| 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 | 43.4 | Very low | 49.9 | Very low | 245 Ų | 245 | 180.1 Ų | 180.1 | 100% | 1.207 | 88% | 0.877 | S | S | * | * | 0 | 0 | 0 | -71.4 | -158.6 | 164.5 | 0 | 0 | 110 | |||||
| 2 | N | 48.4 | Very low | 49.6 | Very low | 170 Ų | 170 | 182 Ų | 182 | 91% | 0.909 | 87% | 0.867 | S | S | * | * | 0 | 84.6 | 0 | -98.2 | -11.6 | 0 | 0 | 0 | 109.7 | |||||
| 3 | T | 44.6 | Very low | 49.7 | Very low | 155 Ų | 155 | 180.8 Ų | 180.8 | 95% | 0.951 | 86% | 0.86 | S | S | * | * | trans | -83.3 | 102.1 | 155.5 | 44.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 4 | G | 56.9 | Low | 49.2 | Very low | 65 Ų | 65 | 179.9 Ų | 179.9 | 67% | 0.67 | 86% | 0.863 | S | S | * | * | trans | -126.2 | 104.6 | 168.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 5 | Q | 54.6 | Low | 49.3 | Very low | 185 Ų | 185 | 174.3 Ų | 174.3 | 86% | 0.864 | 85% | 0.85 | S | S | * | * | 94.8 | 0 | 95.4 | -76.7 | -132.8 | -25 | 0 | 0 | 110.2 | |||||
| 6 | S | 54.9 | Low | 48.9 | Very low | 111 Ų | 111 | 178.8 Ų | 178.8 | 78% | 0.776 | 86% | 0.855 | S | S | * | * | 0 | 93.5 | 0 | 71.9 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 7 | E | 45.4 | Very low | 48.8 | Very low | 202 Ų | 202 | 177.4 Ų | 177.4 | 94% | 0.944 | 85% | 0.851 | S | S | * | * | trans | -44.1 | 97.2 | 136.4 | -117.5 | 165.5 | -176.8 | 0 | 0 | 111.7 | ||||
| 8 | R | 53.6 | Low | 48.6 | Very low | 204 Ų | 204 | 174.2 Ų | 174.2 | 77% | 0.77 | 85% | 0.851 | S | S | * | * | trans | -142.1 | 0 | 164.9 | -131.2 | 179.2 | 174.5 | -174.7 | -1 | 109.4 | ||||
| 9 | R | 52.9 | Low | 48.5 | Very low | 214 Ų | 214 | 167.9 Ų | 167.9 | 81% | 0.808 | 84% | 0.835 | S | S | * | * | 0 | 92 | 0 | -90.8 | -177.3 | 158.3 | 167.9 | 0.4 | 109.7 | |||||
| 10 | K | 46.9 | Very low | 48.4 | Very low | 211 Ų | 211 | 171.5 Ų | 171.5 | 92% | 0.917 | 84% | 0.839 | S | S | * | * | trans | -74.1 | 94.2 | 154.1 | -91.9 | -179.3 | -176.9 | -178.9 | 0 | 110.6 | ||||
| 11 | R | 47 | Very low | 48.1 | Very low | 219 Ų | 219 | 172.6 Ų | 172.6 | 83% | 0.826 | 84% | 0.84 | S | S | * | * | trans | -152.3 | 111.3 | 152.9 | -77.2 | -164.7 | 168.5 | -176.3 | 0.5 | 109.5 | ||||
| 12 | R | 46.5 | Very low | 48.3 | Very low | 203 Ų | 203 | 169.4 Ų | 169.4 | 77% | 0.766 | 82% | 0.822 | S | S | * | * | 137.7 | 0 | 116.3 | -75 | -168.4 | 164 | -173.6 | 1.2 | 109.4 | |||||
| 13 | H | 51 | Low | 48.2 | Very low | 167 Ų | 167 | 168.9 Ų | 168.9 | 77% | 0.773 | 82% | 0.818 | S | S | * | * | 0 | 85.4 | 0 | -95.9 | -66.8 | 0 | 0 | 0 | 109.4 | |||||
| 14 | D | 42.3 | Very low | 47.8 | Very low | 167 Ų | 167 | 170.6 Ų | 170.6 | 89% | 0.893 | 81% | 0.813 | S | S | * | * | trans | -57.9 | 81.4 | 146.5 | -90 | -11.3 | 0 | 0 | 0 | 111.1 | ||||
| 15 | S | 50.9 | Low | 47.8 | Very low | 96 Ų | 96 | 173.1 Ų | 173.1 | 67% | 0.671 | 82% | 0.815 | S | S | * | * | trans | -109.5 | 91.6 | 156.9 | 58 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 16 | R | 42.7 | Very low | 47.7 | Very low | 247 Ų | 247 | 168.5 Ų | 168.5 | 93% | 0.932 | 80% | 0.801 | S | S | * | * | trans | -33 | 78.5 | 141.8 | -88.8 | -177.2 | -173.7 | 174.8 | -1 | 111.4 | ||||
| 17 | I | 47.5 | Very low | 47.2 | Very low | 154 Ų | 154 | 171.3 Ų | 171.3 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -73.6 | 80.9 | 162.5 | -68.3 | 162.5 | 0 | 0 | 0 | 109.1 | G19 | I17-G19 VanDerWaalsContact C-N 3.29Š| ||
| 18 | S | 45.4 | Very low | 47.5 | Very low | 121 Ų | 121 | 168.7 Ų | 168.7 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | trans | -46 | 0 | 148.5 | 86.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 19 | G | 46.1 | Very low | 47.1 | Very low | 54 Ų | 54 | 167.5 Ų | 167.5 | 56% | 0.557 | 79% | 0.793 | S | S | * | * | 0 | 80.2 | 0 | 0 | 0 | 0 | 0 | 0 | 110.7 | I17 F21 | I17-G19 VanDerWaalsContact C-N 3.29Å; G19-F21 PolarHBondContact O-N 3.49Å | |||
| 20 | R | 46.4 | Very low | 46.5 | Very low | 240 Ų | 240 | 164.6 Ų | 164.6 | 91% | 0.906 | 79% | 0.793 | S | S | * | * | trans | -18.5 | 84.8 | 145.3 | -135.1 | 177.6 | -176.8 | 166 | -0.4 | 111.6 | ||||
| 21 | F | 42.8 | Very low | 46.5 | Very low | 195 Ų | 195 | 160.4 Ų | 160.4 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | trans | -70.6 | 76.2 | 167.1 | -106.4 | -89.4 | 0 | 0 | 0 | 110 | G19 L23 | G19-F21 PolarHBondContact O-N 3.49Å; F21-L23 VanDerWaalsContact C-N 3.33Å; F21-L23 PolarHBondContact O-N 3.29Å | ||
| 22 | E | 46.9 | Very low | 46.2 | Very low | 178 Ų | 178 | 157.6 Ų | 157.6 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | trans | -56 | 88 | 159.8 | -92.5 | -163 | 177.4 | 0 | 0 | 111.2 | F24 | E22-F24 PolarHBondContact O-N 2.99Š| ||
| 23 | L | 47.1 | Very low | 45.9 | Very low | 158 Ų | 158 | 156 Ų | 156 | 83% | 0.827 | 79% | 0.785 | S | S | * | * | trans | -44.7 | 86.8 | 158 | -70.6 | 172.7 | 0 | 0 | 0 | 110.9 | F21 | F21-L23 VanDerWaalsContact C-N 3.33Å; F21-L23 PolarHBondContact O-N 3.29Å | ||
| 24 | F | 36.7 | Very low | 45.5 | Very low | 192 Ų | 192 | 153.1 Ų | 153.1 | 84% | 0.842 | 78% | 0.783 | S | S | * | * | trans | -63.1 | 88.2 | 161.8 | -168.8 | -106.6 | 0 | 0 | 0 | 110.8 | E22 P26 | E22-F24 PolarHBondContact O-N 2.99Å; F24-P26 HydrophobicContact CE1-CB 4.44Å | ||
| 25 | V | 56 | Low | 45.8 | Very low | 117 Ų | 117 | 151.7 Ų | 151.7 | 71% | 0.709 | 78% | 0.775 | S | S | * | * | trans | -70.8 | 103.5 | 165.1 | -175.6 | 0 | 0 | 0 | 0 | 108.9 | E27 | V25-E27 PolarHBondContact O-N 3Š| ||
| 26 | P | 52.1 | Low | 45.4 | Very low | 89 Ų | 89 | 155 Ų | 155 | 58% | 0.578 | 79% | 0.786 | S | S | * | * | trans | -71 | 100.9 | 171.7 | 27.7 | -22.6 | 0 | 0 | 0 | 111.6 | F24 I28 | F24-P26 HydrophobicContact CE1-CB 4.44Å; P26-I28 VanDerWaalsContact C-N 3.32Å; P26-I28 PolarHBondContact O-N 2.61Å | ||
| 27 | E | 44.1 | Very low | 45.4 | Very low | 170 Ų | 170 | 146.6 Ų | 146.6 | 79% | 0.794 | 78% | 0.775 | S | S | * | * | trans | -39.1 | 87 | 158.7 | -88 | -177.6 | 179.8 | 0 | 0 | 111.3 | V25 | V25-E27 PolarHBondContact O-N 3Š| ||
| 28 | I | 52.1 | Low | 45 | Very low | 147 Ų | 147 | 144.8 Ų | 144.8 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | trans | -67.8 | 89.6 | 161.6 | -60.3 | 170.7 | 0 | 0 | 0 | 108.9 | P26 L30 | P26-I28 VanDerWaalsContact C-N 3.32Å; P26-I28 PolarHBondContact O-N 2.61Å; I28-L30 PolarHBondContact O-N 1.97Å | ||
| 29 | K | 46.1 | Very low | 45 | Very low | 179 Ų | 179 | 149 Ų | 149 | 78% | 0.778 | 78% | 0.779 | S | S | * | * | trans | -58.1 | 88.8 | 161.6 | -83.1 | -175.5 | -174.9 | 174.3 | 0 | 111.1 | T31 | K29-T31 VanDerWaalsContact C-N 3.32Å; K29-T31 PolarHBondContact O-N 3.23Å | ||
| 30 | L | 41 | Very low | 44.7 | Very low | 153 Ų | 153 | 154.9 Ų | 154.9 | 80% | 0.801 | 79% | 0.792 | S | S | * | * | trans | -65.7 | 83.4 | 161.2 | -78.9 | 172 | 0 | 0 | 0 | 110.2 | I28 L32 | I28-L30 PolarHBondContact O-N 1.97Å; L30-L32 VanDerWaalsContact C-N 3.3Å; L30-L32 PolarHBondContact O-N 3.4Å | ||
| 31 | T | 45.1 | Very low | 44.8 | Very low | 123 Ų | 123 | 151.1 Ų | 151.1 | 76% | 0.755 | 79% | 0.79 | S | S | * | * | trans | -61.9 | 86.6 | 162.5 | 50.8 | 0 | 0 | 0 | 0 | 110.6 | K29 F33 | K29-T31 VanDerWaalsContact C-N 3.32Å; K29-T31 PolarHBondContact O-N 3.23Å; T31-F33 VanDerWaalsContact C-N 3.29Å; T31-F33 PolarHBondContact O-N 3.33Å | ||
| 32 | L | 41.8 | Very low | 44.7 | Very low | 160 Ų | 160 | 150.7 Ų | 150.7 | 84% | 0.838 | 79% | 0.791 | S | S | * | * | trans | -54.5 | 80.6 | 154.7 | -83.2 | 161.1 | 0 | 0 | 0 | 110.7 | L30 S34 | L30-L32 VanDerWaalsContact C-N 3.3Å; L30-L32 PolarHBondContact O-N 3.4Å; L32-S34 VanDerWaalsContact C-N 3.26Å; L32-S34 PolarHBondContact O-N 3.02Å | ||
| 33 | F | 40.9 | Very low | 44.9 | Very low | 170 Ų | 170 | 147.5 Ų | 147.5 | 75% | 0.746 | 79% | 0.788 | S | S | * | * | trans | -56.4 | 82 | 161.7 | -120.3 | -96.1 | 0 | 0 | 0 | 111 | T31 | T31-F33 VanDerWaalsContact C-N 3.29Å; T31-F33 PolarHBondContact O-N 3.33Å | ||
