobicContact CB-CG1 4.38Å; A208-F352 WeakPolarHBondContact O-CZ 3.46Å |
| 209 | G | 89.9 | Confident | 87.9 | Confident | 7 Ų | 7 | 56.9 Ų | 56.9 | 7% | 0.072 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -78.2 | -35.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q204 K206 F207 F211 Y212 F213 | Q204-G209 CarbonylContact O-C 3.58Å; Q204-G209 VanDerWaalsContact O-CA 3.28Å; Q204-G209 WeakPolarHBondContact O-CA 3.35Å; K206-G209 PolarHBondContact O-N 3.21Å; F207-G209 PolarHBondContact O-N 3.41Å; G209-F211 VanDerWaalsContact C-N 3.26Å; G209-F211 PolarHBondContact O-N 2.98Å; G209-Y212 PolarHBondContact O-N 3.4Å; G209-F213 WeakPolarHBondContact O-CB 3.37Å; G209-F213 PolarHBondContact O-N 2.76Å |
| 210 | S | 93.4 | Very high | 88.8 | Confident | 46 Ų | 46 | 53 Ų | 53 | 32% | 0.322 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -60.2 | -37.1 | 168.7 | -60.1 | 0 | 0 | 0 | 0 | 112 | K206 F207 A214 | K206-S210 PolarHBondContact O-N 3.28Å; K206-S210 PolarHBondContact O-OG 3.31Å; F207-S210 PolarHBondContact O-N 3.45Å; S210-A214 WeakPolarHBondContact O-CB 3.37Å; S210-A214 PolarHBondContact O-N 3.26Å |
| 211 | F | 92.8 | Very high | 90 | Very high | 95 Ų | 95 | 45.1 Ų | 45.1 | 42% | 0.417 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -72.8 | -39.1 | 174.8 | -171.6 | -97.5 | 0 | 0 | 0 | 112.1 | F207 G209 A214 I215 F352 | F207-F211 VanDerWaalsContact O-CB 3.25Å; F207-F211 WeakPolarHBondContact O-CB 3.46Å; F207-F211 PolarHBondContact O-N 3.35Å; G209-F211 VanDerWaalsContact C-N 3.26Å; G209-F211 PolarHBondContact O-N 2.98Å; F211-A214 PolarHBondContact O-N 2.99Å; F211-I215 HydrophobicContact CD1-CD1 3.82Å; F211-I215 HydrophobicContact CD1-CG1 4.42Å; F211-I215 HydrophobicContact CE1-CD1 3.56Å; F211-I215 HydrophobicContact CE1-CG1 4.23Å; F211-I215 HydrophobicContact CZ-CD1 4.36Å; F211-I215 WeakPolarHBondContact O-CG1 3.33Å; F211-I215 PolarHBondContact O-N 3.09Å; F211-F352 AromaticContact CD1-CD2 3.64Å; F211-F352 HydrophobicContact CD1-CD2 3.64Å; F211-F352 AromaticContact CD1-CE2 3.46Å; F211-F352 HydrophobicContact CD1-CE2 3.46Å; F211-F352 VanDerWaalsContact CD1-CE2 3.46Å; F211-F352 HydrophobicContact CD1-CG 4.46Å; F211-F352 HydrophobicContact CD1-CZ 4.16Å; F211-F352 AromaticContact CE1-CD2 3.71Å; F211-F352 HydrophobicContact CE1-CD2 3.71Å; F211-F352 HydrophobicContact CE1-CE2 4.03Å; F211-F352 HydrophobicContact CE1-CG 4.4Å |
| 212 | Y | 92.7 | Very high | 91.3 | Very high | 1 Ų | 1 | 46.4 Ų | 46.4 | 0% | 0.004 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.4 | -47.8 | 171.7 | -173.9 | -137.9 | 0 | 0 | 0 | 111.7 | A208 G209 A214 I215 T216 Y223 H225 V333 F352 I355 | A208-Y212 PolarHBondContact O-N 2.82Å; G209-Y212 PolarHBondContact O-N 3.4Å; Y212-A214 PolarHBondContact O-N 3.29Å; Y212-I215 WeakPolarHBondContact O-CB 3.3Å; Y212-I215 PolarHBondContact O-N 3.45Å; Y212-T216 HydrophobicContact CD2-CG2 4.38Å; Y212-T216 HydrophobicContact CE2-CG2 4.27Å; Y212-T216 WeakPolarHBondContact O-CG2 3.45Å; Y212-T216 PolarHBondContact O-N 3.34Å; Y212-Y223 HydrophobicContact CE2-CE2 4.27Å; Y212-Y223 AromaticContact CZ-CE2 3.83Å; Y212-Y223 WeakPolarHBondContact OH-CE2 3.34Å; Y212-H225 AromaticContact CD1-CE1 3.82Å; Y212-H225 AromaticContact CD1-NE2 3.63Å; Y212-H225 AromaticContact CE1-CE1 3.41Å; Y212-H225 VanDerWaalsContact CE1-CE1 3.41Å; Y212-H225 WeakPolarHBondContact CE1-CE1 3.34Å; Y212-H225 AromaticContact CE1-NE2 3.52Å; Y212-V333 HydrophobicContact CE1-CG1 3.99Å; Y212-V333 WeakPolarHBondContact OH-CG1 3.45Å; Y212-F352 AromaticContact CD2-CD1 3.97Å; Y212-F352 HydrophobicContact CD2-CD1 3.97Å; Y212-F352 AromaticContact CD2-CE1 3.45Å; Y212-F352 HydrophobicContact CD2-CE1 3.45Å; Y212-F352 VanDerWaalsContact CD2-CE1 3.45Å; Y212-F352 HydrophobicContact CD2-CZ 4.47Å; Y212-F352 HydrophobicContact CE2-CE1 4.34Å; Y212-F352 AromaticContact CG-CE1 3.8Å; Y212-F352 HydrophobicContact CG-CE1 3.8Å; Y212-F352 HydrophobicContact CG-CZ 4.46Å; Y212-I355 HydrophobicContact CE2-CD1 3.91Å |
| 213 | F | 94.5 | Very high | 92 | Very high | 33 Ų | 33 | 45.2 Ų | 45.2 | 15% | 0.145 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -57.1 | -47.7 | 174.1 | 176.1 | -98.3 | 0 | 0 | 0 | 111.3 | W205 G209 I215 T216 V217 A226 P228 | W205-F213 HydrophobicContact CH2-CB 4.38Å; W205-F213 AromaticContact CH2-CD1 3.8Å; W205-F213 HydrophobicContact CH2-CD1 3.8Å; W205-F213 AromaticContact CH2-CD2 3.89Å; W205-F213 HydrophobicContact CH2-CD2 3.89Å; W205-F213 HydrophobicContact CH2-CE1 4.03Å; W205-F213 HydrophobicContact CH2-CE2 4.12Å; W205-F213 AromaticContact CH2-CG 3.74Å; W205-F213 HydrophobicContact CH2-CG 3.74Å; W205-F213 HydrophobicContact CH2-CZ 4.19Å; W205-F213 HydrophobicContact CZ3-CB 4.36Å; W205-F213 AromaticContact CZ3-CD1 3.91Å; W205-F213 HydrophobicContact CZ3-CD1 3.91Å; W205-F213 HydrophobicContact CZ3-CE1 4.41Å; W205-F213 HydrophobicContact CZ3-CG 4.04Å; G209-F213 WeakPolarHBondContact O-CB 3.37Å; G209-F213 PolarHBondContact O-N 2.76Å; F213-I215 VanDerWaalsContact C-N 3.34Å; F213-I215 PolarHBondContact O-N 3.48Å; F213-T216 WeakPolarHBondContact CA-OG1 3.27Å; F213-T216 PolarHBondContact O-N 3.39Å; F213-T216 VanDerWaalsContact O-N 3.08Å; F213-T216 PolarHBondContact O-OG1 3.08Å; F213-V217 HydrophobicContact CD1-CG2 4.27Å; F213-V217 HydrophobicContact CD2-CG2 4.49Å; F213-V217 HydrophobicContact CE1-CG2 3.79Å; F213-V217 HydrophobicContact CE2-CG2 4.03Å; F213-V217 HydrophobicContact CZ-CG2 3.65Å; F213-V217 WeakPolarHBondContact O-CG2 3.41Å; F213-V217 PolarHBondContact O-N 3.37Å; F213-A226 WeakPolarHBondContact CD2-O 3.3Å; F213-A226 WeakPolarHBondContact CE2-O 3.12Å; F213-P228 HydrophobicContact CZ-CG 4.38Å |
| 214 | A | 96.3 | Very high | 92.5 | Very high | 20 Ų | 20 | 43.5 Ų | 43.5 | 17% | 0.165 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -57 | -43.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | S210 F211 Y212 V217 I218 Y240 | S210-A214 WeakPolarHBondContact O-CB 3.37Å; S210-A214 PolarHBondContact O-N 3.26Å; F211-A214 PolarHBondContact O-N 2.99Å; Y212-A214 PolarHBondContact O-N 3.29Å; A214-V217 PolarHBondContact O-N 2.82Å; A214-I218 WeakPolarHBondContact O-CG1 3.41Å; A214-I218 PolarHBondContact O-N 3.33Å; A214-I218 VanDerWaalsContact O-N 3.09Å; A214-Y240 HydrophobicContact CB-CE1 4.07Å |
| 215 | I | 94.7 | Very high | 92.7 | Very high | 6 Ų | 6 | 44.4 Ų | 44.4 | 3% | 0.031 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -56.9 | -53.1 | 171.7 | -69.6 | 168.1 | 0 | 0 | 0 | 110.1 | F211 Y212 F213 V217 I218 T219 F352 I355 | F211-I215 HydrophobicContact CD1-CD1 3.82Å; F211-I215 HydrophobicContact CD1-CG1 4.42Å; F211-I215 HydrophobicContact CE1-CD1 3.56Å; F211-I215 HydrophobicContact CE1-CG1 4.23Å; F211-I215 HydrophobicContact CZ-CD1 4.36Å; F211-I215 WeakPolarHBondContact O-CG1 3.33Å; F211-I215 PolarHBondContact O-N 3.09Å; Y212-I215 WeakPolarHBondContact O-CB 3.3Å; Y212-I215 PolarHBondContact O-N 3.45Å; F213-I215 VanDerWaalsContact C-N 3.34Å; F213-I215 PolarHBondContact O-N 3.48Å; I215-V217 PolarHBondContact O-N 3.25Å; I215-I218 PolarHBondContact O-N 2.86Å; I215-T219 HydrophobicContact CG2-CG2 3.99Å; I215-T219 WeakPolarHBondContact O-CB 3.18Å; I215-T219 WeakPolarHBondContact O-CG2 3.36Å; I215-T219 PolarHBondContact O-N 3.46Å; I215-T219 PolarHBondContact O-OG1 2.86Å; I215-F352 HydrophobicContact CD1-CB 3.96Å; I215-F352 HydrophobicContact CD1-CD1 3.94Å; I215-F352 HydrophobicContact CD1-CD2 4.3Å; I215-F352 HydrophobicContact CD1-CG 3.81Å; I215-I355 HydrophobicContact CG2-CG2 4.14Å |
| 216 | T | 95.4 | Very high | 92.7 | Very high | 5 Ų | 5 | 39.2 Ų | 39.2 | 3% | 0.031 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -62.2 | -28.7 | -175.2 | 61.6 | 0 | 0 | 0 | 0 | 113.5 | Y212 F213 T220 I221 G222 Y223 | Y212-T216 HydrophobicContact CD2-CG2 4.38Å; Y212-T216 HydrophobicContact CE2-CG2 4.27Å; Y212-T216 WeakPolarHBondContact O-CG2 3.45Å; Y212-T216 PolarHBondContact O-N 3.34Å; F213-T216 WeakPolarHBondContact CA-OG1 3.27Å; F213-T216 PolarHBondContact O-N 3.39Å; F213-T216 VanDerWaalsContact O-N 3.08Å; F213-T216 PolarHBondContact O-OG1 3.08Å; T216-T220 PolarHBondContact O-N 2.94Å; T216-I221 PolarHBondContact O-N 3.02Å; T216-G222 PolarHBondContact O-N 3.27Å; T216-Y223 HydrophobicContact CG2-CD2 3.54Å; T216-Y223 HydrophobicContact CG2-CE2 3.79Å |
| 217 | V | 96.9 | Very high | 92.9 | Very high | 21 Ų | 21 | 36.6 Ų | 36.6 | 13% | 0.127 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -73.6 | -54.4 | 174.2 | 173 | 0 | 0 | 0 | 0 | 111.3 | F213 A214 I215 T219 T220 Y240 A241 | F213-V217 HydrophobicContact CD1-CG2 4.27Å; F213-V217 HydrophobicContact CD2-CG2 4.49Å; F213-V217 HydrophobicContact CE1-CG2 3.79Å; F213-V217 HydrophobicContact CE2-CG2 4.03Å; F213-V217 HydrophobicContact CZ-CG2 3.65Å; F213-V217 WeakPolarHBondContact O-CG2 3.41Å; F213-V217 PolarHBondContact O-N 3.37Å; A214-V217 PolarHBondContact O-N 2.82Å; I215-V217 PolarHBondContact O-N 3.25Å; V217-T219 VanDerWaalsContact C-N 3.29Å; V217-T219 PolarHBondContact O-N 3.4Å; V217-T220 PolarHBondContact O-N 3.04Å; V217-T220 VanDerWaalsContact O-N 3.15Å; V217-Y240 HydrophobicContact CB-CD1 4.44Å; V217-Y240 HydrophobicContact CB-CE1 4.43Å; V217-Y240 HydrophobicContact CG1-CD1 3.92Å; V217-Y240 HydrophobicContact CG1-CE1 4.32Å; V217-A241 HydrophobicContact CG1-CB 3.9Å |
| 218 | I | 96.4 | Very high | 93 | Very high | 35 Ų | 35 | 29.7 Ų | 29.7 | 18% | 0.179 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -71.4 | -24.8 | -175 | 69.9 | -174.6 | 0 | 0 | 0 | 113.4 | A214 I215 T220 Y240 T248 | A214-I218 WeakPolarHBondContact O-CG1 3.41Å; A214-I218 PolarHBondContact O-N 3.33Å; A214-I218 VanDerWaalsContact O-N 3.09Å; I215-I218 PolarHBondContact O-N 2.86Å; I218-T220 VanDerWaalsContact C-N 3.35Å; I218-Y240 HydrophobicContact CG2-CD1 4.2Å; I218-Y240 HydrophobicContact CG2-CE1 3.39Å; I218-Y240 HydrophobicContact CG2-CE2 4.4Å; I218-Y240 VanDerWaalsContact CG2-CZ 3.5Å; I218-Y240 WeakPolarHBondContact CG2-OH 3.44Å; I218-T248 WeakPolarHBondContact CB-OG1 3.16Å; I218-T248 HydrophobicContact CG1-CG2 4.5Å; I218-T248 WeakPolarHBondContact O-CB 3.29Å; I218-T248 WeakPolarHBondContact O-CG2 3.45Å |
| 219 | T | 95.1 | Very high | 93.1 | Very high | 5 Ų | 5 | 31.8 Ų | 31.8 | 3% | 0.031 | 23% | 0.227 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | 2.8 | 175 | 60.4 | 0 | 0 | 0 | 0 | 113.4 | I215 V217 I221 T248 F252 T326 L359 | I215-T219 HydrophobicContact CG2-CG2 3.99Å; I215-T219 WeakPolarHBondContact O-CB 3.18Å; I215-T219 WeakPolarHBondContact O-CG2 3.36Å; I215-T219 PolarHBondContact O-N 3.46Å; I215-T219 PolarHBondContact O-OG1 2.86Å; V217-T219 VanDerWaalsContact C-N 3.29Å; V217-T219 PolarHBondContact O-N 3.4Å; T219-I221 PolarHBondContact O-N 2.97Å; T219-I221 VanDerWaalsContact O-N 3.1Å; T219-I221 WeakPolarHBondContact OG1-CD1 3.43Å; T219-I221 WeakPolarHBondContact OG1-CG1 3.39Å; T219-T248 HydrophobicContact CG2-CG2 4.26Å; T219-F252 HydrophobicContact CG2-CE2 4.13Å; T219-F252 HydrophobicContact CG2-CZ 4.27Å; T219-T326 WeakPolarHBondContact O-CG2 3.26Å; T219-L359 HydrophobicContact CG2-CD1 3.54Å |
| 220 | T | 96.3 | Very high | 93.4 | Very high | 65 Ų | 65 | 36 Ų | 36 | 40% | 0.399 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.2 | 27.5 | -178 | 63.5 | 0 | 0 | 0 | 0 | 115.1 | T216 V217 I218 I245 | T216-T220 PolarHBondContact O-N 2.94Å; V217-T220 PolarHBondContact O-N 3.04Å; V217-T220 VanDerWaalsContact O-N 3.15Å; I218-T220 VanDerWaalsContact C-N 3.35Å; T220-I245 HydrophobicContact CG2-CB 4.42Å; T220-I245 HydrophobicContact CG2-CD1 3.58Å; T220-I245 HydrophobicContact CG2-CG1 3.68Å; T220-I245 HydrophobicContact CG2-CG2 3.85Å |
| 221 | I | 96.2 | Very high | 93.5 | Very high | 3 Ų | 3 | 39.6 Ų | 39.6 | 2% | 0.015 | 27% | 0.267 | C | S | . | . | trans | -76.2 | -47 | 173.9 | -60.3 | 168 | 0 | 0 | 0 | 110.2 | T216 T219 Y223 T323 T326 G328 I355 L359 | T216-I221 PolarHBondContact O-N 3.02Å; T219-I221 PolarHBondContact O-N 2.97Å; T219-I221 VanDerWaalsContact O-N 3.1Å; T219-I221 WeakPolarHBondContact OG1-CD1 3.43Å; T219-I221 WeakPolarHBondContact OG1-CG1 3.39Å; I221-Y223 HydrophobicContact CG2-CD1 3.86Å; I221-Y223 HydrophobicContact CG2-CD2 4.05Å; I221-Y223 HydrophobicContact CG2-CE1 3.59Å; I221-Y223 HydrophobicContact CG2-CE2 3.78Å; I221-Y223 HydrophobicContact CG2-CG 4.08Å; I221-Y223 PolarHBondContact O-N 3.34Å; I221-T323 HydrophobicContact CD1-CG2 4.18Å; I221-T326 HydrophobicContact CG1-CG2 4.07Å; I221-G328 WeakPolarHBondContact O-CA 3.46Å; I221-I355 HydrophobicContact CD1-CG2 3.74Å; I221-L359 HydrophobicContact CD1-CD1 4.27Å | ||
| 222 | G | 94.6 | Very high | 93.7 | Very high | 50 Ų | 50 | 38.9 Ų | 38.9 | 52% | 0.515 | 28% | 0.278 | S | S | . | . | trans | 61.7 | 29.9 | 165.9 | 0 | 0 | 0 | 0 | 0 | 119 | T216 G224 | T216-G222 PolarHBondContact O-N 3.27Å; G222-G224 PolarHBondContact O-N 3.2Å | ||
| 223 | Y | 92.6 | Very high | 93.9 | Very high | 7 Ų | 7 | 39.7 Ų | 39.7 | 3% | 0.027 | 29% | 0.288 | C | S | . | . | trans | -41.6 | -13.2 | -176.6 | -63.2 | -61.2 | 0 | 0 | 0 | 120.2 | Y212 T216 I221 H225 Y319 T323 G328 G330 V333 | Y212-Y223 HydrophobicContact CE2-CE2 4.27Å; Y212-Y223 AromaticContact CZ-CE2 3.83Å; Y212-Y223 WeakPolarHBondContact OH-CE2 3.34Å; T216-Y223 HydrophobicContact CG2-CD2 3.54Å; T216-Y223 HydrophobicContact CG2-CE2 3.79Å; I221-Y223 HydrophobicContact CG2-CD1 3.86Å; I221-Y223 HydrophobicContact CG2-CD2 4.05Å; I221-Y223 HydrophobicContact CG2-CE1 3.59Å; I221-Y223 HydrophobicContact CG2-CE2 3.78Å; I221-Y223 HydrophobicContact CG2-CG 4.08Å; I221-Y223 PolarHBondContact O-N 3.34Å; Y223-H225 VanDerWaalsContact CB-ND1 3.33Å; Y223-H225 WeakPolarHBondContact CB-ND1 3.34Å; Y223-H225 AromaticContact CD2-CE1 4Å; Y223-H225 AromaticContact CD2-ND1 3.97Å; Y223-H225 PolarHBondContact O-N 3.03Å; Y223-Y319 HydrophobicContact CE1-CE2 4.16Å; Y223-Y319 AromaticContact CZ-CE2 3.99Å; Y223-Y319 WeakPolarHBondContact OH-CE2 3.28Å; Y223-Y319 PolarHBondContact OH-OH 3.27Å; Y223-T323 WeakPolarHBondContact OH-CG2 3.44Å; Y223-T323 PolarHBondContact OH-OG1 3.05Å; Y223-G328 VanDerWaalsContact CA-O 3.3Å; Y223-G328 WeakPolarHBondContact CA-O 3.46Å; Y223-G330 VanDerWaalsContact O-CA 3.27Å; Y223-G330 WeakPolarHBondContact O-CA 3.35Å; Y223-V333 HydrophobicContact CD1-CG2 4.12Å; Y223-V333 HydrophobicContact CD2-CG1 4.28Å; Y223-V333 HydrophobicContact CG-CG2 4.08Å | ||
| 224 | G | 90.1 | Very high | 94 | Very high | 58 Ų | 58 | 42.1 Ų | 42.1 | 60% | 0.598 | 30% | 0.298 | S | S | * | . | S | Bend | trans | 71.4 | -21.3 | 179 | 0 | 0 | 0 | 0 | 0 | 117.2 | G222 A226 | G222-G224 PolarHBondContact O-N 3.2Å; G224-A226 PolarHBondContact O-N 3.37Å |
| 225 | H | 86.3 | Confident | 94.1 | Very high | 37 Ų | 37 | 43.1 Ų | 43.1 | 17% | 0.171 | 31% | 0.306 | C | S | . | . | S | Bend | trans | -53 | -26.5 | -178.9 | 72.9 | -88.1 | 0 | 0 | 0 | 114.7 | Y212 Y223 V333 Q336 | Y212-H225 AromaticContact CD1-CE1 3.82Å; Y212-H225 AromaticContact CD1-NE2 3.63Å; Y212-H225 AromaticContact CE1-CE1 3.41Å; Y212-H225 VanDerWaalsContact CE1-CE1 3.41Å; Y212-H225 WeakPolarHBondContact CE1-CE1 3.34Å; Y212-H225 AromaticContact CE1-NE2 3.52Å; Y223-H225 VanDerWaalsContact CB-ND1 3.33Å; Y223-H225 WeakPolarHBondContact CB-ND1 3.34Å; Y223-H225 AromaticContact CD2-CE1 4Å; Y223-H225 AromaticContact CD2-ND1 3.97Å; Y223-H225 PolarHBondContact O-N 3.03Å; H225-V333 HydrophobicContact CB-CG1 4.47Å; H225-V333 HydrophobicContact CB-CG2 4.21Å; H225-Q336 PolarHBondContact CD2-NE2 2.96Å; H225-Q336 VanDerWaalsContact CD2-NE2 3.28Å |
| 226 | A | 87.3 | Confident | 94.2 | Very high | 15 Ų | 15 | 49.3 Ų | 49.3 | 12% | 0.124 | 33% | 0.333 | C | S | . | . | S | Bend | trans | -136.3 | 124.8 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | Q204 W205 F213 G224 | Q204-A226 HydrophobicContact CB-CB 4.32Å; Q204-A226 HydrophobicContact CG-CB 4.46Å; W205-A226 HydrophobicContact CZ2-CB 4.31Å; F213-A226 WeakPolarHBondContact CD2-O 3.3Å; F213-A226 WeakPolarHBondContact CE2-O 3.12Å; G224-A226 PolarHBondContact O-N 3.37Å |
| 227 | A | 91.4 | Very high | 94.3 | Very high | 63 Ų | 63 | 50.3 Ų | 50.3 | 52% | 0.521 | 34% | 0.34 | S | S | . | . | trans | -131.6 | 149.2 | 178.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | G229 | A227-G229 PolarHBondContact O-N 3.45Å; A227-G229 VanDerWaalsContact O-N 3.1Å | ||
| 228 | P | 93.1 | Very high | 94.4 | Very high | 29 Ų | 29 | 55.4 Ų | 55.4 | 19% | 0.188 | 36% | 0.364 | C | S | . | . | trans | -70 | 107.6 | -179.8 | 27.1 | -33.1 | 0 | 0 | 0 | 110.8 | F213 K234 C237 | F213-P228 HydrophobicContact CZ-CG 4.38Å; P228-K234 HydrophobicContact CB-CG 4.37Å; P228-K234 HydrophobicContact CG-CG 4.07Å; P228-K234 WeakPolarHBondContact O-CE 3.47Å; P228-K234 VanDerWaalsContact O-CG 3.3Å; P228-K234 WeakPolarHBondContact O-CG 3.47Å; P228-C237 HydrophobicContact CG-CB 4.32Å | ||
| 229 | G | 90.1 | Very high | 94.4 | Very high | 66 Ų | 66 | 61 Ų | 61 | 68% | 0.68 | 39% | 0.387 | S | S | * | . | trans | -68.3 | -32.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | A227 K234 | A227-G229 PolarHBondContact O-N 3.45Å; A227-G229 VanDerWaalsContact O-N 3.1Å; G229-K234 WeakPolarHBondContact O-CE 3.44Å; G229-K234 PolarHBondContact O-NZ 3.1Å | ||
| 230 | T | 95 | Very high | 94.5 | Very high | 97 Ų | 97 | 64.3 Ų | 64.3 | 60% | 0.595 | 40% | 0.4 | S | S | * | . | S | Bend | trans | -84.4 | 143.9 | -177.8 | 62.2 | 0 | 0 | 0 | 0 | 112.3 | A232 G233 K234 | T230-A232 VanDerWaalsContact C-N 3.32Å; T230-A232 PolarHBondContact O-N 3.08Å; T230-G233 WeakPolarHBondContact O-CA 3.31Å; T230-G233 PolarHBondContact O-N 3.27Å; T230-G233 PolarHBondContact OG1-N 3.44Å; T230-K234 WeakPolarHBondContact O-CG 3.32Å; T230-K234 PolarHBondContact O-N 2.91Å |
| 231 | D | 96.9 | Very high | 94.6 | Very high | 121 Ų | 121 | 62.2 Ų | 62.2 | 65% | 0.647 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -66.6 | -34.1 | -177.8 | -58.1 | -35.8 | 0 | 0 | 0 | 112.7 | G233 K234 A235 | D231-G233 VanDerWaalsContact C-N 3.31Å; D231-G233 PolarHBondContact O-N 2.86Å; D231-K234 PolarHBondContact O-N 3.33Å; D231-K234 IonicContact OD1-NZ 2.81Å; D231-K234 PolarHBondContact OD1-NZ 3.12Å; D231-A235 WeakPolarHBondContact O-CB 3.26Å; D231-A235 PolarHBondContact O-N 2.89Å |
| 232 | A | 96.8 | Very high | 94.6 | Very high | 79 Ų | 79 | 67 Ų | 67 | 65% | 0.653 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -61.3 | -38.6 | 169.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | T230 F236 | T230-A232 VanDerWaalsContact C-N 3.32Å; T230-A232 PolarHBondContact O-N 3.08Å; A232-F236 WeakPolarHBondContact O-CB 3.4Å; A232-F236 PolarHBondContact O-N 3.2Å |
| 233 | G | 96.5 | Very high | 94.7 | Very high | 19 Ų | 19 | 71.1 Ų | 71.1 | 20% | 0.196 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -67.7 | -40.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | T230 D231 C237 | T230-G233 WeakPolarHBondContact O-CA 3.31Å; T230-G233 PolarHBondContact O-N 3.27Å; T230-G233 PolarHBondContact OG1-N 3.44Å; D231-G233 VanDerWaalsContact C-N 3.31Å; D231-G233 PolarHBondContact O-N 2.86Å; G233-C237 VanDerWaalsContact O-CB 3.3Å; G233-C237 WeakPolarHBondContact O-CB 3.5Å; G233-C237 PolarHBondContact O-N 3.48Å |
