| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 42.3 | Very low | 46 | Very low | 226 Ų | 226 | 148.9 Ų | 148.9 | 100% | 1.113 | 83% | 0.834 | S | S | * | * | 0 | 87.3 | 0 | -74.3 | 174.5 | 167.6 | 0 | 0 | 107.9 | |||||
| 2 | F | 46.7 | Very low | 46.1 | Very low | 196 Ų | 196 | 139.3 Ų | 139.3 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | trans | -143.8 | 120.7 | 175.3 | -51.6 | -69.9 | 0 | 0 | 0 | 106.8 | ||||
| 3 | D | 39.2 | Very low | 46.6 | Very low | 168 Ų | 168 | 136.5 Ų | 136.5 | 90% | 0.898 | 78% | 0.775 | S | S | * | * | trans | 169.7 | 96.6 | 141.1 | -93.9 | -42.5 | 0 | 0 | 0 | 108 | ||||
| 4 | T | 43.9 | Very low | 47.1 | Very low | 142 Ų | 142 | 130.4 Ų | 130.4 | 87% | 0.871 | 75% | 0.745 | S | S | * | * | trans | -108.5 | 116.6 | 178 | -63.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 5 | T | 40.2 | Very low | 47.7 | Very low | 133 Ų | 133 | 127.8 Ų | 127.8 | 82% | 0.816 | 74% | 0.738 | S | S | * | * | trans | -162.2 | 137.8 | 165.9 | -79.4 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 6 | P | 52.8 | Low | 48.2 | Very low | 105 Ų | 105 | 123.6 Ų | 123.6 | 68% | 0.682 | 72% | 0.718 | S | S | * | * | cis | -132.3 | -168.2 | 26.1 | 29.1 | -5.3 | 0 | 0 | 0 | 115.8 | ||||
| 7 | H | 45.2 | Very low | 48.9 | Very low | 176 Ų | 176 | 121.6 Ų | 121.6 | 82% | 0.815 | 71% | 0.711 | S | S | * | * | trans | 79.6 | 68.5 | 158.9 | -85.6 | -77.8 | 0 | 0 | 0 | 120.6 | G9 | H7-G9 PolarHBondContact O-N 3.33Š| ||
| 8 | S | 47.3 | Very low | 49.4 | Very low | 98 Ų | 98 | 119.9 Ų | 119.9 | 69% | 0.685 | 71% | 0.706 | S | S | * | * | 20.1 | 90.9 | 121.4 | -84.5 | 0 | 0 | 0 | 0 | 117.9 | R10 | S8-R10 PolarHBondContact O-N 3.07Š| |||
| 9 | G | 48.8 | Very low | 49.7 | Very low | 82 Ų | 82 | 117.4 Ų | 117.4 | 85% | 0.845 | 69% | 0.689 | S | S | * | * | trans | -70.5 | 51.6 | 152.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | H7 S11 | H7-G9 PolarHBondContact O-N 3.33Å; G9-S11 PolarHBondContact O-N 3.31Å | ||
| 10 | R | 47.8 | Very low | 50.4 | Low | 186 Ų | 186 | 117.6 Ų | 117.6 | 70% | 0.702 | 68% | 0.677 | S | S | * | * | trans | -79.5 | 87.3 | -168.4 | -170 | -168.9 | -174.8 | -119.4 | 16.9 | 110.3 | S8 S12 | S8-R10 PolarHBondContact O-N 3.07Å; R10-S12 WeakPolarHBondContact CD-OG 3.31Å; R10-S12 WeakPolarHBondContact CG-OG 3.44Å; R10-S12 PolarHBondContact NH1-OG 2.88Å; R10-S12 PolarHBondContact O-N 3.47Å; R10-S12 PolarHBondContact O-OG 3.41Å | ||
| 11 | S | 51.2 | Low | 51 | Low | 126 Ų | 126 | 119.4 Ų | 119.4 | 88% | 0.881 | 68% | 0.677 | S | S | * | * | trans | -58.7 | 78.2 | 159.2 | -76.5 | 0 | 0 | 0 | 0 | 109.7 | G9 | G9-S11 PolarHBondContact O-N 3.31Š| ||
| 12 | S | 48.3 | Very low | 52.1 | Low | 34 Ų | 34 | 116.9 Ų | 116.9 | 24% | 0.238 | 66% | 0.655 | C | S | . | * | trans | -69.1 | 146.4 | -175.6 | -58.5 | 0 | 0 | 0 | 0 | 108.6 | R10 S14 S15 | R10-S12 WeakPolarHBondContact CD-OG 3.31Å; R10-S12 WeakPolarHBondContact CG-OG 3.44Å; R10-S12 PolarHBondContact NH1-OG 2.88Å; R10-S12 PolarHBondContact O-N 3.47Å; R10-S12 PolarHBondContact O-OG 3.41Å; S12-S14 PolarHBondContact O-N 3.23Å; S12-S15 PolarHBondContact O-N 2.73Å | ||
| 13 | P | 52.4 | Low | 52.8 | Low | 103 Ų | 103 | 111.9 Ų | 111.9 | 67% | 0.669 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -62.1 | -0.1 | 179.2 | 25.3 | -34.8 | 0 | 0 | 0 | 114.5 | S15 | P13-S15 VanDerWaalsContact C-N 3.34Š|
| 14 | S | 53.8 | Low | 53.9 | Low | 51 Ų | 51 | 111.8 Ų | 111.8 | 36% | 0.357 | 63% | 0.631 | S | S | . | * | G | 310 helix | trans | -82.4 | 4.6 | 176.6 | -154.4 | 0 | 0 | 0 | 0 | 114.4 | S12 S16 R20 | S12-S14 PolarHBondContact O-N 3.23Å; S14-S16 PolarHBondContact O-N 2.74Å; S14-R20 WeakPolarHBondContact O-CD 3.43Å; S14-R20 WeakPolarHBondContact O-CG 3.34Å; S14-R20 PolarHBondContact O-NE 2.89Å |
| 15 | S | 55.7 | Low | 54.8 | Low | 91 Ų | 91 | 112 Ų | 112 | 64% | 0.636 | 63% | 0.627 | S | S | * | * | G | 310 helix | trans | -69.9 | -29.9 | -179.9 | -162 | 0 | 0 | 0 | 0 | 113.2 | S12 P13 R20 | S12-S15 PolarHBondContact O-N 2.73Å; P13-S15 VanDerWaalsContact C-N 3.34Å; S15-R20 PolarHBondContact O-NH2 2.91Å |
| 16 | S | 55 | Low | 55.9 | Low | 60 Ų | 60 | 111.2 Ų | 111.2 | 42% | 0.42 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -73.5 | 127.1 | 177.1 | -54.5 | 0 | 0 | 0 | 0 | 112.4 | S14 S18 L19 R20 | S14-S16 PolarHBondContact O-N 2.74Å; S16-S18 VanDerWaalsContact C-N 3.31Å; S16-S18 PolarHBondContact O-N 3.03Å; S16-L19 PolarHBondContact O-N 2.76Å; S16-R20 PolarHBondContact O-N 3.02Å; S16-R20 VanDerWaalsContact O-N 3.08Å |
| 17 | P | 61.3 | Low | 56.4 | Low | 91 Ų | 91 | 111.4 Ų | 111.4 | 59% | 0.591 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -62.1 | -36.8 | -176.5 | 24.3 | -33.8 | 0 | 0 | 0 | 112.8 | L19 R20 K21 | P17-L19 VanDerWaalsContact C-N 3.29Å; P17-L19 PolarHBondContact O-N 3.27Å; P17-R20 PolarHBondContact O-N 2.65Å; P17-K21 PolarHBondContact O-N 3.5Å |
| 18 | S | 57.4 | Low | 56.7 | Low | 91 Ų | 91 | 109.2 Ų | 109.2 | 64% | 0.636 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -67.1 | -28 | 176.2 | -47.6 | 0 | 0 | 0 | 0 | 113.4 | S16 | S16-S18 VanDerWaalsContact C-N 3.31Å; S16-S18 PolarHBondContact O-N 3.03Å |
| 19 | L | 55.3 | Low | 56.9 | Low | 71 Ų | 71 | 112.8 Ų | 112.8 | 37% | 0.372 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -80.7 | -35.7 | 175.9 | -62.5 | -178.8 | 0 | 0 | 0 | 111.2 | S16 P17 K21 R22 L23 | S16-L19 PolarHBondContact O-N 2.76Å; P17-L19 VanDerWaalsContact C-N 3.29Å; P17-L19 PolarHBondContact O-N 3.27Å; L19-K21 PolarHBondContact O-N 3.15Å; L19-R22 PolarHBondContact O-N 3.22Å; L19-R22 VanDerWaalsContact O-N 3.13Å; L19-L23 WeakPolarHBondContact O-CB 3.37Å; L19-L23 VanDerWaalsContact O-CG 3.27Å; L19-L23 WeakPolarHBondContact O-CG 3.38Å; L19-L23 PolarHBondContact O-N 2.88Å |