| 34 | S | 40.7 | Very low | 44.5 | Very low | 105 Ų | 105 | 147.4 Ų | 147.4 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | trans | -68.3 | 81.1 | 158 | -65.2 | 0 | 0 | 0 | 0 | 110.6 | L32 | L32-S34 VanDerWaalsContact C-N 3.26Å; L32-S34 PolarHBondContact O-N 3.02Å | ||
| 35 | D | 50 | Low | 44.7 | Very low | 137 Ų | 137 | 148.3 Ų | 148.3 | 73% | 0.733 | 79% | 0.792 | S | S | * | * | trans | -81.6 | 86 | 164.4 | -95.8 | -13.6 | 0 | 0 | 0 | 110.3 | ||||
| 36 | D | 41.1 | Very low | 44.2 | Very low | 167 Ų | 167 | 149.9 Ų | 149.9 | 89% | 0.893 | 79% | 0.792 | S | S | * | * | trans | -68.8 | 84.4 | 149.2 | -92.5 | -10.3 | 0 | 0 | 0 | 110.9 | ||||
| 37 | G | 43.8 | Very low | 43.8 | Very low | 69 Ų | 69 | 152.8 Ų | 152.8 | 71% | 0.711 | 80% | 0.798 | S | S | * | * | trans | -140.4 | 89.7 | 159 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 38 | S | 38.4 | Very low | 43.8 | Very low | 117 Ų | 117 | 152.8 Ų | 152.8 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | -5.5 | 93.7 | 127.5 | 55.5 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 39 | K | 47 | Very low | 43.5 | Very low | 209 Ų | 209 | 151.1 Ų | 151.1 | 91% | 0.909 | 80% | 0.804 | S | S | * | * | trans | -159.6 | 96.6 | 146.8 | -92.8 | -175.5 | -178.5 | 157.4 | 0 | 109.3 | ||||
| 40 | E | 39.4 | Very low | 43.5 | Very low | 177 Ų | 177 | 147.9 Ų | 147.9 | 83% | 0.827 | 80% | 0.804 | S | S | * | * | 9.9 | 95 | 124.5 | -61.2 | -136 | 169.7 | 0 | 0 | 111.5 | |||||
| 41 | D | 48.4 | Very low | 43.7 | Very low | 161 Ų | 161 | 146.1 Ų | 146.1 | 86% | 0.861 | 80% | 0.804 | S | S | * | * | trans | -159.2 | 96.4 | 144 | -72.5 | -25.3 | 0 | 0 | 0 | 109.1 | ||||
| 42 | E | 39.9 | Very low | 43.4 | Very low | 187 Ų | 187 | 152.2 Ų | 152.2 | 87% | 0.874 | 81% | 0.813 | S | S | * | * | -7.4 | 97 | 129 | -68.8 | -104.1 | 160.8 | 0 | 0 | 111.6 | |||||
| 43 | S | 50.4 | Low | 43.5 | Very low | 110 Ų | 110 | 152 Ų | 152 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | trans | -171.3 | 100.8 | 142.5 | 59.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 44 | N | 40.2 | Very low | 43.6 | Very low | 157 Ų | 157 | 148.8 Ų | 148.8 | 84% | 0.84 | 81% | 0.81 | S | S | * | * | 57.8 | 94.5 | 110.5 | -83.9 | -17.6 | 0 | 0 | 0 | 111.2 | |||||
| 45 | F | 40.1 | Very low | 43.9 | Very low | 210 Ų | 210 | 150.4 Ų | 150.4 | 92% | 0.921 | 82% | 0.815 | S | S | * | * | trans | -156 | 96.8 | 144.4 | -157.8 | -98.8 | 0 | 0 | 0 | 109 | ||||
| 46 | E | 45.9 | Very low | 43.6 | Very low | 150 Ų | 150 | 151.7 Ų | 151.7 | 70% | 0.701 | 82% | 0.821 | S | S | * | * | trans | -14.3 | 110 | 132.2 | -73.7 | -160.6 | 175 | 0 | 0 | 111.8 | ||||
| 47 | H | 43.6 | Very low | 43.8 | Very low | 150 Ų | 150 | 149.3 Ų | 149.3 | 69% | 0.694 | 82% | 0.817 | S | S | * | * | 137.8 | 100.8 | 115.8 | -85.6 | -78.7 | 0 | 0 | 0 | 109.4 | |||||
| 48 | L | 44.8 | Very low | 43.8 | Very low | 170 Ų | 170 | 150 Ų | 150 | 89% | 0.89 | 82% | 0.824 | S | S | * | * | 166.4 | 0 | 123.3 | -71.5 | 167.2 | 0 | 0 | 0 | 109 | |||||
| 49 | S | 45 | Very low | 43.9 | Very low | 112 Ų | 112 | 149.9 Ų | 149.9 | 78% | 0.783 | 82% | 0.824 | S | S | * | * | 0 | 0 | 0 | 136.8 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 50 | S | 45.6 | Very low | 43.9 | Very low | 111 Ų | 111 | 145.3 Ų | 145.3 | 78% | 0.776 | 82% | 0.818 | S | S | * | * | 0 | 104.7 | 0 | -119 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 51 | S | 45.4 | Very low | 44 | Very low | 116 Ų | 116 | 141.9 Ų | 141.9 | 81% | 0.811 | 81% | 0.813 | S | S | * | * | 151.2 | 86.8 | 111.4 | -34.1 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 52 | R | 38.7 | Very low | 43.6 | Very low | 252 Ų | 252 | 139.1 Ų | 139.1 | 95% | 0.951 | 81% | 0.813 | S | S | * | * | trans | -65.4 | 95.6 | 156 | -124.6 | 177.2 | 177.7 | 158.2 | 0.6 | 111.1 | ||||
| 53 | I | 45 | Very low | 44.1 | Very low | 155 Ų | 155 | 138.4 Ų | 138.4 | 80% | 0.795 | 81% | 0.81 | S | S | * | * | trans | -68.1 | 94.2 | 152.8 | -66.3 | 170 | 0 | 0 | 0 | 109 | V55 | I53-V55 HydrophobicContact CG2-CG2 4.35Š| ||
| 54 | S | 43 | Very low | 43.6 | Very low | 103 Ų | 103 | 142 Ų | 142 | 72% | 0.72 | 82% | 0.815 | S | S | * | * | trans | -61 | 98.3 | 159.3 | 48.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 55 | V | 47.2 | Very low | 43.9 | Very low | 138 Ų | 138 | 141.1 Ų | 141.1 | 84% | 0.836 | 81% | 0.809 | S | S | * | * | trans | -88.3 | 89 | 157.6 | -159 | 0 | 0 | 0 | 0 | 108.4 | I53 | I53-V55 HydrophobicContact CG2-CG2 4.35Š| ||
| 56 | L | 43 | Very low | 44.1 | Very low | 165 Ų | 165 | 136.8 Ų | 136.8 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | -47.1 | 90.9 | 152.4 | -71.5 | 166.6 | 0 | 0 | 0 | 111.1 | ||||
| 57 | S | 44.5 | Very low | 44.1 | Very low | 116 Ų | 116 | 135.5 Ų | 135.5 | 81% | 0.811 | 80% | 0.802 | S | S | * | * | trans | -75.9 | 92.4 | 151.8 | 67.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 58 | G | 44.5 | Very low | 44.1 | Very low | 83 Ų | 83 | 134.3 Ų | 134.3 | 86% | 0.856 | 81% | 0.805 | S | S | * | * | trans | -62.6 | 93.8 | 158.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 59 | S | 40.7 | Very low | 44.2 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -65.2 | 105.3 | 146.2 | 71 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 60 | S | 46.4 | Very low | 44.4 | Very low | 114 Ų | 114 | 132.2 Ų | 132.2 | 80% | 0.797 | 80% | 0.796 | S | S | * | * | trans | 176.9 | 107.2 | 143.3 | 172.4 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 61 | S | 41.9 | Very low | 44.2 | Very low | 104 Ų | 104 | 131.6 Ų | 131.6 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | 120.3 | 96.7 | 104 | -165.6 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 62 | A | 40.1 | Very low | 44.1 | Very low | 104 Ų | 104 | 135.3 Ų | 135.3 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | 4.9 | 85.5 | 128.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 63 | E | 50.1 | Low | 44.5 | Very low | 171 Ų | 171 | 134.1 Ų | 134.1 | 80% | 0.799 | 79% | 0.789 | S | S | * | * | trans | -115.9 | 98.3 | 158.4 | -75 | -172.9 | 173.6 | 0 | 0 | 109.7 | ||||
| 64 | E | 41 | Very low | 44.5 | Very low | 186 Ų | 186 | 133.2 Ų | 133.2 | 87% | 0.869 | 79% | 0.786 | S | S | * | * | trans | -15.3 | 85.5 | 139.4 | -139.3 | 178.8 | 177.5 | 0 | 0 | 111.9 | ||||
| 65 | I | 46.1 | Very low | 44.7 | Very low | 139 Ų | 139 | 134.8 Ų | 134.8 | 71% | 0.713 | 79% | 0.786 | S | S | * | * | trans | -110.2 | 97.3 | 166.2 | -60.2 | 169.4 | 0 | 0 | 0 | 108.2 | V67 | I65-V67 HydrophobicContact CG2-CG2 3.93Š| ||
| 66 | T | 44.5 | Very low | 44.9 | Very low | 119 Ų | 119 | 135.4 Ų | 135.4 | 73% | 0.73 | 79% | 0.785 | S | S | * | * | trans | -50.7 | 95.9 | 155.2 | 51.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 67 | V | 44.2 | Very low | 45.2 | Very low | 123 Ų | 123 | 132.6 Ų | 132.6 | 75% | 0.745 | 78% | 0.776 | S | S | * | * | trans | -101.3 | 96.4 | 168 | 179.2 | 0 | 0 | 0 | 0 | 108.2 | I65 V69 | I65-V67 HydrophobicContact CG2-CG2 3.93Å; V67-V69 HydrophobicContact CG1-CG2 4.47Å | ||
| 68 | T | 45 | Very low | 45.4 | Very low | 125 Ų | 125 | 134.1 Ų | 134.1 | 77% | 0.767 | 78% | 0.775 | S | S | * | * | trans | -67 | 101.3 | 157 | -45.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 69 | V | 46.8 | Very low | 45.6 | Very low | 125 Ų | 125 | 136.6 Ų | 136.6 | 76% | 0.758 | 77% | 0.774 | S | S | * | * | trans | -76.4 | 0 | 158.4 | -174.1 | 0 | 0 | 0 | 0 | 108.7 | V67 | V67-V69 HydrophobicContact CG1-CG2 4.47Š| ||
| 70 | P | 48.5 | Very low | 45.6 | Very low | 113 Ų | 113 | 135.4 Ų | 135.4 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | 0 | 0 | 0 | 33.8 | -5.9 | 0 | 0 | 0 | 111.7 | |||||