| 234 | K | 97.1 | Very high | 94.9 | Very high | 83 Ų | 83 | 71.1 Ų | 71.1 | 36% | 0.361 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -62.2 | -49.4 | 174 | -64.1 | 168.3 | -160.3 | 156 | 0 | 110.9 | P228 G229 T230 D231 F236 C237 M238 | P228-K234 HydrophobicContact CB-CG 4.37Å; P228-K234 HydrophobicContact CG-CG 4.07Å; P228-K234 WeakPolarHBondContact O-CE 3.47Å; P228-K234 VanDerWaalsContact O-CG 3.3Å; P228-K234 WeakPolarHBondContact O-CG 3.47Å; G229-K234 WeakPolarHBondContact O-CE 3.44Å; G229-K234 PolarHBondContact O-NZ 3.1Å; T230-K234 WeakPolarHBondContact O-CG 3.32Å; T230-K234 PolarHBondContact O-N 2.91Å; D231-K234 PolarHBondContact O-N 3.33Å; D231-K234 IonicContact OD1-NZ 2.81Å; D231-K234 PolarHBondContact OD1-NZ 3.12Å; K234-F236 PolarHBondContact O-N 3.07Å; K234-C237 WeakPolarHBondContact O-CB 3.23Å; K234-C237 PolarHBondContact O-N 3.33Å; K234-M238 WeakPolarHBondContact O-CG 3.5Å; K234-M238 PolarHBondContact O-N 3.38Å |
| 235 | A | 97.6 | Very high | 95.2 | Very high | 41 Ų | 41 | 70.7 Ų | 70.7 | 34% | 0.339 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -59.6 | -46.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | D231 C237 M238 F239 | D231-A235 WeakPolarHBondContact O-CB 3.26Å; D231-A235 PolarHBondContact O-N 2.89Å; A235-C237 VanDerWaalsContact C-N 3.34Å; A235-C237 PolarHBondContact O-N 2.85Å; A235-M238 PolarHBondContact O-N 3.06Å; A235-F239 WeakPolarHBondContact O-CD2 3.32Å; A235-F239 PolarHBondContact O-N 3.23Å |
| 236 | F | 97.6 | Very high | 95.6 | Very high | 137 Ų | 137 | 72.3 Ų | 72.3 | 60% | 0.601 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -59.1 | -43.9 | 174.2 | 176.9 | -99.2 | 0 | 0 | 0 | 112.1 | A232 K234 M238 F239 Y240 | A232-F236 WeakPolarHBondContact O-CB 3.4Å; A232-F236 PolarHBondContact O-N 3.2Å; K234-F236 PolarHBondContact O-N 3.07Å; F236-M238 VanDerWaalsContact C-N 3.31Å; F236-M238 PolarHBondContact O-N 2.91Å; F236-F239 PolarHBondContact O-N 3.18Å; F236-Y240 HydrophobicContact CE1-CG 4.37Å; F236-Y240 HydrophobicContact CZ-CD2 4.38Å; F236-Y240 VanDerWaalsContact O-CB 3.24Å; F236-Y240 WeakPolarHBondContact O-CB 3.39Å; F236-Y240 PolarHBondContact O-N 3.27Å |
| 237 | C | 97.5 | Very high | 96 | Very high | 25 Ų | 25 | 77.6 Ų | 77.6 | 17% | 0.169 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -59.7 | -39.2 | 178.1 | -168.9 | 0 | 0 | 0 | 0 | 112.4 | P228 G233 K234 A235 Y240 A241 | P228-C237 HydrophobicContact CG-CB 4.32Å; G233-C237 VanDerWaalsContact O-CB 3.3Å; G233-C237 WeakPolarHBondContact O-CB 3.5Å; G233-C237 PolarHBondContact O-N 3.48Å; K234-C237 WeakPolarHBondContact O-CB 3.23Å; K234-C237 PolarHBondContact O-N 3.33Å; A235-C237 VanDerWaalsContact C-N 3.34Å; A235-C237 PolarHBondContact O-N 2.85Å; C237-Y240 PolarHBondContact O-N 2.96Å; C237-A241 VanDerWaalsContact O-CB 3.32Å; C237-A241 WeakPolarHBondContact O-CB 3.32Å; C237-A241 PolarHBondContact O-N 3.42Å |
| 238 | M | 97.5 | Very high | 96.1 | Very high | 129 Ų | 129 | 75 Ų | 75 | 64% | 0.635 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -61.3 | -51.8 | 176 | -66.3 | 169.3 | -173.8 | 0 | 0 | 111.6 | K234 A235 F236 Y240 A241 V242 | K234-M238 WeakPolarHBondContact O-CG 3.5Å; K234-M238 PolarHBondContact O-N 3.38Å; A235-M238 PolarHBondContact O-N 3.06Å; F236-M238 VanDerWaalsContact C-N 3.31Å; F236-M238 PolarHBondContact O-N 2.91Å; M238-Y240 VanDerWaalsContact C-N 3.34Å; M238-Y240 PolarHBondContact O-N 3.44Å; M238-A241 PolarHBondContact O-N 3.29Å; M238-V242 WeakPolarHBondContact O-CG2 3.36Å; M238-V242 PolarHBondContact O-N 3.38Å; M238-V242 VanDerWaalsContact O-N 3.11Å |
| 239 | F | 97.4 | Very high | 96 | Very high | 152 Ų | 152 | 78.4 Ų | 78.4 | 67% | 0.667 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -64.1 | -38.6 | 177.9 | -68.3 | -66.3 | 0 | 0 | 0 | 112.5 | A235 F236 V242 L243 | A235-F239 WeakPolarHBondContact O-CD2 3.32Å; A235-F239 PolarHBondContact O-N 3.23Å; F236-F239 PolarHBondContact O-N 3.18Å; F239-V242 PolarHBondContact O-N 3.12Å; F239-L243 PolarHBondContact O-N 3.39Å |
| 240 | Y | 97.7 | Very high | 96.1 | Very high | 75 Ų | 75 | 79.8 Ų | 79.8 | 29% | 0.294 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.2 | -42.3 | 177.7 | -176.8 | -112.7 | 0 | 0 | 0 | 112.1 | A214 V217 I218 F236 C237 M238 G244 | A214-Y240 HydrophobicContact CB-CE1 4.07Å; V217-Y240 HydrophobicContact CB-CD1 4.44Å; V217-Y240 HydrophobicContact CB-CE1 4.43Å; V217-Y240 HydrophobicContact CG1-CD1 3.92Å; V217-Y240 HydrophobicContact CG1-CE1 4.32Å; I218-Y240 HydrophobicContact CG2-CD1 4.2Å; I218-Y240 HydrophobicContact CG2-CE1 3.39Å; I218-Y240 HydrophobicContact CG2-CE2 4.4Å; I218-Y240 VanDerWaalsContact CG2-CZ 3.5Å; I218-Y240 WeakPolarHBondContact CG2-OH 3.44Å; F236-Y240 HydrophobicContact CE1-CG 4.37Å; F236-Y240 HydrophobicContact CZ-CD2 4.38Å; F236-Y240 VanDerWaalsContact O-CB 3.24Å; F236-Y240 WeakPolarHBondContact O-CB 3.39Å; F236-Y240 PolarHBondContact O-N 3.27Å; C237-Y240 PolarHBondContact O-N 2.96Å; M238-Y240 VanDerWaalsContact C-N 3.34Å; M238-Y240 PolarHBondContact O-N 3.44Å; Y240-G244 WeakPolarHBondContact O-CA 3.5Å; Y240-G244 PolarHBondContact O-N 3.21Å |
| 241 | A | 97.1 | Very high | 96 | Very high | 21 Ų | 21 | 79 Ų | 79 | 17% | 0.174 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -65 | -44.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V217 C237 M238 L243 G244 I245 | V217-A241 HydrophobicContact CG1-CB 3.9Å; C237-A241 VanDerWaalsContact O-CB 3.32Å; C237-A241 WeakPolarHBondContact O-CB 3.32Å; C237-A241 PolarHBondContact O-N 3.42Å; M238-A241 PolarHBondContact O-N 3.29Å; A241-L243 VanDerWaalsContact C-N 3.27Å; A241-L243 PolarHBondContact O-N 2.92Å; A241-G244 PolarHBondContact O-N 2.99Å; A241-I245 HydrophobicContact CB-CD1 3.95Å; A241-I245 WeakPolarHBondContact O-CB 3.32Å; A241-I245 VanDerWaalsContact O-CG1 3.29Å; A241-I245 WeakPolarHBondContact O-CG1 3.43Å; A241-I245 PolarHBondContact O-N 2.69Å |
| 242 | V | 97 | Very high | 95.7 | Very high | 104 Ų | 104 | 74.3 Ų | 74.3 | 63% | 0.63 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -56.9 | -38.2 | -179.2 | 166.5 | 0 | 0 | 0 | 0 | 112.6 | M238 F239 P246 | M238-V242 WeakPolarHBondContact O-CG2 3.36Å; M238-V242 PolarHBondContact O-N 3.38Å; M238-V242 VanDerWaalsContact O-N 3.11Å; F239-V242 PolarHBondContact O-N 3.12Å; V242-P246 WeakPolarHBondContact O-CD 3.19Å; V242-P246 WeakPolarHBondContact O-CG 3.5Å |
| 243 | L | 95.6 | Very high | 95.4 | Very high | 135 Ų | 135 | 74.1 Ų | 74.1 | 71% | 0.707 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -91.2 | -36.3 | 177.8 | -61.8 | 177.9 | 0 | 0 | 0 | 113 | F239 A241 L247 | F239-L243 PolarHBondContact O-N 3.39Å; A241-L243 VanDerWaalsContact C-N 3.27Å; A241-L243 PolarHBondContact O-N 2.92Å; L243-L247 WeakPolarHBondContact O-CB 3.12Å; L243-L247 PolarHBondContact O-N 3.29Å |
| 244 | G | 96.6 | Very high | 95.1 | Very high | 8 Ų | 8 | 75.6 Ų | 75.6 | 8% | 0.082 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -73 | -37.8 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y240 A241 T248 | Y240-G244 WeakPolarHBondContact O-CA 3.5Å; Y240-G244 PolarHBondContact O-N 3.21Å; A241-G244 PolarHBondContact O-N 2.99Å; G244-T248 VanDerWaalsContact O-CB 3.26Å; G244-T248 WeakPolarHBondContact O-CB 3.4Å; G244-T248 PolarHBondContact O-N 3.13Å; G244-T248 PolarHBondContact O-OG1 3.08Å |
| 245 | I | 96.4 | Very high | 95 | Very high | 49 Ų | 49 | 74.9 Ų | 74.9 | 25% | 0.251 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -66.8 | -50.8 | -178.6 | -63 | 165.8 | 0 | 0 | 0 | 111.1 | T220 A241 L247 T248 L249 | T220-I245 HydrophobicContact CG2-CB 4.42Å; T220-I245 HydrophobicContact CG2-CD1 3.58Å; T220-I245 HydrophobicContact CG2-CG1 3.68Å; T220-I245 HydrophobicContact CG2-CG2 3.85Å; A241-I245 HydrophobicContact CB-CD1 3.95Å; A241-I245 WeakPolarHBondContact O-CB 3.32Å; A241-I245 VanDerWaalsContact O-CG1 3.29Å; A241-I245 WeakPolarHBondContact O-CG1 3.43Å; A241-I245 PolarHBondContact O-N 2.69Å; I245-L247 VanDerWaalsContact C-N 3.33Å; I245-L247 PolarHBondContact O-N 2.63Å; I245-T248 PolarHBondContact O-N 3.38Å; I245-L249 HydrophobicContact CG2-CD1 3.94Å; I245-L249 HydrophobicContact CG2-CG 4.33Å; I245-L249 WeakPolarHBondContact O-CG 3.38Å; I245-L249 PolarHBondContact O-N 2.98Å |
| 246 | P | 96.1 | Very high | 94.7 | Very high | 71 Ų | 71 | 73 Ų | 73 | 46% | 0.461 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -59.7 | -41 | 176.5 | -24.5 | 35.2 | 0 | 0 | 0 | 113.1 | V242 L249 V250 | V242-P246 WeakPolarHBondContact O-CD 3.19Å; V242-P246 WeakPolarHBondContact O-CG 3.5Å; P246-L249 PolarHBondContact O-N 3.28Å; P246-V250 WeakPolarHBondContact O-CG2 3.39Å; P246-V250 PolarHBondContact O-N 3.03Å |
| 247 | L | 94.9 | Very high | 94.3 | Very high | 125 Ų | 125 | 72.4 Ų | 72.4 | 65% | 0.654 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -61.1 | -45.5 | 176.9 | 178.5 | 62.7 | 0 | 0 | 0 | 111.6 | L243 I245 V250 M251 | L243-L247 WeakPolarHBondContact O-CB 3.12Å; L243-L247 PolarHBondContact O-N 3.29Å; I245-L247 VanDerWaalsContact C-N 3.33Å; I245-L247 PolarHBondContact O-N 2.63Å; L247-V250 PolarHBondContact O-N 3.1Å; L247-M251 WeakPolarHBondContact O-CB 3.2Å; L247-M251 PolarHBondContact O-N 2.86Å |
| 248 | T | 93.5 | Very high | 94.2 | Very high | 10 Ų | 10 | 80 Ų | 80 | 6% | 0.061 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -67.6 | -39.2 | 179.8 | -61.7 | 0 | 0 | 0 | 0 | 111.9 | I218 T219 G244 I245 M251 F252 | I218-T248 WeakPolarHBondContact CB-OG1 3.16Å; I218-T248 HydrophobicContact CG1-CG2 4.5Å; I218-T248 WeakPolarHBondContact O-CB 3.29Å; I218-T248 WeakPolarHBondContact O-CG2 3.45Å; T219-T248 HydrophobicContact CG2-CG2 4.26Å; G244-T248 VanDerWaalsContact O-CB 3.26Å; G244-T248 WeakPolarHBondContact O-CB 3.4Å; G244-T248 PolarHBondContact O-N 3.13Å; G244-T248 PolarHBondContact O-OG1 3.08Å; I245-T248 PolarHBondContact O-N 3.38Å; T248-M251 HydrophobicContact CG2-CE 4.31Å; T248-M251 WeakPolarHBondContact O-CB 3.47Å; T248-M251 PolarHBondContact O-N 3.4Å; T248-F252 HydrophobicContact CG2-CD2 3.62Å; T248-F252 HydrophobicContact CG2-CE2 3.32Å; T248-F252 HydrophobicContact CG2-CZ 4.19Å; T248-F252 WeakPolarHBondContact O-CD2 3.38Å; T248-F252 PolarHBondContact O-N 2.9Å |
| 249 | L | 91.3 | Very high | 93.9 | Very high | 100 Ų | 100 | 76.5 Ų | 76.5 | 52% | 0.524 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -62 | -48.5 | 174 | -72.7 | 172.8 | 0 | 0 | 0 | 111.6 | I245 P246 M251 F252 Q253 | I245-L249 HydrophobicContact CG2-CD1 3.94Å; I245-L249 HydrophobicContact CG2-CG 4.33Å; I245-L249 WeakPolarHBondContact O-CG 3.38Å; I245-L249 PolarHBondContact O-N 2.98Å; P246-L249 PolarHBondContact O-N 3.28Å; L249-M251 VanDerWaalsContact C-N 3.3Å; L249-M251 PolarHBondContact O-N 3.2Å; L249-F252 PolarHBondContact O-N 3.43Å; L249-Q253 WeakPolarHBondContact O-CB 3.33Å; L249-Q253 VanDerWaalsContact O-CG 3.28Å; L249-Q253 WeakPolarHBondContact O-CG 3.35Å; L249-Q253 PolarHBondContact O-N 2.99Å |
| 250 | V | 92 | Very high | 93.6 | Very high | 95 Ų | 95 | 70.5 Ų | 70.5 | 58% | 0.576 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -62.4 | -38.8 | 177.1 | 172.2 | 0 | 0 | 0 | 0 | 111.3 | P246 L247 S254 | P246-V250 WeakPolarHBondContact O-CG2 3.39Å; P246-V250 PolarHBondContact O-N 3.03Å; L247-V250 PolarHBondContact O-N 3.1Å; V250-S254 WeakPolarHBondContact O-CB 3.47Å; V250-S254 PolarHBondContact O-N 2.94Å; V250-S254 PolarHBondContact O-OG 3Å |
| 251 | M | 92.8 | Very high | 93.4 | Very high | 81 Ų | 81 | 71 Ų | 71 | 40% | 0.399 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -61 | -52.2 | 175 | -177.9 | -172.1 | 70.3 | 0 | 0 | 111.4 | L247 T248 L249 Q253 S254 L255 | L247-M251 WeakPolarHBondContact O-CB 3.2Å; L247-M251 PolarHBondContact O-N 2.86Å; T248-M251 HydrophobicContact CG2-CE 4.31Å; T248-M251 WeakPolarHBondContact O-CB 3.47Å; T248-M251 PolarHBondContact O-N 3.4Å; L249-M251 VanDerWaalsContact C-N 3.3Å; L249-M251 PolarHBondContact O-N 3.2Å; M251-Q253 PolarHBondContact O-N 3.23Å; M251-S254 PolarHBondContact O-N 3.25Å; M251-L255 HydrophobicContact CG-CD1 3.87Å; M251-L255 HydrophobicContact CG-CG 4.4Å; M251-L255 WeakPolarHBondContact O-CB 3.33Å; M251-L255 VanDerWaalsContact O-CG 3.31Å; M251-L255 WeakPolarHBondContact O-CG 3.2Å; M251-L255 PolarHBondContact O-N 3.2Å |
| 252 | F | 90.9 | Very high | 93.1 | Very high | 22 Ų | 22 | 76.1 Ų | 76.1 | 10% | 0.096 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -66.1 | -35.6 | -180 | -74.4 | -46.8 | 0 | 0 | 0 | 113.1 | T219 T248 L249 G256 L356 L359 T360 | T219-F252 HydrophobicContact CG2-CE2 4.13Å; T219-F252 HydrophobicContact CG2-CZ 4.27Å; T248-F252 HydrophobicContact CG2-CD2 3.62Å; T248-F252 HydrophobicContact CG2-CE2 3.32Å; T248-F252 HydrophobicContact CG2-CZ 4.19Å; T248-F252 WeakPolarHBondContact O-CD2 3.38Å; T248-F252 PolarHBondContact O-N 2.9Å; L249-F252 PolarHBondContact O-N 3.43Å; F252-G256 WeakPolarHBondContact O-CA 3.34Å; F252-G256 PolarHBondContact O-N 2.96Å; F252-L356 HydrophobicContact CZ-CD2 4.26Å; F252-L359 HydrophobicContact CD1-CB 4.48Å; F252-L359 HydrophobicContact CE1-CB 3.83Å; F252-L359 HydrophobicContact CE2-CB 3.99Å; F252-L359 HydrophobicContact CE2-CD1 3.93Å; F252-L359 HydrophobicContact CZ-CB 3.55Å; F252-L359 HydrophobicContact CZ-CD1 3.71Å; F252-L359 HydrophobicContact CZ-CG 4.31Å; F252-T360 WeakPolarHBondContact CD1-OG1 3.4Å; F252-T360 WeakPolarHBondContact CE1-OG1 3.36Å |
| 253 | Q | 89.5 | Confident | 92.8 | Very high | 74 Ų | 74 | 72.8 Ų | 72.8 | 35% | 0.346 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.5 | -47.7 | 172.6 | -70.9 | -63.4 | -27.6 | 0 | 0 | 111.2 | L249 M251 G256 E257 N367 | L249-Q253 WeakPolarHBondContact O-CB 3.33Å; L249-Q253 VanDerWaalsContact O-CG 3.28Å; L249-Q253 WeakPolarHBondContact O-CG 3.35Å; L249-Q253 PolarHBondContact O-N 2.99Å; M251-Q253 PolarHBondContact O-N 3.23Å; Q253-G256 PolarHBondContact O-N 3.36Å; Q253-E257 PolarHBondContact O-N 2.6Å; Q253-N367 PolarHBondContact O-ND2 2.91Å; Q253-N367 PolarHBondContact OE1-ND2 3.36Å |
| 254 | S | 91.8 | Very high | 92.6 | Very high | 51 Ų | 51 | 70.7 Ų | 70.7 | 36% | 0.357 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.5 | -41.7 | 179.7 | -57.7 | 0 | 0 | 0 | 0 | 112.8 | V250 M251 R258 | V250-S254 WeakPolarHBondContact O-CB 3.47Å; V250-S254 PolarHBondContact O-N 2.94Å; V250-S254 PolarHBondContact O-OG 3Å; M251-S254 PolarHBondContact O-N 3.25Å; S254-R258 VanDerWaalsContact O-CG 3.29Å; S254-R258 WeakPolarHBondContact O-CG 3.46Å; S254-R258 PolarHBondContact O-N 2.94Å |
| 255 | L | 93.5 | Very high | 92.4 | Very high | 68 Ų | 68 | 76.5 Ų | 76.5 | 36% | 0.356 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -68.9 | -39.7 | 175.1 | -69.3 | 175 | 0 | 0 | 0 | 111.4 | M251 R258 M259 T360 | M251-L255 HydrophobicContact CG-CD1 3.87Å; M251-L255 HydrophobicContact CG-CG 4.4Å; M251-L255 WeakPolarHBondContact O-CB 3.33Å; M251-L255 VanDerWaalsContact O-CG 3.31Å; M251-L255 WeakPolarHBondContact O-CG 3.2Å; M251-L255 PolarHBondContact O-N 3.2Å; L255-R258 PolarHBondContact O-N 2.97Å; L255-M259 WeakPolarHBondContact O-CB 3.33Å; L255-M259 PolarHBondContact O-N 3.12Å; L255-T360 HydrophobicContact CB-CG2 3.65Å; L255-T360 HydrophobicContact CD1-CG2 4.5Å |
| 256 | G | 91.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 77.9 Ų | 77.9 | 0% | 0 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -64.9 | -40.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | F252 Q253 M259 N260 | F252-G256 WeakPolarHBondContact O-CA 3.34Å; F252-G256 PolarHBondContact O-N 2.96Å; Q253-G256 PolarHBondContact O-N 3.36Å; G256-M259 PolarHBondContact O-N 3.17Å; G256-N260 WeakPolarHBondContact O-CB 3.38Å; G256-N260 VanDerWaalsContact O-CG 3.32Å; G256-N260 PolarHBondContact O-N 3.03Å; G256-N260 PolarHBondContact O-ND2 2.93Å |
| 257 | E | 90.9 | Very high | 91.9 | Very high | 126 Ų | 126 | 76 Ų | 76 | 59% | 0.589 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -63.3 | -45.4 | 173.7 | -172.2 | -172.4 | 175.7 | 0 | 0 | 111.8 | Q253 M259 N260 T261 | Q253-E257 PolarHBondContact O-N 2.6Å; E257-M259 VanDerWaalsContact C-N 3.32Å; E257-M259 PolarHBondContact O-N 2.94Å; E257-N260 PolarHBondContact O-N 2.81Å; E257-T261 WeakPolarHBondContact O-CB 3.39Å; E257-T261 PolarHBondContact O-N 2.94Å; E257-T261 PolarHBondContact O-OG1 3.18Å |
| 258 | R | 93.8 | Very high | 91.6 | Very high | 184 Ų | 184 | 74.6 Ų | 74.6 | 69% | 0.694 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -60.8 | -42 | 175.4 | -71.5 | 173.8 | -176.5 | -171.2 | 2.2 | 111.4 | S254 L255 T261 F262 | S254-R258 VanDerWaalsContact O-CG 3.29Å; S254-R258 WeakPolarHBondContact O-CG 3.46Å; S254-R258 PolarHBondContact O-N 2.94Å; L255-R258 PolarHBondContact O-N 2.97Å; R258-T261 PolarHBondContact O-N 2.86Å; R258-F262 WeakPolarHBondContact O-CB 3.43Å; R258-F262 PolarHBondContact O-N 3.49Å |
| 259 | M | 91.9 | Very high | 91.4 | Very high | 55 Ų | 55 | 81.2 Ų | 81.2 | 27% | 0.271 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -67.8 | -42.4 | 177.7 | -170 | 154.3 | 67.1 | 0 | 0 | 112.2 | L255 G256 E257 T261 F262 V263 T360 V361 A364 | L255-M259 WeakPolarHBondContact O-CB 3.33Å; L255-M259 PolarHBondContact O-N 3.12Å; G256-M259 PolarHBondContact O-N 3.17Å; E257-M259 VanDerWaalsContact C-N 3.32Å; E257-M259 PolarHBondContact O-N 2.94Å; M259-T261 VanDerWaalsContact C-N 3.28Å; M259-T261 PolarHBondContact O-N 3.47Å; M259-F262 PolarHBondContact O-N 2.96Å; M259-V263 HydrophobicContact CG-CG2 4.5Å; M259-V263 WeakPolarHBondContact O-CB 3.45Å; M259-V263 WeakPolarHBondContact O-CG2 3.43Å; M259-V263 PolarHBondContact O-N 3.32Å; M259-T360 HydrophobicContact CE-CG2 3.85Å; M259-T360 VanDerWaalsContact CE-O 3.27Å; M259-T360 WeakPolarHBondContact CE-O 3.45Å; M259-V361 HydrophobicContact CE-CB 4.21Å; M259-V361 HydrophobicContact CE-CG2 3.71Å; M259-V361 HydrophobicContact SD-CG2 4.45Å; M259-A364 HydrophobicContact CE-CB 3.75Å |
| 260 | N | 91.7 | Very high | 91.3 | Very high | 27 Ų | 27 | 80.4 Ų | 80.4 | 14% | 0.144 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -59.8 | -38.3 | 172.4 | -77.8 | -33.1 | 0 | 0 | 0 | 112 | G256 E257 R264 M286 A364 | G256-N260 WeakPolarHBondContact O-CB 3.38Å; G256-N260 VanDerWaalsContact O-CG 3.32Å; G256-N260 PolarHBondContact O-N 3.03Å; G256-N260 PolarHBondContact O-ND2 2.93Å; E257-N260 PolarHBondContact O-N 2.81Å; N260-R264 WeakPolarHBondContact O-CB 3.48Å; N260-R264 PolarHBondContact O-N 3.05Å; N260-M286 HydrophobicContact CB-CE 4.46Å; N260-M286 VanDerWaalsContact O-CE 3.23Å; N260-M286 WeakPolarHBondContact O-CE 3.26Å; N260-A364 PolarHBondContact ND2-O 3.13Å |
| 261 | T | 92 | Very high | 91.2 | Very high | 86 Ų | 86 | 77.5 Ų | 77.5 | 53% | 0.528 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -67.5 | -42.2 | 175.2 | -59.7 | 0 | 0 | 0 | 0 | 111.7 | E257 R258 M259 R264 Y265 | E257-T261 WeakPolarHBondContact O-CB 3.39Å; E257-T261 PolarHBondContact O-N 2.94Å; E257-T261 PolarHBondContact O-OG1 3.18Å; R258-T261 PolarHBondContact O-N 2.86Å; M259-T261 VanDerWaalsContact C-N 3.28Å; M259-T261 PolarHBondContact O-N 3.47Å; T261-R264 PolarHBondContact O-N 3.24Å; T261-Y265 PolarHBondContact O-N 3.01Å |