| 20 | R | 62.4 | Low | 56.6 | Low | 121 Ų | 121 | 120 Ų | 120 | 46% | 0.457 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -54.7 | -49.2 | 173.2 | -64.7 | -177.1 | -145.5 | 167 | 10.7 | 112 | S14 S15 S16 P17 R22 L23 Q24 | S14-R20 WeakPolarHBondContact O-CD 3.43Å; S14-R20 WeakPolarHBondContact O-CG 3.34Å; S14-R20 PolarHBondContact O-NE 2.89Å; S15-R20 PolarHBondContact O-NH2 2.91Å; S16-R20 PolarHBondContact O-N 3.02Å; S16-R20 VanDerWaalsContact O-N 3.08Å; P17-R20 PolarHBondContact O-N 2.65Å; R20-R22 VanDerWaalsContact C-N 3.28Å; R20-R22 PolarHBondContact O-N 3.34Å; R20-L23 PolarHBondContact O-N 3.09Å; R20-Q24 WeakPolarHBondContact O-CB 3.38Å; R20-Q24 WeakPolarHBondContact O-CG 3.43Å; R20-Q24 PolarHBondContact O-N 3.47Å |
| 21 | K | 64.1 | Low | 57.1 | Low | 156 Ų | 156 | 116.5 Ų | 116.5 | 68% | 0.678 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -57.6 | -40.4 | 177.2 | -69.5 | -168.8 | 176.4 | -171.1 | 0 | 112.6 | P17 L19 L25 | P17-K21 PolarHBondContact O-N 3.5Å; L19-K21 PolarHBondContact O-N 3.15Å; K21-L25 WeakPolarHBondContact O-CD1 3.16Å; K21-L25 WeakPolarHBondContact O-CG 3.23Å |
| 22 | R | 64.6 | Low | 56.9 | Low | 174 Ų | 174 | 116.3 Ų | 116.3 | 66% | 0.657 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -75.3 | -33.3 | -179.3 | -168.5 | 172.6 | -69.1 | 159.7 | -1.7 | 112.7 | L19 R20 L25 | L19-R22 PolarHBondContact O-N 3.22Å; L19-R22 VanDerWaalsContact O-N 3.13Å; R20-R22 VanDerWaalsContact C-N 3.28Å; R20-R22 PolarHBondContact O-N 3.34Å; R22-L25 PolarHBondContact O-N 3.4Å |
| 23 | L | 62.8 | Low | 56.9 | Low | 91 Ų | 91 | 120.4 Ų | 120.4 | 48% | 0.476 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -75.9 | -32 | 176.5 | -69.9 | 167.7 | 0 | 0 | 0 | 112.5 | L19 R20 L25 L26 | L19-L23 WeakPolarHBondContact O-CB 3.37Å; L19-L23 VanDerWaalsContact O-CG 3.27Å; L19-L23 WeakPolarHBondContact O-CG 3.38Å; L19-L23 PolarHBondContact O-N 2.88Å; R20-L23 PolarHBondContact O-N 3.09Å; L23-L25 PolarHBondContact O-N 3.31Å; L23-L26 PolarHBondContact O-N 3.06Å |
| 24 | Q | 61.1 | Low | 56.2 | Low | 165 Ų | 165 | 120.7 Ų | 120.7 | 77% | 0.771 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | -20.9 | 172.1 | -77.4 | 175.2 | -33.7 | 0 | 0 | 113.3 | R20 | R20-Q24 WeakPolarHBondContact O-CB 3.38Å; R20-Q24 WeakPolarHBondContact O-CG 3.43Å; R20-Q24 PolarHBondContact O-N 3.47Å |
| 25 | L | 64.3 | Low | 55.8 | Low | 148 Ų | 148 | 124.1 Ų | 124.1 | 78% | 0.775 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.6 | 2.5 | 178.2 | -66.6 | 168.9 | 0 | 0 | 0 | 113.2 | K21 R22 L23 | K21-L25 WeakPolarHBondContact O-CD1 3.16Å; K21-L25 WeakPolarHBondContact O-CG 3.23Å; R22-L25 PolarHBondContact O-N 3.4Å; L23-L25 PolarHBondContact O-N 3.31Å |
| 26 | L | 63.1 | Low | 55.1 | Low | 116 Ų | 116 | 127.4 Ų | 127.4 | 61% | 0.607 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -128.6 | 132.1 | -170.4 | -129.5 | 71.3 | 0 | 0 | 0 | 112.3 | L23 | L23-L26 PolarHBondContact O-N 3.06Š|
| 27 | P | 61.5 | Low | 55.3 | Low | 109 Ų | 109 | 130.1 Ų | 130.1 | 71% | 0.708 | 71% | 0.71 | S | S | * | * | trans | -66.9 | 149 | 175.2 | 25.8 | -32.8 | 0 | 0 | 0 | 112.7 | ||||
| 28 | P | 53.1 | Low | 54.7 | Low | 129 Ų | 129 | 133.6 Ų | 133.6 | 84% | 0.838 | 72% | 0.718 | S | S | * | * | trans | -88.9 | 132.3 | -163.5 | 33.2 | -36.1 | 0 | 0 | 0 | 115.4 | ||||
| 29 | I | 51 | Low | 54.5 | Low | 173 Ų | 173 | 135.5 Ų | 135.5 | 89% | 0.887 | 73% | 0.728 | S | S | * | * | trans | -138.7 | 162.4 | 177.7 | -54.5 | -177.1 | 0 | 0 | 0 | 112 | ||||
| 30 | R | 42.4 | Very low | 53.9 | Low | 235 Ų | 235 | 135.4 Ų | 135.4 | 89% | 0.887 | 75% | 0.745 | S | S | * | * | trans | -103.1 | 151.3 | -149.9 | -176 | 179.3 | 174.4 | 175.5 | -2 | 115.9 | ||||
| 31 | P | 57.3 | Low | 53 | Low | 111 Ų | 111 | 136.2 Ų | 136.2 | 72% | 0.721 | 76% | 0.763 | S | S | * | * | trans | -92.1 | -174.3 | 179.3 | 40.6 | -40.1 | 0 | 0 | 0 | 113.8 | ||||
| 32 | P | 48.7 | Very low | 52.3 | Low | 123 Ų | 123 | 136.2 Ų | 136.2 | 80% | 0.799 | 77% | 0.767 | S | S | * | * | cis | -133.9 | -103.2 | 26 | 27.2 | 2.3 | 0 | 0 | 0 | 123.3 | ||||
| 33 | P | 48.2 | Very low | 52.1 | Low | 120 Ų | 120 | 133.3 Ų | 133.3 | 78% | 0.779 | 77% | 0.769 | S | S | * | * | -131.3 | 164.6 | -121.6 | 42 | -24.7 | 0 | 0 | 0 | 120.5 | |||||
| 34 | A | 37.2 | Very low | 51.8 | Low | 109 Ų | 109 | 137.2 Ų | 137.2 | 90% | 0.901 | 78% | 0.784 | S | S | * | * | trans | -174.8 | 168.4 | 149.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 35 | S | 45.1 | Very low | 51.7 | Low | 122 Ų | 122 | 138.6 Ų | 138.6 | 85% | 0.853 | 79% | 0.788 | S | S | * | * | trans | -135.6 | 161.6 | -163.8 | 53.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 36 | E | 40.4 | Very low | 50.7 | Low | 161 Ų | 161 | 134.8 Ų | 134.8 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | trans | -62.2 | 179.6 | 168.7 | -90.4 | -88.3 | 124.6 | 0 | 0 | 114.8 | ||||
| 37 | P | 59.9 | Low | 50.6 | Low | 117 Ų | 117 | 134.9 Ų | 134.9 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | cis | -152.4 | -180 | 32.3 | 43.3 | -20.5 | 0 | 0 | 0 | 121.9 | ||||
| 38 | E | 48.2 | Very low | 49.7 | Very low | 163 Ų | 163 | 136.7 Ų | 136.7 | 76% | 0.762 | 80% | 0.798 | S | S | * | * | trans | -92.2 | 153.8 | 169.2 | -57.2 | -145.7 | 148 | 0 | 0 | 115.8 | ||||