| 71 | S | 42.7 | Very low | 45.8 | Very low | 98 Ų | 98 | 136.5 Ų | 136.5 | 69% | 0.685 | 77% | 0.768 | S | S | * | * | 0 | 107.3 | 0 | -172.7 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 72 | K | 42.2 | Very low | 45.7 | Very low | 193 Ų | 193 | 142.4 Ų | 142.4 | 84% | 0.839 | 77% | 0.774 | S | S | * | * | 33.6 | 105.4 | 117.7 | -89.7 | -174.4 | -177.2 | 173.3 | 0 | 111.4 | |||||
| 73 | R | 48.2 | Very low | 46 | Very low | 228 Ų | 228 | 145.8 Ų | 145.8 | 86% | 0.86 | 78% | 0.777 | S | S | * | * | trans | -173.8 | 0 | 142.7 | -79.5 | -170.2 | -166.1 | 115.6 | 0.1 | 109.4 | ||||
| 74 | D | 43.8 | Very low | 45.8 | Very low | 135 Ų | 135 | 141.1 Ų | 141.1 | 72% | 0.722 | 77% | 0.767 | S | S | * | * | 0 | 0 | 0 | -69.4 | -36.2 | 0 | 0 | 0 | 110.8 | |||||
| 75 | D | 46.5 | Very low | 46.2 | Very low | 136 Ų | 136 | 139 Ų | 139 | 73% | 0.727 | 76% | 0.762 | S | S | * | * | 0 | 0 | 0 | -73.6 | -48.1 | 0 | 0 | 0 | 109.4 | |||||
| 76 | D | 51.5 | Low | 46.1 | Very low | 151 Ų | 151 | 141.4 Ų | 141.4 | 81% | 0.807 | 77% | 0.77 | S | S | * | * | 0 | 145 | 0 | -74.6 | -32.7 | 0 | 0 | 0 | 109.7 | |||||
| 77 | P | 50.9 | Low | 46 | Very low | 106 Ų | 106 | 140.7 Ų | 140.7 | 69% | 0.688 | 77% | 0.77 | S | S | * | * | trans | -102.6 | 0 | -166.9 | 34.5 | -6.8 | 0 | 0 | 0 | 111.8 | ||||
| 78 | D | 47.1 | Very low | 46.2 | Very low | 149 Ų | 149 | 141.3 Ų | 141.3 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | 0 | 0 | 0 | -112.1 | -3.4 | 0 | 0 | 0 | 109.3 | |||||
| 79 | V | 48.8 | Very low | 46.2 | Very low | 135 Ų | 135 | 143.1 Ų | 143.1 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | 0 | 90.1 | 0 | 177.2 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 80 | A | 40.9 | Very low | 46.2 | Very low | 89 Ų | 89 | 145.4 Ų | 145.4 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | -2.1 | 101.8 | 115.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 81 | N | 50.4 | Low | 45.7 | Very low | 138 Ų | 138 | 145.3 Ų | 145.3 | 74% | 0.738 | 78% | 0.777 | S | S | * | * | trans | -170.3 | 105.9 | 146.4 | -96.9 | -6.6 | 0 | 0 | 0 | 109.8 | ||||
| 82 | R | 40.6 | Very low | 46 | Very low | 227 Ų | 227 | 146.2 Ų | 146.2 | 86% | 0.857 | 78% | 0.783 | S | S | * | * | 60.7 | 0 | 93.9 | -95 | -176.5 | -175.7 | 168.4 | -0.8 | 110.8 | |||||
| 83 | L | 45.8 | Very low | 46.2 | Very low | 176 Ų | 176 | 146.6 Ų | 146.6 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | 0 | 0 | 0 | -85.1 | 160 | 0 | 0 | 0 | 109.1 | |||||
| 84 | A | 46.2 | Very low | 45.7 | Very low | 73 Ų | 73 | 138.7 Ų | 138.7 | 60% | 0.603 | 78% | 0.778 | S | S | * | * | 0 | 110.3 | 0 | 0 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 85 | N | 49.9 | Very low | 45.8 | Very low | 141 Ų | 141 | 137.1 Ų | 137.1 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | 129.3 | 106.4 | 109.9 | -67.6 | -28.8 | 0 | 0 | 0 | 109.9 | |||||
| 86 | H | 44.4 | Very low | 45.6 | Very low | 189 Ų | 189 | 141 Ų | 141 | 88% | 0.875 | 78% | 0.784 | S | S | * | * | -178 | 0 | 125.1 | -87.7 | -8.1 | 0 | 0 | 0 | 109.4 | |||||
| 87 | S | 42.3 | Very low | 45.2 | Very low | 104 Ų | 104 | 142.1 Ų | 142.1 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | 0 | 109.7 | 0 | 178.9 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 88 | V | 47.2 | Very low | 44.7 | Very low | 136 Ų | 136 | 146.4 Ų | 146.4 | 82% | 0.824 | 79% | 0.794 | S | S | * | * | 178.9 | 0 | 124.5 | 173.9 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 89 | H | 45 | Very low | 44.4 | Very low | 163 Ų | 163 | 143.2 Ų | 143.2 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | 0 | 114.8 | 0 | -96.2 | -59.9 | 0 | 0 | 0 | 111.4 | |||||
| 90 | Q | 46.8 | Very low | 44 | Very low | 173 Ų | 173 | 141.1 Ų | 141.1 | 81% | 0.808 | 79% | 0.786 | S | S | * | * | 154.7 | 106.6 | 108.1 | -76.6 | -168.1 | 16 | 0 | 0 | 109.5 | |||||
| 91 | S | 37.8 | Very low | 44 | Very low | 111 Ų | 111 | 143.6 Ų | 143.6 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | 60.9 | 101 | 103.8 | 31.7 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 92 | S | 50.5 | Low | 43.8 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 82% | 0.818 | 78% | 0.784 | S | S | * | * | trans | -165.1 | 99 | 135.5 | 66.5 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 93 | E | 45.9 | Very low | 43.8 | Very low | 201 Ų | 201 | 142.8 Ų | 142.8 | 94% | 0.939 | 79% | 0.785 | S | S | * | * | 41.4 | 86.7 | 124.6 | -72.9 | -171 | 175.3 | 0 | 0 | 111.1 | |||||
| 94 | G | 36.8 | Very low | 43.8 | Very low | 63 Ų | 63 | 143 Ų | 143 | 65% | 0.649 | 78% | 0.778 | S | S | * | * | trans | -40.2 | 0 | 147.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 95 | S | 47.2 | Very low | 43.6 | Very low | 101 Ų | 101 | 144.8 Ų | 144.8 | 71% | 0.706 | 79% | 0.786 | S | S | * | * | 0 | 91.7 | 0 | 175.5 | 0 | 0 | 0 | 0 | 109.9 | H97 | S95-H97 PolarHBondContact O-N 3.43Š| |||
| 96 | Y | 41.7 | Very low | 43.3 | Very low | 219 Ų | 219 | 144.3 Ų | 144.3 | 86% | 0.859 | 79% | 0.788 | S | S | * | * | trans | -50.6 | 84 | 160.6 | -69.2 | -79.3 | 0 | 0 | 0 | 111 | ||||
| 97 | H | 43.7 | Very low | 43.2 | Very low | 173 Ų | 173 | 140.7 Ų | 140.7 | 80% | 0.801 | 78% | 0.78 | S | S | * | * | trans | -93.5 | 86 | 156.5 | -86.9 | -66.3 | 0 | 0 | 0 | 109.9 | S95 A99 | S95-H97 PolarHBondContact O-N 3.43Å; H97-A99 VanDerWaalsContact C-N 3.28Å; H97-A99 PolarHBondContact O-N 3.33Å | ||
| 98 | E | 39 | Very low | 42.8 | Very low | 197 Ų | 197 | 144.5 Ų | 144.5 | 92% | 0.921 | 78% | 0.783 | S | S | * | * | trans | -33.7 | 76.8 | 150.1 | -136.7 | 178.7 | 178 | 0 | 0 | 111.8 | ||||
| 99 | A | 40.4 | Very low | 42.5 | Very low | 82 Ų | 82 | 144.8 Ų | 144.8 | 68% | 0.678 | 78% | 0.776 | S | S | * | * | trans | -90.1 | 82.2 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | H97 I101 | H97-A99 VanDerWaalsContact C-N 3.28Å; H97-A99 PolarHBondContact O-N 3.33Å; A99-I101 PolarHBondContact O-N 3.48Å | ||
| 100 | A | 41 | Very low | 42.5 | Very low | 91 Ų | 91 | 141.4 Ų | 141.4 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | trans | -24.2 | 80.5 | 144.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | T102 | A100-T102 PolarHBondContact O-N 2.81Š| ||
| 101 | I | 41.2 | Very low | 42.2 | Very low | 140 Ų | 140 | 140.6 Ų | 140.6 | 72% | 0.718 | 77% | 0.767 | S | S | * | * | trans | -61.2 | 0 | 160.1 | -61.8 | 169.6 | 0 | 0 | 0 | 108.9 | A99 R103 | A99-I101 PolarHBondContact O-N 3.48Å; I101-R103 VanDerWaalsContact C-N 3.34Å; I101-R103 HydrophobicContact CG2-CG 3.84Å | ||
| 102 | T | 46.9 | Very low | 42.4 | Very low | 117 Ų | 117 | 142.8 Ų | 142.8 | 72% | 0.718 | 77% | 0.77 | S | S | * | * | 0 | 0 | 0 | 48.3 | 0 | 0 | 0 | 0 | 110.5 | A100 K104 | A100-T102 PolarHBondContact O-N 2.81Å; T102-K104 PolarHBondContact O-N 3.4Å | |||
| 103 | R | 39.4 | Very low | 41.9 | Very low | 232 Ų | 232 | 140.4 Ų | 140.4 | 88% | 0.875 | 76% | 0.764 | S | S | * | * | 0 | 73 | 0 | -67.2 | -171.3 | -179.8 | -173 | -0 | 110.7 | I101 | I101-R103 VanDerWaalsContact C-N 3.34Å; I101-R103 HydrophobicContact CG2-CG 3.84Å | |||
| 104 | K | 46 | Very low | 41.8 | Very low | 180 Ų | 180 | 138.4 Ų | 138.4 | 78% | 0.783 | 76% | 0.758 | S | S | * | * | trans | -86.4 | 83.3 | 160.1 | -80.2 | -179.5 | 179.9 | -178.5 | 0 | 110.2 | T102 T106 | T102-K104 PolarHBondContact O-N 3.4Å; K104-T106 VanDerWaalsContact C-N 3.33Å; K104-T106 PolarHBondContact O-N 3.23Å | ||
| 105 | S | 42.1 | Very low | 42.1 | Very low | 110 Ų | 110 | 142.8 Ų | 142.8 | 77% | 0.769 | 77% | 0.766 | S | S | * | * | trans | -29.5 | 0 | 150.5 | 66.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 106 | T | 43.1 | Very low | 42.1 | Very low | 131 Ų | 131 | 143.8 Ų | 143.8 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | 0 | 84 | 0 | 54.8 | 0 | 0 | 0 | 0 | 109.6 | K104 F108 | K104-T106 VanDerWaalsContact C-N 3.33Å; K104-T106 PolarHBondContact O-N 3.23Å; T106-F108 VanDerWaalsContact C-N 3.27Å; T106-F108 PolarHBondContact O-N 2.98Å | |||