| 262 | F | 92.3 | Very high | 91 | Very high | 127 Ų | 127 | 81.3 Ų | 81.3 | 56% | 0.557 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -63.6 | -46.2 | 175.2 | 178.9 | -102.5 | 0 | 0 | 0 | 112.3 | R258 M259 R264 Y265 L266 | R258-F262 WeakPolarHBondContact O-CB 3.43Å; R258-F262 PolarHBondContact O-N 3.49Å; M259-F262 PolarHBondContact O-N 2.96Å; F262-R264 VanDerWaalsContact C-N 3.32Å; F262-R264 PolarHBondContact O-N 3.14Å; F262-Y265 WeakPolarHBondContact O-CB 3.25Å; F262-Y265 PolarHBondContact O-N 3.27Å; F262-L266 HydrophobicContact CE1-CD2 4.49Å; F262-L266 WeakPolarHBondContact O-CB 3.49Å; F262-L266 PolarHBondContact O-N 3.44Å |
| 263 | V | 91.2 | Very high | 90.8 | Very high | 34 Ų | 34 | 85.3 Ų | 85.3 | 21% | 0.206 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.3 | -43.4 | 174.2 | 169.1 | 0 | 0 | 0 | 0 | 110.7 | M259 Y265 L266 L267 M286 V289 | M259-V263 HydrophobicContact CG-CG2 4.5Å; M259-V263 WeakPolarHBondContact O-CB 3.45Å; M259-V263 WeakPolarHBondContact O-CG2 3.43Å; M259-V263 PolarHBondContact O-N 3.32Å; V263-Y265 PolarHBondContact O-N 3.43Å; V263-L266 PolarHBondContact O-N 3.34Å; V263-L267 HydrophobicContact CG1-CD1 3.85Å; V263-L267 HydrophobicContact CG1-CG 4.33Å; V263-L267 WeakPolarHBondContact O-CB 3.47Å; V263-L267 VanDerWaalsContact O-CG 3.29Å; V263-L267 WeakPolarHBondContact O-CG 3.37Å; V263-L267 PolarHBondContact O-N 2.84Å; V263-M286 HydrophobicContact CB-CE 4.22Å; V263-M286 HydrophobicContact CG1-CE 3.93Å; V263-M286 HydrophobicContact CG1-SD 4.44Å; V263-V289 HydrophobicContact CG1-CG1 3.7Å |
| 264 | R | 90.6 | Very high | 90.7 | Very high | 92 Ų | 92 | 86 Ų | 86 | 35% | 0.347 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -60.6 | -43.2 | 175.2 | -175.9 | -178.3 | -63.1 | -76.1 | 3.5 | 112.2 | N260 T261 F262 K268 V281 M286 | N260-R264 WeakPolarHBondContact O-CB 3.48Å; N260-R264 PolarHBondContact O-N 3.05Å; T261-R264 PolarHBondContact O-N 3.24Å; F262-R264 VanDerWaalsContact C-N 3.32Å; F262-R264 PolarHBondContact O-N 3.14Å; R264-K268 WeakPolarHBondContact O-CG 3.43Å; R264-K268 PolarHBondContact O-N 3.09Å; R264-V281 HydrophobicContact CG-CB 4.24Å; R264-V281 HydrophobicContact CG-CG1 4.3Å; R264-V281 PolarHBondContact NH1-O 3.23Å; R264-M286 HydrophobicContact CB-CE 4.07Å; R264-M286 HydrophobicContact CB-SD 3.87Å; R264-M286 HydrophobicContact CG-SD 4.32Å |
| 265 | Y | 91.9 | Very high | 90.3 | Very high | 130 Ų | 130 | 86.7 Ų | 86.7 | 51% | 0.51 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 175.1 | 170.1 | -92.8 | 0 | 0 | 0 | 111.6 | T261 F262 V263 L267 K268 R269 | T261-Y265 PolarHBondContact O-N 3.01Å; F262-Y265 WeakPolarHBondContact O-CB 3.25Å; F262-Y265 PolarHBondContact O-N 3.27Å; V263-Y265 PolarHBondContact O-N 3.43Å; Y265-L267 PolarHBondContact O-N 3.41Å; Y265-K268 WeakPolarHBondContact O-CB 3.37Å; Y265-K268 PolarHBondContact O-N 2.91Å; Y265-R269 PolarHBondContact O-N 3.4Å; Y265-R269 PolarHBondContact OH-NH1 3.33Å; Y265-R269 VanDerWaalsContact OH-NH1 3.1Å |
| 266 | L | 91.6 | Very high | 89.8 | Confident | 77 Ų | 77 | 88 Ų | 88 | 40% | 0.403 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63 | -43.4 | 179.4 | -174.1 | 60.9 | 0 | 0 | 0 | 111.4 | F262 V263 K268 R269 I270 | F262-L266 HydrophobicContact CE1-CD2 4.49Å; F262-L266 WeakPolarHBondContact O-CB 3.49Å; F262-L266 PolarHBondContact O-N 3.44Å; V263-L266 PolarHBondContact O-N 3.34Å; L266-K268 PolarHBondContact O-N 3.25Å; L266-R269 WeakPolarHBondContact O-CB 3.49Å; L266-R269 PolarHBondContact O-N 3.29Å; L266-R269 VanDerWaalsContact O-N 3.16Å; L266-I270 HydrophobicContact CD1-CD1 4.4Å; L266-I270 HydrophobicContact CG-CD1 3.98Å; L266-I270 WeakPolarHBondContact O-CG1 3.47Å; L266-I270 PolarHBondContact O-N 3.22Å |
| 267 | L | 89.7 | Confident | 89 | Confident | 31 Ų | 31 | 100.7 Ų | 100.7 | 16% | 0.162 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -61.9 | -42.1 | 174.2 | -71.9 | 169.9 | 0 | 0 | 0 | 112.4 | V263 Y265 R269 I270 K271 V281 M286 V289 | V263-L267 HydrophobicContact CG1-CD1 3.85Å; V263-L267 HydrophobicContact CG1-CG 4.33Å; V263-L267 WeakPolarHBondContact O-CB 3.47Å; V263-L267 VanDerWaalsContact O-CG 3.29Å; V263-L267 WeakPolarHBondContact O-CG 3.37Å; V263-L267 PolarHBondContact O-N 2.84Å; Y265-L267 PolarHBondContact O-N 3.41Å; L267-R269 VanDerWaalsContact C-N 3.3Å; L267-R269 PolarHBondContact O-N 3.49Å; L267-I270 PolarHBondContact O-N 3.08Å; L267-K271 WeakPolarHBondContact O-CB 3.28Å; L267-K271 WeakPolarHBondContact O-CG 3.48Å; L267-K271 PolarHBondContact O-N 2.9Å; L267-V281 HydrophobicContact CB-CG1 4.44Å; L267-V281 HydrophobicContact CB-CG2 4.09Å; L267-V281 HydrophobicContact CD1-CG1 4.07Å; L267-M286 HydrophobicContact CD1-SD 3.88Å; L267-V289 HydrophobicContact CD1-CB 4.31Å; L267-V289 HydrophobicContact CD1-CG1 4.36Å; L267-V289 HydrophobicContact CD1-CG2 3.99Å; L267-V289 HydrophobicContact CD2-CG2 3.95Å |
| 268 | K | 89.5 | Confident | 88.3 | Confident | 96 Ų | 96 | 99.4 Ų | 99.4 | 42% | 0.417 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.1 | -42.8 | 172.6 | -77.2 | -172.9 | 173.6 | -167.6 | 0 | 111.5 | R264 Y265 L266 K272 V281 | R264-K268 WeakPolarHBondContact O-CG 3.43Å; R264-K268 PolarHBondContact O-N 3.09Å; Y265-K268 WeakPolarHBondContact O-CB 3.37Å; Y265-K268 PolarHBondContact O-N 2.91Å; L266-K268 PolarHBondContact O-N 3.25Å; K268-K272 WeakPolarHBondContact O-CB 3.19Å; K268-K272 PolarHBondContact O-N 3.08Å; K268-V281 HydrophobicContact CG-CG2 3.58Å |
| 269 | R | 90.1 | Very high | 87.6 | Confident | 149 Ų | 149 | 93.4 Ų | 93.4 | 56% | 0.562 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -65.5 | -45.6 | 178.4 | -168.7 | 169.7 | -179.8 | 152.1 | -5 | 111.7 | Y265 L266 L267 K272 C273 | Y265-R269 PolarHBondContact O-N 3.4Å; Y265-R269 PolarHBondContact OH-NH1 3.33Å; Y265-R269 VanDerWaalsContact OH-NH1 3.1Å; L266-R269 WeakPolarHBondContact O-CB 3.49Å; L266-R269 PolarHBondContact O-N 3.29Å; L266-R269 VanDerWaalsContact O-N 3.16Å; L267-R269 VanDerWaalsContact C-N 3.3Å; L267-R269 PolarHBondContact O-N 3.49Å; R269-K272 PolarHBondContact O-N 2.66Å; R269-C273 PolarHBondContact O-N 3.32Å; R269-C273 PolarHBondContact O-SG 3.08Å |
| 270 | I | 89.3 | Confident | 87.2 | Confident | 84 Ų | 84 | 95.8 Ų | 95.8 | 43% | 0.431 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -59.9 | -51.9 | 175.4 | -68.1 | 165.4 | 0 | 0 | 0 | 110.5 | L266 L267 K272 C273 C274 | L266-I270 HydrophobicContact CD1-CD1 4.4Å; L266-I270 HydrophobicContact CG-CD1 3.98Å; L266-I270 WeakPolarHBondContact O-CG1 3.47Å; L266-I270 PolarHBondContact O-N 3.22Å; L267-I270 PolarHBondContact O-N 3.08Å; I270-K272 VanDerWaalsContact C-N 3.26Å; I270-K272 PolarHBondContact O-N 2.96Å; I270-C273 PolarHBondContact O-N 3.01Å; I270-C274 PolarHBondContact O-N 2.72Å; I270-C274 PolarHBondContact O-SG 2.89Å |
| 271 | K | 89.1 | Confident | 86.9 | Confident | 33 Ų | 33 | 95 Ų | 95 | 14% | 0.143 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -55.2 | -40.9 | 177.2 | -73.2 | -166.9 | 177.8 | -167.2 | 0 | 112.5 | L267 C274 G275 M276 T279 D280 | L267-K271 WeakPolarHBondContact O-CB 3.28Å; L267-K271 WeakPolarHBondContact O-CG 3.48Å; L267-K271 PolarHBondContact O-N 2.9Å; K271-C274 PolarHBondContact O-N 2.99Å; K271-G275 PolarHBondContact O-N 2.99Å; K271-M276 HydrophobicContact CB-CB 4.32Å; K271-M276 HydrophobicContact CB-SD 4.07Å; K271-M276 HydrophobicContact CD-SD 4.14Å; K271-M276 HydrophobicContact CG-SD 3.72Å; K271-M276 WeakPolarHBondContact O-CB 3.42Å; K271-M276 PolarHBondContact O-N 2.92Å; K271-T279 HydrophobicContact CB-CG2 4.41Å; K271-D280 PolarHBondContact NZ-O 2.99Å |
| 272 | K | 87.8 | Confident | 86.7 | Confident | 162 Ų | 162 | 93.6 Ų | 93.6 | 70% | 0.704 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -67 | -41.9 | 176.5 | -169.9 | 176.1 | -177.9 | 179.4 | 0 | 112.2 | K268 R269 I270 C274 G275 T279 | K268-K272 WeakPolarHBondContact O-CB 3.19Å; K268-K272 PolarHBondContact O-N 3.08Å; R269-K272 PolarHBondContact O-N 2.66Å; I270-K272 VanDerWaalsContact C-N 3.26Å; I270-K272 PolarHBondContact O-N 2.96Å; K272-C274 VanDerWaalsContact C-N 3.35Å; K272-G275 PolarHBondContact O-N 3.1Å; K272-T279 HydrophobicContact CB-CG2 4.31Å |
| 273 | C | 88.5 | Confident | 86.4 | Confident | 105 Ų | 105 | 91.3 Ų | 91.3 | 71% | 0.709 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -66 | -34.5 | 174.7 | -70.1 | 0 | 0 | 0 | 0 | 112.7 | R269 I270 G275 | R269-C273 PolarHBondContact O-N 3.32Å; R269-C273 PolarHBondContact O-SG 3.08Å; I270-C273 PolarHBondContact O-N 3.01Å; C273-G275 PolarHBondContact O-N 3.2Å |
| 274 | C | 86.9 | Confident | 86.3 | Confident | 90 Ų | 90 | 96.8 Ų | 96.8 | 61% | 0.608 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | 9.2 | 173.8 | -61.9 | 0 | 0 | 0 | 0 | 113.9 | I270 K271 K272 M276 | I270-C274 PolarHBondContact O-N 2.72Å; I270-C274 PolarHBondContact O-SG 2.89Å; K271-C274 PolarHBondContact O-N 2.99Å; K272-C274 VanDerWaalsContact C-N 3.35Å; C274-M276 HydrophobicContact CB-CG 4.34Å; C274-M276 PolarHBondContact O-N 3.13Å |
| 275 | G | 83.4 | Confident | 86.2 | Confident | 65 Ų | 65 | 95.4 Ų | 95.4 | 67% | 0.67 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.7 | 16.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | K271 K272 C273 R277 | K271-G275 PolarHBondContact O-N 2.99Å; K272-G275 PolarHBondContact O-N 3.1Å; C273-G275 PolarHBondContact O-N 3.2Å; G275-R277 PolarHBondContact O-N 3.36Å |
| 276 | M | 83.5 | Confident | 86.2 | Confident | 96 Ų | 96 | 89.4 Ų | 89.4 | 47% | 0.473 | 46% | 0.459 | S | S | . | . | trans | -69.3 | 121.5 | -176.8 | -65 | -175.6 | 70.6 | 0 | 0 | 111.4 | K271 C274 N278 | K271-M276 HydrophobicContact CB-CB 4.32Å; K271-M276 HydrophobicContact CB-SD 4.07Å; K271-M276 HydrophobicContact CD-SD 4.14Å; K271-M276 HydrophobicContact CG-SD 3.72Å; K271-M276 WeakPolarHBondContact O-CB 3.42Å; K271-M276 PolarHBondContact O-N 2.92Å; C274-M276 HydrophobicContact CB-CG 4.34Å; C274-M276 PolarHBondContact O-N 3.13Å; M276-N278 PolarHBondContact O-N 2.86Å | ||
| 277 | R | 73.9 | Confident | 86.2 | Confident | 265 Ų | 265 | 88.2 Ų | 88.2 | 100% | 1 | 45% | 0.454 | S | S | * | . | S | Bend | trans | -63.8 | -21.6 | -179 | -163.3 | 171.3 | 177.9 | 175.9 | -1.8 | 113.9 | G275 | G275-R277 PolarHBondContact O-N 3.36Š|
| 278 | N | 76.8 | Confident | 86.3 | Confident | 100 Ų | 100 | 90.1 Ų | 90.1 | 54% | 0.535 | 47% | 0.468 | S | S | . | . | trans | -114.6 | 115.7 | 168.6 | -173.5 | -15.2 | 0 | 0 | 0 | 109.8 | M276 D280 | M276-N278 PolarHBondContact O-N 2.86Å; N278-D280 WeakPolarHBondContact OD1-CB 3.48Å; N278-D280 PolarHBondContact OD1-N 3.23Å; N278-D280 PolarHBondContact OD1-OD2 2.98Å | ||
| 279 | T | 78.6 | Confident | 86.5 | Confident | 57 Ų | 57 | 87.8 Ų | 87.8 | 35% | 0.35 | 46% | 0.461 | S | S | . | . | trans | -99.6 | 5.5 | -179.4 | 58.4 | 0 | 0 | 0 | 0 | 113.5 | K271 K272 | K271-T279 HydrophobicContact CB-CG2 4.41Å; K272-T279 HydrophobicContact CB-CG2 4.31Å | ||
| 280 | D | 82.1 | Confident | 86.6 | Confident | 105 Ų | 105 | 81.4 Ų | 81.4 | 56% | 0.561 | 44% | 0.442 | S | S | * | . | trans | -66.6 | 138.7 | 178.8 | -71.1 | -42.3 | 0 | 0 | 0 | 112.1 | K271 N278 | K271-D280 PolarHBondContact NZ-O 2.99Å; N278-D280 WeakPolarHBondContact OD1-CB 3.48Å; N278-D280 PolarHBondContact OD1-N 3.23Å; N278-D280 PolarHBondContact OD1-OD2 2.98Å | ||
| 281 | V | 86.2 | Confident | 86.8 | Confident | 12 Ų | 12 | 82.5 Ų | 82.5 | 7% | 0.073 | 44% | 0.444 | C | S | . | . | trans | -106.7 | 85 | -178.7 | -177.4 | 0 | 0 | 0 | 0 | 107.9 | R264 L267 K268 N285 M286 | R264-V281 HydrophobicContact CG-CB 4.24Å; R264-V281 HydrophobicContact CG-CG1 4.3Å; R264-V281 PolarHBondContact NH1-O 3.23Å; L267-V281 HydrophobicContact CB-CG1 4.44Å; L267-V281 HydrophobicContact CB-CG2 4.09Å; L267-V281 HydrophobicContact CD1-CG1 4.07Å; K268-V281 HydrophobicContact CG-CG2 3.58Å; V281-N285 HydrophobicContact CG1-CB 4.33Å; V281-M286 HydrophobicContact CG1-CG 3.82Å; V281-M286 HydrophobicContact CG1-SD 3.5Å; V281-M286 WeakPolarHBondContact CG1-SD 3.47Å | ||
| 282 | S | 87.9 | Confident | 87.1 | Confident | 56 Ų | 56 | 87.4 Ų | 87.4 | 39% | 0.392 | 47% | 0.465 | S | S | . | . | trans | -49.5 | 151 | 169.6 | 176.9 | 0 | 0 | 0 | 0 | 111.2 | E284 N285 M286 | S282-E284 PolarHBondContact O-N 3.16Å; S282-E284 PolarHBondContact OG-N 3.22Å; S282-N285 PolarHBondContact N-ND2 3.33Å; S282-N285 WeakPolarHBondContact O-CB 3.28Å; S282-N285 PolarHBondContact O-N 2.89Å; S282-N285 VanDerWaalsContact O-N 3.15Å; S282-M286 PolarHBondContact O-N 3.14Å | ||
| 283 | M | 86.6 | Confident | 87.5 | Confident | 79 Ų | 79 | 82.2 Ų | 82.2 | 39% | 0.389 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -56.9 | -36.8 | 175.1 | -173.9 | 176.3 | -70 | 0 | 0 | 111.9 | N285 M286 V287 R372 | M283-N285 VanDerWaalsContact C-N 3.31Å; M283-N285 PolarHBondContact O-N 2.92Å; M283-M286 WeakPolarHBondContact O-CA 3.38Å; M283-M286 WeakPolarHBondContact O-CB 3.18Å; M283-M286 PolarHBondContact O-N 2.91Å; M283-V287 HydrophobicContact CG-CG2 4.37Å; M283-V287 WeakPolarHBondContact O-CG2 3.35Å; M283-V287 PolarHBondContact O-N 3.48Å; M283-R372 PolarHBondContact SD-NH1 2.92Å |
| 284 | E | 87.7 | Confident | 87.8 | Confident | 148 Ų | 148 | 77.8 Ų | 77.8 | 69% | 0.692 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -58.4 | -42.1 | 176.9 | -64.3 | 168.3 | 166.2 | 0 | 0 | 111.9 | S282 M286 V287 T288 | S282-E284 PolarHBondContact O-N 3.16Å; S282-E284 PolarHBondContact OG-N 3.22Å; E284-M286 VanDerWaalsContact C-N 3.28Å; E284-M286 PolarHBondContact O-N 2.88Å; E284-V287 PolarHBondContact O-N 3.42Å; E284-T288 WeakPolarHBondContact O-CB 3.4Å; E284-T288 PolarHBondContact O-N 3.02Å; E284-T288 PolarHBondContact O-OG1 3.48Å |
| 285 | N | 89.6 | Confident | 88.2 | Confident | 64 Ų | 64 | 77 Ų | 77 | 34% | 0.342 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.4 | -37.3 | 175.4 | -62.3 | -58.5 | 0 | 0 | 0 | 111.5 | V281 S282 M283 V289 | V281-N285 HydrophobicContact CG1-CB 4.33Å; S282-N285 PolarHBondContact N-ND2 3.33Å; S282-N285 WeakPolarHBondContact O-CB 3.28Å; S282-N285 PolarHBondContact O-N 2.89Å; S282-N285 VanDerWaalsContact O-N 3.15Å; M283-N285 VanDerWaalsContact C-N 3.31Å; M283-N285 PolarHBondContact O-N 2.92Å; N285-V289 WeakPolarHBondContact O-CB 3.34Å; N285-V289 WeakPolarHBondContact O-CG2 3.31Å; N285-V289 PolarHBondContact O-N 3.09Å |
| 286 | M | 90.7 | Very high | 88.8 | Confident | 3 Ų | 3 | 75.1 Ų | 75.1 | 2% | 0.015 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -70.2 | -41.7 | 177.3 | -63.4 | -65 | -56.9 | 0 | 0 | 112.1 | N260 V263 R264 L267 V281 S282 M283 E284 V289 G290 L368 | N260-M286 HydrophobicContact CB-CE 4.46Å; N260-M286 VanDerWaalsContact O-CE 3.23Å; N260-M286 WeakPolarHBondContact O-CE 3.26Å; V263-M286 HydrophobicContact CB-CE 4.22Å; V263-M286 HydrophobicContact CG1-CE 3.93Å; V263-M286 HydrophobicContact CG1-SD 4.44Å; R264-M286 HydrophobicContact CB-CE 4.07Å; R264-M286 HydrophobicContact CB-SD 3.87Å; R264-M286 HydrophobicContact CG-SD 4.32Å; L267-M286 HydrophobicContact CD1-SD 3.88Å; V281-M286 HydrophobicContact CG1-CG 3.82Å; V281-M286 HydrophobicContact CG1-SD 3.5Å; V281-M286 WeakPolarHBondContact CG1-SD 3.47Å; S282-M286 PolarHBondContact O-N 3.14Å; M283-M286 WeakPolarHBondContact O-CA 3.38Å; M283-M286 WeakPolarHBondContact O-CB 3.18Å; M283-M286 PolarHBondContact O-N 2.91Å; E284-M286 VanDerWaalsContact C-N 3.28Å; E284-M286 PolarHBondContact O-N 2.88Å; M286-V289 PolarHBondContact O-N 2.88Å; M286-G290 PolarHBondContact O-N 2.98Å; M286-L368 HydrophobicContact CB-CD1 3.64Å; M286-L368 HydrophobicContact CE-CD1 4.29Å; M286-L368 HydrophobicContact CG-CD1 4.46Å |
| 287 | V | 91.8 | Very high | 89.5 | Confident | 52 Ų | 52 | 71.6 Ų | 71.6 | 32% | 0.315 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -61.4 | -48.1 | 175.5 | 174.8 | 0 | 0 | 0 | 0 | 110.1 | M283 E284 G290 F291 F365 L368 | M283-V287 HydrophobicContact CG-CG2 4.37Å; M283-V287 WeakPolarHBondContact O-CG2 3.35Å; M283-V287 PolarHBondContact O-N 3.48Å; E284-V287 PolarHBondContact O-N 3.42Å; V287-G290 PolarHBondContact O-N 2.63Å; V287-F291 WeakPolarHBondContact O-CB 3.48Å; V287-F291 PolarHBondContact O-N 3.42Å; V287-F365 HydrophobicContact CG1-CE2 4.34Å; V287-L368 HydrophobicContact CB-CD2 4.48Å; V287-L368 HydrophobicContact CG2-CD2 3.49Å; V287-L368 VanDerWaalsContact CG2-CD2 3.49Å |
| 288 | T | 91.6 | Very high | 90.6 | Very high | 71 Ų | 71 | 59.6 Ų | 59.6 | 44% | 0.436 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.4 | -46.8 | 178.6 | -63 | 0 | 0 | 0 | 0 | 111.9 | E284 F291 F292 | E284-T288 WeakPolarHBondContact O-CB 3.4Å; E284-T288 PolarHBondContact O-N 3.02Å; E284-T288 PolarHBondContact O-OG1 3.48Å; T288-F291 PolarHBondContact O-N 3.24Å; T288-F292 HydrophobicContact CG2-CD2 3.82Å; T288-F292 HydrophobicContact CG2-CE2 3.56Å; T288-F292 WeakPolarHBondContact O-CD2 3.37Å; T288-F292 PolarHBondContact O-N 2.84Å |
| 289 | V | 93.5 | Very high | 91.5 | Very high | 48 Ų | 48 | 57.2 Ų | 57.2 | 29% | 0.291 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -67.8 | -37.5 | 177.8 | 171.1 | 0 | 0 | 0 | 0 | 111.5 | V263 L267 N285 M286 F292 S293 | V263-V289 HydrophobicContact CG1-CG1 3.7Å; L267-V289 HydrophobicContact CD1-CB 4.31Å; L267-V289 HydrophobicContact CD1-CG1 4.36Å; L267-V289 HydrophobicContact CD1-CG2 3.99Å; L267-V289 HydrophobicContact CD2-CG2 3.95Å; N285-V289 WeakPolarHBondContact O-CB 3.34Å; N285-V289 WeakPolarHBondContact O-CG2 3.31Å; N285-V289 PolarHBondContact O-N 3.09Å; M286-V289 PolarHBondContact O-N 2.88Å; V289-F292 PolarHBondContact O-N 3.01Å; V289-S293 VanDerWaalsContact O-CB 3.32Å; V289-S293 WeakPolarHBondContact O-CB 3.28Å; V289-S293 PolarHBondContact O-N 3.35Å |
| 290 | G | 93.3 | Very high | 92.4 | Very high | 15 Ų | 15 | 60 Ų | 60 | 16% | 0.155 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.6 | -44 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | M286 V287 S293 C294 | M286-G290 PolarHBondContact O-N 2.98Å; V287-G290 PolarHBondContact O-N 2.63Å; G290-S293 WeakPolarHBondContact O-CB 3.49Å; G290-S293 PolarHBondContact O-N 3.33Å; G290-C294 PolarHBondContact O-N 2.9Å; G290-C294 PolarHBondContact O-SG 2.94Å |
| 291 | F | 93.7 | Very high | 93 | Very high | 106 Ų | 106 | 55 Ų | 55 | 47% | 0.465 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -60.9 | -48.8 | 175.7 | 179.1 | -98 | 0 | 0 | 0 | 112.1 | V287 T288 S293 C294 M295 F365 | V287-F291 WeakPolarHBondContact O-CB 3.48Å; V287-F291 PolarHBondContact O-N 3.42Å; T288-F291 PolarHBondContact O-N 3.24Å; F291-S293 VanDerWaalsContact C-N 3.3Å; F291-S293 PolarHBondContact O-N 3.45Å; F291-C294 PolarHBondContact O-N 3.18Å; F291-M295 HydrophobicContact CE1-CE 4.16Å; F291-M295 HydrophobicContact CE2-CE 4.32Å; F291-M295 HydrophobicContact CZ-CE 3.7Å; F291-M295 WeakPolarHBondContact O-CB 3.23Å; F291-M295 PolarHBondContact O-N 3.22Å; F291-F365 HydrophobicContact CB-CE2 4.38Å |
| 292 | F | 95.2 | Very high | 93.5 | Very high | 136 Ų | 136 | 54.4 Ų | 54.4 | 60% | 0.596 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -64 | -34.3 | 175.1 | -74.5 | -60.1 | 0 | 0 | 0 | 112.7 | T288 V289 G296 | T288-F292 HydrophobicContact CG2-CD2 3.82Å; T288-F292 HydrophobicContact CG2-CE2 3.56Å; T288-F292 WeakPolarHBondContact O-CD2 3.37Å; T288-F292 PolarHBondContact O-N 2.84Å; V289-F292 PolarHBondContact O-N 3.01Å; F292-G296 PolarHBondContact O-N 3.49Å |