| 39 | P | 53.7 | Low | 49.6 | Very low | 132 Ų | 132 | 135.2 Ų | 135.2 | 86% | 0.857 | 79% | 0.791 | S | S | * | * | -153.4 | -178.1 | 118.8 | 39.7 | -22.5 | 0 | 0 | 0 | 114.9 | |||||
| 40 | G | 42 | Very low | 49.1 | Very low | 69 Ų | 69 | 132.7 Ų | 132.7 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | cis | 156.7 | 125.5 | -15.4 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 41 | T | 45.4 | Very low | 49.2 | Very low | 138 Ų | 138 | 126.5 Ų | 126.5 | 85% | 0.847 | 78% | 0.782 | S | S | * | * | trans | 69.5 | 166 | 154.9 | -155.9 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 42 | M | 48.8 | Very low | 48.9 | Very low | 155 Ų | 155 | 129.2 Ų | 129.2 | 76% | 0.764 | 79% | 0.785 | S | S | * | * | trans | 96.3 | 140.7 | 177.9 | -54.6 | -44 | -109.6 | 0 | 0 | 117.2 | ||||
| 43 | V | 60.3 | Low | 48.8 | Very low | 114 Ų | 114 | 132.4 Ų | 132.4 | 69% | 0.691 | 79% | 0.786 | S | S | * | * | cis | -158.5 | 154.9 | -21.7 | -88.3 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 44 | E | 55.2 | Low | 48.7 | Very low | 172 Ų | 172 | 132 Ų | 132 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | 58 | 151.2 | 144.1 | -83 | -79.9 | 54.7 | 0 | 0 | 128.1 | ||||
| 45 | K | 59.2 | Low | 48.9 | Very low | 195 Ų | 195 | 130.2 Ų | 130.2 | 85% | 0.848 | 78% | 0.778 | S | S | * | * | trans | -75.5 | 172 | 175 | -73.2 | 171.7 | 162.5 | -173.2 | 0 | 114 | ||||
| 46 | G | 43.6 | Very low | 48.8 | Very low | 68 Ų | 68 | 131.3 Ų | 131.3 | 70% | 0.701 | 78% | 0.78 | S | S | * | * | cis | 163.1 | 170.7 | -5.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 47 | S | 61 | Low | 49.1 | Very low | 117 Ų | 117 | 129.5 Ų | 129.5 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | 36.6 | 120.2 | 160.6 | -54.8 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 48 | D | 42.5 | Very low | 48.3 | Very low | 147 Ų | 147 | 126.8 Ų | 126.8 | 79% | 0.786 | 78% | 0.778 | S | S | * | * | -178.3 | 175.4 | 94.3 | -122.6 | -131.2 | 0 | 0 | 0 | 110.1 | |||||
| 49 | S | 52.5 | Low | 48.1 | Very low | 98 Ų | 98 | 125.6 Ų | 125.6 | 69% | 0.685 | 78% | 0.782 | S | S | * | * | cis | -153.3 | 159.8 | -5.5 | -153.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 50 | S | 39.3 | Very low | 47.8 | Very low | 120 Ų | 120 | 126.7 Ų | 126.7 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | -171.1 | 117.6 | 151.1 | -166.8 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 51 | S | 44.8 | Very low | 48.3 | Very low | 105 Ų | 105 | 128.5 Ų | 128.5 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | trans | -95.9 | 148.5 | 171.6 | 178.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 52 | E | 51.8 | Low | 48.2 | Very low | 169 Ų | 169 | 127.5 Ų | 127.5 | 79% | 0.79 | 78% | 0.775 | S | S | * | * | cis | -149.4 | 161 | 37 | 53.3 | -169.9 | 79.2 | 0 | 0 | 109.5 | ||||
| 53 | K | 46.1 | Very low | 48.4 | Very low | 189 Ų | 189 | 126.7 Ų | 126.7 | 82% | 0.822 | 77% | 0.77 | S | S | * | * | cis | -173.1 | 145.7 | 44.6 | -177.4 | -173.1 | 176.4 | -177.8 | 0 | 111.8 | ||||
| 54 | S | 45.2 | Very low | 48.1 | Very low | 112 Ų | 112 | 126.5 Ų | 126.5 | 78% | 0.783 | 77% | 0.773 | S | S | * | * | trans | 77 | 105.5 | 154.5 | -175.7 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 55 | G | 42.9 | Very low | 48.2 | Very low | 71 Ų | 71 | 126 Ų | 126 | 73% | 0.732 | 78% | 0.775 | S | S | * | * | trans | 77 | 152.5 | 140.2 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 56 | V | 42.6 | Very low | 47.9 | Very low | 146 Ų | 146 | 119.5 Ų | 119.5 | 89% | 0.885 | 76% | 0.764 | S | S | * | * | cis | -146 | 177.6 | 1.5 | -57.9 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 57 | S | 45.8 | Very low | 48.4 | Very low | 122 Ų | 122 | 119.6 Ų | 119.6 | 85% | 0.853 | 75% | 0.754 | S | S | * | * | trans | -70.1 | 145.9 | -174.6 | -174.1 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 58 | G | 42.7 | Very low | 48.3 | Very low | 61 Ų | 61 | 124.3 Ų | 124.3 | 63% | 0.629 | 75% | 0.754 | S | S | * | * | trans | 84.2 | 157.4 | 153.5 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 59 | T | 45.6 | Very low | 49.1 | Very low | 137 Ų | 137 | 122.4 Ų | 122.4 | 84% | 0.84 | 74% | 0.744 | S | S | * | * | cis | -155.9 | 145.5 | -1.6 | 47.7 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 60 | L | 46.1 | Very low | 49.3 | Very low | 155 Ų | 155 | 125.9 Ų | 125.9 | 81% | 0.812 | 75% | 0.747 | S | S | * | * | trans | 48 | 107.9 | 139.7 | -150.3 | 71.1 | 0 | 0 | 0 | 120.7 | T62 | L60-T62 PolarHBondContact O-N 3.2Š| ||
| 61 | S | 52.9 | Low | 50.3 | Low | 108 Ų | 108 | 125.6 Ų | 125.6 | 76% | 0.755 | 74% | 0.735 | S | S | * | * | trans | -6.5 | 115.6 | 139.4 | 164.3 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 62 | T | 43.9 | Very low | 51.1 | Low | 116 Ų | 116 | 129.3 Ų | 129.3 | 71% | 0.712 | 73% | 0.732 | S | S | * | * | trans | -112.6 | 112.3 | 161.4 | 35.4 | 0 | 0 | 0 | 0 | 111.7 | L60 | L60-T62 PolarHBondContact O-N 3.2Š| ||
| 63 | Q | 53.3 | Low | 51.4 | Low | 139 Ų | 139 | 124.1 Ų | 124.1 | 65% | 0.65 | 71% | 0.71 | S | S | * | * | trans | 5.7 | 105.5 | 163.3 | 50.5 | -91.3 | 8 | 0 | 0 | 119.8 | L65 | Q63-L65 HydrophobicContact CB-CB 4.44Å; Q63-L65 HydrophobicContact CB-CD1 3.91Å; Q63-L65 HydrophobicContact CB-CG 4.04Å; Q63-L65 PolarHBondContact O-N 3.11Å | ||