| 107 | V | 42.4 | Very low | 42 | Very low | 114 Ų | 114 | 137.1 Ų | 137.1 | 69% | 0.691 | 77% | 0.769 | S | S | * | * | trans | -36.1 | 77.8 | 151.1 | -179.2 | 0 | 0 | 0 | 0 | 110 | E109 | V107-E109 VanDerWaalsContact C-N 3.26Å; V107-E109 HydrophobicContact CG1-CG 3.96Å; V107-E109 PolarHBondContact O-N 3Å | ||
| 108 | F | 35.4 | Very low | 41.6 | Very low | 183 Ų | 183 | 132.6 Ų | 132.6 | 80% | 0.803 | 77% | 0.768 | S | S | * | * | trans | -55.3 | 78.6 | 156.5 | -156.4 | -100.9 | 0 | 0 | 0 | 110.4 | T106 | T106-F108 VanDerWaalsContact C-N 3.27Å; T106-F108 PolarHBondContact O-N 2.98Å | ||
| 109 | E | 40.7 | Very low | 41.5 | Very low | 142 Ų | 142 | 130.8 Ų | 130.8 | 66% | 0.664 | 77% | 0.765 | S | S | * | * | trans | -68.6 | 80.1 | 163.8 | -100.6 | 166.1 | -178.7 | 0 | 0 | 110.8 | V107 E111 | V107-E109 VanDerWaalsContact C-N 3.26Å; V107-E109 HydrophobicContact CG1-CG 3.96Å; V107-E109 PolarHBondContact O-N 3Å; E109-E111 VanDerWaalsContact C-N 3.25Å; E109-E111 HydrophobicContact CB-CG 4.33Å | ||
| 110 | S | 45.1 | Very low | 41.7 | Very low | 93 Ų | 93 | 131.9 Ų | 131.9 | 65% | 0.65 | 77% | 0.768 | S | S | * | * | trans | -65.5 | 78.8 | 157.1 | 55.8 | 0 | 0 | 0 | 0 | 110.7 | N112 | S110-N112 VanDerWaalsContact C-N 3.29Å; S110-N112 PolarHBondContact O-N 3.24Å | ||
| 111 | E | 39.9 | Very low | 41.6 | Very low | 155 Ų | 155 | 132.8 Ų | 132.8 | 72% | 0.724 | 77% | 0.769 | S | S | * | * | trans | -64.7 | 79.5 | 167.5 | -58.2 | -160.1 | 170 | 0 | 0 | 110.4 | E109 | E109-E111 VanDerWaalsContact C-N 3.25Å; E109-E111 HydrophobicContact CB-CG 4.33Å | ||
| 112 | N | 42.2 | Very low | 41.6 | Very low | 158 Ų | 158 | 135.2 Ų | 135.2 | 85% | 0.845 | 78% | 0.777 | S | S | * | * | trans | -94.2 | 73.3 | 152.9 | -79.9 | -10 | 0 | 0 | 0 | 110.3 | S110 | S110-N112 VanDerWaalsContact C-N 3.29Å; S110-N112 PolarHBondContact O-N 3.24Å | ||
| 113 | G | 39 | Very low | 41.7 | Very low | 67 Ų | 67 | 138.4 Ų | 138.4 | 69% | 0.691 | 78% | 0.783 | S | S | * | * | trans | -93.6 | 96.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 114 | I | 44.4 | Very low | 42.2 | Very low | 158 Ų | 158 | 133 Ų | 133 | 81% | 0.81 | 78% | 0.778 | S | S | * | * | 3.3 | 84.8 | 126.6 | -60.1 | 165.9 | 0 | 0 | 0 | 110.1 | P116 | I114-P116 WeakPolarHBondContact O-CD 3.09Š| |||
| 115 | N | 42.8 | Very low | 42.4 | Very low | 156 Ų | 156 | 129 Ų | 129 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | trans | -35.9 | 109.9 | 156.5 | -87.3 | -38.9 | 0 | 0 | 0 | 111.9 | ||||
| 116 | P | 48.1 | Very low | 43.3 | Very low | 121 Ų | 121 | 130.3 Ų | 130.3 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | trans | -108.2 | 0 | 152.3 | 31.1 | -16.8 | 0 | 0 | 0 | 111.8 | I114 | I114-P116 WeakPolarHBondContact O-CD 3.09Š| ||
| 117 | G | 39.2 | Very low | 44 | Very low | 80 Ų | 80 | 132.4 Ų | 132.4 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | 0 | 100.1 | 0 | 0 | 0 | 0 | 0 | 0 | 112 | |||||
| 118 | G | 36.2 | Very low | 45.2 | Very low | 77 Ų | 77 | 130.9 Ų | 130.9 | 79% | 0.794 | 78% | 0.776 | S | S | * | * | 104.5 | 104.4 | 118.3 | 0 | 0 | 0 | 0 | 0 | 111 | |||||
| 119 | D | 36.8 | Very low | 46.6 | Very low | 160 Ų | 160 | 127.8 Ų | 127.8 | 86% | 0.856 | 78% | 0.775 | S | S | * | * | 119.7 | 0 | 112.2 | -147 | 2.3 | 0 | 0 | 0 | 109.6 | |||||
| 120 | S | 44 | Very low | 47.6 | Very low | 105 Ų | 105 | 127.2 Ų | 127.2 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | 0 | 95.6 | 0 | 62.5 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 121 | S | 38 | Very low | 48.2 | Very low | 110 Ų | 110 | 134.4 Ų | 134.4 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | 56.4 | 0 | 114.5 | 54.7 | 0 | 0 | 0 | 0 | 111 | |||||
| 122 | H | 42.2 | Very low | 48.9 | Very low | 191 Ų | 191 | 137 Ų | 137 | 88% | 0.884 | 80% | 0.8 | S | S | * | * | 0 | 84.9 | 0 | -128.5 | 47.3 | 0 | 0 | 0 | 109.2 | |||||
| 123 | E | 48.3 | Very low | 49.1 | Very low | 184 Ų | 184 | 141.1 Ų | 141.1 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -39.2 | 0 | 159.8 | -79.4 | -86.4 | 149.1 | 0 | 0 | 111.4 | ||||
| 124 | P | 50.1 | Low | 49.6 | Very low | 119 Ų | 119 | 144.7 Ų | 144.7 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | 0 | 0 | 0 | 30.6 | -16.1 | 0 | 0 | 0 | 111.6 | |||||
| 125 | A | 51.5 | Low | 49.8 | Very low | 94 Ų | 94 | 142.9 Ų | 142.9 | 78% | 0.777 | 80% | 0.798 | S | S | * | * | 0 | 88.7 | 0 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 126 | D | 60.6 | Low | 50 | Low | 139 Ų | 139 | 140.9 Ų | 140.9 | 74% | 0.743 | 79% | 0.792 | S | S | * | * | trans | -47 | 0 | 153.7 | -167.4 | 4.1 | 0 | 0 | 0 | 111.1 | S128 | D126-S128 VanDerWaalsContact C-N 3.28Å; D126-S128 PolarHBondContact OD1-N 2.94Å; D126-S128 PolarHBondContact OD1-OG 2.97Å | ||
| 127 | L | 57.1 | Low | 49.6 | Very low | 175 Ų | 175 | 146 Ų | 146 | 92% | 0.916 | 80% | 0.795 | S | S | * | * | 0 | 49 | 0 | -63.4 | 174.9 | 0 | 0 | 0 | 110.5 | |||||
| 128 | S | 66.9 | Low | 49.9 | Very low | 81 Ų | 81 | 153.9 Ų | 153.9 | 57% | 0.566 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -122.5 | 132.3 | 166.2 | -55.5 | 0 | 0 | 0 | 0 | 109.4 | D126 | D126-S128 VanDerWaalsContact C-N 3.28Å; D126-S128 PolarHBondContact OD1-N 2.94Å; D126-S128 PolarHBondContact OD1-OG 2.97Å |
| 129 | P | 65.9 | Low | 50 | Low | 118 Ų | 118 | 162 Ų | 162 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | trans | -52.6 | 137.1 | -175 | 16 | -3.7 | 0 | 0 | 0 | 111.9 | R131 | P129-R131 PolarHBondContact O-N 3.21Š| ||
| 130 | P | 62 | Low | 50.1 | Low | 131 Ų | 131 | 163 Ų | 163 | 85% | 0.851 | 81% | 0.806 | S | S | * | * | trans | -60.5 | 0 | -165.5 | 22.9 | -15.3 | 0 | 0 | 0 | 111.8 | ||||
| 131 | R | 56.8 | Low | 50 | Low | 244 Ų | 244 | 164.8 Ų | 164.8 | 92% | 0.921 | 81% | 0.807 | S | S | * | * | 0 | 89.1 | 0 | -126.5 | 177.1 | -144.3 | -134 | 0 | 110.2 | P129 R133 | P129-R131 PolarHBondContact O-N 3.21Å; R131-R133 PolarHBondContact O-N 3.47Å | |||
| 132 | R | 54.2 | Low | 50.3 | Low | 210 Ų | 210 | 164.5 Ų | 164.5 | 79% | 0.792 | 81% | 0.805 | S | S | * | * | trans | -19.8 | 93.6 | 154.4 | -157 | 174.8 | 174.7 | -147.7 | -0.6 | 111.7 | Q134 | R132-Q134 HydrophobicContact CG-CG 4.42Š| ||
| 133 | R | 46.9 | Very low | 50.3 | Low | 243 Ų | 243 | 163.5 Ų | 163.5 | 92% | 0.917 | 80% | 0.801 | S | S | * | * | trans | -80.8 | 90.6 | 164.3 | -73.9 | -171.3 | 175 | -172.6 | -1 | 110.1 | R131 | R131-R133 PolarHBondContact O-N 3.47Š| ||
| 134 | Q | 50.8 | Low | 50 | Low | 143 Ų | 143 | 163.1 Ų | 163.1 | 67% | 0.668 | 80% | 0.799 | S | S | * | * | trans | -79.3 | 97 | 165.6 | -83.7 | -160.6 | -22.9 | 0 | 0 | 110.5 | R132 | R132-Q134 HydrophobicContact CG-CG 4.42Š| ||
| 135 | T | 47.5 | Very low | 49.7 | Very low | 119 Ų | 119 | 162.8 Ų | 162.8 | 73% | 0.73 | 80% | 0.8 | S | S | * | * | trans | -35 | 112.4 | 135.8 | 58.3 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 136 | V | 46.7 | Very low | 49.9 | Very low | 115 Ų | 115 | 165.3 Ų | 165.3 | 70% | 0.697 | 80% | 0.8 | S | S | * | * | 83 | 103.4 | 112.6 | -173.2 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 137 | R | 40.9 | Very low | 49.5 | Very low | 229 Ų | 229 | 166.3 Ų | 166.3 | 86% | 0.864 | 80% | 0.804 | S | S | * | * | 81.9 | 99.5 | 119.8 | -76.2 | -169.9 | 161.5 | 170.1 | -1 | 110.2 | |||||
| 138 | R | 43.6 | Very low | 49.8 | Very low | 245 Ų | 245 | 162.5 Ų | 162.5 | 93% | 0.925 | 79% | 0.793 | S | S | * | * | trans | 177.9 | 99.3 | 141.8 | -85.1 | -163.4 | 174.1 | -160.4 | -0.6 | 109.2 | ||||
| 139 | R | 40.1 | Very low | 49.6 | Very low | 247 Ų | 247 | 164.1 Ų | 164.1 | 93% | 0.932 | 80% | 0.801 | S | S | * | * | 60.5 | 0 | 109.1 | -82.1 | -173.8 | 179.7 | 149.3 | -1.1 | 110.7 | |||||