| 293 | S | 95.1 | Very high | 93.9 | Very high | 53 Ų | 53 | 53.6 Ų | 53.6 | 37% | 0.371 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -64.6 | -45.5 | 174.1 | -168.4 | 0 | 0 | 0 | 0 | 111.6 | V289 G290 F291 G296 T297 | V289-S293 VanDerWaalsContact O-CB 3.32Å; V289-S293 WeakPolarHBondContact O-CB 3.28Å; V289-S293 PolarHBondContact O-N 3.35Å; G290-S293 WeakPolarHBondContact O-CB 3.49Å; G290-S293 PolarHBondContact O-N 3.33Å; F291-S293 VanDerWaalsContact C-N 3.3Å; F291-S293 PolarHBondContact O-N 3.45Å; S293-G296 PolarHBondContact O-N 2.94Å; S293-T297 PolarHBondContact O-N 3.41Å; S293-T297 PolarHBondContact O-OG1 2.75Å; S293-T297 VanDerWaalsContact O-OG1 3.08Å |
| 294 | C | 95.4 | Very high | 94.3 | Very high | 13 Ų | 13 | 50.9 Ų | 50.9 | 9% | 0.088 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -61.9 | -47.7 | 177.1 | -63.2 | 0 | 0 | 0 | 0 | 111 | G290 F291 G296 T297 L298 I362 | G290-C294 PolarHBondContact O-N 2.9Å; G290-C294 PolarHBondContact O-SG 2.94Å; F291-C294 PolarHBondContact O-N 3.18Å; C294-G296 VanDerWaalsContact C-N 3.34Å; C294-G296 PolarHBondContact O-N 2.58Å; C294-T297 PolarHBondContact O-N 2.76Å; C294-L298 WeakPolarHBondContact O-CG 3.16Å; C294-L298 PolarHBondContact O-N 3.36Å; C294-I362 HydrophobicContact CB-CD1 3.8Å |
| 295 | M | 96 | Very high | 94.6 | Very high | 72 Ų | 72 | 43.9 Ų | 43.9 | 36% | 0.355 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -58.2 | -45.1 | 176.1 | -168.4 | 66.7 | 63.9 | 0 | 0 | 111.6 | F291 L298 C299 Y317 | F291-M295 HydrophobicContact CE1-CE 4.16Å; F291-M295 HydrophobicContact CE2-CE 4.32Å; F291-M295 HydrophobicContact CZ-CE 3.7Å; F291-M295 WeakPolarHBondContact O-CB 3.23Å; F291-M295 PolarHBondContact O-N 3.22Å; M295-L298 PolarHBondContact O-N 2.89Å; M295-C299 PolarHBondContact O-N 2.83Å; M295-C299 PolarHBondContact O-SG 3.25Å; M295-C299 VanDerWaalsContact O-SG 3.34Å; M295-Y317 PolarHBondContact SD-OH 3.48Å |
| 296 | G | 96.5 | Very high | 94.8 | Very high | 27 Ų | 27 | 41.9 Ų | 41.9 | 28% | 0.278 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -61.4 | -44.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | F292 S293 C294 L298 C299 I300 | F292-G296 PolarHBondContact O-N 3.49Å; S293-G296 PolarHBondContact O-N 2.94Å; C294-G296 VanDerWaalsContact C-N 3.34Å; C294-G296 PolarHBondContact O-N 2.58Å; G296-L298 VanDerWaalsContact C-N 3.34Å; G296-L298 PolarHBondContact O-N 3.17Å; G296-C299 PolarHBondContact O-N 2.86Å; G296-I300 WeakPolarHBondContact O-CB 3.31Å; G296-I300 WeakPolarHBondContact O-CD1 3.4Å; G296-I300 VanDerWaalsContact O-CG1 3.22Å; G296-I300 WeakPolarHBondContact O-CG1 3.35Å; G296-I300 PolarHBondContact O-N 3.04Å |
| 297 | T | 96.4 | Very high | 94.8 | Very high | 22 Ų | 22 | 49.4 Ų | 49.4 | 14% | 0.135 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -61.1 | -40 | 176 | -63.3 | 0 | 0 | 0 | 0 | 112.3 | S293 C294 G301 L324 Y354 | S293-T297 PolarHBondContact O-N 3.41Å; S293-T297 PolarHBondContact O-OG1 2.75Å; S293-T297 VanDerWaalsContact O-OG1 3.08Å; C294-T297 PolarHBondContact O-N 2.76Å; T297-G301 PolarHBondContact O-N 3.1Å; T297-L324 HydrophobicContact CG2-CD1 3.79Å; T297-Y354 HydrophobicContact CG2-CE2 4.2Å; T297-Y354 WeakPolarHBondContact O-CE2 3.31Å; T297-Y354 PolarHBondContact O-OH 3.42Å |
| 298 | L | 97.3 | Very high | 94.6 | Very high | 13 Ų | 13 | 49.3 Ų | 49.3 | 7% | 0.068 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -66.4 | -46.2 | 175.1 | -67.3 | 171.6 | 0 | 0 | 0 | 111.6 | C294 M295 G296 I300 G301 A302 Y317 C320 F321 L324 | C294-L298 WeakPolarHBondContact O-CG 3.16Å; C294-L298 PolarHBondContact O-N 3.36Å; M295-L298 PolarHBondContact O-N 2.89Å; G296-L298 VanDerWaalsContact C-N 3.34Å; G296-L298 PolarHBondContact O-N 3.17Å; L298-I300 PolarHBondContact O-N 3.5Å; L298-G301 PolarHBondContact O-N 3.37Å; L298-A302 VanDerWaalsContact O-CB 3.31Å; L298-A302 WeakPolarHBondContact O-CB 3.43Å; L298-A302 PolarHBondContact O-N 3.21Å; L298-Y317 HydrophobicContact CB-CD2 4.17Å; L298-Y317 HydrophobicContact CB-CE2 3.53Å; L298-Y317 HydrophobicContact CD1-CE1 4.45Å; L298-Y317 WeakPolarHBondContact CD1-OH 3.46Å; L298-C320 HydrophobicContact CD2-CB 3.92Å; L298-F321 HydrophobicContact CD1-CD2 4.08Å; L298-F321 HydrophobicContact CD2-CB 4.23Å; L298-L324 HydrophobicContact CD2-CD1 4.16Å |
| 299 | C | 97.3 | Very high | 94.4 | Very high | 49 Ų | 49 | 46.3 Ų | 46.3 | 33% | 0.331 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.5 | -40.8 | 177.7 | -70.1 | 0 | 0 | 0 | 0 | 113.4 | M295 G296 A302 A303 | M295-C299 PolarHBondContact O-N 2.83Å; M295-C299 PolarHBondContact O-SG 3.25Å; M295-C299 VanDerWaalsContact O-SG 3.34Å; G296-C299 PolarHBondContact O-N 2.86Å; C299-A302 PolarHBondContact O-N 3.4Å; C299-A303 WeakPolarHBondContact O-CB 3.34Å; C299-A303 PolarHBondContact O-N 3.18Å |
| 300 | I | 96.5 | Very high | 94.2 | Very high | 115 Ų | 115 | 51.9 Ų | 51.9 | 59% | 0.59 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -65.4 | -42.6 | 176.9 | -69.7 | 164.4 | 0 | 0 | 0 | 110.4 | G296 L298 A304 | G296-I300 WeakPolarHBondContact O-CB 3.31Å; G296-I300 WeakPolarHBondContact O-CD1 3.4Å; G296-I300 VanDerWaalsContact O-CG1 3.22Å; G296-I300 WeakPolarHBondContact O-CG1 3.35Å; G296-I300 PolarHBondContact O-N 3.04Å; L298-I300 PolarHBondContact O-N 3.5Å; I300-A304 PolarHBondContact O-N 3.48Å; I300-A304 VanDerWaalsContact O-N 3.14Å |
| 301 | G | 95.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -60.6 | -52.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | T297 L298 A303 A304 F305 | T297-G301 PolarHBondContact O-N 3.1Å; L298-G301 PolarHBondContact O-N 3.37Å; G301-A303 VanDerWaalsContact C-N 3.29Å; G301-A303 PolarHBondContact O-N 3.46Å; G301-A304 PolarHBondContact O-N 3.18Å; G301-F305 WeakPolarHBondContact O-CD2 3.34Å; G301-F305 PolarHBondContact O-N 3.16Å |
| 302 | A | 96.7 | Very high | 94.3 | Very high | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -54 | -44.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L298 C299 S306 F313 A316 Y317 | L298-A302 VanDerWaalsContact O-CB 3.31Å; L298-A302 WeakPolarHBondContact O-CB 3.43Å; L298-A302 PolarHBondContact O-N 3.21Å; C299-A302 PolarHBondContact O-N 3.4Å; A302-S306 VanDerWaalsContact O-CB 3.25Å; A302-S306 WeakPolarHBondContact O-CB 3.24Å; A302-S306 PolarHBondContact O-N 3.45Å; A302-S306 PolarHBondContact O-OG 2.74Å; A302-F313 HydrophobicContact CB-CD2 3.94Å; A302-F313 HydrophobicContact CB-CE1 4.3Å; A302-F313 HydrophobicContact CB-CE2 3.5Å; A302-F313 HydrophobicContact CB-CZ 3.71Å; A302-A316 HydrophobicContact CB-CB 4.38Å; A302-A316 VanDerWaalsContact O-CB 3.29Å; A302-A316 WeakPolarHBondContact O-CB 3.38Å; A302-Y317 HydrophobicContact CB-CD2 3.99Å; A302-Y317 HydrophobicContact CB-CG 4.34Å |
| 303 | A | 96.1 | Very high | 94.4 | Very high | 39 Ų | 39 | 50 Ų | 50 | 32% | 0.322 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -66.6 | -34.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | C299 G301 S306 Q307 F313 | C299-A303 WeakPolarHBondContact O-CB 3.34Å; C299-A303 PolarHBondContact O-N 3.18Å; G301-A303 VanDerWaalsContact C-N 3.29Å; G301-A303 PolarHBondContact O-N 3.46Å; A303-S306 PolarHBondContact O-OG 3.33Å; A303-Q307 WeakPolarHBondContact O-CG 3.49Å; A303-F313 HydrophobicContact CB-CE2 4.29Å |
| 304 | A | 94.1 | Very high | 94.5 | Very high | 23 Ų | 23 | 54.4 Ų | 54.4 | 19% | 0.19 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -76.2 | -46.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | I300 G301 Q307 C308 F350 | I300-A304 PolarHBondContact O-N 3.48Å; I300-A304 VanDerWaalsContact O-N 3.14Å; G301-A304 PolarHBondContact O-N 3.18Å; A304-Q307 PolarHBondContact O-N 3.44Å; A304-C308 WeakPolarHBondContact O-CB 3.35Å; A304-C308 PolarHBondContact O-N 2.99Å; A304-C308 PolarHBondContact O-SG 3.33Å; A304-F350 HydrophobicContact CB-CE1 3.8Å; A304-F350 HydrophobicContact CB-CZ 3.55Å |
| 305 | F | 93.8 | Very high | 94.5 | Very high | 0 Ų | 0 | 57.1 Ų | 57.1 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -71.2 | -34.9 | -178 | -72.2 | -70 | 0 | 0 | 0 | 112.9 | G301 Q307 C308 E309 A316 Y319 A334 Y347 F350 Y354 | G301-F305 WeakPolarHBondContact O-CD2 3.34Å; G301-F305 PolarHBondContact O-N 3.16Å; F305-Q307 VanDerWaalsContact C-N 3.28Å; F305-Q307 PolarHBondContact O-N 3.09Å; F305-C308 PolarHBondContact O-N 3.43Å; F305-E309 PolarHBondContact O-N 3.24Å; F305-A316 HydrophobicContact CB-CB 4.14Å; F305-Y319 HydrophobicContact CB-CD1 4.47Å; F305-Y319 AromaticContact CD1-CE1 3.94Å; F305-Y319 HydrophobicContact CD1-CE1 3.94Å; F305-Y319 HydrophobicContact CD2-CD1 4.12Å; F305-Y319 AromaticContact CD2-CE1 3.82Å; F305-Y319 HydrophobicContact CD2-CE1 3.82Å; F305-Y319 HydrophobicContact CE1-CE1 4.03Å; F305-Y319 AromaticContact CE2-CE1 3.91Å; F305-Y319 HydrophobicContact CE2-CE1 3.91Å; F305-Y319 HydrophobicContact CG-CD1 4.13Å; F305-Y319 AromaticContact CG-CE1 3.87Å; F305-Y319 HydrophobicContact CG-CE1 3.87Å; F305-Y319 HydrophobicContact CZ-CE1 4.02Å; F305-A334 HydrophobicContact CD1-CB 3.83Å; F305-A334 HydrophobicContact CE1-CB 3.6Å; F305-Y347 HydrophobicContact CD1-CE2 4.45Å; F305-Y347 VanDerWaalsContact CD1-OH 3.26Å; F305-Y347 WeakPolarHBondContact CD1-OH 3.36Å; F305-Y347 HydrophobicContact CE1-CE2 4.21Å; F305-Y347 WeakPolarHBondContact CE1-OH 3.47Å; F305-F350 HydrophobicContact CZ-CE1 4.33Å; F305-Y354 AromaticContact CE2-CD1 3.61Å; F305-Y354 HydrophobicContact CE2-CD1 3.61Å; F305-Y354 AromaticContact CE2-CE1 3.89Å; F305-Y354 HydrophobicContact CE2-CE1 3.89Å; F305-Y354 AromaticContact CE2-CG 4Å; F305-Y354 HydrophobicContact CE2-CG 4Å; F305-Y354 HydrophobicContact CZ-CD1 4.11Å; F305-Y354 HydrophobicContact CZ-CG 4.42Å |
| 306 | S | 94.7 | Very high | 94.5 | Very high | 23 Ų | 23 | 53.7 Ų | 53.7 | 16% | 0.161 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.3 | -37.9 | 173.9 | 64 | 0 | 0 | 0 | 0 | 112.6 | A302 A303 E310 W311 | A302-S306 VanDerWaalsContact O-CB 3.25Å; A302-S306 WeakPolarHBondContact O-CB 3.24Å; A302-S306 PolarHBondContact O-N 3.45Å; A302-S306 PolarHBondContact O-OG 2.74Å; A303-S306 PolarHBondContact O-OG 3.33Å; S306-E310 WeakPolarHBondContact O-CA 3.24Å; S306-E310 PolarHBondContact O-N 3.5Å; S306-W311 WeakPolarHBondContact CA-O 3.42Å; S306-W311 WeakPolarHBondContact CB-O 3.38Å; S306-W311 PolarHBondContact O-N 3.22Å |
| 307 | Q | 90.1 | Very high | 94.6 | Very high | 161 Ų | 161 | 55 Ų | 55 | 75% | 0.752 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -76.7 | -31.6 | 176.4 | -66.2 | -179.7 | 23.7 | 0 | 0 | 113.3 | A303 A304 F305 | A303-Q307 WeakPolarHBondContact O-CG 3.49Å; A304-Q307 PolarHBondContact O-N 3.44Å; F305-Q307 VanDerWaalsContact C-N 3.28Å; F305-Q307 PolarHBondContact O-N 3.09Å |
| 308 | C | 87.8 | Confident | 94.7 | Very high | 50 Ų | 50 | 57.1 Ų | 57.1 | 34% | 0.338 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -84.7 | -35.1 | -175.5 | -66.4 | 0 | 0 | 0 | 0 | 114.2 | A304 F305 Y347 | A304-C308 WeakPolarHBondContact O-CB 3.35Å; A304-C308 PolarHBondContact O-N 2.99Å; A304-C308 PolarHBondContact O-SG 3.33Å; F305-C308 PolarHBondContact O-N 3.43Å; C308-Y347 HydrophobicContact CB-CD2 4.18Å; C308-Y347 HydrophobicContact CB-CE1 4.21Å; C308-Y347 HydrophobicContact CB-CE2 3.48Å; C308-Y347 VanDerWaalsContact CB-CE2 3.48Å; C308-Y347 VanDerWaalsContact SG-CE2 3.57Å |
| 309 | E | 88.2 | Confident | 94.6 | Very high | 8 Ų | 8 | 56.7 Ų | 56.7 | 4% | 0.037 | 29% | 0.286 | C | S | . | . | S | Bend | trans | -112.1 | 8.5 | -174.9 | -62 | -71.4 | 178.7 | 0 | 0 | 112.9 | F305 W311 L335 T337 Y347 | F305-E309 PolarHBondContact O-N 3.24Å; E309-W311 HydrophobicContact CB-CD2 3.7Å; E309-W311 HydrophobicContact CB-CE3 4.12Å; E309-W311 HydrophobicContact CB-CG 4.11Å; E309-W311 HydrophobicContact CB-CH2 4.24Å; E309-W311 HydrophobicContact CB-CZ2 3.82Å; E309-W311 HydrophobicContact CB-CZ3 4.37Å; E309-W311 HydrophobicContact CG-CH2 4.15Å; E309-W311 HydrophobicContact CG-CZ2 4.06Å; E309-W311 HydrophobicContact CG-CZ3 4.43Å; E309-W311 PolarHBondContact O-N 2.83Å; E309-W311 PolarHBondContact O-NE1 2.88Å; E309-L335 PolarHBondContact OE1-N 3.06Å; E309-T337 WeakPolarHBondContact OE2-CB 3.35Å; E309-T337 PolarHBondContact OE2-OG1 2.82Å; E309-Y347 WeakPolarHBondContact CG-OH 3.18Å; E309-Y347 WeakPolarHBondContact OE1-CE1 3.38Å; E309-Y347 PolarHBondContact OE1-OH 3.02Å |
| 310 | E | 89.3 | Confident | 94.7 | Very high | 164 Ų | 164 | 54.3 Ų | 54.3 | 77% | 0.766 | 27% | 0.271 | S | S | * | . | trans | 61.2 | 23.5 | 178 | -52 | -177.3 | 106.9 | 0 | 0 | 114 | S306 | S306-E310 WeakPolarHBondContact O-CA 3.24Å; S306-E310 PolarHBondContact O-N 3.5Å | ||
| 311 | W | 93.3 | Very high | 94.7 | Very high | 51 Ų | 51 | 53.3 Ų | 53.3 | 19% | 0.193 | 26% | 0.262 | C | S | . | . | trans | -85 | 156.9 | 179.1 | -60.4 | -19 | 0 | 0 | 0 | 113.1 | S306 E309 H315 A316 Y319 Y332 | S306-W311 WeakPolarHBondContact CA-O 3.42Å; S306-W311 WeakPolarHBondContact CB-O 3.38Å; S306-W311 PolarHBondContact O-N 3.22Å; E309-W311 HydrophobicContact CB-CD2 3.7Å; E309-W311 HydrophobicContact CB-CE3 4.12Å; E309-W311 HydrophobicContact CB-CG 4.11Å; E309-W311 HydrophobicContact CB-CH2 4.24Å; E309-W311 HydrophobicContact CB-CZ2 3.82Å; E309-W311 HydrophobicContact CB-CZ3 4.37Å; E309-W311 HydrophobicContact CG-CH2 4.15Å; E309-W311 HydrophobicContact CG-CZ2 4.06Å; E309-W311 HydrophobicContact CG-CZ3 4.43Å; E309-W311 PolarHBondContact O-N 2.83Å; E309-W311 PolarHBondContact O-NE1 2.88Å; W311-H315 HydrophobicContact CB-CB 4.37Å; W311-A316 HydrophobicContact CE3-CB 4.44Å; W311-Y319 HydrophobicContact CH2-CG 4.45Å; W311-Y319 AromaticContact CZ3-CD1 3.84Å; W311-Y319 HydrophobicContact CZ3-CD1 3.84Å; W311-Y319 HydrophobicContact CZ3-CD2 4.27Å; W311-Y319 HydrophobicContact CZ3-CE1 4.39Å; W311-Y319 AromaticContact CZ3-CG 3.77Å; W311-Y319 HydrophobicContact CZ3-CG 3.77Å; W311-Y332 AromaticContact CD2-CD1 3.87Å; W311-Y332 HydrophobicContact CD2-CD1 3.87Å; W311-Y332 HydrophobicContact CD2-CE1 4.38Å; W311-Y332 AromaticContact CE2-CD1 3.78Å; W311-Y332 HydrophobicContact CE3-CD1 4.14Å; W311-Y332 HydrophobicContact CG-CD1 4.4Å; W311-Y332 HydrophobicContact CG-CE1 4.45Å; W311-Y332 HydrophobicContact CH2-CD1 4.26Å; W311-Y332 HydrophobicContact CZ2-CD1 4Å; W311-Y332 HydrophobicContact CZ3-CD1 4.32Å | ||
| 312 | S | 95.8 | Very high | 94.8 | Very high | 57 Ų | 57 | 53.8 Ų | 53.8 | 40% | 0.399 | 27% | 0.265 | S | S | . | . | trans | -62.7 | 150.8 | 167.4 | 88.8 | 0 | 0 | 0 | 0 | 110.5 | F314 H315 A316 | S312-F314 PolarHBondContact O-N 3.11Å; S312-F314 PolarHBondContact OG-N 2.94Å; S312-H315 PolarHBondContact O-N 3.25Å; S312-H315 VanDerWaalsContact O-N 3.16Å; S312-H315 PolarHBondContact OG-CD2 3.28Å; S312-H315 PolarHBondContact OG-N 3.41Å; S312-A316 WeakPolarHBondContact O-CB 3.12Å; S312-A316 PolarHBondContact O-N 2.87Å | ||
| 313 | F | 96.3 | Very high | 94.8 | Very high | 109 Ų | 109 | 53.8 Ų | 53.8 | 48% | 0.478 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -56.3 | -34.2 | 176.9 | -178.1 | -91.1 | 0 | 0 | 0 | 112.1 | A302 A303 Y317 | A302-F313 HydrophobicContact CB-CD2 3.94Å; A302-F313 HydrophobicContact CB-CE1 4.3Å; A302-F313 HydrophobicContact CB-CE2 3.5Å; A302-F313 HydrophobicContact CB-CZ 3.71Å; A303-F313 HydrophobicContact CB-CE2 4.29Å; F313-Y317 HydrophobicContact CE1-CD2 4.31Å; F313-Y317 HydrophobicContact CZ-CD2 4.46Å; F313-Y317 VanDerWaalsContact O-CB 3.24Å; F313-Y317 WeakPolarHBondContact O-CB 3.34Å; F313-Y317 PolarHBondContact O-N 2.78Å |
| 314 | F | 97 | Very high | 94.8 | Very high | 147 Ų | 147 | 52.1 Ų | 52.1 | 65% | 0.645 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -66.5 | -47.6 | 176.8 | -179.3 | -100.6 | 0 | 0 | 0 | 112.2 | S312 A316 Y317 Y318 | S312-F314 PolarHBondContact O-N 3.11Å; S312-F314 PolarHBondContact OG-N 2.94Å; F314-A316 VanDerWaalsContact C-N 3.35Å; F314-A316 PolarHBondContact O-N 3.39Å; F314-Y317 PolarHBondContact O-N 3.21Å; F314-Y318 WeakPolarHBondContact O-CB 3.41Å; F314-Y318 PolarHBondContact O-N 3.17Å |
| 315 | H | 95.8 | Very high | 94.8 | Very high | 69 Ų | 69 | 53.2 Ų | 53.2 | 32% | 0.319 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -64.3 | -40 | 176.4 | -63.8 | -54.9 | 0 | 0 | 0 | 111.7 | W311 S312 Y317 Y318 Y319 Y332 | W311-H315 HydrophobicContact CB-CB 4.37Å; S312-H315 PolarHBondContact O-N 3.25Å; S312-H315 VanDerWaalsContact O-N 3.16Å; S312-H315 PolarHBondContact OG-CD2 3.28Å; S312-H315 PolarHBondContact OG-N 3.41Å; H315-Y317 VanDerWaalsContact C-N 3.34Å; H315-Y317 PolarHBondContact O-N 2.83Å; H315-Y318 PolarHBondContact O-N 2.91Å; H315-Y319 WeakPolarHBondContact O-CB 3.5Å; H315-Y319 PolarHBondContact O-N 3.06Å; H315-Y332 HydrophobicContact CB-CD1 4.38Å; H315-Y332 HydrophobicContact CB-CE1 3.8Å; H315-Y332 HydrophobicContact CB-CE2 4.48Å; H315-Y332 PolarHBondContact CE1-OH 3.03Å; H315-Y332 AromaticContact CG-CZ 3.73Å; H315-Y332 AromaticContact ND1-CZ 3.64Å; H315-Y332 PolarHBondContact ND1-OH 3.44Å; H315-Y332 VanDerWaalsContact ND1-OH 3.13Å |
| 316 | A | 96.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -64.9 | -36.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A302 F305 W311 S312 F314 C320 | A302-A316 HydrophobicContact CB-CB 4.38Å; A302-A316 VanDerWaalsContact O-CB 3.29Å; A302-A316 WeakPolarHBondContact O-CB 3.38Å; F305-A316 HydrophobicContact CB-CB 4.14Å; W311-A316 HydrophobicContact CE3-CB 4.44Å; S312-A316 WeakPolarHBondContact O-CB 3.12Å; S312-A316 PolarHBondContact O-N 2.87Å; F314-A316 VanDerWaalsContact C-N 3.35Å; F314-A316 PolarHBondContact O-N 3.39Å; A316-C320 PolarHBondContact O-N 2.78Å; A316-C320 PolarHBondContact O-SG 3.41Å |
| 317 | Y | 97.5 | Very high | 95 | Very high | 55 Ų | 55 | 58.6 Ų | 58.6 | 22% | 0.216 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -68.8 | -45.1 | 174.4 | -172.5 | -81.1 | 0 | 0 | 0 | 112 | M295 L298 A302 F313 F314 H315 C320 F321 | M295-Y317 PolarHBondContact SD-OH 3.48Å; L298-Y317 HydrophobicContact CB-CD2 4.17Å; L298-Y317 HydrophobicContact CB-CE2 3.53Å; L298-Y317 HydrophobicContact CD1-CE1 4.45Å; L298-Y317 WeakPolarHBondContact CD1-OH 3.46Å; A302-Y317 HydrophobicContact CB-CD2 3.99Å; A302-Y317 HydrophobicContact CB-CG 4.34Å; F313-Y317 HydrophobicContact CE1-CD2 4.31Å; F313-Y317 HydrophobicContact CZ-CD2 4.46Å; F313-Y317 VanDerWaalsContact O-CB 3.24Å; F313-Y317 WeakPolarHBondContact O-CB 3.34Å; F313-Y317 PolarHBondContact O-N 2.78Å; F314-Y317 PolarHBondContact O-N 3.21Å; H315-Y317 VanDerWaalsContact C-N 3.34Å; H315-Y317 PolarHBondContact O-N 2.83Å; Y317-C320 PolarHBondContact O-N 3.02Å; Y317-F321 WeakPolarHBondContact O-CB 3.19Å; Y317-F321 PolarHBondContact O-N 3.37Å |