| 64 | S | 53 | Low | 52.2 | Low | 109 Ų | 109 | 117.5 Ų | 117.5 | 76% | 0.762 | 69% | 0.688 | S | S | * | * | trans | -75.5 | 70.4 | 158.8 | -174.7 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 65 | L | 57.6 | Low | 53.4 | Low | 161 Ų | 161 | 120.3 Ų | 120.3 | 84% | 0.843 | 69% | 0.686 | S | S | * | * | trans | -110.3 | 73.2 | 177.2 | -71.6 | 172.9 | 0 | 0 | 0 | 110.7 | Q63 | Q63-L65 HydrophobicContact CB-CB 4.44Å; Q63-L65 HydrophobicContact CB-CD1 3.91Å; Q63-L65 HydrophobicContact CB-CG 4.04Å; Q63-L65 PolarHBondContact O-N 3.11Å | ||
| 66 | G | 53.4 | Low | 54.9 | Low | 59 Ų | 59 | 122.3 Ų | 122.3 | 61% | 0.608 | 68% | 0.675 | S | S | * | * | S | Bend | trans | 172.8 | -32.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 116.9 | R68 | G66-R68 VanDerWaalsContact C-N 3.26Å; G66-R68 PolarHBondContact O-N 2.92Å |
| 67 | S | 54 | Low | 56.3 | Low | 71 Ų | 71 | 121.2 Ų | 121.2 | 50% | 0.497 | 66% | 0.661 | S | S | . | * | G | 310 helix | trans | -76.4 | 1.2 | -162.3 | -50.3 | 0 | 0 | 0 | 0 | 116.7 | N69 F70 | S67-N69 PolarHBondContact O-N 2.72Å; S67-F70 PolarHBondContact O-N 3.32Å |
| 68 | R | 58.1 | Low | 57.6 | Low | 216 Ų | 216 | 120.7 Ų | 120.7 | 82% | 0.815 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -69.8 | -5 | -172 | -152.5 | 168.2 | 175.8 | -174.5 | -2.7 | 114.6 | G66 R72 | G66-R68 VanDerWaalsContact C-N 3.26Å; G66-R68 PolarHBondContact O-N 2.92Å; R68-R72 PolarHBondContact O-NE 3.03Å |
| 69 | N | 59.3 | Low | 59.1 | Low | 107 Ų | 107 | 121 Ų | 121 | 57% | 0.572 | 64% | 0.638 | S | S | * | * | G | 310 helix | trans | -98.3 | -33.9 | 175.7 | -66.6 | -39.3 | 0 | 0 | 0 | 113.5 | S67 R72 N73 | S67-N69 PolarHBondContact O-N 2.72Å; N69-R72 PolarHBondContact O-N 2.7Å; N69-R72 PolarHBondContact OD1-NH2 2.81Å; N69-N73 PolarHBondContact O-N 3.48Å |
| 70 | F | 57.1 | Low | 60.5 | Low | 171 Ų | 171 | 121.9 Ų | 121.9 | 75% | 0.75 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -69.4 | -42.5 | -175.9 | -158 | -99.5 | 0 | 0 | 0 | 111.6 | S67 R72 N73 S74 | S67-F70 PolarHBondContact O-N 3.32Å; F70-R72 PolarHBondContact O-N 3.33Å; F70-N73 PolarHBondContact O-N 2.97Å; F70-S74 PolarHBondContact O-N 3.43Å |
| 71 | I | 59.9 | Low | 61.7 | Low | 114 Ų | 114 | 121.5 Ų | 121.5 | 59% | 0.585 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -63.1 | -28.8 | -180 | -54.4 | 166.4 | 0 | 0 | 0 | 112.2 | S74 | I71-S74 PolarHBondContact O-OG 3.28Å |
| 72 | R | 61.8 | Low | 62.6 | Low | 182 Ų | 182 | 118.5 Ų | 118.5 | 69% | 0.687 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -79.8 | -21.5 | 176.3 | -63.6 | -171.2 | -71.9 | 163.7 | 1.9 | 112.7 | R68 N69 F70 | R68-R72 PolarHBondContact O-NE 3.03Å; N69-R72 PolarHBondContact O-N 2.7Å; N69-R72 PolarHBondContact OD1-NH2 2.81Å; F70-R72 PolarHBondContact O-N 3.33Å |
| 73 | N | 58.8 | Low | 64.1 | Low | 61 Ų | 61 | 118.2 Ų | 118.2 | 33% | 0.326 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -90.4 | -30.8 | 177.6 | -160.8 | -33.8 | 0 | 0 | 0 | 111.5 | N69 F70 K75 K76 M77 | N69-N73 PolarHBondContact O-N 3.48Å; F70-N73 PolarHBondContact O-N 2.97Å; N73-K75 PolarHBondContact O-N 2.86Å; N73-K76 WeakPolarHBondContact O-CB 3.04Å; N73-K76 PolarHBondContact O-N 3.03Å; N73-K76 VanDerWaalsContact O-N 3.13Å; N73-K76 WeakPolarHBondContact OD1-CE 3.43Å; N73-K76 PolarHBondContact OD1-NZ 3.13Å; N73-M77 PolarHBondContact O-N 3.36Å; N73-M77 WeakPolarHBondContact OD1-CG 3.45Å |
| 74 | S | 62.8 | Low | 65 | Low | 50 Ų | 50 | 118 Ų | 118 | 35% | 0.35 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -58 | -44.2 | -176.4 | 64.2 | 0 | 0 | 0 | 0 | 114 | F70 I71 K76 M77 Q78 | F70-S74 PolarHBondContact O-N 3.43Å; I71-S74 PolarHBondContact O-OG 3.28Å; S74-K76 VanDerWaalsContact C-N 3.28Å; S74-K76 PolarHBondContact O-N 3.41Å; S74-M77 PolarHBondContact O-N 2.98Å; S74-M77 VanDerWaalsContact O-N 3.16Å; S74-Q78 VanDerWaalsContact O-CB 3.26Å; S74-Q78 WeakPolarHBondContact O-CB 3.41Å; S74-Q78 PolarHBondContact O-N 3.04Å |
| 75 | K | 70.1 | Confident | 65.6 | Low | 171 Ų | 171 | 115.9 Ų | 115.9 | 74% | 0.743 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -62.3 | -34.1 | 178.4 | -62.4 | -175.7 | 80.4 | 168.5 | 0 | 112.6 | N73 S79 | N73-K75 PolarHBondContact O-N 2.86Å; K75-S79 PolarHBondContact O-N 3.34Å |
| 76 | K | 73.4 | Confident | 66.2 | Low | 113 Ų | 113 | 110.5 Ų | 110.5 | 49% | 0.491 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.9 | -55.2 | 170.6 | 164.3 | -177.1 | 65 | 176 | 0 | 110.3 | N73 S74 Q78 S79 W80 | N73-K76 WeakPolarHBondContact O-CB 3.04Å; N73-K76 PolarHBondContact O-N 3.03Å; N73-K76 VanDerWaalsContact O-N 3.13Å; N73-K76 WeakPolarHBondContact OD1-CE 3.43Å; N73-K76 PolarHBondContact OD1-NZ 3.13Å; S74-K76 VanDerWaalsContact C-N 3.28Å; S74-K76 PolarHBondContact O-N 3.41Å; K76-Q78 VanDerWaalsContact C-N 3.28Å; K76-Q78 PolarHBondContact O-N 3.15Å; K76-S79 WeakPolarHBondContact O-CB 3.46Å; K76-S79 PolarHBondContact O-N 2.93Å; K76-S79 VanDerWaalsContact O-N 3.14Å; K76-W80 VanDerWaalsContact O-CD1 3.22Å; K76-W80 PolarHBondContact O-N 2.81Å |
| 77 | M | 72.7 | Confident | 67.2 | Low | 122 Ų | 122 | 112 Ų | 112 | 60% | 0.601 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.5 | -31.7 | -177.7 | -67.9 | -169.9 | 74.7 | 0 | 0 | 113 | N73 S74 S79 W80 Y81 | N73-M77 PolarHBondContact O-N 3.36Å; N73-M77 WeakPolarHBondContact OD1-CG 3.45Å; S74-M77 PolarHBondContact O-N 2.98Å; S74-M77 VanDerWaalsContact O-N 3.16Å; M77-S79 VanDerWaalsContact C-N 3.33Å; M77-S79 PolarHBondContact O-N 2.83Å; M77-W80 PolarHBondContact O-N 2.68Å; M77-Y81 VanDerWaalsContact O-CB 3.29Å; M77-Y81 WeakPolarHBondContact O-CB 3.44Å; M77-Y81 PolarHBondContact O-N 3.33Å |