| 140 | H | 37.4 | Very low | 49.6 | Very low | 180 Ų | 180 | 164.2 Ų | 164.2 | 83% | 0.833 | 80% | 0.802 | S | S | * | * | 0 | 112.2 | 0 | -93.8 | -73.5 | 0 | 0 | 0 | 111.1 | |||||
| 141 | D | 42 | Very low | 49.3 | Very low | 144 Ų | 144 | 170.2 Ų | 170.2 | 77% | 0.77 | 81% | 0.807 | S | S | * | * | trans | 162.2 | 103 | 130.8 | -91.2 | -12.2 | 0 | 0 | 0 | 109.2 | ||||
| 142 | S | 44.9 | Very low | 49.1 | Very low | 103 Ų | 103 | 168.6 Ų | 168.6 | 72% | 0.72 | 81% | 0.807 | S | S | * | * | 120 | 107.5 | 115 | 37.9 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 143 | E | 42.8 | Very low | 49 | Very low | 170 Ų | 170 | 162.3 Ų | 162.3 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | 97.3 | 101 | 105 | -53.5 | -122.8 | 167.9 | 0 | 0 | 109.8 | |||||
| 144 | E | 42 | Very low | 49.1 | Very low | 177 Ų | 177 | 156.9 Ų | 156.9 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | 145.9 | 83.5 | 127.2 | -167.1 | 94.6 | -147.5 | 0 | 0 | 109.4 | |||||
| 145 | S | 44 | Very low | 49 | Very low | 112 Ų | 112 | 157.7 Ų | 157.7 | 78% | 0.783 | 80% | 0.804 | S | S | * | * | trans | 160 | 75 | 134.8 | -148.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 146 | D | 54 | Low | 48.7 | Very low | 147 Ų | 147 | 159.2 Ų | 159.2 | 79% | 0.786 | 81% | 0.807 | S | S | * | * | trans | -63 | 91.9 | 160.8 | -159.7 | 2.4 | 0 | 0 | 0 | 110.8 | ||||
| 147 | L | 54.1 | Low | 48.7 | Very low | 159 Ų | 159 | 158.2 Ų | 158.2 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | trans | -115.3 | 62.7 | 159.1 | -67 | 175.3 | 0 | 0 | 0 | 109.8 | ||||
| 148 | S | 62.3 | Low | 48.7 | Very low | 96 Ų | 96 | 156.1 Ų | 156.1 | 67% | 0.671 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -131.5 | 125.1 | 155.1 | -57.2 | 0 | 0 | 0 | 0 | 109.5 | ||
| 149 | P | 63.8 | Low | 48.7 | Very low | 114 Ų | 114 | 148 Ų | 148 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | trans | -55.7 | 138.7 | -178.3 | 15.4 | -0.3 | 0 | 0 | 0 | 111.9 | ||||
| 150 | P | 64.5 | Low | 49 | Very low | 121 Ų | 121 | 146.8 Ų | 146.8 | 79% | 0.786 | 79% | 0.788 | S | S | * | * | trans | -54.5 | 114.4 | -171.5 | 23.8 | -16.3 | 0 | 0 | 0 | 111.8 | K152 | P150-K152 PolarHBondContact O-N 2.49Š| ||
| 151 | R | 55.8 | Low | 49.3 | Very low | 256 Ų | 256 | 142.9 Ų | 142.9 | 97% | 0.966 | 79% | 0.787 | S | S | * | * | trans | -43.3 | 94.6 | 157 | -103.3 | -178.3 | -160.5 | -141.5 | 0.5 | 111.4 | A153 | R151-A153 PolarHBondContact O-N 3.18Š| ||
| 152 | K | 53.5 | Low | 49.5 | Very low | 210 Ų | 210 | 140.6 Ų | 140.6 | 91% | 0.913 | 79% | 0.787 | S | S | * | * | trans | -42.7 | 100.1 | 162.2 | -77.1 | -163 | 176.9 | -172.1 | 0 | 111.2 | P150 | P150-K152 PolarHBondContact O-N 2.49Š| ||
| 153 | A | 52 | Low | 49.9 | Very low | 78 Ų | 78 | 142 Ų | 142 | 65% | 0.645 | 79% | 0.792 | S | S | * | * | trans | -39.6 | 136.8 | 149.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | R151 I155 | R151-A153 PolarHBondContact O-N 3.18Å; A153-I155 PolarHBondContact O-N 3.36Å | ||
| 154 | P | 48.7 | Very low | 50.5 | Low | 129 Ų | 129 | 139.6 Ų | 139.6 | 84% | 0.838 | 79% | 0.791 | S | S | * | * | trans | -76.4 | 0 | -179.9 | 16.9 | 3.1 | 0 | 0 | 0 | 111.6 | ||||
| 155 | I | 47.8 | Very low | 51.7 | Low | 160 Ų | 160 | 136.7 Ų | 136.7 | 82% | 0.821 | 79% | 0.787 | S | S | * | * | 0 | 100.1 | 0 | -66.6 | 170 | 0 | 0 | 0 | 109 | A153 | A153-I155 PolarHBondContact O-N 3.36Š| |||
| 156 | D | 42.8 | Very low | 52.7 | Low | 151 Ų | 151 | 137.2 Ų | 137.2 | 81% | 0.807 | 79% | 0.788 | S | S | * | * | trans | -24.8 | 105.4 | 133.5 | -78.2 | -18.6 | 0 | 0 | 0 | 111.5 | ||||
| 157 | S | 45.8 | Very low | 52.6 | Low | 95 Ų | 95 | 136.2 Ų | 136.2 | 66% | 0.664 | 79% | 0.789 | S | S | * | * | trans | 170.3 | 104.4 | 135.5 | 58.3 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 158 | H | 41.5 | Very low | 52.1 | Low | 184 Ų | 184 | 140.9 Ų | 140.9 | 85% | 0.852 | 80% | 0.796 | S | S | * | * | 84.4 | 100.4 | 108.8 | -86.5 | -70.7 | 0 | 0 | 0 | 110.3 | |||||
| 159 | A | 42.4 | Very low | 51.3 | Low | 76 Ų | 76 | 142.1 Ų | 142.1 | 63% | 0.628 | 80% | 0.804 | S | S | * | * | 146.6 | 93.6 | 126.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 160 | Y | 46.1 | Very low | 50.3 | Low | 221 Ų | 221 | 147.9 Ų | 147.9 | 87% | 0.867 | 81% | 0.811 | S | S | * | * | 138.5 | 90.2 | 119.6 | -81 | -84.1 | 0 | 0 | 0 | 109.2 | |||||
| 161 | A | 44.3 | Very low | 49.4 | Very low | 98 Ų | 98 | 147.9 Ų | 147.9 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | 138.1 | 89.7 | 124.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 162 | A | 45.5 | Very low | 48.8 | Very low | 95 Ų | 95 | 140.8 Ų | 140.8 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | 100.5 | 0 | 112.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 163 | V | 53.4 | Low | 48.2 | Very low | 134 Ų | 134 | 136 Ų | 136 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | 0 | 105.7 | 0 | -173.4 | 0 | 0 | 0 | 0 | 107.7 | |||||
| 164 | P | 56.4 | Low | 47.9 | Very low | 119 Ų | 119 | 137.7 Ų | 137.7 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 0 | -178.3 | 27.9 | -9.6 | 0 | 0 | 0 | 111.7 | ||
| 165 | P | 66.3 | Low | 47.7 | Very low | 116 Ų | 116 | 139.7 Ų | 139.7 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | 0 | 0 | 0 | 26.8 | -15.5 | 0 | 0 | 0 | 111.8 | |||
| 166 | P | 66.3 | Low | 47.3 | Very low | 122 Ų | 122 | 143.6 Ų | 143.6 | 79% | 0.792 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | 0 | 0 | 0 | 24.3 | -20.8 | 0 | 0 | 0 | 111.9 | |||
| 167 | P | 52 | Low | 47.1 | Very low | 126 Ų | 126 | 146.9 Ų | 146.9 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | 0 | 115 | 0 | 27.2 | -7.6 | 0 | 0 | 0 | 111.7 | |||||
| 168 | R | 43 | Very low | 46.8 | Very low | 258 Ų | 258 | 147.1 Ų | 147.1 | 97% | 0.974 | 80% | 0.796 | S | S | * | * | trans | -55.9 | 91.2 | 155.6 | -82.4 | -176.7 | 176.7 | 177.6 | -0.2 | 110.9 | ||||
| 169 | S | 44.5 | Very low | 46.8 | Very low | 121 Ų | 121 | 148.3 Ų | 148.3 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | trans | -69.6 | 97.1 | 165.9 | 65.2 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 170 | R | 43.6 | Very low | 46.8 | Very low | 236 Ų | 236 | 156.5 Ų | 156.5 | 89% | 0.891 | 81% | 0.808 | S | S | * | * | trans | -93.3 | 104.4 | 147.2 | -81.4 | -175.4 | 164.1 | 169.5 | 0 | 110.4 | ||||
| 171 | T | 45.4 | Very low | 46.6 | Very low | 121 Ų | 121 | 158.1 Ų | 158.1 | 74% | 0.742 | 81% | 0.813 | S | S | * | * | 123.9 | 165.2 | 111.1 | 56.9 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 172 | P | 44.5 | Very low | 46.3 | Very low | 107 Ų | 107 | 157 Ų | 157 | 70% | 0.695 | 81% | 0.811 | S | S | * | * | cis | -171.3 | 136.1 | 20 | 33.6 | -4.8 | 0 | 0 | 0 | 111.9 | ||||
| 173 | S | 38.9 | Very low | 46.1 | Very low | 108 Ų | 108 | 157.8 Ų | 157.8 | 76% | 0.755 | 81% | 0.811 | S | S | * | * | 121.5 | 98.9 | 128.7 | 96.1 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 174 | V | 46.9 | Very low | 45.6 | Very low | 114 Ų | 114 | 160.6 Ų | 160.6 | 69% | 0.691 | 82% | 0.815 | S | S | * | * | trans | -171.5 | 98.2 | 140.6 | -176 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 175 | E | 45 | Very low | 45.1 | Very low | 172 Ų | 172 | 163.4 Ų | 163.4 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | 94 | 97.9 | 114.1 | -102.6 | 178.5 | -179.5 | 0 | 0 | 110.2 | |||||
| 176 | R | 38.1 | Very low | 43.9 | Very low | 241 Ų | 241 | 163.8 Ų | 163.8 | 91% | 0.909 | 82% | 0.823 | S | S | * | * | 55.8 | 100.7 | 108.4 | -86.6 | -171.2 | 162.9 | 168 | -0.6 | 110.8 | |||||
| 177 | R | 38.9 | Very low | 43.6 | Very low | 220 Ų | 220 | 164.2 Ų | 164.2 | 83% | 0.83 | 82% | 0.819 | S | S | * | * | trans | 165 | 99.5 | 131.9 | -124.8 | 174.1 | 172.4 | -173.9 | -0.2 | 109.2 | ||||