| 318 | Y | 97.8 | Very high | 95.3 | Very high | 67 Ų | 67 | 51.1 Ų | 51.1 | 26% | 0.263 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -58.2 | -47.9 | 173.6 | 165.2 | -92.8 | 0 | 0 | 0 | 111.3 | F314 H315 C320 F321 I322 F329 D331 Y332 | F314-Y318 WeakPolarHBondContact O-CB 3.41Å; F314-Y318 PolarHBondContact O-N 3.17Å; H315-Y318 PolarHBondContact O-N 2.91Å; Y318-C320 PolarHBondContact O-N 2.93Å; Y318-F321 WeakPolarHBondContact O-CB 3.2Å; Y318-F321 PolarHBondContact O-N 2.95Å; Y318-F321 VanDerWaalsContact O-N 3.14Å; Y318-I322 HydrophobicContact CD1-CG1 4.47Å; Y318-I322 HydrophobicContact CD2-CG1 3.99Å; Y318-I322 HydrophobicContact CE1-CG1 4.14Å; Y318-I322 HydrophobicContact CE2-CD1 4.07Å; Y318-I322 HydrophobicContact CE2-CG1 3.63Å; Y318-I322 HydrophobicContact CG-CG1 4.41Å; Y318-I322 WeakPolarHBondContact O-CB 3.35Å; Y318-I322 WeakPolarHBondContact O-CG1 3.41Å; Y318-I322 PolarHBondContact O-N 3.01Å; Y318-F329 WeakPolarHBondContact OH-CD2 3.27Å; Y318-D331 WeakPolarHBondContact CE1-OD2 3.46Å; Y318-D331 VanDerWaalsContact CZ-OD2 3.28Å; Y318-D331 PolarHBondContact OH-OD2 2.9Å; Y318-Y332 HydrophobicContact CD1-CD2 4.05Å; Y318-Y332 HydrophobicContact CD1-CE2 4.46Å; Y318-Y332 AromaticContact CE1-CD2 3.92Å; Y318-Y332 HydrophobicContact CE1-CD2 3.92Å; Y318-Y332 HydrophobicContact CE1-CE2 4.4Å |
| 319 | Y | 97.1 | Very high | 95.6 | Very high | 3 Ų | 3 | 55.1 Ų | 55.1 | 1% | 0.012 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -53.1 | -52 | 172.2 | 164.3 | -106.9 | 0 | 0 | 0 | 111.4 | Y223 F305 W311 H315 F321 I322 T323 Y332 A334 | Y223-Y319 HydrophobicContact CE1-CE2 4.16Å; Y223-Y319 AromaticContact CZ-CE2 3.99Å; Y223-Y319 WeakPolarHBondContact OH-CE2 3.28Å; Y223-Y319 PolarHBondContact OH-OH 3.27Å; F305-Y319 HydrophobicContact CB-CD1 4.47Å; F305-Y319 AromaticContact CD1-CE1 3.94Å; F305-Y319 HydrophobicContact CD1-CE1 3.94Å; F305-Y319 HydrophobicContact CD2-CD1 4.12Å; F305-Y319 AromaticContact CD2-CE1 3.82Å; F305-Y319 HydrophobicContact CD2-CE1 3.82Å; F305-Y319 HydrophobicContact CE1-CE1 4.03Å; F305-Y319 AromaticContact CE2-CE1 3.91Å; F305-Y319 HydrophobicContact CE2-CE1 3.91Å; F305-Y319 HydrophobicContact CG-CD1 4.13Å; F305-Y319 AromaticContact CG-CE1 3.87Å; F305-Y319 HydrophobicContact CG-CE1 3.87Å; F305-Y319 HydrophobicContact CZ-CE1 4.02Å; W311-Y319 HydrophobicContact CH2-CG 4.45Å; W311-Y319 AromaticContact CZ3-CD1 3.84Å; W311-Y319 HydrophobicContact CZ3-CD1 3.84Å; W311-Y319 HydrophobicContact CZ3-CD2 4.27Å; W311-Y319 HydrophobicContact CZ3-CE1 4.39Å; W311-Y319 AromaticContact CZ3-CG 3.77Å; W311-Y319 HydrophobicContact CZ3-CG 3.77Å; H315-Y319 WeakPolarHBondContact O-CB 3.5Å; H315-Y319 PolarHBondContact O-N 3.06Å; Y319-F321 VanDerWaalsContact C-N 3.29Å; Y319-F321 PolarHBondContact O-N 3.23Å; Y319-I322 PolarHBondContact O-N 3.28Å; Y319-T323 VanDerWaalsContact CE2-OG1 3.31Å; Y319-T323 WeakPolarHBondContact CE2-OG1 3.42Å; Y319-T323 WeakPolarHBondContact O-CB 3.29Å; Y319-T323 PolarHBondContact O-N 2.94Å; Y319-T323 PolarHBondContact O-OG1 3.35Å; Y319-Y332 WeakPolarHBondContact CD2-O 3.41Å; Y319-Y332 WeakPolarHBondContact CE2-O 3.42Å; Y319-A334 HydrophobicContact CE1-CB 4.17Å; Y319-A334 WeakPolarHBondContact OH-CB 3.25Å |
| 320 | C | 97.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.1 | -39 | 178.9 | -67.3 | 0 | 0 | 0 | 0 | 112.4 | L298 A316 Y317 Y318 L324 Y354 | L298-C320 HydrophobicContact CD2-CB 3.92Å; A316-C320 PolarHBondContact O-N 2.78Å; A316-C320 PolarHBondContact O-SG 3.41Å; Y317-C320 PolarHBondContact O-N 3.02Å; Y318-C320 PolarHBondContact O-N 2.93Å; C320-L324 WeakPolarHBondContact O-CB 3.22Å; C320-L324 VanDerWaalsContact O-CG 3.28Å; C320-L324 WeakPolarHBondContact O-CG 3.4Å; C320-L324 PolarHBondContact O-N 2.84Å; C320-Y354 HydrophobicContact CB-CE1 4.47Å |
| 321 | F | 97.6 | Very high | 95.9 | Very high | 93 Ų | 93 | 52.1 Ų | 52.1 | 41% | 0.408 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -64.2 | -57.9 | 177.1 | -178.6 | -96.5 | 0 | 0 | 0 | 111.2 | L298 Y317 Y318 Y319 T323 L324 T325 | L298-F321 HydrophobicContact CD1-CD2 4.08Å; L298-F321 HydrophobicContact CD2-CB 4.23Å; Y317-F321 WeakPolarHBondContact O-CB 3.19Å; Y317-F321 PolarHBondContact O-N 3.37Å; Y318-F321 WeakPolarHBondContact O-CB 3.2Å; Y318-F321 PolarHBondContact O-N 2.95Å; Y318-F321 VanDerWaalsContact O-N 3.14Å; Y319-F321 VanDerWaalsContact C-N 3.29Å; Y319-F321 PolarHBondContact O-N 3.23Å; F321-T323 PolarHBondContact O-N 3.31Å; F321-L324 PolarHBondContact O-N 3.07Å; F321-L324 VanDerWaalsContact O-N 3.16Å; F321-T325 HydrophobicContact CD1-CG2 4.46Å; F321-T325 HydrophobicContact CD2-CG2 4.22Å; F321-T325 HydrophobicContact CE1-CG2 4.18Å; F321-T325 HydrophobicContact CE2-CG2 3.93Å; F321-T325 HydrophobicContact CG-CG2 4.48Å; F321-T325 HydrophobicContact CZ-CG2 3.91Å; F321-T325 WeakPolarHBondContact O-CG2 3.18Å; F321-T325 PolarHBondContact O-N 3.3Å; F321-T325 PolarHBondContact O-OG1 3.47Å |
| 322 | I | 97.3 | Very high | 95.9 | Very high | 11 Ų | 11 | 52.6 Ų | 52.6 | 6% | 0.056 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -57.9 | -34.1 | 179.4 | -66.4 | -56.7 | 0 | 0 | 0 | 112.3 | Y318 Y319 I327 G328 F329 | Y318-I322 HydrophobicContact CD1-CG1 4.47Å; Y318-I322 HydrophobicContact CD2-CG1 3.99Å; Y318-I322 HydrophobicContact CE1-CG1 4.14Å; Y318-I322 HydrophobicContact CE2-CD1 4.07Å; Y318-I322 HydrophobicContact CE2-CG1 3.63Å; Y318-I322 HydrophobicContact CG-CG1 4.41Å; Y318-I322 WeakPolarHBondContact O-CB 3.35Å; Y318-I322 WeakPolarHBondContact O-CG1 3.41Å; Y318-I322 PolarHBondContact O-N 3.01Å; Y319-I322 PolarHBondContact O-N 3.28Å; I322-I327 HydrophobicContact CD1-CB 4.33Å; I322-I327 HydrophobicContact CD1-CD1 4.01Å; I322-I327 HydrophobicContact CD1-CG2 4.25Å; I322-I327 HydrophobicContact CG2-CB 4.12Å; I322-I327 HydrophobicContact CG2-CG2 4.24Å; I322-I327 PolarHBondContact O-N 3.1Å; I322-G328 PolarHBondContact O-N 3.44Å; I322-F329 HydrophobicContact CD1-CD2 3.88Å; I322-F329 HydrophobicContact CD1-CE2 3.59Å; I322-F329 HydrophobicContact CG1-CD2 4.13Å; I322-F329 HydrophobicContact CG1-CE2 4.32Å; I322-F329 HydrophobicContact CG2-CB 4.41Å; I322-F329 HydrophobicContact CG2-CD2 3.83Å; I322-F329 HydrophobicContact CG2-CG 4.31Å |
| 323 | T | 96.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.5 | -56.5 | 173.4 | -60.4 | 0 | 0 | 0 | 0 | 111.9 | I221 Y223 Y319 F321 T325 T326 I355 | I221-T323 HydrophobicContact CD1-CG2 4.18Å; Y223-T323 WeakPolarHBondContact OH-CG2 3.44Å; Y223-T323 PolarHBondContact OH-OG1 3.05Å; Y319-T323 VanDerWaalsContact CE2-OG1 3.31Å; Y319-T323 WeakPolarHBondContact CE2-OG1 3.42Å; Y319-T323 WeakPolarHBondContact O-CB 3.29Å; Y319-T323 PolarHBondContact O-N 2.94Å; Y319-T323 PolarHBondContact O-OG1 3.35Å; F321-T323 PolarHBondContact O-N 3.31Å; T323-T325 VanDerWaalsContact C-N 3.34Å; T323-T325 PolarHBondContact O-N 2.82Å; T323-T326 PolarHBondContact O-N 2.73Å; T323-T326 VanDerWaalsContact O-N 3.09Å; T323-I355 HydrophobicContact CG2-CD1 4.46Å; T323-I355 HydrophobicContact CG2-CG1 3.97Å |
| 324 | L | 96.1 | Very high | 95.4 | Very high | 3 Ų | 3 | 45.3 Ų | 45.3 | 2% | 0.016 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -80.2 | -14.8 | -171.1 | -61.9 | -174.1 | 0 | 0 | 0 | 113.4 | T297 L298 C320 F321 T326 Y354 L359 I362 | T297-L324 HydrophobicContact CG2-CD1 3.79Å; L298-L324 HydrophobicContact CD2-CD1 4.16Å; C320-L324 WeakPolarHBondContact O-CB 3.22Å; C320-L324 VanDerWaalsContact O-CG 3.28Å; C320-L324 WeakPolarHBondContact O-CG 3.4Å; C320-L324 PolarHBondContact O-N 2.84Å; F321-L324 PolarHBondContact O-N 3.07Å; F321-L324 VanDerWaalsContact O-N 3.16Å; L324-T326 VanDerWaalsContact C-N 3.28Å; L324-Y354 HydrophobicContact CD1-CE1 4.09Å; L324-Y354 HydrophobicContact CD2-CE1 4.29Å; L324-Y354 HydrophobicContact CG-CE1 4.3Å; L324-L359 HydrophobicContact CD2-CD2 4.47Å; L324-L359 HydrophobicContact CD2-CG 4.21Å; L324-I362 HydrophobicContact CB-CG1 3.85Å; L324-I362 HydrophobicContact CD1-CG1 4.48Å |
| 325 | T | 95.4 | Very high | 94.7 | Very high | 47 Ų | 47 | 38.4 Ų | 38.4 | 29% | 0.288 | 19% | 0.19 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -87.1 | 5.6 | 165.8 | 60.4 | 0 | 0 | 0 | 0 | 113.2 | F321 T323 I327 | F321-T325 HydrophobicContact CD1-CG2 4.46Å; F321-T325 HydrophobicContact CD2-CG2 4.22Å; F321-T325 HydrophobicContact CE1-CG2 4.18Å; F321-T325 HydrophobicContact CE2-CG2 3.93Å; F321-T325 HydrophobicContact CG-CG2 4.48Å; F321-T325 HydrophobicContact CZ-CG2 3.91Å; F321-T325 WeakPolarHBondContact O-CG2 3.18Å; F321-T325 PolarHBondContact O-N 3.3Å; F321-T325 PolarHBondContact O-OG1 3.47Å; T323-T325 VanDerWaalsContact C-N 3.34Å; T323-T325 PolarHBondContact O-N 2.82Å; T325-I327 PolarHBondContact O-N 3.15Å; T325-I327 VanDerWaalsContact OG1-CD1 3.32Å; T325-I327 WeakPolarHBondContact OG1-CD1 3.5Å; T325-I327 WeakPolarHBondContact OG1-CG1 3.46Å |
| 326 | T | 96 | Very high | 94 | Very high | 53 Ų | 53 | 36.6 Ų | 36.6 | 33% | 0.325 | 18% | 0.182 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 50.8 | 38.8 | -178.3 | 70 | 0 | 0 | 0 | 0 | 113.5 | T219 I221 T323 L324 L359 | T219-T326 WeakPolarHBondContact O-CG2 3.26Å; I221-T326 HydrophobicContact CG1-CG2 4.07Å; T323-T326 PolarHBondContact O-N 2.73Å; T323-T326 VanDerWaalsContact O-N 3.09Å; L324-T326 VanDerWaalsContact C-N 3.28Å; T326-L359 HydrophobicContact CG2-CD2 3.51Å |
| 327 | I | 96.9 | Very high | 92.9 | Very high | 82 Ų | 82 | 39.2 Ų | 39.2 | 42% | 0.421 | 20% | 0.198 | S | C | . | . | trans | -89.1 | -46.5 | 172.5 | -65.5 | 171.6 | 0 | 0 | 0 | 109.3 | I322 T325 F329 | I322-I327 HydrophobicContact CD1-CB 4.33Å; I322-I327 HydrophobicContact CD1-CD1 4.01Å; I322-I327 HydrophobicContact CD1-CG2 4.25Å; I322-I327 HydrophobicContact CG2-CB 4.12Å; I322-I327 HydrophobicContact CG2-CG2 4.24Å; I322-I327 PolarHBondContact O-N 3.1Å; T325-I327 PolarHBondContact O-N 3.15Å; T325-I327 VanDerWaalsContact OG1-CD1 3.32Å; T325-I327 WeakPolarHBondContact OG1-CD1 3.5Å; T325-I327 WeakPolarHBondContact OG1-CG1 3.46Å; I327-F329 HydrophobicContact CG2-CD1 3.87Å; I327-F329 HydrophobicContact CG2-CD2 4.02Å; I327-F329 HydrophobicContact CG2-CE1 3.55Å; I327-F329 HydrophobicContact CG2-CE2 3.72Å; I327-F329 HydrophobicContact CG2-CG 4.1Å; I327-F329 HydrophobicContact CG2-CZ 3.48Å; I327-F329 VanDerWaalsContact CG2-CZ 3.48Å; I327-F329 PolarHBondContact O-N 2.89Å | ||
| 328 | G | 95.9 | Very high | 91.3 | Very high | 5 Ų | 5 | 44.4 Ų | 44.4 | 5% | 0.052 | 22% | 0.221 | C | C | . | . | trans | 50.3 | 55.9 | 170.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | I221 Y223 I322 G330 | I221-G328 WeakPolarHBondContact O-CA 3.46Å; Y223-G328 VanDerWaalsContact CA-O 3.3Å; Y223-G328 WeakPolarHBondContact CA-O 3.46Å; I322-G328 PolarHBondContact O-N 3.44Å; G328-G330 PolarHBondContact O-N 2.79Å | ||
| 329 | F | 93.9 | Very high | 89.7 | Confident | 133 Ų | 133 | 42 Ų | 42 | 58% | 0.583 | 22% | 0.217 | S | C | * | . | trans | -56 | -33.1 | 179.2 | -66.4 | -54.2 | 0 | 0 | 0 | 114.5 | Y318 I322 I327 | Y318-F329 WeakPolarHBondContact OH-CD2 3.27Å; I322-F329 HydrophobicContact CD1-CD2 3.88Å; I322-F329 HydrophobicContact CD1-CE2 3.59Å; I322-F329 HydrophobicContact CG1-CD2 4.13Å; I322-F329 HydrophobicContact CG1-CE2 4.32Å; I322-F329 HydrophobicContact CG2-CB 4.41Å; I322-F329 HydrophobicContact CG2-CD2 3.83Å; I322-F329 HydrophobicContact CG2-CG 4.31Å; I327-F329 HydrophobicContact CG2-CD1 3.87Å; I327-F329 HydrophobicContact CG2-CD2 4.02Å; I327-F329 HydrophobicContact CG2-CE1 3.55Å; I327-F329 HydrophobicContact CG2-CE2 3.72Å; I327-F329 HydrophobicContact CG2-CG 4.1Å; I327-F329 HydrophobicContact CG2-CZ 3.48Å; I327-F329 VanDerWaalsContact CG2-CZ 3.48Å; I327-F329 PolarHBondContact O-N 2.89Å | ||
| 330 | G | 91.9 | Very high | 88.6 | Confident | 24 Ų | 24 | 42.3 Ų | 42.3 | 25% | 0.247 | 22% | 0.22 | C | C | . | . | S | Bend | trans | 87.9 | 2.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | Y223 G328 V333 | Y223-G330 VanDerWaalsContact O-CA 3.27Å; Y223-G330 WeakPolarHBondContact O-CA 3.35Å; G328-G330 PolarHBondContact O-N 2.79Å; G330-V333 WeakPolarHBondContact O-CG2 3.5Å |
| 331 | D | 92 | Very high | 87.5 | Confident | 85 Ų | 85 | 42.9 Ų | 42.9 | 46% | 0.455 | 22% | 0.223 | S | C | . | . | S | Bend | trans | -61.9 | -41.3 | 168.8 | 54.3 | -9.9 | 0 | 0 | 0 | 112.4 | Y318 | Y318-D331 WeakPolarHBondContact CE1-OD2 3.46Å; Y318-D331 VanDerWaalsContact CZ-OD2 3.28Å; Y318-D331 PolarHBondContact OH-OD2 2.9Å |
| 332 | Y | 92.9 | Very high | 86.3 | Confident | 62 Ų | 62 | 43.3 Ų | 43.3 | 24% | 0.243 | 23% | 0.227 | C | C | . | . | S | Bend | trans | -117.2 | 124.6 | 168.5 | -69.9 | -90.5 | 0 | 0 | 0 | 110 | W311 H315 Y318 Y319 | W311-Y332 AromaticContact CD2-CD1 3.87Å; W311-Y332 HydrophobicContact CD2-CD1 3.87Å; W311-Y332 HydrophobicContact CD2-CE1 4.38Å; W311-Y332 AromaticContact CE2-CD1 3.78Å; W311-Y332 HydrophobicContact CE3-CD1 4.14Å; W311-Y332 HydrophobicContact CG-CD1 4.4Å; W311-Y332 HydrophobicContact CG-CE1 4.45Å; W311-Y332 HydrophobicContact CH2-CD1 4.26Å; W311-Y332 HydrophobicContact CZ2-CD1 4Å; W311-Y332 HydrophobicContact CZ3-CD1 4.32Å; H315-Y332 HydrophobicContact CB-CD1 4.38Å; H315-Y332 HydrophobicContact CB-CE1 3.8Å; H315-Y332 HydrophobicContact CB-CE2 4.48Å; H315-Y332 PolarHBondContact CE1-OH 3.03Å; H315-Y332 AromaticContact CG-CZ 3.73Å; H315-Y332 AromaticContact ND1-CZ 3.64Å; H315-Y332 PolarHBondContact ND1-OH 3.44Å; H315-Y332 VanDerWaalsContact ND1-OH 3.13Å; Y318-Y332 HydrophobicContact CD1-CD2 4.05Å; Y318-Y332 HydrophobicContact CD1-CE2 4.46Å; Y318-Y332 AromaticContact CE1-CD2 3.92Å; Y318-Y332 HydrophobicContact CE1-CD2 3.92Å; Y318-Y332 HydrophobicContact CE1-CE2 4.4Å; Y319-Y332 WeakPolarHBondContact CD2-O 3.41Å; Y319-Y332 WeakPolarHBondContact CE2-O 3.42Å |
| 333 | V | 91.4 | Very high | 85.4 | Confident | 12 Ų | 12 | 50.3 Ų | 50.3 | 7% | 0.073 | 26% | 0.257 | C | S | . | . | trans | -139.9 | 119 | 178.4 | -174.8 | 0 | 0 | 0 | 0 | 109.6 | Y212 Y223 H225 G330 Q336 | Y212-V333 HydrophobicContact CE1-CG1 3.99Å; Y212-V333 WeakPolarHBondContact OH-CG1 3.45Å; Y223-V333 HydrophobicContact CD1-CG2 4.12Å; Y223-V333 HydrophobicContact CD2-CG1 4.28Å; Y223-V333 HydrophobicContact CG-CG2 4.08Å; H225-V333 HydrophobicContact CB-CG1 4.47Å; H225-V333 HydrophobicContact CB-CG2 4.21Å; G330-V333 WeakPolarHBondContact O-CG2 3.5Å; V333-Q336 HydrophobicContact CB-CG 3.88Å; V333-Q336 HydrophobicContact CG1-CG 3.77Å; V333-Q336 WeakPolarHBondContact O-CG 3.31Å | ||
| 334 | A | 89.3 | Confident | 84.8 | Confident | 0 Ų | 0 | 56 Ų | 56 | 0% | 0 | 28% | 0.281 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | 164 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | F305 Y319 Q336 | F305-A334 HydrophobicContact CD1-CB 3.83Å; F305-A334 HydrophobicContact CE1-CB 3.6Å; Y319-A334 HydrophobicContact CE1-CB 4.17Å; Y319-A334 WeakPolarHBondContact OH-CB 3.25Å; A334-Q336 PolarHBondContact O-N 3.42Å |
| 335 | L | 83.8 | Confident | 84.3 | Confident | 2 Ų | 2 | 60.2 Ų | 60.2 | 1% | 0.01 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 71.2 | -1.8 | -179.7 | -47.7 | 172.6 | 0 | 0 | 0 | 115.5 | E309 L341 Y347 V348 F352 | E309-L335 PolarHBondContact OE1-N 3.06Å; L335-L341 HydrophobicContact CB-CD1 4.03Å; L335-L341 HydrophobicContact CD1-CD1 4.02Å; L335-Y347 HydrophobicContact CD2-CD1 3.52Å; L335-Y347 HydrophobicContact CD2-CE1 3.49Å; L335-Y347 VanDerWaalsContact CD2-CE1 3.49Å; L335-Y347 HydrophobicContact CD2-CG 4.24Å; L335-V348 HydrophobicContact CD1-CG1 4.37Å; L335-V348 HydrophobicContact CD1-CG2 4.42Å; L335-V348 HydrophobicContact CD2-CB 4.39Å; L335-V348 HydrophobicContact CD2-CG2 3.92Å; L335-F352 HydrophobicContact CD1-CD1 4.48Å; L335-F352 HydrophobicContact CD1-CE1 3.76Å; L335-F352 HydrophobicContact CD1-CZ 4.42Å |
| 336 | Q | 79.9 | Confident | 83.9 | Confident | 31 Ų | 31 | 65.2 Ų | 65.2 | 15% | 0.145 | 33% | 0.333 | C | S | . | . | trans | -81.4 | -22.5 | -179.4 | -62 | -55.7 | -54.3 | 0 | 0 | 113.8 | A201 H225 V333 A334 K338 | A201-Q336 HydrophobicContact CB-CB 4.11Å; A201-Q336 WeakPolarHBondContact CB-O 3.47Å; H225-Q336 PolarHBondContact CD2-NE2 2.96Å; H225-Q336 VanDerWaalsContact CD2-NE2 3.28Å; V333-Q336 HydrophobicContact CB-CG 3.88Å; V333-Q336 HydrophobicContact CG1-CG 3.77Å; V333-Q336 WeakPolarHBondContact O-CG 3.31Å; A334-Q336 PolarHBondContact O-N 3.42Å; Q336-K338 PolarHBondContact O-N 2.88Å | ||
| 337 | T | 74.1 | Confident | 83.6 | Confident | 55 Ų | 55 | 63.8 Ų | 63.8 | 34% | 0.337 | 32% | 0.322 | S | S | . | . | G | 310 helix | trans | -69 | 116.2 | -173.9 | -59.9 | 0 | 0 | 0 | 0 | 113.1 | E309 G339 A340 | E309-T337 WeakPolarHBondContact OE2-CB 3.35Å; E309-T337 PolarHBondContact OE2-OG1 2.82Å; T337-G339 PolarHBondContact O-N 3.42Å; T337-A340 WeakPolarHBondContact O-CB 3.28Å; T337-A340 PolarHBondContact O-N 2.82Å |
| 338 | K | 63.8 | Low | 83.2 | Confident | 164 Ų | 164 | 60.3 Ų | 60.3 | 71% | 0.713 | 30% | 0.304 | S | S | * | . | G | 310 helix | trans | 52.1 | 31.6 | 165.2 | -61.5 | 169.7 | -176.3 | 160.8 | 0 | 115.2 | Q336 K343 | Q336-K338 PolarHBondContact O-N 2.88Å; K338-K343 PolarHBondContact O-NZ 3.46Å |
| 339 | G | 64.4 | Low | 83 | Confident | 17 Ų | 17 | 62.4 Ų | 62.4 | 18% | 0.175 | 32% | 0.321 | C | S | . | . | G | 310 helix | trans | 77.8 | 27.1 | -179 | 0 | 0 | 0 | 0 | 0 | 114.8 | T337 L341 Q342 K343 | T337-G339 PolarHBondContact O-N 3.42Å; G339-L341 PolarHBondContact O-N 3.31Å; G339-Q342 PolarHBondContact O-N 2.98Å; G339-K343 PolarHBondContact O-N 3.48Å; G339-K343 VanDerWaalsContact O-N 3.12Å |
| 340 | A | 73.5 | Confident | 82.9 | Confident | 10 Ų | 10 | 60 Ų | 60 | 8% | 0.083 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -49.4 | -38 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | T337 Q342 K343 K344 | T337-A340 WeakPolarHBondContact O-CB 3.28Å; T337-A340 PolarHBondContact O-N 2.82Å; A340-Q342 PolarHBondContact O-N 3.4Å; A340-Q342 VanDerWaalsContact O-N 3.1Å; A340-K343 PolarHBondContact O-N 3.46Å; A340-K344 PolarHBondContact O-N 2.93Å |
| 341 | L | 74.8 | Confident | 82.9 | Confident | 11 Ų | 11 | 59 Ų | 59 | 6% | 0.058 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -52 | -28.1 | 176.4 | -163.7 | 68.9 | 0 | 0 | 0 | 115 | A208 L335 G339 V348 | A208-L341 HydrophobicContact CB-CD1 4.33Å; A208-L341 HydrophobicContact CB-CG 4.29Å; L335-L341 HydrophobicContact CB-CD1 4.03Å; L335-L341 HydrophobicContact CD1-CD1 4.02Å; G339-L341 PolarHBondContact O-N 3.31Å; L341-V348 HydrophobicContact CD1-CG2 4.31Å |
| 342 | Q | 72.4 | Confident | 83 | Confident | 103 Ų | 103 | 55.7 Ų | 55.7 | 48% | 0.481 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -104.7 | -33.1 | 174.8 | -58.4 | -57.3 | -54.4 | 0 | 0 | 112.6 | G339 A340 | G339-Q342 PolarHBondContact O-N 2.98Å; A340-Q342 PolarHBondContact O-N 3.4Å; A340-Q342 VanDerWaalsContact O-N 3.1Å |
| 343 | K | 77.9 | Confident | 83 | Confident | 158 Ų | 158 | 57.9 Ų | 57.9 | 69% | 0.687 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -85 | -23.3 | -172.2 | -67.1 | 173.4 | -177.6 | 164.9 | 0 | 114.5 | K338 G339 A340 | K338-K343 PolarHBondContact O-NZ 3.46Å; G339-K343 PolarHBondContact O-N 3.48Å; G339-K343 VanDerWaalsContact O-N 3.12Å; A340-K343 PolarHBondContact O-N 3.46Å |
| 344 | K | 84.1 | Confident | 83.3 | Confident | 118 Ų | 118 | 58.2 Ų | 58.2 | 51% | 0.513 | 30% | 0.295 | S | S | . | . | trans | -130 | 68.7 | -172.5 | -64 | -176 | 178.1 | 178.9 | 0 | 112 | A340 L346 Y347 V348 | A340-K344 PolarHBondContact O-N 2.93Å; K344-L346 VanDerWaalsContact C-N 3.27Å; K344-L346 PolarHBondContact O-N 2.91Å; K344-Y347 WeakPolarHBondContact O-CB 3.48Å; K344-Y347 PolarHBondContact O-N 3.45Å; K344-V348 PolarHBondContact O-N 3.13Å; K344-V348 VanDerWaalsContact O-N 3.13Å | ||