| 78 | Q | 73.6 | Confident | 67.8 | Low | 112 Ų | 112 | 116.9 Ų | 116.9 | 52% | 0.523 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.3 | -38.4 | 174.2 | -168.9 | 64.4 | 53 | 0 | 0 | 111.8 | S74 K76 Y81 S82 | S74-Q78 VanDerWaalsContact O-CB 3.26Å; S74-Q78 WeakPolarHBondContact O-CB 3.41Å; S74-Q78 PolarHBondContact O-N 3.04Å; K76-Q78 VanDerWaalsContact C-N 3.28Å; K76-Q78 PolarHBondContact O-N 3.15Å; Q78-Y81 PolarHBondContact O-N 2.86Å; Q78-S82 WeakPolarHBondContact O-CB 3.45Å; Q78-S82 PolarHBondContact O-N 3.13Å; Q78-S82 PolarHBondContact O-OG 2.77Å; Q78-S82 VanDerWaalsContact O-OG 3.08Å |
| 79 | S | 74 | Confident | 68.2 | Low | 68 Ų | 68 | 113.9 Ų | 113.9 | 48% | 0.476 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.2 | -49.1 | 174.6 | -176.5 | 0 | 0 | 0 | 0 | 111.5 | K75 K76 M77 Y81 S82 M83 | K75-S79 PolarHBondContact O-N 3.34Å; K76-S79 WeakPolarHBondContact O-CB 3.46Å; K76-S79 PolarHBondContact O-N 2.93Å; K76-S79 VanDerWaalsContact O-N 3.14Å; M77-S79 VanDerWaalsContact C-N 3.33Å; M77-S79 PolarHBondContact O-N 2.83Å; S79-Y81 VanDerWaalsContact C-N 3.3Å; S79-Y81 PolarHBondContact O-N 2.99Å; S79-S82 PolarHBondContact O-N 3.41Å; S79-M83 WeakPolarHBondContact O-CG 3.34Å; S79-M83 PolarHBondContact O-N 2.87Å |
| 80 | W | 75.6 | Confident | 69.1 | Low | 155 Ų | 155 | 113.3 Ų | 113.3 | 59% | 0.587 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.6 | -39.5 | 174.2 | -70.4 | 99.2 | 0 | 0 | 0 | 112.4 | K76 M77 M83 L84 | K76-W80 VanDerWaalsContact O-CD1 3.22Å; K76-W80 PolarHBondContact O-N 2.81Å; M77-W80 PolarHBondContact O-N 2.68Å; W80-M83 HydrophobicContact CD2-CE 3.73Å; W80-M83 HydrophobicContact CE3-CE 3.45Å; W80-M83 VanDerWaalsContact CE3-CE 3.45Å; W80-M83 HydrophobicContact CG-CE 4.27Å; W80-M83 HydrophobicContact CH2-CE 4.43Å; W80-M83 HydrophobicContact CZ3-CE 3.84Å; W80-M83 PolarHBondContact O-N 3.08Å; W80-L84 WeakPolarHBondContact O-CB 3.22Å; W80-L84 VanDerWaalsContact O-CG 3.28Å; W80-L84 WeakPolarHBondContact O-CG 3.42Å; W80-L84 PolarHBondContact O-N 2.82Å |
| 81 | Y | 70.1 | Confident | 70 | Confident | 146 Ų | 146 | 110.6 Ų | 110.6 | 57% | 0.573 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.7 | -43.3 | 176.3 | -171 | -101.9 | 0 | 0 | 0 | 112.1 | M77 Q78 S79 M83 L84 C85 | M77-Y81 VanDerWaalsContact O-CB 3.29Å; M77-Y81 WeakPolarHBondContact O-CB 3.44Å; M77-Y81 PolarHBondContact O-N 3.33Å; Q78-Y81 PolarHBondContact O-N 2.86Å; S79-Y81 VanDerWaalsContact C-N 3.3Å; S79-Y81 PolarHBondContact O-N 2.99Å; Y81-M83 VanDerWaalsContact C-N 3.3Å; Y81-M83 PolarHBondContact O-N 3.4Å; Y81-L84 PolarHBondContact O-N 3.37Å; Y81-C85 HydrophobicContact CE1-CB 4.39Å; Y81-C85 HydrophobicContact CE2-CB 4.31Å; Y81-C85 WeakPolarHBondContact O-CA 3.47Å; Y81-C85 WeakPolarHBondContact O-CB 3.27Å; Y81-C85 PolarHBondContact O-N 3.37Å |
| 82 | S | 72.8 | Confident | 70.8 | Confident | 45 Ų | 45 | 107.9 Ų | 107.9 | 32% | 0.315 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.6 | -29.7 | 175.1 | -64.3 | 0 | 0 | 0 | 0 | 113.4 | Q78 S79 | Q78-S82 WeakPolarHBondContact O-CB 3.45Å; Q78-S82 PolarHBondContact O-N 3.13Å; Q78-S82 PolarHBondContact O-OG 2.77Å; Q78-S82 VanDerWaalsContact O-OG 3.08Å; S79-S82 PolarHBondContact O-N 3.41Å |
| 83 | M | 74 | Confident | 71.7 | Confident | 111 Ų | 111 | 102.1 Ų | 102.1 | 55% | 0.547 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -73.6 | -41.1 | 173.1 | -69.5 | -168.3 | -60.7 | 0 | 0 | 112.7 | S79 W80 Y81 | S79-M83 WeakPolarHBondContact O-CG 3.34Å; S79-M83 PolarHBondContact O-N 2.87Å; W80-M83 HydrophobicContact CD2-CE 3.73Å; W80-M83 HydrophobicContact CE3-CE 3.45Å; W80-M83 VanDerWaalsContact CE3-CE 3.45Å; W80-M83 HydrophobicContact CG-CE 4.27Å; W80-M83 HydrophobicContact CH2-CE 4.43Å; W80-M83 HydrophobicContact CZ3-CE 3.84Å; W80-M83 PolarHBondContact O-N 3.08Å; Y81-M83 VanDerWaalsContact C-N 3.3Å; Y81-M83 PolarHBondContact O-N 3.4Å |
| 84 | L | 72.6 | Confident | 72.6 | Confident | 135 Ų | 135 | 101.8 Ų | 101.8 | 71% | 0.707 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -84.3 | -27.2 | -176.6 | -66.4 | 172.5 | 0 | 0 | 0 | 113.4 | W80 Y81 | W80-L84 WeakPolarHBondContact O-CB 3.22Å; W80-L84 VanDerWaalsContact O-CG 3.28Å; W80-L84 WeakPolarHBondContact O-CG 3.42Å; W80-L84 PolarHBondContact O-N 2.82Å; Y81-L84 PolarHBondContact O-N 3.37Å |
| 85 | C | 66 | Low | 73.2 | Confident | 63 Ų | 63 | 104.2 Ų | 104.2 | 43% | 0.426 | 50% | 0.495 | S | S | . | . | S | Bend | trans | -130.6 | 72.6 | 178.7 | -70 | 0 | 0 | 0 | 0 | 109.8 | Y81 T87 | Y81-C85 HydrophobicContact CE1-CB 4.39Å; Y81-C85 HydrophobicContact CE2-CB 4.31Å; Y81-C85 WeakPolarHBondContact O-CA 3.47Å; Y81-C85 WeakPolarHBondContact O-CB 3.27Å; Y81-C85 PolarHBondContact O-N 3.37Å; C85-T87 PolarHBondContact O-N 3.48Å; C85-T87 VanDerWaalsContact O-N 3.13Å |
| 86 | P | 70.2 | Confident | 73.4 | Confident | 48 Ų | 48 | 102.5 Ų | 102.5 | 31% | 0.312 | 48% | 0.484 | S | S | . | . | trans | -58.4 | 121.2 | 174.1 | -20.5 | 32.4 | 0 | 0 | 0 | 109.5 | R91 | P86-R91 HydrophobicContact CB-CG 3.83Š| ||
| 87 | T | 75.3 | Confident | 73.5 | Confident | 90 Ų | 90 | 103.1 Ų | 103.1 | 55% | 0.552 | 49% | 0.487 | S | S | * | . | trans | -54.4 | 143.7 | -176.3 | -44.4 | 0 | 0 | 0 | 0 | 110.2 | C85 K89 Q90 R91 | C85-T87 PolarHBondContact O-N 3.48Å; C85-T87 VanDerWaalsContact O-N 3.13Å; T87-K89 PolarHBondContact O-N 3Å; T87-Q90 WeakPolarHBondContact O-CA 3.38Å; T87-Q90 WeakPolarHBondContact O-CB 3.43Å; T87-Q90 PolarHBondContact O-N 3.34Å; T87-R91 PolarHBondContact O-N 3.36Å | ||
| 88 | Y | 65.2 | Low | 73.7 | Confident | 175 Ų | 175 | 103.7 Ų | 103.7 | 69% | 0.686 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -47.9 | -40 | -179.7 | 177.8 | -97.2 | 0 | 0 | 0 | 113.1 | Q90 R91 N92 | Y88-Q90 PolarHBondContact O-N 3.31Å; Y88-R91 PolarHBondContact O-N 3.16Å; Y88-N92 WeakPolarHBondContact O-CB 3.46Å; Y88-N92 PolarHBondContact O-N 3.35Å |