| 178 | S | 40.4 | Very low | 44.2 | Very low | 100 Ų | 100 | 166.4 Ų | 166.4 | 70% | 0.699 | 82% | 0.823 | S | S | * | * | 31.9 | 104.9 | 115.5 | 114.8 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 179 | R | 41.7 | Very low | 45.6 | Very low | 209 Ų | 209 | 157.7 Ų | 157.7 | 79% | 0.789 | 80% | 0.801 | S | S | * | * | trans | 175.9 | 100 | 138.8 | -82.3 | -172.6 | -174.9 | 135.5 | 0.2 | 109.1 | ||||
| 180 | R | 41.4 | Very low | 46.7 | Very low | 249 Ų | 249 | 157.1 Ų | 157.1 | 94% | 0.94 | 80% | 0.795 | S | S | * | * | 22.8 | 108.8 | 115.2 | -86.8 | -168.1 | -176 | -164 | 0.5 | 111.2 | |||||
| 181 | R | 42.9 | Very low | 47.8 | Very low | 254 Ų | 254 | 151.8 Ų | 151.8 | 96% | 0.958 | 79% | 0.791 | S | S | * | * | trans | 151.3 | 100.4 | 139 | -136.3 | 176.1 | -159.7 | -161.9 | 0.9 | 109.2 | ||||
| 182 | G | 36.7 | Very low | 48.5 | Very low | 76 Ų | 76 | 157.8 Ų | 157.8 | 78% | 0.784 | 80% | 0.8 | S | S | * | * | 80.7 | 90.4 | 112.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 183 | S | 42.9 | Very low | 48.8 | Very low | 110 Ų | 110 | 161.4 Ų | 161.4 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | -146.6 | 0 | 153.3 | 129.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 184 | E | 42.1 | Very low | 49.1 | Very low | 194 Ų | 194 | 158.9 Ų | 158.9 | 91% | 0.907 | 80% | 0.796 | S | S | * | * | 0 | 83.8 | 0 | -72.1 | -176.4 | 176.1 | 0 | 0 | 111.3 | |||||
| 185 | E | 45.7 | Very low | 48.9 | Very low | 178 Ų | 178 | 165.3 Ų | 165.3 | 83% | 0.832 | 81% | 0.808 | S | S | * | * | trans | -134.2 | 88.1 | 154 | -136.4 | 144.5 | -168.4 | 0 | 0 | 109.7 | D187 | E185-D187 PolarHBondContact O-N 3.4Š| ||
| 186 | S | 40.3 | Very low | 49.1 | Very low | 123 Ų | 123 | 162.1 Ų | 162.1 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | trans | 49 | 68.3 | 131.4 | -102.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 187 | D | 61 | Low | 49.7 | Very low | 131 Ų | 131 | 156.6 Ų | 156.6 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | trans | -88 | 95.2 | 163 | -168.4 | 6 | 0 | 0 | 0 | 110 | E185 S189 | E185-D187 PolarHBondContact O-N 3.4Å; D187-S189 PolarHBondContact O-N 3.31Å; D187-S189 VanDerWaalsContact OD1-CB 3.29Å; D187-S189 WeakPolarHBondContact OD1-CB 3.12Å; D187-S189 PolarHBondContact OD1-N 2.96Å; D187-S189 PolarHBondContact OD1-OG 2.77Å | ||
| 188 | L | 63.7 | Low | 50.3 | Low | 173 Ų | 173 | 151 Ų | 151 | 91% | 0.906 | 78% | 0.784 | S | S | * | * | trans | -69.6 | 41.3 | 167.8 | -64.1 | 174.9 | 0 | 0 | 0 | 110.3 | ||||
| 189 | S | 72.4 | Confident | 51.1 | Low | 74 Ų | 74 | 154.5 Ų | 154.5 | 52% | 0.517 | 79% | 0.79 | S | S | . | * | S | Bend | trans | -107.7 | 125.8 | 170.1 | -60.3 | 0 | 0 | 0 | 0 | 109.8 | D187 | D187-S189 PolarHBondContact O-N 3.31Å; D187-S189 VanDerWaalsContact OD1-CB 3.29Å; D187-S189 WeakPolarHBondContact OD1-CB 3.12Å; D187-S189 PolarHBondContact OD1-N 2.96Å; D187-S189 PolarHBondContact OD1-OG 2.77Å |
| 190 | P | 68.6 | Low | 51.7 | Low | 109 Ų | 109 | 147.8 Ų | 147.8 | 71% | 0.708 | 78% | 0.778 | S | S | * | * | trans | -45.7 | 125 | 173.7 | 7.8 | 0 | 0 | 0 | 0 | 111.8 | R192 | P190-R192 PolarHBondContact O-N 2.36Š| ||
| 191 | P | 65.9 | Low | 52.1 | Low | 124 Ų | 124 | 145.9 Ų | 145.9 | 81% | 0.805 | 77% | 0.773 | S | S | * | * | trans | -38.5 | 103 | 176.9 | 17.5 | -19.1 | 0 | 0 | 0 | 111.7 | K193 | P191-K193 VanDerWaalsContact C-N 3.25Å; P191-K193 PolarHBondContact O-N 2.76Å | ||
| 192 | R | 61 | Low | 52.7 | Low | 247 Ų | 247 | 138.9 Ų | 138.9 | 93% | 0.932 | 76% | 0.763 | S | S | * | * | trans | -57.7 | 0 | 163.1 | -90.6 | -176.2 | -160.1 | -130.7 | 1 | 110.9 | P190 G194 | P190-R192 PolarHBondContact O-N 2.36Å; R192-G194 VanDerWaalsContact C-N 3.31Å; R192-G194 PolarHBondContact O-N 2.69Å | ||
| 193 | K | 50.4 | Low | 53.4 | Low | 183 Ų | 183 | 140.2 Ų | 140.2 | 80% | 0.796 | 76% | 0.76 | S | S | * | * | 0 | 84.9 | 0 | -132.9 | 171.7 | -179.1 | -174.3 | 0 | 111.7 | P191 I196 | P191-K193 VanDerWaalsContact C-N 3.25Å; P191-K193 PolarHBondContact O-N 2.76Å; K193-I196 HydrophobicContact CD-CD1 3.85Å; K193-I196 HydrophobicContact CG-CD1 4.25Å | |||
| 194 | G | 45.9 | Very low | 54.1 | Low | 56 Ų | 56 | 140.4 Ų | 140.4 | 58% | 0.577 | 76% | 0.757 | S | S | * | * | trans | 4.5 | 97.6 | 132 | 0 | 0 | 0 | 0 | 0 | 112.5 | R192 I196 | R192-G194 VanDerWaalsContact C-N 3.31Å; R192-G194 PolarHBondContact O-N 2.69Å; G194-I196 PolarHBondContact O-N 2.66Å | ||
| 195 | R | 42.6 | Very low | 55 | Low | 249 Ų | 249 | 136.7 Ų | 136.7 | 94% | 0.94 | 75% | 0.749 | S | S | * | * | trans | 39.5 | 66.6 | 137.2 | -144.1 | 178.8 | -174.9 | -146.3 | 0.3 | 111.2 | ||||
| 196 | I | 48.7 | Very low | 55.7 | Low | 104 Ų | 104 | 134.3 Ų | 134.3 | 53% | 0.533 | 75% | 0.749 | S | S | . | * | trans | -81.1 | 0 | 169.2 | -62.5 | 172.3 | 0 | 0 | 0 | 108.7 | K193 G194 A198 A200 | K193-I196 HydrophobicContact CD-CD1 3.85Å; K193-I196 HydrophobicContact CG-CD1 4.25Å; G194-I196 PolarHBondContact O-N 2.66Å; I196-A198 PolarHBondContact O-N 3.34Å; I196-A200 HydrophobicContact CG2-CB 4.31Å | ||
| 197 | D | 50 | Low | 56 | Low | 126 Ų | 126 | 133.1 Ų | 133.1 | 67% | 0.674 | 75% | 0.747 | S | S | * | * | 0 | 90.7 | 0 | -63.8 | -24.3 | 0 | 0 | 0 | 111.3 | Q199 A200 | D197-Q199 PolarHBondContact O-N 2.95Å; D197-A200 PolarHBondContact O-N 3.48Å | |||
| 198 | A | 53.1 | Low | 55.3 | Low | 102 Ų | 102 | 132.5 Ų | 132.5 | 84% | 0.843 | 75% | 0.753 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -22.1 | 29.4 | 152.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | I196 | I196-A198 PolarHBondContact O-N 3.34Š|
| 199 | Q | 56 | Low | 54.6 | Low | 174 Ų | 174 | 129.6 Ų | 129.6 | 81% | 0.813 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.1 | 0 | 168.9 | -105 | 117.9 | -20.5 | 0 | 0 | 109.6 | D197 | D197-Q199 PolarHBondContact O-N 2.95Š|
| 200 | A | 53.7 | Low | 53.3 | Low | 67 Ų | 67 | 138.1 Ų | 138.1 | 55% | 0.554 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 109.3 | I196 D197 | I196-A200 HydrophobicContact CG2-CB 4.31Å; D197-A200 PolarHBondContact O-N 3.48Å | |
| 201 | Y | 49.7 | Very low | 52.5 | Low | 209 Ų | 209 | 138.2 Ų | 138.2 | 82% | 0.82 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | 0 | 38.1 | 0 | -98.2 | -88.2 | 0 | 0 | 0 | 109.2 | S203 | Y201-S203 PolarHBondContact O-N 3.19Š| |
| 202 | S | 55.7 | Low | 51.6 | Low | 108 Ų | 108 | 138.2 Ų | 138.2 | 76% | 0.755 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.7 | 40.7 | 170.5 | 146 | 0 | 0 | 0 | 0 | 109.6 | ||
| 203 | S | 53.1 | Low | 50.9 | Low | 104 Ų | 104 | 131.4 Ų | 131.4 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.6 | 0 | 164 | -17.6 | 0 | 0 | 0 | 0 | 109.5 | Y201 | Y201-S203 PolarHBondContact O-N 3.19Š|
| 204 | V | 56.2 | Low | 50.7 | Low | 114 Ų | 114 | 128.5 Ų | 128.5 | 69% | 0.691 | 76% | 0.759 | S | S | * | * | 0 | 101.7 | 0 | -140 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 205 | P | 61.7 | Low | 50.9 | Low | 115 Ų | 115 | 133.9 Ų | 133.9 | 75% | 0.747 | 77% | 0.769 | S | S | * | * | trans | -62.9 | 0 | 178.1 | 19.6 | -12.5 | 0 | 0 | 0 | 111.6 | ||||
| 206 | P | 60.6 | Low | 50.7 | Low | 128 Ų | 128 | 127.3 Ų | 127.3 | 83% | 0.831 | 76% | 0.761 | S | S | * | * | 0 | 111 | 0 | 23.6 | -20.1 | 0 | 0 | 0 | 111.7 | S208 | P206-S208 PolarHBondContact O-N 2.82Š| |||
| 207 | A | 47.2 | Very low | 50.5 | Low | 99 Ų | 99 | 134.1 Ų | 134.1 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | -37 | 0 | 153 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 208 | S | 46.3 | Very low | 50.1 | Low | 118 Ų | 118 | 133.2 Ų | 133.2 | 83% | 0.825 | 78% | 0.784 | S | S | * | * | 0 | 78.7 | 0 | 167.8 | 0 | 0 | 0 | 0 | 109.9 | P206 | P206-S208 PolarHBondContact O-N 2.82Š| |||