| 345 | P | 85.1 | Confident | 83.6 | Confident | 93 Ų | 93 | 58.2 Ų | 58.2 | 60% | 0.604 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -60 | -31.1 | -175.2 | 23.9 | -34.5 | 0 | 0 | 0 | 114.3 | V348 A349 | P345-V348 PolarHBondContact O-N 2.99Å; P345-A349 WeakPolarHBondContact O-CB 3.47Å; P345-A349 PolarHBondContact O-N 3.26Å |
| 346 | L | 87.6 | Confident | 84 | Confident | 152 Ų | 152 | 60.4 Ų | 60.4 | 80% | 0.796 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -65.7 | -36.7 | 174.2 | -66 | 177.1 | 0 | 0 | 0 | 112.5 | K344 A349 F350 | K344-L346 VanDerWaalsContact C-N 3.27Å; K344-L346 PolarHBondContact O-N 2.91Å; L346-A349 PolarHBondContact O-N 3.48Å; L346-F350 WeakPolarHBondContact O-CB 3.48Å; L346-F350 PolarHBondContact O-N 3.14Å |
| 347 | Y | 89.3 | Confident | 84.7 | Confident | 23 Ų | 23 | 63 Ų | 63 | 9% | 0.09 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -72.8 | -36.6 | 177.7 | 177.6 | -127.1 | 0 | 0 | 0 | 111.9 | F305 C308 E309 L335 K344 F350 S351 | F305-Y347 HydrophobicContact CD1-CE2 4.45Å; F305-Y347 VanDerWaalsContact CD1-OH 3.26Å; F305-Y347 WeakPolarHBondContact CD1-OH 3.36Å; F305-Y347 HydrophobicContact CE1-CE2 4.21Å; F305-Y347 WeakPolarHBondContact CE1-OH 3.47Å; C308-Y347 HydrophobicContact CB-CD2 4.18Å; C308-Y347 HydrophobicContact CB-CE1 4.21Å; C308-Y347 HydrophobicContact CB-CE2 3.48Å; C308-Y347 VanDerWaalsContact CB-CE2 3.48Å; C308-Y347 VanDerWaalsContact SG-CE2 3.57Å; E309-Y347 WeakPolarHBondContact CG-OH 3.18Å; E309-Y347 WeakPolarHBondContact OE1-CE1 3.38Å; E309-Y347 PolarHBondContact OE1-OH 3.02Å; L335-Y347 HydrophobicContact CD2-CD1 3.52Å; L335-Y347 HydrophobicContact CD2-CE1 3.49Å; L335-Y347 VanDerWaalsContact CD2-CE1 3.49Å; L335-Y347 HydrophobicContact CD2-CG 4.24Å; K344-Y347 WeakPolarHBondContact O-CB 3.48Å; K344-Y347 PolarHBondContact O-N 3.45Å; Y347-F350 HydrophobicContact CD2-CD1 4.15Å; Y347-F350 HydrophobicContact CE2-CD1 4.2Å; Y347-F350 PolarHBondContact O-N 3.24Å; Y347-S351 WeakPolarHBondContact O-CB 3.49Å; Y347-S351 PolarHBondContact O-N 2.9Å; Y347-S351 PolarHBondContact O-OG 3.43Å |
| 348 | V | 89.5 | Confident | 85.8 | Confident | 8 Ų | 8 | 60.4 Ų | 60.4 | 5% | 0.048 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58 | -51.6 | 169.8 | 176.2 | 0 | 0 | 0 | 0 | 110.5 | A208 L335 L341 K344 P345 F350 S351 F352 | A208-V348 HydrophobicContact CB-CG1 4.38Å; L335-V348 HydrophobicContact CD1-CG1 4.37Å; L335-V348 HydrophobicContact CD1-CG2 4.42Å; L335-V348 HydrophobicContact CD2-CB 4.39Å; L335-V348 HydrophobicContact CD2-CG2 3.92Å; L341-V348 HydrophobicContact CD1-CG2 4.31Å; K344-V348 PolarHBondContact O-N 3.13Å; K344-V348 VanDerWaalsContact O-N 3.13Å; P345-V348 PolarHBondContact O-N 2.99Å; V348-F350 PolarHBondContact O-N 2.98Å; V348-S351 PolarHBondContact O-N 3.19Å; V348-F352 HydrophobicContact CG1-CD2 4.09Å; V348-F352 HydrophobicContact CG1-CE1 3.98Å; V348-F352 HydrophobicContact CG1-CE2 3.33Å; V348-F352 HydrophobicContact CG1-CZ 3.27Å; V348-F352 WeakPolarHBondContact O-CG 3.45Å; V348-F352 PolarHBondContact O-N 3.17Å |
| 349 | A | 90.6 | Very high | 87.2 | Confident | 49 Ų | 49 | 53.1 Ų | 53.1 | 41% | 0.405 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.2 | -43.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | P345 L346 S351 F352 M353 | P345-A349 WeakPolarHBondContact O-CB 3.47Å; P345-A349 PolarHBondContact O-N 3.26Å; L346-A349 PolarHBondContact O-N 3.48Å; A349-S351 VanDerWaalsContact C-N 3.34Å; A349-S351 PolarHBondContact O-N 2.97Å; A349-F352 PolarHBondContact O-N 3.28Å; A349-M353 WeakPolarHBondContact O-CB 3.45Å; A349-M353 WeakPolarHBondContact O-CG 3.45Å; A349-M353 PolarHBondContact O-N 3.29Å |
| 350 | F | 92.7 | Very high | 88.7 | Confident | 84 Ų | 84 | 53.2 Ų | 53.2 | 37% | 0.368 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -56.3 | -47 | 172.9 | 168.9 | -96.8 | 0 | 0 | 0 | 111.6 | A304 F305 L346 Y347 V348 F352 M353 Y354 | A304-F350 HydrophobicContact CB-CE1 3.8Å; A304-F350 HydrophobicContact CB-CZ 3.55Å; F305-F350 HydrophobicContact CZ-CE1 4.33Å; L346-F350 WeakPolarHBondContact O-CB 3.48Å; L346-F350 PolarHBondContact O-N 3.14Å; Y347-F350 HydrophobicContact CD2-CD1 4.15Å; Y347-F350 HydrophobicContact CE2-CD1 4.2Å; Y347-F350 PolarHBondContact O-N 3.24Å; V348-F350 PolarHBondContact O-N 2.98Å; F350-F352 PolarHBondContact O-N 3.03Å; F350-M353 PolarHBondContact O-N 3.35Å; F350-Y354 WeakPolarHBondContact O-CB 3.45Å; F350-Y354 PolarHBondContact O-N 3.08Å |
| 351 | S | 92.8 | Very high | 89.7 | Confident | 1 Ų | 1 | 53.2 Ų | 53.2 | 1% | 0.007 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.7 | -40.8 | -178.3 | -59.2 | 0 | 0 | 0 | 0 | 112.1 | Y347 V348 A349 Y354 I355 | Y347-S351 WeakPolarHBondContact O-CB 3.49Å; Y347-S351 PolarHBondContact O-N 2.9Å; Y347-S351 PolarHBondContact O-OG 3.43Å; V348-S351 PolarHBondContact O-N 3.19Å; A349-S351 VanDerWaalsContact C-N 3.34Å; A349-S351 PolarHBondContact O-N 2.97Å; S351-Y354 PolarHBondContact O-N 2.93Å; S351-I355 WeakPolarHBondContact O-CG1 3.47Å; S351-I355 PolarHBondContact O-N 3.34Å |
| 352 | F | 93.3 | Very high | 90.6 | Very high | 16 Ų | 16 | 53.9 Ų | 53.9 | 7% | 0.07 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -66.7 | -42.2 | 175.5 | -59.5 | -16.3 | 0 | 0 | 0 | 112.1 | A208 F211 Y212 I215 L335 V348 A349 F350 I355 L356 | A208-F352 WeakPolarHBondContact O-CZ 3.46Å; F211-F352 AromaticContact CD1-CD2 3.64Å; F211-F352 HydrophobicContact CD1-CD2 3.64Å; F211-F352 AromaticContact CD1-CE2 3.46Å; F211-F352 HydrophobicContact CD1-CE2 3.46Å; F211-F352 VanDerWaalsContact CD1-CE2 3.46Å; F211-F352 HydrophobicContact CD1-CG 4.46Å; F211-F352 HydrophobicContact CD1-CZ 4.16Å; F211-F352 AromaticContact CE1-CD2 3.71Å; F211-F352 HydrophobicContact CE1-CD2 3.71Å; F211-F352 HydrophobicContact CE1-CE2 4.03Å; F211-F352 HydrophobicContact CE1-CG 4.4Å; Y212-F352 AromaticContact CD2-CD1 3.97Å; Y212-F352 HydrophobicContact CD2-CD1 3.97Å; Y212-F352 AromaticContact CD2-CE1 3.45Å; Y212-F352 HydrophobicContact CD2-CE1 3.45Å; Y212-F352 VanDerWaalsContact CD2-CE1 3.45Å; Y212-F352 HydrophobicContact CD2-CZ 4.47Å; Y212-F352 HydrophobicContact CE2-CE1 4.34Å; Y212-F352 AromaticContact CG-CE1 3.8Å; Y212-F352 HydrophobicContact CG-CE1 3.8Å; Y212-F352 HydrophobicContact CG-CZ 4.46Å; I215-F352 HydrophobicContact CD1-CB 3.96Å; I215-F352 HydrophobicContact CD1-CD1 3.94Å; I215-F352 HydrophobicContact CD1-CD2 4.3Å; I215-F352 HydrophobicContact CD1-CG 3.81Å; L335-F352 HydrophobicContact CD1-CD1 4.48Å; L335-F352 HydrophobicContact CD1-CE1 3.76Å; L335-F352 HydrophobicContact CD1-CZ 4.42Å; V348-F352 HydrophobicContact CG1-CD2 4.09Å; V348-F352 HydrophobicContact CG1-CE1 3.98Å; V348-F352 HydrophobicContact CG1-CE2 3.33Å; V348-F352 HydrophobicContact CG1-CZ 3.27Å; V348-F352 WeakPolarHBondContact O-CG 3.45Å; V348-F352 PolarHBondContact O-N 3.17Å; A349-F352 PolarHBondContact O-N 3.28Å; F350-F352 PolarHBondContact O-N 3.03Å; F352-I355 PolarHBondContact O-N 3.32Å; F352-L356 WeakPolarHBondContact O-CG 3.22Å; F352-L356 PolarHBondContact O-N 2.95Å |
| 353 | M | 93.7 | Very high | 91.6 | Very high | 109 Ų | 109 | 49.6 Ų | 49.6 | 54% | 0.537 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -64 | -40.8 | 175 | -72 | -63.9 | 100.7 | 0 | 0 | 111.8 | A349 F350 L356 V357 | A349-M353 WeakPolarHBondContact O-CB 3.45Å; A349-M353 WeakPolarHBondContact O-CG 3.45Å; A349-M353 PolarHBondContact O-N 3.29Å; F350-M353 PolarHBondContact O-N 3.35Å; M353-L356 HydrophobicContact CE-CD1 3.9Å; M353-L356 PolarHBondContact O-N 3.49Å; M353-V357 VanDerWaalsContact O-CB 3.31Å; M353-V357 WeakPolarHBondContact O-CB 3.41Å; M353-V357 VanDerWaalsContact O-CG2 3.28Å; M353-V357 WeakPolarHBondContact O-CG2 3.47Å; M353-V357 PolarHBondContact O-N 2.84Å |
| 354 | Y | 96.2 | Very high | 92.3 | Very high | 19 Ų | 19 | 42.2 Ų | 42.2 | 8% | 0.075 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.2 | -48 | 175.4 | 178.6 | -93.5 | 0 | 0 | 0 | 111.7 | T297 F305 C320 L324 F350 S351 G358 | T297-Y354 HydrophobicContact CG2-CE2 4.2Å; T297-Y354 WeakPolarHBondContact O-CE2 3.31Å; T297-Y354 PolarHBondContact O-OH 3.42Å; F305-Y354 AromaticContact CE2-CD1 3.61Å; F305-Y354 HydrophobicContact CE2-CD1 3.61Å; F305-Y354 AromaticContact CE2-CE1 3.89Å; F305-Y354 HydrophobicContact CE2-CE1 3.89Å; F305-Y354 AromaticContact CE2-CG 4Å; F305-Y354 HydrophobicContact CE2-CG 4Å; F305-Y354 HydrophobicContact CZ-CD1 4.11Å; F305-Y354 HydrophobicContact CZ-CG 4.42Å; C320-Y354 HydrophobicContact CB-CE1 4.47Å; L324-Y354 HydrophobicContact CD1-CE1 4.09Å; L324-Y354 HydrophobicContact CD2-CE1 4.29Å; L324-Y354 HydrophobicContact CG-CE1 4.3Å; F350-Y354 WeakPolarHBondContact O-CB 3.45Å; F350-Y354 PolarHBondContact O-N 3.08Å; S351-Y354 PolarHBondContact O-N 2.93Å; Y354-G358 WeakPolarHBondContact O-CA 3.41Å; Y354-G358 PolarHBondContact O-N 3.34Å |
| 355 | I | 95.5 | Very high | 92.7 | Very high | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.8 | -49.5 | 178.9 | -68 | 167.1 | 0 | 0 | 0 | 110.6 | Y212 I215 I221 T323 S351 F352 G358 L359 | Y212-I355 HydrophobicContact CE2-CD1 3.91Å; I215-I355 HydrophobicContact CG2-CG2 4.14Å; I221-I355 HydrophobicContact CD1-CG2 3.74Å; T323-I355 HydrophobicContact CG2-CD1 4.46Å; T323-I355 HydrophobicContact CG2-CG1 3.97Å; S351-I355 WeakPolarHBondContact O-CG1 3.47Å; S351-I355 PolarHBondContact O-N 3.34Å; F352-I355 PolarHBondContact O-N 3.32Å; I355-G358 PolarHBondContact O-N 3.45Å; I355-L359 HydrophobicContact CG2-CD1 3.79Å; I355-L359 HydrophobicContact CG2-CG 4.36Å; I355-L359 VanDerWaalsContact O-CB 3.31Å; I355-L359 WeakPolarHBondContact O-CB 3.25Å; I355-L359 VanDerWaalsContact O-CG 3.23Å; I355-L359 WeakPolarHBondContact O-CG 3.39Å; I355-L359 PolarHBondContact O-N 2.88Å |
| 356 | L | 93.4 | Very high | 92.9 | Very high | 47 Ų | 47 | 38.6 Ų | 38.6 | 25% | 0.246 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -66.6 | -42.7 | -177.3 | -68.1 | 173.3 | 0 | 0 | 0 | 112.9 | F252 F352 M353 T360 | F252-L356 HydrophobicContact CZ-CD2 4.26Å; F352-L356 WeakPolarHBondContact O-CG 3.22Å; F352-L356 PolarHBondContact O-N 2.95Å; M353-L356 HydrophobicContact CE-CD1 3.9Å; M353-L356 PolarHBondContact O-N 3.49Å; L356-T360 WeakPolarHBondContact O-CB 3.48Å; L356-T360 PolarHBondContact O-N 3Å; L356-T360 VanDerWaalsContact O-N 3.15Å; L356-T360 PolarHBondContact O-OG1 3.46Å |
| 357 | V | 94.7 | Very high | 92.9 | Very high | 86 Ų | 86 | 32.3 Ų | 32.3 | 52% | 0.521 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -69.4 | -42.8 | 176.5 | 174.1 | 0 | 0 | 0 | 0 | 110.5 | M353 T360 V361 | M353-V357 VanDerWaalsContact O-CB 3.31Å; M353-V357 WeakPolarHBondContact O-CB 3.41Å; M353-V357 VanDerWaalsContact O-CG2 3.28Å; M353-V357 WeakPolarHBondContact O-CG2 3.47Å; M353-V357 PolarHBondContact O-N 2.84Å; V357-T360 CarbonylContact O-C 3.58Å; V357-T360 WeakPolarHBondContact O-CA 3.48Å; V357-T360 WeakPolarHBondContact O-CB 3.39Å; V357-T360 PolarHBondContact O-N 3.27Å; V357-T360 VanDerWaalsContact O-N 3.1Å; V357-V361 WeakPolarHBondContact O-CG2 3.31Å; V357-V361 PolarHBondContact O-N 2.99Å |
| 358 | G | 95.9 | Very high | 92.8 | Very high | 1 Ų | 1 | 32.6 Ų | 32.6 | 1% | 0.01 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.4 | -44.7 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y354 I355 T360 V361 I362 | Y354-G358 WeakPolarHBondContact O-CA 3.41Å; Y354-G358 PolarHBondContact O-N 3.34Å; I355-G358 PolarHBondContact O-N 3.45Å; G358-T360 PolarHBondContact O-N 3.32Å; G358-V361 PolarHBondContact O-N 3.24Å; G358-I362 PolarHBondContact O-N 2.99Å |
| 359 | L | 94.7 | Very high | 92.7 | Very high | 11 Ų | 11 | 34.4 Ų | 34.4 | 6% | 0.058 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.5 | -32.7 | 172.6 | -72.5 | 173.1 | 0 | 0 | 0 | 111.8 | T219 I221 F252 L324 T326 I355 G363 | T219-L359 HydrophobicContact CG2-CD1 3.54Å; I221-L359 HydrophobicContact CD1-CD1 4.27Å; F252-L359 HydrophobicContact CD1-CB 4.48Å; F252-L359 HydrophobicContact CE1-CB 3.83Å; F252-L359 HydrophobicContact CE2-CB 3.99Å; F252-L359 HydrophobicContact CE2-CD1 3.93Å; F252-L359 HydrophobicContact CZ-CB 3.55Å; F252-L359 HydrophobicContact CZ-CD1 3.71Å; F252-L359 HydrophobicContact CZ-CG 4.31Å; L324-L359 HydrophobicContact CD2-CD2 4.47Å; L324-L359 HydrophobicContact CD2-CG 4.21Å; T326-L359 HydrophobicContact CG2-CD2 3.51Å; I355-L359 HydrophobicContact CG2-CD1 3.79Å; I355-L359 HydrophobicContact CG2-CG 4.36Å; I355-L359 VanDerWaalsContact O-CB 3.31Å; I355-L359 WeakPolarHBondContact O-CB 3.25Å; I355-L359 VanDerWaalsContact O-CG 3.23Å; I355-L359 WeakPolarHBondContact O-CG 3.39Å; I355-L359 PolarHBondContact O-N 2.88Å; L359-G363 WeakPolarHBondContact O-CA 3.29Å; L359-G363 PolarHBondContact O-N 2.86Å |
| 360 | T | 94.2 | Very high | 92.3 | Very high | 18 Ų | 18 | 35.1 Ų | 35.1 | 11% | 0.11 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -68.8 | -35.5 | 173 | -53.3 | 0 | 0 | 0 | 0 | 111.8 | F252 L255 M259 L356 V357 G358 A364 | F252-T360 WeakPolarHBondContact CD1-OG1 3.4Å; F252-T360 WeakPolarHBondContact CE1-OG1 3.36Å; L255-T360 HydrophobicContact CB-CG2 3.65Å; L255-T360 HydrophobicContact CD1-CG2 4.5Å; M259-T360 HydrophobicContact CE-CG2 3.85Å; M259-T360 VanDerWaalsContact CE-O 3.27Å; M259-T360 WeakPolarHBondContact CE-O 3.45Å; L356-T360 WeakPolarHBondContact O-CB 3.48Å; L356-T360 PolarHBondContact O-N 3Å; L356-T360 VanDerWaalsContact O-N 3.15Å; L356-T360 PolarHBondContact O-OG1 3.46Å; V357-T360 CarbonylContact O-C 3.58Å; V357-T360 WeakPolarHBondContact O-CA 3.48Å; V357-T360 WeakPolarHBondContact O-CB 3.39Å; V357-T360 PolarHBondContact O-N 3.27Å; V357-T360 VanDerWaalsContact O-N 3.1Å; G358-T360 PolarHBondContact O-N 3.32Å; T360-A364 VanDerWaalsContact O-CB 3.25Å; T360-A364 WeakPolarHBondContact O-CB 3.38Å; T360-A364 PolarHBondContact O-N 3.06Å |
| 361 | V | 95.3 | Very high | 91.4 | Very high | 11 Ų | 11 | 34.6 Ų | 34.6 | 7% | 0.067 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -69 | -51.1 | 175.4 | 173.3 | 0 | 0 | 0 | 0 | 111.5 | M259 V357 G358 G363 A364 F365 | M259-V361 HydrophobicContact CE-CB 4.21Å; M259-V361 HydrophobicContact CE-CG2 3.71Å; M259-V361 HydrophobicContact SD-CG2 4.45Å; V357-V361 WeakPolarHBondContact O-CG2 3.31Å; V357-V361 PolarHBondContact O-N 2.99Å; G358-V361 PolarHBondContact O-N 3.24Å; V361-G363 VanDerWaalsContact C-N 3.33Å; V361-G363 PolarHBondContact O-N 3.24Å; V361-A364 PolarHBondContact O-N 3.14Å; V361-F365 PolarHBondContact O-N 3.27Å; V361-F365 VanDerWaalsContact O-N 3.11Å |
| 362 | I | 93.9 | Very high | 90.3 | Very high | 25 Ų | 25 | 42 Ų | 42 | 13% | 0.128 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.6 | -44.3 | 175.6 | -59.5 | -50.9 | 0 | 0 | 0 | 110.1 | C294 L324 G358 A364 F365 L366 | C294-I362 HydrophobicContact CB-CD1 3.8Å; L324-I362 HydrophobicContact CB-CG1 3.85Å; L324-I362 HydrophobicContact CD1-CG1 4.48Å; G358-I362 PolarHBondContact O-N 2.99Å; I362-A364 PolarHBondContact O-N 3.41Å; I362-F365 PolarHBondContact O-N 3.11Å; I362-L366 HydrophobicContact CG2-CD1 3.86Å; I362-L366 HydrophobicContact CG2-CG 4.15Å; I362-L366 WeakPolarHBondContact O-CB 3.47Å; I362-L366 WeakPolarHBondContact O-CG 3.39Å; I362-L366 PolarHBondContact O-N 3.36Å |
| 363 | G | 92.4 | Very high | 89.4 | Confident | 12 Ų | 12 | 47.2 Ų | 47.2 | 12% | 0.124 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.3 | -38.3 | 176 | 0 | 0 | 0 | 0 | 0 | 113.7 | L359 V361 N367 | L359-G363 WeakPolarHBondContact O-CA 3.29Å; L359-G363 PolarHBondContact O-N 2.86Å; V361-G363 VanDerWaalsContact C-N 3.33Å; V361-G363 PolarHBondContact O-N 3.24Å; G363-N367 WeakPolarHBondContact O-CB 3.16Å; G363-N367 PolarHBondContact O-N 2.92Å |
| 364 | A | 92.7 | Very high | 88.5 | Confident | 4 Ų | 4 | 47.3 Ų | 47.3 | 3% | 0.033 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.5 | -41.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | M259 N260 T360 V361 I362 L368 | M259-A364 HydrophobicContact CE-CB 3.75Å; N260-A364 PolarHBondContact ND2-O 3.13Å; T360-A364 VanDerWaalsContact O-CB 3.25Å; T360-A364 WeakPolarHBondContact O-CB 3.38Å; T360-A364 PolarHBondContact O-N 3.06Å; V361-A364 PolarHBondContact O-N 3.14Å; I362-A364 PolarHBondContact O-N 3.41Å; A364-L368 WeakPolarHBondContact O-CB 3.32Å; A364-L368 PolarHBondContact O-N 3.45Å |
| 365 | F | 92.8 | Very high | 87.5 | Confident | 50 Ų | 50 | 49.3 Ų | 49.3 | 22% | 0.219 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68 | -44.9 | 176.6 | -178.5 | -106 | 0 | 0 | 0 | 112 | V287 F291 V361 I362 L368 V369 | V287-F365 HydrophobicContact CG1-CE2 4.34Å; F291-F365 HydrophobicContact CB-CE2 4.38Å; V361-F365 PolarHBondContact O-N 3.27Å; V361-F365 VanDerWaalsContact O-N 3.11Å; I362-F365 PolarHBondContact O-N 3.11Å; F365-L368 PolarHBondContact O-N 3.37Å; F365-V369 HydrophobicContact CD2-CG2 4.4Å; F365-V369 HydrophobicContact CE1-CG2 4.34Å; F365-V369 HydrophobicContact CE2-CG2 4.04Å; F365-V369 HydrophobicContact CZ-CG2 4.01Å; F365-V369 WeakPolarHBondContact O-CG2 3.23Å; F365-V369 PolarHBondContact O-N 2.87Å |
| 366 | L | 90.4 | Very high | 86.3 | Confident | 84 Ų | 84 | 53.3 Ų | 53.3 | 44% | 0.44 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 174.5 | -69.8 | 176.9 | 0 | 0 | 0 | 111.8 | I362 L368 V369 V370 | I362-L366 HydrophobicContact CG2-CD1 3.86Å; I362-L366 HydrophobicContact CG2-CG 4.15Å; I362-L366 WeakPolarHBondContact O-CB 3.47Å; I362-L366 WeakPolarHBondContact O-CG 3.39Å; I362-L366 PolarHBondContact O-N 3.36Å; L366-L368 PolarHBondContact O-N 2.86Å; L366-V369 PolarHBondContact O-N 3.42Å; L366-V370 HydrophobicContact CB-CG2 4.5Å; L366-V370 HydrophobicContact CD2-CG2 3.98Å; L366-V370 WeakPolarHBondContact O-CA 3.34Å; L366-V370 WeakPolarHBondContact O-CB 3.49Å; L366-V370 PolarHBondContact O-N 3.37Å |
| 367 | N | 87.6 | Confident | 85.3 | Confident | 21 Ų | 21 | 52.8 Ų | 52.8 | 11% | 0.112 | 27% | 0.273 | C | S | . | . | I | π-helix | trans | -58.1 | -49.4 | 172.7 | -177.4 | -5 | 0 | 0 | 0 | 110.4 | Q253 G363 V369 L371 | Q253-N367 PolarHBondContact O-ND2 2.91Å; Q253-N367 PolarHBondContact OE1-ND2 3.36Å; G363-N367 WeakPolarHBondContact O-CB 3.16Å; G363-N367 PolarHBondContact O-N 2.92Å; N367-V369 VanDerWaalsContact C-N 3.35Å; N367-V369 PolarHBondContact O-N 3.32Å; N367-L371 WeakPolarHBondContact O-CB 3.32Å; N367-L371 PolarHBondContact O-N 3.01Å; N367-L371 WeakPolarHBondContact OD1-CD2 3.45Å |
| 368 | L | 86.5 | Confident | 84.3 | Confident | 29 Ų | 29 | 51.6 Ų | 51.6 | 15% | 0.152 | 27% | 0.268 | C | S | . | . | I | π-helix | trans | -61.3 | -38.7 | -178.9 | -172.3 | 141.3 | 0 | 0 | 0 | 113.9 | M286 V287 A364 F365 L366 | M286-L368 HydrophobicContact CB-CD1 3.64Å; M286-L368 HydrophobicContact CE-CD1 4.29Å; M286-L368 HydrophobicContact CG-CD1 4.46Å; V287-L368 HydrophobicContact CB-CD2 4.48Å; V287-L368 HydrophobicContact CG2-CD2 3.49Å; V287-L368 VanDerWaalsContact CG2-CD2 3.49Å; A364-L368 WeakPolarHBondContact O-CB 3.32Å; A364-L368 PolarHBondContact O-N 3.45Å; F365-L368 PolarHBondContact O-N 3.37Å; L366-L368 PolarHBondContact O-N 2.86Å |