| 89 | K | 68 | Low | 73.3 | Confident | 153 Ų | 153 | 103.2 Ų | 103.2 | 67% | 0.665 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -58.8 | -45 | 174.1 | -165.3 | -172.2 | -177.4 | -172.1 | 0 | 113 | T87 N92 E93 | T87-K89 PolarHBondContact O-N 3Å; K89-N92 WeakPolarHBondContact O-CB 3.29Å; K89-N92 PolarHBondContact O-N 3.24Å; K89-E93 WeakPolarHBondContact O-CG 3.43Å; K89-E93 PolarHBondContact O-N 2.98Å |
| 90 | Q | 76.6 | Confident | 72.9 | Confident | 94 Ų | 94 | 103.9 Ų | 103.9 | 44% | 0.439 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.1 | -46.5 | 177 | -178.5 | 178.5 | -16.2 | 0 | 0 | 111 | T87 Y88 N92 E93 D94 | T87-Q90 WeakPolarHBondContact O-CA 3.38Å; T87-Q90 WeakPolarHBondContact O-CB 3.43Å; T87-Q90 PolarHBondContact O-N 3.34Å; Y88-Q90 PolarHBondContact O-N 3.31Å; Q90-N92 PolarHBondContact O-N 3Å; Q90-E93 PolarHBondContact O-N 2.93Å; Q90-E93 VanDerWaalsContact O-N 3.13Å; Q90-D94 PolarHBondContact O-N 2.76Å |
| 91 | R | 76.4 | Confident | 72.2 | Confident | 114 Ų | 114 | 105.5 Ų | 105.5 | 43% | 0.43 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.4 | -36.3 | 175.1 | -61.8 | -153.5 | -63.1 | 111.2 | -7.2 | 112.1 | P86 T87 Y88 D94 F95 | P86-R91 HydrophobicContact CB-CG 3.83Å; T87-R91 PolarHBondContact O-N 3.36Å; Y88-R91 PolarHBondContact O-N 3.16Å; R91-D94 PolarHBondContact O-N 2.94Å; R91-F95 HydrophobicContact CB-CE2 4.41Å; R91-F95 WeakPolarHBondContact O-CB 3.35Å; R91-F95 WeakPolarHBondContact O-CD2 2.85Å; R91-F95 WeakPolarHBondContact O-CG 3.44Å; R91-F95 PolarHBondContact O-N 3.25Å |
| 92 | N | 77.6 | Confident | 71.8 | Confident | 57 Ų | 57 | 100.7 Ų | 100.7 | 31% | 0.305 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.9 | -45.1 | 173.8 | 177.8 | 80.5 | 0 | 0 | 0 | 112.7 | Y88 K89 Q90 D94 F95 R96 | Y88-N92 WeakPolarHBondContact O-CB 3.46Å; Y88-N92 PolarHBondContact O-N 3.35Å; K89-N92 WeakPolarHBondContact O-CB 3.29Å; K89-N92 PolarHBondContact O-N 3.24Å; Q90-N92 PolarHBondContact O-N 3Å; N92-D94 VanDerWaalsContact C-N 3.27Å; N92-D94 PolarHBondContact O-N 3.26Å; N92-F95 PolarHBondContact O-N 3.14Å; N92-R96 WeakPolarHBondContact O-CG 3.27Å; N92-R96 PolarHBondContact O-N 3.43Å |
| 93 | E | 79.8 | Confident | 71.4 | Confident | 61 Ų | 61 | 102 Ų | 102 | 29% | 0.285 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.5 | -41.9 | 172.6 | -64.3 | -51.2 | 126.4 | 0 | 0 | 111.3 | K89 Q90 R96 K97 | K89-E93 WeakPolarHBondContact O-CG 3.43Å; K89-E93 PolarHBondContact O-N 2.98Å; Q90-E93 PolarHBondContact O-N 2.93Å; Q90-E93 VanDerWaalsContact O-N 3.13Å; E93-R96 PolarHBondContact O-N 3.26Å; E93-R96 IonicContact OE1-CZ 3.64Å; E93-R96 IonicContact OE1-NH1 3.24Å; E93-R96 PolarHBondContact OE1-NH1 3.33Å; E93-R96 IonicContact OE1-NH2 2.72Å; E93-R96 IonicContact OE2-CZ 2.65Å; E93-R96 VanDerWaalsContact OE2-CZ 3.23Å; E93-R96 IonicContact OE2-NH1 3.27Å; E93-R96 PolarHBondContact OE2-NH1 3.13Å; E93-R96 IonicContact OE2-NH2 2.92Å; E93-R96 PolarHBondContact OE2-NH2 3.05Å; E93-K97 WeakPolarHBondContact O-CG 3.28Å; E93-K97 PolarHBondContact O-N 3.05Å |
| 94 | D | 77.8 | Confident | 70.6 | Confident | 55 Ų | 55 | 102.7 Ų | 102.7 | 29% | 0.294 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -72.7 | -37.4 | -178.4 | -64.3 | -26.1 | 0 | 0 | 0 | 112 | Q90 R91 N92 R96 K97 L98 | Q90-D94 PolarHBondContact O-N 2.76Å; R91-D94 PolarHBondContact O-N 2.94Å; N92-D94 VanDerWaalsContact C-N 3.27Å; N92-D94 PolarHBondContact O-N 3.26Å; D94-R96 VanDerWaalsContact C-N 3.34Å; D94-R96 PolarHBondContact O-N 3.37Å; D94-K97 PolarHBondContact O-N 2.99Å; D94-K97 VanDerWaalsContact O-N 3.15Å; D94-K97 IonicContact OD1-NZ 3.23Å; D94-K97 PolarHBondContact OD1-NZ 3.29Å; D94-L98 WeakPolarHBondContact O-CB 3.43Å; D94-L98 WeakPolarHBondContact O-CD1 3.26Å; D94-L98 VanDerWaalsContact O-CG 3.27Å; D94-L98 WeakPolarHBondContact O-CG 3.43Å; D94-L98 PolarHBondContact O-N 3.36Å |
| 95 | F | 75.1 | Confident | 69.8 | Low | 101 Ų | 101 | 101.1 Ų | 101.1 | 44% | 0.443 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57.2 | -46.3 | 167.4 | -81 | -57.2 | 0 | 0 | 0 | 111.7 | R91 N92 K97 L98 F99 | R91-F95 HydrophobicContact CB-CE2 4.41Å; R91-F95 WeakPolarHBondContact O-CB 3.35Å; R91-F95 WeakPolarHBondContact O-CD2 2.85Å; R91-F95 WeakPolarHBondContact O-CG 3.44Å; R91-F95 PolarHBondContact O-N 3.25Å; N92-F95 PolarHBondContact O-N 3.14Å; F95-K97 PolarHBondContact O-N 3.45Å; F95-L98 PolarHBondContact O-N 3.01Å; F95-F99 HydrophobicContact CD1-CD2 4.21Å; F95-F99 AromaticContact CD1-CE2 3.84Å; F95-F99 HydrophobicContact CD1-CE2 3.84Å; F95-F99 HydrophobicContact CE1-CE2 4.4Å; F95-F99 WeakPolarHBondContact O-CB 3.47Å; F95-F99 WeakPolarHBondContact O-CD2 3.4Å; F95-F99 PolarHBondContact O-N 3.36Å |
| 96 | R | 73.8 | Confident | 69.5 | Low | 134 Ų | 134 | 104.2 Ų | 104.2 | 51% | 0.506 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.8 | -26.6 | 176.7 | -74.6 | -148.7 | -88.4 | 73.7 | 166.7 | 113.4 | N92 E93 D94 S100 | N92-R96 WeakPolarHBondContact O-CG 3.27Å; N92-R96 PolarHBondContact O-N 3.43Å; E93-R96 PolarHBondContact O-N 3.26Å; E93-R96 IonicContact OE1-CZ 3.64Å; E93-R96 IonicContact OE1-NH1 3.24Å; E93-R96 PolarHBondContact OE1-NH1 3.33Å; E93-R96 IonicContact OE1-NH2 2.72Å; E93-R96 IonicContact OE2-CZ 2.65Å; E93-R96 VanDerWaalsContact OE2-CZ 3.23Å; E93-R96 IonicContact OE2-NH1 3.27Å; E93-R96 PolarHBondContact OE2-NH1 3.13Å; E93-R96 IonicContact OE2-NH2 2.92Å; E93-R96 PolarHBondContact OE2-NH2 3.05Å; D94-R96 VanDerWaalsContact C-N 3.34Å; D94-R96 PolarHBondContact O-N 3.37Å; R96-S100 WeakPolarHBondContact O-CA 3.36Å; R96-S100 VanDerWaalsContact O-CB 3.23Å; R96-S100 WeakPolarHBondContact O-CB 3.4Å; R96-S100 PolarHBondContact O-N 3.47Å; R96-S100 VanDerWaalsContact O-N 3.09Å |