| 209 | S | 48.8 | Very low | 49.9 | Very low | 112 Ų | 112 | 133 Ų | 133 | 78% | 0.783 | 78% | 0.775 | S | S | * | * | trans | -150.8 | 74.8 | 147 | 58.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 210 | R | 44.6 | Very low | 49.3 | Very low | 253 Ų | 253 | 136.3 Ų | 136.3 | 96% | 0.955 | 78% | 0.781 | S | S | * | * | trans | -91.5 | 93.9 | 162 | -100.3 | 172.3 | 121.6 | -164.5 | 0.8 | 109.9 | ||||
| 211 | S | 52.2 | Low | 48.7 | Very low | 110 Ų | 110 | 144.4 Ų | 144.4 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | trans | -87.7 | 125.4 | 146.4 | -7.4 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 212 | P | 45.5 | Very low | 48.6 | Very low | 124 Ų | 124 | 138.8 Ų | 138.8 | 81% | 0.805 | 79% | 0.788 | S | S | * | * | trans | -90.2 | 102 | 175.2 | 7.2 | 10.5 | 0 | 0 | 0 | 111.7 | ||||
| 213 | S | 46.7 | Very low | 47.9 | Very low | 104 Ų | 104 | 142.1 Ų | 142.1 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -102.9 | 94.4 | 166.4 | 89.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 214 | T | 47.3 | Very low | 47.5 | Very low | 123 Ų | 123 | 142.2 Ų | 142.2 | 76% | 0.755 | 79% | 0.792 | S | S | * | * | trans | -30.9 | 89.6 | 138.3 | 50.6 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 215 | H | 48.4 | Very low | 47.4 | Very low | 168 Ų | 168 | 148.4 Ų | 148.4 | 78% | 0.778 | 80% | 0.803 | S | S | * | * | trans | -136.6 | 0 | 154.3 | -67.3 | -18.4 | 0 | 0 | 0 | 109.5 | ||||
| 216 | S | 38.9 | Very low | 46.7 | Very low | 111 Ų | 111 | 148.5 Ų | 148.5 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | 0 | 94 | 0 | 133.6 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 217 | R | 44 | Very low | 46.1 | Very low | 248 Ų | 248 | 147.5 Ų | 147.5 | 94% | 0.936 | 80% | 0.8 | S | S | * | * | trans | -143.6 | 0 | 154.1 | -90.2 | -180 | 98.9 | 166.7 | -0.4 | 109.4 | ||||
| 218 | S | 42.6 | Very low | 46.4 | Very low | 107 Ų | 107 | 152.5 Ų | 152.5 | 75% | 0.748 | 80% | 0.804 | S | S | * | * | 0 | 108.3 | 0 | 113 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 219 | S | 48.2 | Very low | 46.7 | Very low | 96 Ų | 96 | 152.8 Ų | 152.8 | 67% | 0.671 | 80% | 0.796 | S | S | * | * | 132.1 | 99.4 | 124.2 | 70.6 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 220 | R | 44 | Very low | 46.9 | Very low | 244 Ų | 244 | 155.6 Ų | 155.6 | 92% | 0.921 | 79% | 0.794 | S | S | * | * | trans | -175.5 | 0 | 134.8 | -82.7 | -175.8 | -170.9 | -160.7 | 0.1 | 109.2 | ||||
| 221 | R | 42 | Very low | 47.2 | Very low | 238 Ų | 238 | 151.6 Ų | 151.6 | 90% | 0.898 | 79% | 0.785 | S | S | * | * | 0 | 110.8 | 0 | -154.1 | 171.4 | 179.1 | -152.9 | -0.5 | 111 | |||||
| 222 | S | 47 | Very low | 47.3 | Very low | 90 Ų | 90 | 150.4 Ų | 150.4 | 63% | 0.629 | 78% | 0.777 | S | S | * | * | 122 | 108.8 | 105.3 | 63 | 0 | 0 | 0 | 0 | 109.8 | |||||
| 223 | E | 40.2 | Very low | 47.6 | Very low | 179 Ų | 179 | 152.1 Ų | 152.1 | 84% | 0.836 | 77% | 0.772 | S | S | * | * | 54.5 | 100.3 | 106.8 | -100.3 | 128.6 | -167.4 | 0 | 0 | 111.1 | |||||
| 224 | S | 46.3 | Very low | 48 | Very low | 106 Ų | 106 | 151.5 Ų | 151.5 | 74% | 0.741 | 76% | 0.764 | S | S | * | * | trans | 171.9 | 0 | 140.2 | 62.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 225 | R | 52.3 | Low | 48.4 | Very low | 243 Ų | 243 | 149.1 Ų | 149.1 | 92% | 0.917 | 76% | 0.757 | S | S | * | * | 0 | 0 | 0 | -73.9 | -176.8 | 138.3 | -155.2 | 0.4 | 109.3 | |||||
| 226 | P | 48.2 | Very low | 48.6 | Very low | 117 Ų | 117 | 148.6 Ų | 148.6 | 76% | 0.76 | 75% | 0.748 | S | S | * | * | 0 | 0 | 0 | 34.4 | -6.1 | 0 | 0 | 0 | 111.7 | |||||
| 227 | S | 47.4 | Very low | 49.4 | Very low | 108 Ų | 108 | 150.7 Ų | 150.7 | 76% | 0.755 | 75% | 0.745 | S | S | * | * | 0 | 81.7 | 0 | -65.2 | 0 | 0 | 0 | 0 | 109.2 | |||||
| 228 | K | 53 | Low | 50 | Low | 204 Ų | 204 | 148.1 Ų | 148.1 | 89% | 0.887 | 74% | 0.741 | S | S | * | * | trans | -150.5 | 0 | 145 | -126.6 | 172.7 | -179.5 | 168 | 0 | 109.3 | ||||
| 229 | D | 52.4 | Low | 50.3 | Low | 123 Ų | 123 | 145.9 Ų | 145.9 | 66% | 0.658 | 73% | 0.726 | S | S | * | * | 0 | 91.8 | 0 | -82.1 | -19.9 | 0 | 0 | 0 | 111.6 | |||||
| 230 | K | 53.8 | Low | 50.2 | Low | 172 Ų | 172 | 144.7 Ų | 144.7 | 75% | 0.748 | 72% | 0.717 | S | S | * | * | S | Bend | 107.4 | 0 | 110.3 | -88.5 | 179.6 | -179.2 | 177.5 | 0 | 110.4 | |||
| 231 | H | 50.6 | Low | 50.9 | Low | 168 Ų | 168 | 137.3 Ų | 137.3 | 78% | 0.778 | 70% | 0.703 | S | S | * | * | S | Bend | 0 | 14.6 | 0 | -77.3 | -60.7 | 0 | 0 | 0 | 109.9 | |||
| 232 | S | 54 | Low | 51.6 | Low | 85 Ų | 85 | 131.3 Ų | 131.3 | 59% | 0.594 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -114.4 | 0 | 177.4 | 66.3 | 0 | 0 | 0 | 0 | 110.2 | ||
| 233 | K | 53 | Low | 52.2 | Low | 160 Ų | 160 | 136 Ų | 136 | 70% | 0.696 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | 0 | -6.7 | 0 | -153.4 | 173.8 | -178.8 | 171.3 | 0 | 110 | |||
| 234 | T | 54.3 | Low | 53.1 | Low | 92 Ų | 92 | 128.9 Ų | 128.9 | 56% | 0.564 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.7 | 3.3 | 175.8 | 57 | 0 | 0 | 0 | 0 | 109.7 | ||
| 235 | A | 54.9 | Low | 54 | Low | 73 Ų | 73 | 126.8 Ų | 126.8 | 60% | 0.603 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104 | -3.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 236 | R | 53.7 | Low | 54.6 | Low | 156 Ų | 156 | 121.8 Ų | 121.8 | 59% | 0.589 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -104.9 | 0 | 178.4 | -168.5 | 165.5 | 163.1 | -158.2 | -2.1 | 109.9 | S239 R246 | R236-S239 PolarHBondContact O-OG 3.34Å; R236-R246 VanDerWaalsContact NE-CZ 3.32Å |
| 237 | E | 56.2 | Low | 55.4 | Low | 155 Ų | 155 | 122.8 Ų | 122.8 | 72% | 0.724 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | 0 | 0 | 0 | -88.6 | 178.9 | 178.8 | 0 | 0 | 110.3 | |||
| 238 | K | 56.5 | Low | 56.4 | Low | 195 Ų | 195 | 121.2 Ų | 121.2 | 85% | 0.848 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | 0 | 18.8 | 0 | -76.3 | -179.3 | -176.5 | 178 | 0 | 109.8 | S240 | K238-S240 PolarHBondContact O-N 3.36Š| |
| 239 | S | 48.4 | Very low | 57.3 | Low | 60 Ų | 60 | 120.3 Ų | 120.3 | 42% | 0.42 | 64% | 0.641 | S | S | . | * | S | Bend | trans | -112.3 | 84.7 | 175.6 | 63.5 | 0 | 0 | 0 | 0 | 109.3 | R236 S241 | R236-S239 PolarHBondContact O-OG 3.34Å; S239-S241 PolarHBondContact O-N 2.71Å |
| 240 | S | 47 | Very low | 58.2 | Low | 71 Ų | 71 | 120.2 Ų | 120.2 | 50% | 0.497 | 65% | 0.648 | S | S | . | * | trans | 1.1 | 88.6 | 162.4 | 66.8 | 0 | 0 | 0 | 0 | 111.6 | K238 S242 K243 | K238-S240 PolarHBondContact O-N 3.36Å; S240-S242 PolarHBondContact O-N 2.68Å; S240-K243 PolarHBondContact O-N 3.18Å | ||
| 241 | S | 57.2 | Low | 59 | Low | 89 Ų | 89 | 118.6 Ų | 118.6 | 62% | 0.622 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -10.1 | -7 | 158.8 | 162.2 | 0 | 0 | 0 | 0 | 111.7 | S239 | S239-S241 PolarHBondContact O-N 2.71Š|
| 242 | S | 57.2 | Low | 60.1 | Low | 112 Ų | 112 | 116.4 Ų | 116.4 | 78% | 0.783 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | -4.2 | -178.7 | 172.9 | 0 | 0 | 0 | 0 | 111.5 | S240 | S240-S242 PolarHBondContact O-N 2.68Š|
| 243 | K | 59.1 | Low | 60.8 | Low | 187 Ų | 187 | 123.4 Ų | 123.4 | 81% | 0.813 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -123.1 | 5.1 | -178.7 | -89.3 | 170.8 | 172.3 | 142.5 | 0 | 109.4 | S240 | S240-K243 PolarHBondContact O-N 3.18Š|
| 244 | S | 59.5 | Low | 61.4 | Low | 30 Ų | 30 | 125.1 Ų | 125.1 | 21% | 0.21 | 67% | 0.671 | C | S | . | * | S | Bend | trans | -115.3 | 0 | -173.2 | 121.9 | 0 | 0 | 0 | 0 | 109.4 | R246 | S244-R246 WeakPolarHBondContact O-CA 3.19Å; S244-R246 VanDerWaalsContact O-CB 3.29Å; S244-R246 WeakPolarHBondContact O-CB 3.29Å; S244-R246 PolarHBondContact O-N 3.29Å; S244-R246 WeakPolarHBondContact OG-CB 3.14Å; S244-R246 WeakPolarHBondContact OG-CD 3.37Å; S244-R246 WeakPolarHBondContact OG-CG 3.29Å |