| 369 | V | 87.1 | Confident | 83.3 | Confident | 45 Ų | 45 | 55.5 Ų | 55.5 | 27% | 0.273 | 29% | 0.286 | S | S | . | . | I | π-helix | trans | -90.9 | -56.5 | -176.8 | 178.9 | 0 | 0 | 0 | 0 | 111.8 | F365 L366 N367 F373 | F365-V369 HydrophobicContact CD2-CG2 4.4Å; F365-V369 HydrophobicContact CE1-CG2 4.34Å; F365-V369 HydrophobicContact CE2-CG2 4.04Å; F365-V369 HydrophobicContact CZ-CG2 4.01Å; F365-V369 WeakPolarHBondContact O-CG2 3.23Å; F365-V369 PolarHBondContact O-N 2.87Å; L366-V369 PolarHBondContact O-N 3.42Å; N367-V369 VanDerWaalsContact C-N 3.35Å; N367-V369 PolarHBondContact O-N 3.32Å; V369-F373 HydrophobicContact CG1-CD2 4.49Å; V369-F373 HydrophobicContact CG1-CE2 4.21Å; V369-F373 WeakPolarHBondContact O-CD2 3.5Å |
| 370 | V | 82.9 | Confident | 82.4 | Confident | 64 Ų | 64 | 58 Ų | 58 | 39% | 0.388 | 30% | 0.3 | S | S | . | . | I | π-helix | trans | -77.7 | -41.2 | -169.1 | -174.8 | 0 | 0 | 0 | 0 | 112 | L366 R372 F373 L374 | L366-V370 HydrophobicContact CB-CG2 4.5Å; L366-V370 HydrophobicContact CD2-CG2 3.98Å; L366-V370 WeakPolarHBondContact O-CA 3.34Å; L366-V370 WeakPolarHBondContact O-CB 3.49Å; L366-V370 PolarHBondContact O-N 3.37Å; V370-R372 PolarHBondContact O-N 2.89Å; V370-F373 PolarHBondContact O-N 3.02Å; V370-L374 HydrophobicContact CG1-CD1 4.07Å; V370-L374 HydrophobicContact CG1-CG 4.19Å; V370-L374 PolarHBondContact O-N 3.31Å |
| 371 | L | 72.8 | Confident | 81.4 | Confident | 74 Ų | 74 | 61.2 Ų | 61.2 | 39% | 0.387 | 31% | 0.313 | S | S | . | . | I | π-helix | trans | -60.9 | -36.4 | -177.6 | -168.6 | 64.5 | 0 | 0 | 0 | 111 | N367 F373 L374 T375 | N367-L371 WeakPolarHBondContact O-CB 3.32Å; N367-L371 PolarHBondContact O-N 3.01Å; N367-L371 WeakPolarHBondContact OD1-CD2 3.45Å; L371-F373 VanDerWaalsContact C-N 3.34Å; L371-F373 PolarHBondContact O-N 3.29Å; L371-L374 PolarHBondContact O-N 3.37Å; L371-T375 HydrophobicContact CD1-CG2 4.44Å; L371-T375 HydrophobicContact CG-CG2 4.27Å; L371-T375 WeakPolarHBondContact O-CG2 3.45Å; L371-T375 PolarHBondContact O-N 3.04Å; L371-T375 PolarHBondContact O-OG1 3.36Å; L371-T375 VanDerWaalsContact O-OG1 3.09Å |
| 372 | R | 70.7 | Confident | 80.6 | Confident | 157 Ų | 157 | 67 Ų | 67 | 59% | 0.592 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -60.9 | -38.8 | 173.8 | -170.4 | -176.1 | -177.7 | -150.4 | -3.3 | 112.9 | M283 V370 T375 M376 | M283-R372 PolarHBondContact SD-NH1 2.92Å; V370-R372 PolarHBondContact O-N 2.89Å; R372-T375 PolarHBondContact O-OG1 2.84Å; R372-M376 WeakPolarHBondContact O-CB 3.22Å; R372-M376 PolarHBondContact O-N 3.5Å; R372-M376 VanDerWaalsContact O-N 3.13Å |
| 373 | F | 73.4 | Confident | 79.9 | Confident | 124 Ų | 124 | 72.2 Ų | 72.2 | 54% | 0.544 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -70.8 | -38 | 175.7 | -75.6 | -67.8 | 0 | 0 | 0 | 111.8 | R134 V369 V370 L371 M376 | R134-F373 PolarHBondContact NH2-O 2.86Å; V369-F373 HydrophobicContact CG1-CD2 4.49Å; V369-F373 HydrophobicContact CG1-CE2 4.21Å; V369-F373 WeakPolarHBondContact O-CD2 3.5Å; V370-F373 PolarHBondContact O-N 3.02Å; L371-F373 VanDerWaalsContact C-N 3.34Å; L371-F373 PolarHBondContact O-N 3.29Å; F373-M376 HydrophobicContact CD1-CE 4.13Å |
| 374 | L | 75.3 | Confident | 79.3 | Confident | 112 Ų | 112 | 73.8 Ų | 73.8 | 59% | 0.586 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -65.7 | -49.3 | 176.7 | -65 | 175.2 | 0 | 0 | 0 | 111.6 | V370 L371 M376 N377 | V370-L374 HydrophobicContact CG1-CD1 4.07Å; V370-L374 HydrophobicContact CG1-CG 4.19Å; V370-L374 PolarHBondContact O-N 3.31Å; L371-L374 PolarHBondContact O-N 3.37Å; L374-M376 VanDerWaalsContact C-N 3.29Å; L374-M376 PolarHBondContact O-N 3.39Å; L374-N377 WeakPolarHBondContact O-CB 3.37Å; L374-N377 PolarHBondContact O-N 3.47Å; L374-N377 VanDerWaalsContact O-N 3.08Å |
| 375 | T | 74.9 | Confident | 78.7 | Confident | 60 Ų | 60 | 75.7 Ų | 75.7 | 37% | 0.368 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -66.4 | -28.8 | 179 | 57 | 0 | 0 | 0 | 0 | 113 | L371 R372 N377 S378 E379 | L371-T375 HydrophobicContact CD1-CG2 4.44Å; L371-T375 HydrophobicContact CG-CG2 4.27Å; L371-T375 WeakPolarHBondContact O-CG2 3.45Å; L371-T375 PolarHBondContact O-N 3.04Å; L371-T375 PolarHBondContact O-OG1 3.36Å; L371-T375 VanDerWaalsContact O-OG1 3.09Å; R372-T375 PolarHBondContact O-OG1 2.84Å; T375-N377 PolarHBondContact O-N 2.85Å; T375-S378 PolarHBondContact O-N 3.01Å; T375-S378 PolarHBondContact O-OG 2.86Å; T375-S378 VanDerWaalsContact O-OG 3.1Å; T375-E379 PolarHBondContact O-N 2.96Å |
| 376 | M | 70.4 | Confident | 78.3 | Confident | 84 Ų | 84 | 78 Ų | 78 | 41% | 0.414 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -57 | -33.8 | 172.3 | -171.7 | 171.9 | 73.6 | 0 | 0 | 111.9 | R372 F373 L374 D380 | R372-M376 WeakPolarHBondContact O-CB 3.22Å; R372-M376 PolarHBondContact O-N 3.5Å; R372-M376 VanDerWaalsContact O-N 3.13Å; F373-M376 HydrophobicContact CD1-CE 4.13Å; L374-M376 VanDerWaalsContact C-N 3.29Å; L374-M376 PolarHBondContact O-N 3.39Å; M376-D380 WeakPolarHBondContact O-CB 3.29Å; M376-D380 PolarHBondContact O-N 3.37Å; M376-D380 VanDerWaalsContact O-N 3.08Å; M376-D380 VanDerWaalsContact O-OD2 3.12Å |
| 377 | N | 72.1 | Confident | 77.8 | Confident | 37 Ų | 37 | 79.8 Ų | 79.8 | 20% | 0.198 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -71.7 | -38.6 | 178.7 | -166.7 | 81.4 | 0 | 0 | 0 | 112.8 | L374 T375 D380 E381 | L374-N377 WeakPolarHBondContact O-CB 3.37Å; L374-N377 PolarHBondContact O-N 3.47Å; L374-N377 VanDerWaalsContact O-N 3.08Å; T375-N377 PolarHBondContact O-N 2.85Å; N377-D380 PolarHBondContact O-N 3.31Å; N377-E381 WeakPolarHBondContact O-CG 3.42Å; N377-E381 PolarHBondContact O-N 3.43Å; N377-E381 VanDerWaalsContact O-N 3.08Å |
| 378 | S | 75.1 | Confident | 77.4 | Confident | 61 Ų | 61 | 85.1 Ų | 85.1 | 43% | 0.427 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -77.6 | -27.7 | 177 | 55.4 | 0 | 0 | 0 | 0 | 112.9 | T375 R382 | T375-S378 PolarHBondContact O-N 3.01Å; T375-S378 PolarHBondContact O-OG 2.86Å; T375-S378 VanDerWaalsContact O-OG 3.1Å; S378-R382 WeakPolarHBondContact O-CB 3.42Å; S378-R382 PolarHBondContact O-N 3.15Å |
| 379 | E | 75.2 | Confident | 77.1 | Confident | 83 Ų | 83 | 86.9 Ų | 86.9 | 39% | 0.388 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -65.5 | -42.2 | 167.5 | -76.7 | -156.8 | 174.9 | 0 | 0 | 112.2 | T375 R382 R383 | T375-E379 PolarHBondContact O-N 2.96Å; E379-R382 PolarHBondContact O-N 2.86Å; E379-R383 VanDerWaalsContact O-CG 3.24Å; E379-R383 WeakPolarHBondContact O-CG 3.48Å; E379-R383 PolarHBondContact O-N 3.04Å; E379-R383 IonicContact OE2-CZ 3.53Å; E379-R383 IonicContact OE2-NH2 2.71Å; E379-R383 PolarHBondContact OE2-NH2 3.35Å |
| 380 | D | 74.7 | Confident | 76.8 | Confident | 64 Ų | 64 | 88.3 Ų | 88.3 | 34% | 0.342 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -60.8 | -45.4 | 174.4 | -69.2 | -27.7 | 0 | 0 | 0 | 110.5 | R134 M376 N377 R382 R383 D384 | R134-D380 IonicContact NH1-OD2 2.66Å; R134-D380 PolarHBondContact NH1-OD2 2.88Å; M376-D380 WeakPolarHBondContact O-CB 3.29Å; M376-D380 PolarHBondContact O-N 3.37Å; M376-D380 VanDerWaalsContact O-N 3.08Å; M376-D380 VanDerWaalsContact O-OD2 3.12Å; N377-D380 PolarHBondContact O-N 3.31Å; D380-R382 VanDerWaalsContact C-N 3.35Å; D380-R382 PolarHBondContact O-N 2.83Å; D380-R383 PolarHBondContact O-N 3.2Å; D380-D384 PolarHBondContact O-N 2.86Å |
| 381 | E | 73.1 | Confident | 76.6 | Confident | 84 Ų | 84 | 90.7 Ų | 90.7 | 39% | 0.393 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -57.8 | -43 | 174.5 | -77.5 | 178.8 | 160.3 | 0 | 0 | 113.1 | Q131 N377 A385 | Q131-E381 PolarHBondContact NE2-OE1 2.96Å; N377-E381 WeakPolarHBondContact O-CG 3.42Å; N377-E381 PolarHBondContact O-N 3.43Å; N377-E381 VanDerWaalsContact O-N 3.08Å; E381-A385 VanDerWaalsContact O-CB 3.32Å; E381-A385 WeakPolarHBondContact O-CB 3.45Å; E381-A385 PolarHBondContact O-N 3.28Å |
| 382 | R | 79.4 | Confident | 76.6 | Confident | 134 Ų | 134 | 90.4 Ų | 90.4 | 51% | 0.506 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.7 | -45 | 177.8 | -175.2 | 175.3 | 70.4 | 92.9 | -5.8 | 111.3 | S378 E379 D380 A385 E386 | S378-R382 WeakPolarHBondContact O-CB 3.42Å; S378-R382 PolarHBondContact O-N 3.15Å; E379-R382 PolarHBondContact O-N 2.86Å; D380-R382 VanDerWaalsContact C-N 3.35Å; D380-R382 PolarHBondContact O-N 2.83Å; R382-A385 PolarHBondContact O-N 3.46Å; R382-E386 VanDerWaalsContact CG-OE1 3.28Å; R382-E386 WeakPolarHBondContact CG-OE1 3.36Å; R382-E386 IonicContact CZ-OE1 3.93Å; R382-E386 IonicContact NE-OE1 2.83Å; R382-E386 IonicContact NH1-OE1 3.82Å; R382-E386 PolarHBondContact NH1-OE1 2.85Å; R382-E386 IonicContact NH1-OE2 3.46Å; R382-E386 PolarHBondContact NH1-OE2 3.41Å; R382-E386 WeakPolarHBondContact O-CG 3.32Å; R382-E386 PolarHBondContact O-N 3.18Å |
| 383 | R | 79.1 | Confident | 76.2 | Confident | 134 Ų | 134 | 85.6 Ų | 85.6 | 51% | 0.506 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.2 | -47.4 | 177.2 | -68.7 | 168.2 | -164.5 | -153 | 8.6 | 111.4 | E379 D380 A385 E386 E387 | E379-R383 VanDerWaalsContact O-CG 3.24Å; E379-R383 WeakPolarHBondContact O-CG 3.48Å; E379-R383 PolarHBondContact O-N 3.04Å; E379-R383 IonicContact OE2-CZ 3.53Å; E379-R383 IonicContact OE2-NH2 2.71Å; E379-R383 PolarHBondContact OE2-NH2 3.35Å; D380-R383 PolarHBondContact O-N 3.2Å; R383-A385 PolarHBondContact O-N 2.94Å; R383-E386 PolarHBondContact O-N 3.43Å; R383-E387 WeakPolarHBondContact O-CB 3.5Å; R383-E387 PolarHBondContact O-N 2.9Å |
| 384 | D | 79 | Confident | 75.4 | Confident | 45 Ų | 45 | 85.5 Ų | 85.5 | 24% | 0.241 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -62.4 | -31.1 | 176.4 | -79.7 | 10.4 | 0 | 0 | 0 | 111.8 | D380 R388 | D380-D384 PolarHBondContact O-N 2.86Å; D384-R388 VanDerWaalsContact C-NH2 3.33Å; D384-R388 VanDerWaalsContact CB-NH2 3.28Å; D384-R388 WeakPolarHBondContact O-CB 3.48Å; D384-R388 WeakPolarHBondContact O-CG 3.32Å; D384-R388 PolarHBondContact O-N 2.83Å; D384-R388 VanDerWaalsContact O-N 3.12Å; D384-R388 PolarHBondContact O-NE 3.16Å; D384-R388 PolarHBondContact O-NH2 2.95Å |
| 385 | A | 80.1 | Confident | 74.3 | Confident | 43 Ų | 43 | 90.6 Ų | 90.6 | 36% | 0.355 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -74.1 | -41.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | E381 R382 R383 R388 A389 | E381-A385 VanDerWaalsContact O-CB 3.32Å; E381-A385 WeakPolarHBondContact O-CB 3.45Å; E381-A385 PolarHBondContact O-N 3.28Å; R382-A385 PolarHBondContact O-N 3.46Å; R383-A385 PolarHBondContact O-N 2.94Å; A385-R388 PolarHBondContact O-N 3.44Å; A385-A389 WeakPolarHBondContact O-CB 3.4Å; A385-A389 PolarHBondContact O-N 3.5Å |
| 386 | E | 83.6 | Confident | 73.2 | Confident | 100 Ų | 100 | 95.1 Ų | 95.1 | 47% | 0.467 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.4 | -41.7 | 174 | -73.5 | 167.8 | -171.8 | 0 | 0 | 111.5 | R382 R383 A389 S390 | R382-E386 VanDerWaalsContact CG-OE1 3.28Å; R382-E386 WeakPolarHBondContact CG-OE1 3.36Å; R382-E386 IonicContact CZ-OE1 3.93Å; R382-E386 IonicContact NE-OE1 2.83Å; R382-E386 IonicContact NH1-OE1 3.82Å; R382-E386 PolarHBondContact NH1-OE1 2.85Å; R382-E386 IonicContact NH1-OE2 3.46Å; R382-E386 PolarHBondContact NH1-OE2 3.41Å; R382-E386 WeakPolarHBondContact O-CG 3.32Å; R382-E386 PolarHBondContact O-N 3.18Å; R383-E386 PolarHBondContact O-N 3.43Å; E386-A389 PolarHBondContact O-N 3.26Å; E386-S390 PolarHBondContact O-N 2.9Å |
| 387 | E | 81.5 | Confident | 72.2 | Confident | 120 Ų | 120 | 95.8 Ų | 95.8 | 56% | 0.561 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.6 | -40.4 | 174.7 | -170.4 | 177.1 | 179.4 | 0 | 0 | 112.2 | R383 A389 S390 L391 | R383-E387 WeakPolarHBondContact O-CB 3.5Å; R383-E387 PolarHBondContact O-N 2.9Å; E387-A389 VanDerWaalsContact C-N 3.32Å; E387-A389 PolarHBondContact O-N 2.77Å; E387-S390 PolarHBondContact O-N 3.41Å; E387-S390 PolarHBondContact O-OG 3.1Å; E387-L391 HydrophobicContact CG-CD1 4.28Å; E387-L391 WeakPolarHBondContact O-CB 3.46Å; E387-L391 VanDerWaalsContact O-CG 3.32Å; E387-L391 WeakPolarHBondContact O-CG 3.39Å; E387-L391 PolarHBondContact O-N 3.2Å; E387-L391 VanDerWaalsContact O-N 3.09Å |
| 388 | R | 77.6 | Confident | 71 | Confident | 133 Ų | 133 | 101.9 Ų | 101.9 | 50% | 0.502 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.5 | -34.9 | 173.6 | -81.3 | 176.8 | -88.9 | 116.3 | -5.7 | 112.7 | D384 A385 A392 | D384-R388 VanDerWaalsContact C-NH2 3.33Å; D384-R388 VanDerWaalsContact CB-NH2 3.28Å; D384-R388 WeakPolarHBondContact O-CB 3.48Å; D384-R388 WeakPolarHBondContact O-CG 3.32Å; D384-R388 PolarHBondContact O-N 2.83Å; D384-R388 VanDerWaalsContact O-N 3.12Å; D384-R388 PolarHBondContact O-NE 3.16Å; D384-R388 PolarHBondContact O-NH2 2.95Å; A385-R388 PolarHBondContact O-N 3.44Å; R388-A392 PolarHBondContact O-N 3.41Å |
| 389 | A | 80.6 | Confident | 69.7 | Low | 66 Ų | 66 | 104.6 Ų | 104.6 | 55% | 0.545 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -70.1 | -41.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | A385 E386 E387 A392 G393 | A385-A389 WeakPolarHBondContact O-CB 3.4Å; A385-A389 PolarHBondContact O-N 3.5Å; E386-A389 PolarHBondContact O-N 3.26Å; E387-A389 VanDerWaalsContact C-N 3.32Å; E387-A389 PolarHBondContact O-N 2.77Å; A389-A392 PolarHBondContact O-N 3.44Å; A389-G393 PolarHBondContact O-N 3.31Å; A389-G393 VanDerWaalsContact O-N 3.08Å |
| 390 | S | 80.6 | Confident | 68.2 | Low | 75 Ų | 75 | 107.2 Ų | 107.2 | 52% | 0.524 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -67.6 | -39.4 | 179.1 | 69.2 | 0 | 0 | 0 | 0 | 112.5 | E386 E387 A392 G393 N394 | E386-S390 PolarHBondContact O-N 2.9Å; E387-S390 PolarHBondContact O-N 3.41Å; E387-S390 PolarHBondContact O-OG 3.1Å; S390-A392 VanDerWaalsContact C-N 3.3Å; S390-A392 PolarHBondContact O-N 3.01Å; S390-G393 PolarHBondContact O-N 3.5Å; S390-N394 PolarHBondContact O-N 3.03Å; S390-N394 VanDerWaalsContact O-N 3.14Å |
| 391 | L | 78.6 | Confident | 66.3 | Low | 115 Ų | 115 | 112.3 Ų | 112.3 | 60% | 0.602 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -64.2 | -32.5 | 173.9 | -70.9 | 172 | 0 | 0 | 0 | 112.9 | E387 | E387-L391 HydrophobicContact CG-CD1 4.28Å; E387-L391 WeakPolarHBondContact O-CB 3.46Å; E387-L391 VanDerWaalsContact O-CG 3.32Å; E387-L391 WeakPolarHBondContact O-CG 3.39Å; E387-L391 PolarHBondContact O-N 3.2Å; E387-L391 VanDerWaalsContact O-N 3.09Å |
| 392 | A | 73.4 | Confident | 64.7 | Low | 68 Ų | 68 | 115.2 Ų | 115.2 | 56% | 0.562 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.9 | -41.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | R388 A389 S390 | R388-A392 PolarHBondContact O-N 3.41Å; A389-A392 PolarHBondContact O-N 3.44Å; S390-A392 VanDerWaalsContact C-N 3.3Å; S390-A392 PolarHBondContact O-N 3.01Å |
| 393 | G | 63.1 | Low | 62.7 | Low | 56 Ų | 56 | 114.5 Ų | 114.5 | 58% | 0.577 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -66.7 | -34.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | A389 S390 R395 | A389-G393 PolarHBondContact O-N 3.31Å; A389-G393 VanDerWaalsContact O-N 3.08Å; S390-G393 PolarHBondContact O-N 3.5Å; G393-R395 PolarHBondContact O-N 3.07Å |
| 394 | N | 55 | Low | 60.5 | Low | 122 Ų | 122 | 117.4 Ų | 117.4 | 65% | 0.652 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -72.3 | -8 | -177.3 | -162.6 | 30.3 | 0 | 0 | 0 | 114.2 | S390 N396 S397 | S390-N394 PolarHBondContact O-N 3.03Å; S390-N394 VanDerWaalsContact O-N 3.14Å; N394-N396 PolarHBondContact O-N 2.9Å; N394-S397 PolarHBondContact O-N 3.24Å |
| 395 | R | 53.3 | Low | 58.2 | Low | 219 Ų | 219 | 124 Ų | 124 | 83% | 0.826 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -74.5 | -8.2 | -173.3 | -152.6 | 168.6 | 176 | 175.7 | -3.5 | 114.4 | G393 | G393-R395 PolarHBondContact O-N 3.07Š|
| 396 | N | 51.3 | Low | 56.2 | Low | 155 Ų | 155 | 127.2 Ų | 127.2 | 83% | 0.829 | 68% | 0.684 | S | S | * | * | G | 310 helix | trans | -94.8 | 2.2 | 178.3 | -74.1 | 5.5 | 0 | 0 | 0 | 114.5 | N394 | N394-N396 PolarHBondContact O-N 2.9Š|
| 397 | S | 50.8 | Low | 53.6 | Low | 97 Ų | 97 | 134.3 Ų | 134.3 | 68% | 0.678 | 71% | 0.706 | S | S | * | * | trans | -112.1 | 29.4 | -171.8 | -155.9 | 0 | 0 | 0 | 0 | 115.1 | N394 | N394-S397 PolarHBondContact O-N 3.24Š| ||
| 398 | M | 46.8 | Very low | 51.4 | Low | 166 Ų | 166 | 134 Ų | 134 | 82% | 0.818 | 72% | 0.715 | S | S | * | * | trans | -110.5 | 68.1 | 174.2 | -165.9 | 171.5 | -71.1 | 0 | 0 | 111.5 | I400 | M398-I400 PolarHBondContact O-N 3.3Š| ||
| 399 | V | 46.5 | Very low | 49.2 | Very low | 118 Ų | 118 | 132.9 Ų | 132.9 | 72% | 0.715 | 73% | 0.727 | S | S | * | * | trans | -80 | 107 | 170.4 | 179.3 | 0 | 0 | 0 | 0 | 108.8 | H401 | V399-H401 PolarHBondContact O-N 3.31Š| ||
| 400 | I | 44.3 | Very low | 46.8 | Very low | 137 Ų | 137 | 141.5 Ų | 141.5 | 70% | 0.703 | 75% | 0.746 | S | S | * | * | trans | -78.2 | 103.4 | 173.3 | -59.5 | 176.5 | 0 | 0 | 0 | 108.1 | M398 I402 | M398-I400 PolarHBondContact O-N 3.3Å; I400-I402 PolarHBondContact O-N 2.84Å | ||
| 401 | H | 35.2 | Very low | 44.6 | Very low | 171 Ų | 171 | 143.5 Ų | 143.5 | 79% | 0.792 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 118.3 | 169.6 | -97.3 | -86.8 | 0 | 0 | 0 | 110.4 | V399 | V399-H401 PolarHBondContact O-N 3.31Š|
| 402 | I | 39.2 | Very low | 42.5 | Very low | 145 Ų | 145 | 148.5 Ų | 148.5 | 74% | 0.744 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 122.6 | 163.5 | -57.5 | 176.4 | 0 | 0 | 0 | 106.7 | I400 | I400-I402 PolarHBondContact O-N 2.84Š|
| 403 | P | 37.3 | Very low | 40.3 | Very low | 120 Ų | 120 | 156.4 Ų | 156.4 | 78% | 0.779 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 128 | 174.7 | 31.4 | -31 | 0 | 0 | 0 | 110.8 | ||
| 404 | E | 32.9 | Very low | 38.7 | Very low | 195 Ų | 195 | 161.3 Ų | 161.3 | 91% | 0.911 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -93.1 | 138.7 | 163.7 | -85.4 | -169.4 | 123.1 | 0 | 0 | 110.8 | ||
| 405 | E | 30.4 | Very low | 37.4 | Very low | 184 Ų | 184 | 160.2 Ų | 160.2 | 86% | 0.86 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -79.2 | 150.5 | 175.9 | -87.3 | -86.5 | 140.2 | 0 | 0 | 111.9 | ||
| 406 | P | 38.5 | Very low | 36.1 | Very low | 110 Ų | 110 | 156.6 Ų | 156.6 | 71% | 0.714 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 141.7 | -166.2 | 34.4 | -34.8 | 0 | 0 | 0 | 114.2 | ||
| 407 | R | 27.8 | Very low | 35.1 | Very low | 248 Ų | 248 | 155.8 Ų | 155.8 | 94% | 0.936 | 80% | 0.795 | S | S | * | * | trans | -136.5 | 155.3 | 162.5 | -78.4 | -165.3 | 177 | -179.8 | 0.3 | 112.3 | ||||
| 408 | P | 36.8 | Very low | 34.1 | Very low | 115 Ų | 115 | 155.6 Ų | 155.6 | 75% | 0.747 | 80% | 0.8 | S | S | * | * | trans | -100 | 146.1 | -139.7 | 36.1 | -36.2 | 0 | 0 | 0 | 116.9 | ||||
| 409 | S | 31.7 | Very low | 33.5 | Very low | 108 Ų | 108 | 154.7 Ų | 154.7 | 76% | 0.755 | 80% | 0.798 | S | S | * | * | trans | 10.7 | 129.7 | 150 | 51.8 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 410 | R | 28.8 | Very low | 32.9 | Very low | 247 Ų | 247 | 155.8 Ų | 155.8 | 93% | 0.932 | 80% | 0.8 | S | S | * | * | -170 | 168.3 | 115.7 | -102.5 | -175.9 | 172.5 | -179.9 | -1.6 | 112.2 | |||||