| 97 | K | 75.9 | Confident | 69.3 | Low | 126 Ų | 126 | 107.7 Ų | 107.7 | 55% | 0.548 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -79.9 | -48.9 | 173.6 | -68.6 | 168.3 | -158.9 | 157.9 | 0 | 111.8 | E93 D94 F95 F99 S100 | E93-K97 WeakPolarHBondContact O-CG 3.28Å; E93-K97 PolarHBondContact O-N 3.05Å; D94-K97 PolarHBondContact O-N 2.99Å; D94-K97 VanDerWaalsContact O-N 3.15Å; D94-K97 IonicContact OD1-NZ 3.23Å; D94-K97 PolarHBondContact OD1-NZ 3.29Å; F95-K97 PolarHBondContact O-N 3.45Å; K97-F99 PolarHBondContact O-N 3.42Å; K97-S100 WeakPolarHBondContact O-CB 3.35Å; K97-S100 PolarHBondContact O-N 3.08Å; K97-S100 VanDerWaalsContact O-N 3.11Å; K97-S100 PolarHBondContact O-OG 2.77Å |
| 98 | L | 77.4 | Confident | 68.7 | Low | 135 Ų | 135 | 111.4 Ų | 111.4 | 71% | 0.707 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -57.3 | -40.2 | 177.8 | -73.5 | 162.7 | 0 | 0 | 0 | 111.3 | D94 F95 | D94-L98 WeakPolarHBondContact O-CB 3.43Å; D94-L98 WeakPolarHBondContact O-CD1 3.26Å; D94-L98 VanDerWaalsContact O-CG 3.27Å; D94-L98 WeakPolarHBondContact O-CG 3.43Å; D94-L98 PolarHBondContact O-N 3.36Å; F95-L98 PolarHBondContact O-N 3.01Å |
| 99 | F | 65.1 | Low | 68.6 | Low | 102 Ų | 102 | 109.4 Ų | 109.4 | 45% | 0.447 | 53% | 0.534 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.6 | 19.9 | 177.9 | -57.7 | -54.3 | 0 | 0 | 0 | 113.5 | F95 K97 K101 L102 | F95-F99 HydrophobicContact CD1-CD2 4.21Å; F95-F99 AromaticContact CD1-CE2 3.84Å; F95-F99 HydrophobicContact CD1-CE2 3.84Å; F95-F99 HydrophobicContact CE1-CE2 4.4Å; F95-F99 WeakPolarHBondContact O-CB 3.47Å; F95-F99 WeakPolarHBondContact O-CD2 3.4Å; F95-F99 PolarHBondContact O-N 3.36Å; K97-F99 PolarHBondContact O-N 3.42Å; F99-K101 PolarHBondContact O-N 3.13Å; F99-L102 HydrophobicContact CB-CB 3.81Å; F99-L102 HydrophobicContact CB-CD2 4.16Å; F99-L102 HydrophobicContact CD1-CB 4.17Å; F99-L102 HydrophobicContact CD1-CD1 3.94Å; F99-L102 HydrophobicContact CD1-CD2 3.66Å; F99-L102 HydrophobicContact CD1-CG 4.13Å; F99-L102 HydrophobicContact CE1-CD1 4.45Å; F99-L102 HydrophobicContact CE1-CD2 4.26Å; F99-L102 HydrophobicContact CG-CB 4.43Å; F99-L102 HydrophobicContact CG-CD2 4.05Å; F99-L102 WeakPolarHBondContact O-CB 3.48Å; F99-L102 PolarHBondContact O-N 3.41Å |
| 100 | S | 64.9 | Low | 68 | Low | 81 Ų | 81 | 108 Ų | 108 | 57% | 0.566 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -28.1 | -179.4 | 55.4 | 0 | 0 | 0 | 0 | 114 | R96 K97 | R96-S100 WeakPolarHBondContact O-CA 3.36Å; R96-S100 VanDerWaalsContact O-CB 3.23Å; R96-S100 WeakPolarHBondContact O-CB 3.4Å; R96-S100 PolarHBondContact O-N 3.47Å; R96-S100 VanDerWaalsContact O-N 3.09Å; K97-S100 WeakPolarHBondContact O-CB 3.35Å; K97-S100 PolarHBondContact O-N 3.08Å; K97-S100 VanDerWaalsContact O-N 3.11Å; K97-S100 PolarHBondContact O-OG 2.77Å |
| 101 | K | 61.8 | Low | 67 | Low | 190 Ų | 190 | 107.1 Ų | 107.1 | 83% | 0.826 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.2 | 7.3 | 176.3 | -60.7 | -173.8 | 179.4 | -175.7 | 0 | 113.1 | F99 P103 | F99-K101 PolarHBondContact O-N 3.13Å; K101-P103 WeakPolarHBondContact O-CD 3.36Å |
| 102 | L | 61.2 | Low | 65.6 | Low | 44 Ų | 44 | 107.3 Ų | 107.3 | 23% | 0.23 | 56% | 0.561 | C | S | . | * | trans | -67.9 | 121.1 | 179.7 | -157.9 | 75.7 | 0 | 0 | 0 | 108 | F99 E106 | F99-L102 HydrophobicContact CB-CB 3.81Å; F99-L102 HydrophobicContact CB-CD2 4.16Å; F99-L102 HydrophobicContact CD1-CB 4.17Å; F99-L102 HydrophobicContact CD1-CD1 3.94Å; F99-L102 HydrophobicContact CD1-CD2 3.66Å; F99-L102 HydrophobicContact CD1-CG 4.13Å; F99-L102 HydrophobicContact CE1-CD1 4.45Å; F99-L102 HydrophobicContact CE1-CD2 4.26Å; F99-L102 HydrophobicContact CG-CB 4.43Å; F99-L102 HydrophobicContact CG-CD2 4.05Å; F99-L102 WeakPolarHBondContact O-CB 3.48Å; F99-L102 PolarHBondContact O-N 3.41Å; L102-E106 HydrophobicContact CD1-CB 4.17Å; L102-E106 WeakPolarHBondContact CD1-OE2 3.08Å; L102-E106 HydrophobicContact CD2-CB 4.04Å; L102-E106 VanDerWaalsContact CD2-O 3.31Å; L102-E106 WeakPolarHBondContact CD2-O 3.42Å; L102-E106 HydrophobicContact CG-CB 3.79Å | ||
| 103 | P | 64.5 | Low | 64.7 | Low | 72 Ų | 72 | 109.9 Ų | 109.9 | 47% | 0.468 | 58% | 0.583 | S | S | . | * | trans | -55.9 | 151.4 | -178.4 | -25.2 | 34.7 | 0 | 0 | 0 | 111.4 | K101 A105 E106 R107 | K101-P103 WeakPolarHBondContact O-CD 3.36Å; P103-A105 PolarHBondContact O-N 2.9Å; P103-E106 PolarHBondContact O-N 3.25Å; P103-R107 PolarHBondContact O-N 3.23Å | ||
| 104 | E | 57.6 | Low | 63.6 | Low | 127 Ų | 127 | 111.7 Ų | 111.7 | 59% | 0.593 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56 | -27 | 179.1 | -159.3 | 65.5 | -138.9 | 0 | 0 | 112.4 | E106 R107 | E104-E106 PolarHBondContact O-N 2.85Å; E104-R107 WeakPolarHBondContact OE1-CD 3.41Å; E104-R107 IonicContact OE1-NH1 3.45Å; E104-R107 PolarHBondContact OE1-NH1 3.03Å; E104-R107 IonicContact OE2-CZ 2.7Å; E104-R107 VanDerWaalsContact OE2-CZ 3.24Å; E104-R107 IonicContact OE2-NE 2.86Å; E104-R107 IonicContact OE2-NH1 3.69Å; E104-R107 PolarHBondContact OE2-NH1 3.32Å |
| 105 | A | 56.3 | Low | 62.5 | Low | 102 Ų | 102 | 113.7 Ų | 113.7 | 84% | 0.843 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.7 | -22.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | P103 | P103-A105 PolarHBondContact O-N 2.9Š|
| 106 | E | 59.2 | Low | 61.7 | Low | 127 Ų | 127 | 112.4 Ų | 112.4 | 59% | 0.593 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108 | -7 | -178.4 | -72.6 | -179 | -177.7 | 0 | 0 | 112.7 | L102 P103 E104 L108 | L102-E106 HydrophobicContact CD1-CB 4.17Å; L102-E106 WeakPolarHBondContact CD1-OE2 3.08Å; L102-E106 HydrophobicContact CD2-CB 4.04Å; L102-E106 VanDerWaalsContact CD2-O 3.31Å; L102-E106 WeakPolarHBondContact CD2-O 3.42Å; L102-E106 HydrophobicContact CG-CB 3.79Å; P103-E106 PolarHBondContact O-N 3.25Å; E104-E106 PolarHBondContact O-N 2.85Å; E106-L108 PolarHBondContact O-N 3.29Å; E106-L108 VanDerWaalsContact O-N 3.15Å |
| 107 | R | 65.4 | Low | 60.7 | Low | 122 Ų | 122 | 117.4 Ų | 117.4 | 46% | 0.46 | 66% | 0.66 | S | S | . | * | S | Bend | trans | -61.4 | 119.9 | 171.2 | -74.8 | -178.1 | 171.6 | 176.9 | 0.6 | 109.3 | P103 E104 I109 | P103-R107 PolarHBondContact O-N 3.23Å; E104-R107 WeakPolarHBondContact OE1-CD 3.41Å; E104-R107 IonicContact OE1-NH1 3.45Å; E104-R107 PolarHBondContact OE1-NH1 3.03Å; E104-R107 IonicContact OE2-CZ 2.7Å; E104-R107 VanDerWaalsContact OE2-CZ 3.24Å; E104-R107 IonicContact OE2-NE 2.86Å; E104-R107 IonicContact OE2-NH1 3.69Å; E104-R107 PolarHBondContact OE2-NH1 3.32Å; R107-I109 PolarHBondContact O-N 3.48Å |
| 108 | L | 62.5 | Low | 59.6 | Low | 167 Ų | 167 | 116.4 Ų | 116.4 | 87% | 0.874 | 67% | 0.667 | S | S | * | * | trans | -62.4 | 87.1 | 164.8 | -77.1 | 165.8 | 0 | 0 | 0 | 108.9 | E106 V110 | E106-L108 PolarHBondContact O-N 3.29Å; E106-L108 VanDerWaalsContact O-N 3.15Å; L108-V110 PolarHBondContact O-N 2.68Å | ||
| 109 | I | 62.8 | Low | 58.4 | Low | 134 Ų | 134 | 119.1 Ų | 119.1 | 69% | 0.687 | 68% | 0.676 | S | S | * | * | trans | -57.4 | 111.6 | 156.9 | -55.7 | 175.5 | 0 | 0 | 0 | 104.3 | R107 A111 | R107-I109 PolarHBondContact O-N 3.48Å; I109-A111 PolarHBondContact O-N 3.47Å | ||
| 110 | V | 56.2 | Low | 58 | Low | 124 Ų | 124 | 122.7 Ų | 122.7 | 75% | 0.752 | 69% | 0.691 | S | S | * | * | trans | -66.6 | 84.7 | 162.2 | 176 | 0 | 0 | 0 | 0 | 105.2 | L108 T112 | L108-V110 PolarHBondContact O-N 2.68Å; V110-T112 VanDerWaalsContact C-N 3.31Å; V110-T112 PolarHBondContact O-N 2.82Å | ||
| 111 | A | 55.8 | Low | 57.9 | Low | 75 Ų | 75 | 124.7 Ų | 124.7 | 62% | 0.62 | 70% | 0.703 | S | S | * | * | trans | -61.4 | 103.5 | 168.3 | 0 | 0 | 0 | 0 | 0 | 105.2 | I109 S113 | I109-A111 PolarHBondContact O-N 3.47Å; A111-S113 PolarHBondContact O-N 2.78Å | ||
| 112 | T | 46.6 | Very low | 57.6 | Low | 118 Ų | 118 | 121.3 Ų | 121.3 | 72% | 0.724 | 70% | 0.703 | S | S | * | * | trans | -67.9 | 66.5 | 165.3 | 53.5 | 0 | 0 | 0 | 0 | 107.9 | V110 S114 | V110-T112 VanDerWaalsContact C-N 3.31Å; V110-T112 PolarHBondContact O-N 2.82Å; T112-S114 PolarHBondContact O-N 3.28Å; T112-S114 PolarHBondContact O-OG 2.87Å | ||
| 113 | S | 58.8 | Low | 57.5 | Low | 110 Ų | 110 | 127.5 Ų | 127.5 | 77% | 0.769 | 75% | 0.75 | S | S | * | * | trans | -75.9 | 54.3 | 168.8 | -163.7 | 0 | 0 | 0 | 0 | 108.9 | A111 A115 | A111-S113 PolarHBondContact O-N 2.78Å; S113-A115 PolarHBondContact O-N 2.86Å | ||
| 114 | S | 56 | Low | 57.1 | Low | 100 Ų | 100 | 130.3 Ų | 130.3 | 70% | 0.699 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -67.6 | 107.2 | 151.5 | 50.5 | 0 | 0 | 0 | 0 | 105.6 | T112 G116 | T112-S114 PolarHBondContact O-N 3.28Å; T112-S114 PolarHBondContact O-OG 2.87Å; S114-G116 PolarHBondContact O-N 3Å |
| 115 | A | 55.4 | Low | 57.1 | Low | 96 Ų | 96 | 130.4 Ų | 130.4 | 79% | 0.793 | 77% | 0.773 | S | S | * | * | trans | -26.6 | 122.3 | -171.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | S113 | S113-A115 PolarHBondContact O-N 2.86Š| ||
| 116 | G | 57.9 | Low | 57.2 | Low | 74 Ų | 74 | 132 Ų | 132 | 76% | 0.763 | 77% | 0.769 | S | S | * | * | trans | -67.9 | 161.3 | -168.4 | 0 | 0 | 0 | 0 | 0 | 115 | S114 | S114-G116 PolarHBondContact O-N 3Š| ||
| 117 | R | 53.3 | Low | 57.1 | Low | 239 Ų | 239 | 132.3 Ų | 132.3 | 90% | 0.902 | 78% | 0.779 | S | S | * | * | trans | -141.2 | 105.8 | 158.9 | -140.6 | 177.2 | -165.3 | -103.1 | 3.1 | 108 | Q119 | R117-Q119 PolarHBondContact O-N 3.26Š| ||
| 118 | P | 52 | Low | 56.5 | Low | 106 Ų | 106 | 132.9 Ų | 132.9 | 69% | 0.688 | 80% | 0.799 | S | S | * | * | trans | -67.8 | 108.1 | 169.8 | 27.4 | -31.1 | 0 | 0 | 0 | 107.8 | F120 | P118-F120 PolarHBondContact O-N 2.99Š| ||
| 119 | Q | 52.3 | Low | 56.1 | Low | 191 Ų | 191 | 130.7 Ų | 130.7 | 89% | 0.893 | 79% | 0.794 | S | S | * | * | trans | -81.4 | 102.3 | 170.1 | -169 | 169.8 | 43.4 | 0 | 0 | 107.2 | R117 | R117-Q119 PolarHBondContact O-N 3.26Š| ||
| 120 | F | 57.6 | Low | 55.6 | Low | 177 Ų | 177 | 130.4 Ų | 130.4 | 78% | 0.776 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 140.8 | 173.6 | -68.9 | -86.4 | 0 | 0 | 0 | 109.8 | P118 S122 | P118-F120 PolarHBondContact O-N 2.99Å; F120-S122 PolarHBondContact O-N 2.88Å |
| 121 | P | 61.5 | Low | 55.6 | Low | 123 Ų | 123 | 130.9 Ų | 130.9 | 80% | 0.799 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 125.5 | 171.9 | 28 | -32.6 | 0 | 0 | 0 | 109 | ||
| 122 | S | 56 | Low | 55.6 | Low | 119 Ų | 119 | 135.6 Ų | 135.6 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 135.1 | 162.9 | -169.9 | 0 | 0 | 0 | 0 | 108.3 | F120 | F120-S122 PolarHBondContact O-N 2.88Š|
| 123 | S | 59.5 | Low | 56.4 | Low | 174 Ų | 174 | 137.2 Ų | 137.2 | 100% | 1.217 | 83% | 0.83 | S | S | * | * | trans | -71.8 | 0 | 159 | -173.2 | 0 | 0 | 0 | 0 | 111.1 |
Retrieved 123 of 123 residues in 78.4 ms
(Link to these results)