| 411 | P | 34.6 | Very low | 32.3 | Very low | 118 Ų | 118 | 157.5 Ų | 157.5 | 77% | 0.766 | 80% | 0.804 | S | S | * | * | trans | -99.2 | 145.5 | -140.9 | 37 | -38.6 | 0 | 0 | 0 | 117.9 | ||||
| 412 | R | 34.9 | Very low | 32.2 | Very low | 219 Ų | 219 | 154.3 Ų | 154.3 | 83% | 0.826 | 80% | 0.802 | S | S | * | * | trans | -8.2 | 123.2 | 150.1 | -160.1 | -179.1 | -148.6 | 169.8 | 6 | 118.5 | ||||
| 413 | Y | 27.6 | Very low | 32 | Very low | 235 Ų | 235 | 153.9 Ų | 153.9 | 92% | 0.922 | 81% | 0.805 | S | S | * | * | trans | -138.3 | 151.5 | 138.2 | -147.7 | -97.2 | 0 | 0 | 0 | 109.6 | ||||
| 414 | K | 30 | Very low | 31.6 | Very low | 158 Ų | 158 | 153.9 Ų | 153.9 | 69% | 0.687 | 81% | 0.807 | S | S | * | * | trans | -104.4 | 145.5 | -175.3 | -82.3 | -173.9 | 167.7 | -164.7 | 0 | 111.8 | ||||
| 415 | A | 27.3 | Very low | 31.5 | Very low | 99 Ų | 99 | 149.4 Ų | 149.4 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | trans | -153.3 | 145.6 | 142.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 416 | D | 26.5 | Very low | 31.4 | Very low | 144 Ų | 144 | 146.1 Ų | 146.1 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | trans | -81.5 | 169.8 | -171.6 | -60.4 | -77.7 | 0 | 0 | 0 | 114.2 | ||||
| 417 | V | 30.1 | Very low | 31.1 | Very low | 137 Ų | 137 | 147.1 Ų | 147.1 | 83% | 0.83 | 80% | 0.797 | S | S | * | * | 175 | 121.5 | 121.7 | 155.5 | 0 | 0 | 0 | 0 | 111 | |||||
| 418 | A | 30.1 | Very low | 31.1 | Very low | 93 Ų | 93 | 140.9 Ų | 140.9 | 77% | 0.769 | 79% | 0.79 | S | S | * | * | trans | 49 | 142.8 | 147.8 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 419 | D | 32.3 | Very low | 30.6 | Very low | 147 Ų | 147 | 146.1 Ų | 146.1 | 79% | 0.786 | 80% | 0.797 | S | S | * | * | cis | -168.4 | -177.2 | -16.1 | -155.8 | -12.2 | 0 | 0 | 0 | 109.7 | ||||
| 420 | L | 34.1 | Very low | 30.5 | Very low | 142 Ų | 142 | 150.4 Ų | 150.4 | 74% | 0.743 | 80% | 0.796 | S | S | * | * | trans | 87.8 | 92.2 | 168.3 | -69.9 | 123.3 | 0 | 0 | 0 | 119.7 | ||||
| 421 | Q | 31.5 | Very low | 30.4 | Very low | 172 Ų | 172 | 144.8 Ų | 144.8 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | 39.5 | 139.6 | 115.4 | -68.9 | 179.7 | -10.9 | 0 | 0 | 119.6 | |||||
| 422 | S | 34.6 | Very low | 30.2 | Very low | 105 Ų | 105 | 145.7 Ų | 145.7 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | cis | -168.9 | -179.5 | 0.7 | 53.4 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 423 | V | 34.4 | Very low | 29.8 | Very low | 136 Ų | 136 | 142.5 Ų | 142.5 | 82% | 0.824 | 79% | 0.788 | S | S | * | * | cis | -135.6 | 168.4 | 12.6 | -171.8 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 424 | C | 29.8 | Very low | 29.8 | Very low | 120 Ų | 120 | 141.9 Ų | 141.9 | 81% | 0.811 | 79% | 0.786 | S | S | * | * | trans | -124.9 | 158.4 | -179.8 | -158.4 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 425 | S | 29.1 | Very low | 29.7 | Very low | 101 Ų | 101 | 138 Ų | 138 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | trans | -97.8 | 158.3 | 172.5 | -57.3 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 426 | C | 28.7 | Very low | 29.6 | Very low | 115 Ų | 115 | 137.4 Ų | 137.4 | 78% | 0.777 | 79% | 0.794 | S | S | * | * | trans | 75.8 | 87.8 | 154.8 | -57.9 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 427 | T | 31.7 | Very low | 29.5 | Very low | 130 Ų | 130 | 142.2 Ų | 142.2 | 80% | 0.798 | 80% | 0.802 | S | S | * | * | 69.3 | 134.9 | 122.8 | 37.2 | 0 | 0 | 0 | 0 | 124.4 | |||||
| 428 | C | 28.8 | Very low | 29.4 | Very low | 117 Ų | 117 | 141 Ų | 141 | 79% | 0.791 | 80% | 0.799 | S | S | * | * | trans | 82.2 | 108.2 | 150.7 | -64.7 | 0 | 0 | 0 | 0 | 120 | ||||
| 429 | Y | 25.3 | Very low | 29.2 | Very low | 226 Ų | 226 | 141.5 Ų | 141.5 | 89% | 0.886 | 80% | 0.803 | S | S | * | * | -157.2 | 167.1 | 100.7 | -146.2 | -112 | 0 | 0 | 0 | 113.7 | |||||
| 430 | R | 30.9 | Very low | 29 | Very low | 197 Ų | 197 | 138.9 Ų | 138.9 | 74% | 0.743 | 80% | 0.802 | S | S | * | * | trans | -96.5 | 142.8 | -177.8 | 168.2 | -176.7 | 177.7 | 156.7 | -2.2 | 109.8 | ||||
| 431 | S | 26 | Very low | 29.3 | Very low | 129 Ų | 129 | 137.6 Ų | 137.6 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | trans | -136.5 | 161.6 | 154.8 | -159.2 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 432 | Q | 31 | Very low | 29.1 | Very low | 137 Ų | 137 | 138.4 Ų | 138.4 | 64% | 0.64 | 81% | 0.806 | S | S | * | * | trans | -135.7 | 136.2 | -156 | 169.5 | 178.1 | -10 | 0 | 0 | 107.1 | ||||
| 433 | D | 26.5 | Very low | 28.7 | Very low | 152 Ų | 152 | 141.2 Ų | 141.2 | 81% | 0.813 | 81% | 0.813 | S | S | * | * | trans | -156.5 | 158.1 | 155.3 | -107.7 | -34.5 | 0 | 0 | 0 | 114.9 | ||||
| 434 | Y | 27.6 | Very low | 28.4 | Very low | 222 Ų | 222 | 140.7 Ų | 140.7 | 87% | 0.871 | 82% | 0.815 | S | S | * | * | trans | -65.6 | 154.7 | -155.2 | -84.6 | -112.5 | 0 | 0 | 0 | 119.4 | ||||
| 435 | G | 26.7 | Very low | 28.2 | Very low | 78 Ų | 78 | 144.5 Ų | 144.5 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | 168.1 | 106.9 | 150.8 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 436 | G | 25.4 | Very low | 28 | Very low | 85 Ų | 85 | 144.9 Ų | 144.9 | 88% | 0.876 | 82% | 0.821 | S | S | * | * | trans | 95.5 | 111.9 | 142.9 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 437 | R | 25.5 | Very low | 27.8 | Very low | 246 Ų | 246 | 143.7 Ų | 143.7 | 93% | 0.928 | 82% | 0.819 | S | S | * | * | trans | -58.9 | 153.4 | 173.9 | -62.5 | 165.2 | 163.6 | 167.9 | -5.5 | 116.6 | ||||
| 438 | S | 26.6 | Very low | 27.6 | Very low | 111 Ų | 111 | 147.1 Ų | 147.1 | 78% | 0.776 | 82% | 0.823 | S | S | * | * | 129.1 | 129.2 | 121.5 | -75.9 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 439 | A | 27.5 | Very low | 27.5 | Very low | 103 Ų | 103 | 149.5 Ų | 149.5 | 85% | 0.851 | 83% | 0.827 | S | S | * | * | trans | 59.5 | 135.9 | 142.8 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 440 | A | 26.5 | Very low | 27.7 | Very low | 92 Ų | 92 | 143.2 Ų | 143.2 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | trans | -85.9 | -173.1 | 159.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 441 | P | 41.6 | Very low | 27.9 | Very low | 115 Ų | 115 | 139.2 Ų | 139.2 | 75% | 0.747 | 82% | 0.821 | S | S | * | * | cis | -128.9 | -179.9 | -11.7 | 39.8 | -23.7 | 0 | 0 | 0 | 113.2 | ||||
| 442 | Q | 27.5 | Very low | 28 | Very low | 189 Ų | 189 | 141.6 Ų | 141.6 | 88% | 0.883 | 82% | 0.818 | S | S | * | * | trans | 163.8 | 147.8 | 131.6 | -92.6 | 176.6 | -9.3 | 0 | 0 | 114.2 | ||||
| 443 | N | 26.3 | Very low | 27.8 | Very low | 165 Ų | 165 | 146.2 Ų | 146.2 | 88% | 0.882 | 83% | 0.831 | S | S | * | * | trans | -81.3 | 138.2 | 165.3 | -71.7 | -32.6 | 0 | 0 | 0 | 110.8 | ||||
| 444 | S | 27.5 | Very low | 27.9 | Very low | 125 Ų | 125 | 148.4 Ų | 148.4 | 87% | 0.874 | 83% | 0.834 | S | S | * | * | trans | -162.5 | 172.2 | 147.3 | 53.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 445 | F | 26.1 | Very low | 27.9 | Very low | 200 Ų | 200 | 147 Ų | 147 | 88% | 0.877 | 84% | 0.835 | S | S | * | * | trans | -95 | 156.5 | -149.6 | -119 | -109.8 | 0 | 0 | 0 | 116.2 | ||||
| 446 | S | 23.9 | Very low | 28 | Very low | 109 Ų | 109 | 148.5 Ų | 148.5 | 76% | 0.762 | 83% | 0.833 | S | S | * | * | trans | 59.6 | 120.1 | 155.5 | -77.6 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 447 | A | 25 | Very low | 28.3 | Very low | 89 Ų | 89 | 151.1 Ų | 151.1 | 74% | 0.736 | 83% | 0.826 | S | S | * | * | -176.1 | 159.9 | 97.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 448 | K | 26.7 | Very low | 28.2 | Very low | 202 Ų | 202 | 145 Ų | 145 | 88% | 0.878 | 82% | 0.821 | S | S | * | * | trans | 86.9 | 135.3 | 160 | -63.8 | 176.2 | -177.6 | 175.8 | 0 | 119.5 | ||||
| 449 | L | 28.1 | Very low | 28.4 | Very low | 167 Ų | 167 | 149.2 Ų | 149.2 | 87% | 0.874 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 148.9 | -175.2 | -67.8 | 67.2 | 0 | 0 | 0 | 111.9 | ||
| 450 | A | 28.7 | Very low | 28.3 | Very low | 94 Ų | 94 | 153.7 Ų | 153.7 | 78% | 0.777 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -92.2 | 131 | 164.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 451 | P | 34.5 | Very low | 28.4 | Very low | 113 Ų | 113 | 156.1 Ų | 156.1 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -86 | 142.5 | 169.6 | 33.1 | -31.6 | 0 | 0 | 0 | 111.6 | ||
| 452 | H | 28.8 | Very low | 27.9 | Very low | 180 Ų | 180 | 159 Ų | 159 | 83% | 0.833 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 134.7 | 170.7 | -78.7 | -101.1 | 0 | 0 | 0 | 111.1 | ||
| 453 | Y | 26.9 | Very low | 28 | Very low | 233 Ų | 233 | 158.9 Ų | 158.9 | 91% | 0.914 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -75 | 123.9 | 170.6 | -89.3 | -98.9 | 0 | 0 | 0 | 111.1 | ||
| 454 | F | 29.2 | Very low | 28.5 | Very low | 199 Ų | 199 | 158.6 Ų | 158.6 | 87% | 0.873 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -83.2 | 134.9 | 162.6 | -93.4 | -101.2 | 0 | 0 | 0 | 109.8 | ||
| 455 | H | 26.9 | Very low | 28.4 | Very low | 191 Ų | 191 | 156.7 Ų | 156.7 | 88% | 0.884 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -88.8 | 116.2 | 162.2 | -112 | -58.2 | 0 | 0 | 0 | 109.2 | ||
| 456 | S | 28.8 | Very low | 28.7 | Very low | 111 Ų | 111 | 153.6 Ų | 153.6 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 129.8 | 176.1 | 43 | 0 | 0 | 0 | 0 | 111.5 | ||
| 457 | I | 31.1 | Very low | 29.1 | Very low | 140 Ų | 140 | 153 Ų | 153 | 72% | 0.718 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 120 | 166.7 | -65.3 | 173.8 | 0 | 0 | 0 | 107.4 | Y459 | I457-Y459 HydrophobicContact CG2-CD2 4.13Å; I457-Y459 HydrophobicContact CG2-CE2 3.76Å; I457-Y459 PolarHBondContact O-N 3.27Å |
| 458 | S | 25 | Very low | 29.6 | Very low | 118 Ų | 118 | 154.9 Ų | 154.9 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 118.1 | 177.5 | -174.3 | 0 | 0 | 0 | 0 | 110.4 | ||
| 459 | Y | 30.5 | Very low | 30 | Very low | 198 Ų | 198 | 153.5 Ų | 153.5 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 127 | 164.1 | -80.1 | -91.1 | 0 | 0 | 0 | 109.1 | I457 I461 | I457-Y459 HydrophobicContact CG2-CD2 4.13Å; I457-Y459 HydrophobicContact CG2-CE2 3.76Å; I457-Y459 PolarHBondContact O-N 3.27Å; Y459-I461 PolarHBondContact O-N 3.23Å |
| 460 | K | 24 | Very low | 30 | Very low | 197 Ų | 197 | 154.5 Ų | 154.5 | 86% | 0.857 | 80% | 0.803 | S | S | * | * | trans | -82.5 | 106.7 | 176.4 | -167.2 | -177 | -176.8 | -169.2 | 0 | 108.6 | ||||
| 461 | I | 30 | Very low | 30 | Very low | 143 Ų | 143 | 157.8 Ų | 157.8 | 73% | 0.733 | 81% | 0.808 | S | S | * | * | trans | -86 | 126.9 | 173.2 | -62.5 | 173.7 | 0 | 0 | 0 | 107.8 | Y459 | Y459-I461 PolarHBondContact O-N 3.23Š| ||
| 462 | E | 30.1 | Very low | 29.7 | Very low | 175 Ų | 175 | 158.2 Ų | 158.2 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -82 | 115.3 | 163.9 | -73.4 | -174.8 | 144.4 | 0 | 0 | 108.5 | I464 | E462-I464 PolarHBondContact O-N 3.27Š| ||
| 463 | E | 30.8 | Very low | 29.7 | Very low | 187 Ų | 187 | 158.1 Ų | 158.1 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 123.2 | 177 | -67.8 | -174.2 | 142.3 | 0 | 0 | 110.8 | ||
| 464 | I | 35.3 | Very low | 29.9 | Very low | 160 Ų | 160 | 156.1 Ų | 156.1 | 82% | 0.821 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -92.4 | 118.8 | 165.2 | -61.6 | 173.2 | 0 | 0 | 0 | 107.6 | E462 | E462-I464 PolarHBondContact O-N 3.27Š|
| 465 | S | 26.5 | Very low | 30.4 | Very low | 84 Ų | 84 | 152.8 Ų | 152.8 | 59% | 0.587 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 136.9 | -176 | -177.8 | 0 | 0 | 0 | 0 | 112.9 | S467 | S465-S467 VanDerWaalsContact C-N 3.31Å; S465-S467 PolarHBondContact O-N 3.22Å |
| 466 | P | 32.8 | Very low | 30.6 | Very low | 136 Ų | 136 | 148.3 Ų | 148.3 | 88% | 0.883 | 80% | 0.803 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80 | 71.6 | -177.6 | 33.8 | -36.5 | 0 | 0 | 0 | 112.4 | ||
| 467 | S | 31.3 | Very low | 31.3 | Very low | 97 Ų | 97 | 148.3 Ų | 148.3 | 68% | 0.678 | 80% | 0.801 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.3 | -4.3 | 175.3 | 55.1 | 0 | 0 | 0 | 0 | 115.9 | S465 | S465-S467 VanDerWaalsContact C-N 3.31Å; S465-S467 PolarHBondContact O-N 3.22Å |
| 468 | T | 36.2 | Very low | 31.3 | Very low | 128 Ų | 128 | 149.4 Ų | 149.4 | 79% | 0.785 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -105.4 | 17.6 | -172.7 | -26 | 0 | 0 | 0 | 0 | 115.2 | ||
| 469 | L | 33.9 | Very low | 31.4 | Very low | 173 Ų | 173 | 148.3 Ų | 148.3 | 91% | 0.906 | 80% | 0.799 | S | S | * | * | trans | -126.2 | 50.4 | 178.7 | -125.6 | 168.8 | 0 | 0 | 0 | 112.9 | ||||
| 470 | K | 29.7 | Very low | 31.3 | Very low | 187 Ų | 187 | 144 Ų | 144 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | trans | -129.7 | 128.6 | 159.8 | -76.2 | -177.2 | 175.4 | 177.8 | 0 | 108.7 | ||||
| 471 | N | 28.9 | Very low | 31.4 | Very low | 163 Ų | 163 | 141.9 Ų | 141.9 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | trans | 107.2 | 75.4 | 171 | -55.8 | -13.2 | 0 | 0 | 0 | 117.7 | ||||
| 472 | S | 27.8 | Very low | 31.5 | Very low | 123 Ų | 123 | 140.3 Ų | 140.3 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | -157.9 | 136.8 | 126 | 52.6 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 473 | L | 28.3 | Very low | 32 | Very low | 177 Ų | 177 | 137.9 Ų | 137.9 | 93% | 0.927 | 80% | 0.795 | S | S | * | * | trans | -94 | 157.2 | -163.4 | -69.3 | 124.8 | 0 | 0 | 0 | 114 | ||||
| 474 | F | 32 | Very low | 31.8 | Very low | 191 Ų | 191 | 132.6 Ų | 132.6 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | trans | -69.2 | 172 | 161.2 | -66.7 | -91.3 | 0 | 0 | 0 | 111.5 | ||||
| 475 | P | 37.9 | Very low | 31.4 | Very low | 129 Ų | 129 | 132.9 Ų | 132.9 | 84% | 0.838 | 79% | 0.793 | S | S | * | * | -142.8 | 158.3 | 88 | 33.5 | -15.7 | 0 | 0 | 0 | 116.5 | |||||
| 476 | S | 32.5 | Very low | 31.5 | Very low | 98 Ų | 98 | 138.1 Ų | 138.1 | 69% | 0.685 | 81% | 0.808 | S | S | * | * | trans | -91 | -177.8 | 171.9 | -38.2 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 477 | P | 42.7 | Very low | 31.1 | Very low | 111 Ų | 111 | 136.3 Ų | 136.3 | 72% | 0.721 | 80% | 0.798 | S | S | * | * | -139.1 | 133.2 | 116.7 | 20.1 | 0.8 | 0 | 0 | 0 | 114.1 | |||||
| 478 | I | 30.9 | Very low | 30.9 | Very low | 163 Ų | 163 | 141.4 Ų | 141.4 | 84% | 0.836 | 81% | 0.808 | S | S | * | * | 73.8 | 129.6 | 93.6 | -62.8 | 164.2 | 0 | 0 | 0 | 112 | |||||
| 479 | S | 26.8 | Very low | 30.5 | Very low | 95 Ų | 95 | 140.5 Ų | 140.5 | 66% | 0.664 | 80% | 0.803 | S | S | * | * | cis | -151.1 | 132.5 | 40.1 | 45.2 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 480 | S | 28.8 | Very low | 30.3 | Very low | 106 Ų | 106 | 138.9 Ų | 138.9 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | 58.4 | 141.9 | 94.4 | 82.3 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 481 | I | 26.7 | Very low | 30.3 | Very low | 154 Ų | 154 | 136.4 Ų | 136.4 | 79% | 0.79 | 79% | 0.786 | S | S | * | * | cis | -148.8 | 151.8 | 29.3 | -62.5 | 171 | 0 | 0 | 0 | 111.3 | ||||
| 482 | S | 31.5 | Very low | 30.3 | Very low | 110 Ų | 110 | 134.2 Ų | 134.2 | 77% | 0.769 | 77% | 0.771 | S | S | * | * | trans | -141.9 | 147.3 | 150.2 | -170.8 | 0 | 0 | 0 | 0 | 108 | ||||
| 483 | P | 41.8 | Very low | 30.3 | Very low | 123 Ų | 123 | 137.9 Ų | 137.9 | 80% | 0.799 | 77% | 0.766 | S | S | * | * | -152.9 | 169.5 | 104.8 | 39.2 | -22.1 | 0 | 0 | 0 | 115.4 | |||||
| 484 | G | 25.5 | Very low | 30.4 | Very low | 76 Ų | 76 | 136.5 Ų | 136.5 | 78% | 0.784 | 76% | 0.759 | S | S | * | * | trans | 172.6 | 81.3 | 168.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 485 | L | 27.3 | Very low | 30.4 | Very low | 167 Ų | 167 | 136.4 Ų | 136.4 | 87% | 0.874 | 76% | 0.763 | S | S | * | * | trans | -69 | 140.4 | 167.5 | -114.4 | 74.6 | 0 | 0 | 0 | 110.6 | ||||
| 486 | H | 27.4 | Very low | 30.1 | Very low | 194 Ų | 194 | 139.9 Ų | 139.9 | 90% | 0.898 | 77% | 0.765 | S | S | * | * | trans | -157.3 | 132.6 | 136.6 | -112.9 | -77.4 | 0 | 0 | 0 | 111.4 | ||||
| 487 | S | 25.6 | Very low | 30 | Very low | 98 Ų | 98 | 146.5 Ų | 146.5 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | trans | -93.8 | 139.3 | 174 | 173.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 488 | F | 26.6 | Very low | 29.8 | Very low | 203 Ų | 203 | 151.6 Ų | 151.6 | 89% | 0.89 | 78% | 0.78 | S | S | * | * | trans | -155.9 | 143.6 | 150.5 | -121.7 | -81.3 | 0 | 0 | 0 | 111.8 | ||||
| 489 | T | 28.6 | Very low | 29.8 | Very low | 109 Ų | 109 | 152.7 Ų | 152.7 | 67% | 0.669 | 78% | 0.778 | S | S | * | * | trans | -100.8 | 157.8 | -176.6 | 40.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 490 | D | 29.6 | Very low | 30.1 | Very low | 139 Ų | 139 | 152.7 Ų | 152.7 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | trans | 66.3 | 152.7 | 169.5 | -82.7 | -58 | 0 | 0 | 0 | 116.4 | ||||
| 491 | H | 28.2 | Very low | 30.7 | Very low | 136 Ų | 136 | 158.1 Ų | 158.1 | 63% | 0.63 | 81% | 0.807 | S | S | * | * | cis | -156.1 | 152.9 | 18.4 | -140.4 | 22.1 | 0 | 0 | 0 | 112.3 | ||||
| 492 | Q | 29.1 | Very low | 30.9 | Very low | 117 Ų | 117 | 158.3 Ų | 158.3 | 55% | 0.547 | 81% | 0.807 | S | S | . | * | trans | 63.4 | 129.8 | 140.4 | -79.3 | -174.9 | 34.9 | 0 | 0 | 125 | ||||
| 493 | R | 29 | Very low | 30.9 | Very low | 199 Ų | 199 | 160.8 Ų | 160.8 | 75% | 0.751 | 81% | 0.809 | S | S | * | * | trans | 89.1 | 113.6 | 135.2 | -74.5 | -178.3 | -148.2 | -145 | 4.8 | 122.6 | ||||
| 494 | L | 29.7 | Very low | 30.3 | Very low | 149 Ų | 149 | 162.9 Ų | 162.9 | 78% | 0.78 | 81% | 0.81 | S | S | * | * | 47.4 | 113.2 | 120.8 | -66.9 | 165 | 0 | 0 | 0 | 119.6 | |||||
| 495 | M | 32.3 | Very low | 30.5 | Very low | 188 Ų | 188 | 168.1 Ų | 168.1 | 93% | 0.926 | 81% | 0.812 | S | S | * | * | -147 | 115.9 | 126.9 | -101.6 | -59.5 | -177.9 | 0 | 0 | 110.7 | |||||
| 496 | K | 31.3 | Very low | 30.7 | Very low | 202 Ų | 202 | 168.1 Ų | 168.1 | 88% | 0.878 | 81% | 0.808 | S | S | * | * | trans | -119 | 102.5 | 172.3 | -178.1 | -178.8 | -173.1 | 175 | 0 | 107.2 | ||||
| 497 | R | 31.4 | Very low | 31 | Very low | 238 Ų | 238 | 166.4 Ų | 166.4 | 90% | 0.898 | 80% | 0.802 | S | S | * | * | trans | -135.3 | 122.4 | 172.5 | -143.5 | -178.7 | -177.9 | -176 | -0.4 | 112.8 | ||||
| 498 | R | 37.1 | Very low | 31.3 | Very low | 218 Ų | 218 | 171.3 Ų | 171.3 | 82% | 0.823 | 81% | 0.81 | S | S | * | * | trans | -54.5 | 168 | 158.5 | -65.4 | 170 | 165.2 | 165.5 | -8 | 109.5 | ||||
| 499 | K | 31.6 | Very low | 31.7 | Very low | 185 Ų | 185 | 168.8 Ų | 168.8 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | cis | -171 | 167.6 | 41.1 | -148 | 170.4 | -175.9 | -167.8 | 0 | 110.4 | ||||
| 500 | S | 32.7 | Very low | 32 | Very low | 96 Ų | 96 | 173.8 Ų | 173.8 | 67% | 0.671 | 82% | 0.815 | S | S | * | * | trans | -44.6 | 147.2 | 167.6 | 52.7 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 501 | V | 41.6 | Very low | 32.2 | Very low | 219 Ų | 219 | 177 Ų | 177 | 100% | 1.327 | 82% | 0.821 | S | S | * | * | -117.7 | 0 | 116.9 | 175.6 | 0 | 0 | 0 | 0 | 106.5 |
Retrieved 501 of 501 residues in 2610 ms
(Link to these results)