| 245 | G | 65.9 | Low | 61.7 | Low | 62 Ų | 62 | 130 Ų | 130 | 64% | 0.639 | 68% | 0.684 | S | S | * | * | G | 310 helix | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 112.3 | D247 A248 | G245-D247 PolarHBondContact O-N 2.82Å; G245-A248 PolarHBondContact O-N 3.42Å | |
| 246 | R | 63.9 | Low | 61.3 | Low | 139 Ų | 139 | 135.6 Ų | 135.6 | 53% | 0.525 | 70% | 0.7 | S | S | . | * | G | 310 helix | 0 | 0 | 0 | -100.7 | -178.6 | 172.3 | 123.9 | -0.3 | 109.5 | R236 S244 | R236-R246 VanDerWaalsContact NE-CZ 3.32Å; S244-R246 WeakPolarHBondContact O-CA 3.19Å; S244-R246 VanDerWaalsContact O-CB 3.29Å; S244-R246 WeakPolarHBondContact O-CB 3.29Å; S244-R246 PolarHBondContact O-N 3.29Å; S244-R246 WeakPolarHBondContact OG-CB 3.14Å; S244-R246 WeakPolarHBondContact OG-CD 3.37Å; S244-R246 WeakPolarHBondContact OG-CG 3.29Å | |
| 247 | D | 64.6 | Low | 61.2 | Low | 137 Ų | 137 | 133.6 Ų | 133.6 | 73% | 0.733 | 71% | 0.705 | S | S | * | * | G | 310 helix | 0 | 0 | 0 | -69.4 | -39.5 | 0 | 0 | 0 | 109.6 | G245 K249 | G245-D247 PolarHBondContact O-N 2.82Å; D247-K249 PolarHBondContact O-N 2.72Å | |
| 248 | A | 69.3 | Low | 61.2 | Low | 75 Ų | 75 | 132.9 Ų | 132.9 | 62% | 0.62 | 71% | 0.711 | S | S | * | * | 0 | 112.7 | 0 | 0 | 0 | 0 | 0 | 0 | 109.2 | G245 | G245-A248 PolarHBondContact O-N 3.42Š| |||
| 249 | K | 72 | Confident | 61.3 | Low | 186 Ų | 186 | 132.2 Ų | 132.2 | 81% | 0.809 | 71% | 0.708 | S | S | * | * | trans | -45.6 | 122.1 | 173 | -68.6 | -174 | -179.2 | 173.1 | 0 | 111.3 | D247 V251 | D247-K249 PolarHBondContact O-N 2.72Å; K249-V251 PolarHBondContact O-N 3.3Å | ||
| 250 | P | 71.3 | Confident | 61.6 | Low | 121 Ų | 121 | 138.7 Ų | 138.7 | 79% | 0.786 | 73% | 0.729 | S | S | * | * | trans | -52.5 | 0 | 176 | 18.8 | -18.8 | 0 | 0 | 0 | 111.6 | V252 | P250-V252 PolarHBondContact O-N 3.47Š| ||
| 251 | V | 70.8 | Confident | 62.1 | Low | 137 Ų | 137 | 138.9 Ų | 138.9 | 83% | 0.83 | 72% | 0.722 | S | S | * | * | 0 | 90.5 | 0 | 178.4 | 0 | 0 | 0 | 0 | 108.6 | K249 R253 | K249-V251 PolarHBondContact O-N 3.3Å; V251-R253 PolarHBondContact O-N 3.27Å | |||
| 252 | V | 73.7 | Confident | 62.7 | Low | 123 Ų | 123 | 138.3 Ų | 138.3 | 75% | 0.745 | 72% | 0.715 | S | S | * | * | trans | -63.3 | 0 | 166.9 | -177.8 | 0 | 0 | 0 | 0 | 109.1 | P250 K254 | P250-V252 PolarHBondContact O-N 3.47Å; V252-K254 PolarHBondContact O-N 2.8Å | ||
| 253 | R | 68.7 | Low | 63.7 | Low | 231 Ų | 231 | 141.3 Ų | 141.3 | 87% | 0.872 | 72% | 0.717 | S | S | * | * | 0 | 103.6 | 0 | -88.3 | -178.4 | 156.6 | 108.9 | -1.1 | 110.6 | V251 K255 | V251-R253 PolarHBondContact O-N 3.27Å; R253-K255 VanDerWaalsContact C-N 3.33Å; R253-K255 PolarHBondContact O-N 3.49Å | |||
| 254 | K | 64.9 | Low | 64.8 | Low | 197 Ų | 197 | 139.5 Ų | 139.5 | 86% | 0.857 | 71% | 0.711 | S | S | * | * | trans | -48.7 | 93.6 | 170.7 | -68.1 | -174 | -178 | 171.7 | 0 | 110.9 | V252 M256 | V252-K254 PolarHBondContact O-N 2.8Å; K254-M256 PolarHBondContact O-N 3.41Å | ||
| 255 | K | 61.2 | Low | 65.8 | Low | 193 Ų | 193 | 143.2 Ų | 143.2 | 84% | 0.839 | 73% | 0.725 | S | S | * | * | trans | -29.3 | 0 | 162.4 | -84.2 | 176.1 | -177.7 | -175.9 | 0 | 111.2 | R253 T257 | R253-K255 VanDerWaalsContact C-N 3.33Å; R253-K255 PolarHBondContact O-N 3.49Å; K255-T257 PolarHBondContact O-N 2.9Å | ||
| 256 | M | 47.4 | Very low | 66.8 | Low | 191 Ų | 191 | 145.4 Ų | 145.4 | 94% | 0.941 | 72% | 0.717 | S | S | * | * | 0 | 65.8 | 0 | -82.5 | -107.2 | -167.4 | 0 | 0 | 111.3 | K254 V258 | K254-M256 PolarHBondContact O-N 3.41Å; M256-V258 PolarHBondContact O-N 3.29Å | |||
| 257 | T | 50.3 | Low | 67.9 | Low | 114 Ų | 114 | 141.3 Ų | 141.3 | 70% | 0.699 | 71% | 0.713 | S | S | * | * | trans | -46.8 | 0 | 163.5 | 53.7 | 0 | 0 | 0 | 0 | 110.1 | K255 K259 | K255-T257 PolarHBondContact O-N 2.9Å; T257-K259 PolarHBondContact O-N 2.9Å | ||
| 258 | V | 56.8 | Low | 69.1 | Low | 140 Ų | 140 | 139.7 Ų | 139.7 | 85% | 0.848 | 70% | 0.703 | S | S | * | * | 0 | 0 | 0 | -179 | 0 | 0 | 0 | 0 | 110.1 | M256 K260 | M256-V258 PolarHBondContact O-N 3.29Å; V258-K260 PolarHBondContact O-N 3.28Å | |||
| 259 | K | 58.1 | Low | 69.9 | Low | 182 Ų | 182 | 143 Ų | 143 | 79% | 0.791 | 70% | 0.7 | S | S | * | * | 0 | 90.4 | 0 | -83 | -178.5 | -177.9 | 175.4 | 0 | 111 | T257 E261 | T257-K259 PolarHBondContact O-N 2.9Å; K259-E261 PolarHBondContact O-N 3.28Å | |||
| 260 | K | 55.5 | Low | 70.8 | Confident | 196 Ų | 196 | 139.5 Ų | 139.5 | 85% | 0.852 | 69% | 0.687 | S | S | * | * | trans | -35.5 | 83.9 | 163.5 | -84.6 | -178 | -175.1 | 176.6 | 0 | 111 | V258 T262 | V258-K260 PolarHBondContact O-N 3.28Å; K260-T262 VanDerWaalsContact C-N 3.28Å; K260-T262 PolarHBondContact O-N 2.95Å | ||
| 261 | E | 57.8 | Low | 71.6 | Confident | 75 Ų | 75 | 137.9 Ų | 137.9 | 35% | 0.35 | 67% | 0.669 | S | S | . | * | trans | -25.5 | 104.8 | 170.3 | -67.2 | -179.2 | 173.7 | 0 | 0 | 111.1 | K259 E263 E265 K266 R269 | K259-E261 PolarHBondContact O-N 3.28Å; E261-E263 PolarHBondContact O-N 3.41Å; E261-E265 HydrophobicContact CB-CB 4.37Å; E261-K266 HydrophobicContact CB-CD 4.28Å; E261-K266 HydrophobicContact CB-CG 3.6Å; E261-K266 WeakPolarHBondContact OE2-CG 3.34Å; E261-R269 IonicContact OE1-NH1 3.06Å | ||
| 262 | T | 69.7 | Low | 72.5 | Confident | 77 Ų | 77 | 136.7 Ų | 136.7 | 47% | 0.472 | 66% | 0.657 | S | S | . | * | trans | -46.1 | 124.4 | 171.7 | 55.4 | 0 | 0 | 0 | 0 | 110.7 | K260 E264 E265 K266 | K260-T262 VanDerWaalsContact C-N 3.28Å; K260-T262 PolarHBondContact O-N 2.95Å; T262-E264 CarbonylContact O-C 3.58Å; T262-E264 PolarHBondContact O-N 3.46Å; T262-E265 PolarHBondContact O-N 2.99Å; T262-E265 WeakPolarHBondContact OG1-CG 3.34Å; T262-K266 PolarHBondContact O-N 3.36Å | ||
| 263 | E | 77.6 | Confident | 73.3 | Confident | 175 Ų | 175 | 136 Ų | 136 | 82% | 0.818 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -28.5 | -23.9 | 176.5 | -71.5 | -175.5 | 173.5 | 0 | 0 | 111.4 | E261 A267 | E261-E263 PolarHBondContact O-N 3.41Å; E263-A267 WeakPolarHBondContact O-CB 3.44Å; E263-A267 PolarHBondContact O-N 2.99Å |
| 264 | E | 81.4 | Confident | 74.2 | Confident | 148 Ų | 148 | 131.9 Ų | 131.9 | 69% | 0.692 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -80.3 | -37.3 | -179.1 | -66.4 | -179.8 | 173.4 | 0 | 0 | 111.2 | T262 K266 A267 L268 | T262-E264 CarbonylContact O-C 3.58Å; T262-E264 PolarHBondContact O-N 3.46Å; E264-K266 PolarHBondContact O-N 2.93Å; E264-A267 PolarHBondContact O-N 3.39Å; E264-L268 WeakPolarHBondContact O-CG 3.13Å; E264-L268 PolarHBondContact O-N 3.06Å |
| 265 | E | 81.9 | Confident | 75.1 | Confident | 108 Ų | 108 | 130 Ų | 130 | 51% | 0.505 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -71.4 | -33.4 | 178.6 | -76.5 | -178.9 | 177 | 0 | 0 | 110.8 | E261 T262 A267 L268 R269 | E261-E265 HydrophobicContact CB-CB 4.37Å; T262-E265 PolarHBondContact O-N 2.99Å; T262-E265 WeakPolarHBondContact OG1-CG 3.34Å; E265-A267 VanDerWaalsContact C-N 3.34Å; E265-L268 PolarHBondContact O-N 2.9Å; E265-R269 WeakPolarHBondContact O-CB 3.4Å; E265-R269 PolarHBondContact O-N 3.28Å |
| 266 | K | 85.5 | Confident | 76.3 | Confident | 108 Ų | 108 | 127.5 Ų | 127.5 | 47% | 0.47 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -69.2 | -40.9 | 176.4 | -72.3 | -178 | -177.2 | -180 | 0 | 110.6 | E261 T262 E264 L268 R269 E270 | E261-K266 HydrophobicContact CB-CD 4.28Å; E261-K266 HydrophobicContact CB-CG 3.6Å; E261-K266 WeakPolarHBondContact OE2-CG 3.34Å; T262-K266 PolarHBondContact O-N 3.36Å; E264-K266 PolarHBondContact O-N 2.93Å; K266-L268 VanDerWaalsContact C-N 3.26Å; K266-L268 PolarHBondContact O-N 3.42Å; K266-R269 PolarHBondContact O-N 3.36Å; K266-E270 WeakPolarHBondContact O-CG 3.36Å; K266-E270 PolarHBondContact O-N 2.57Å |
| 267 | A | 87.9 | Confident | 78.2 | Confident | 53 Ų | 53 | 120.2 Ų | 120.2 | 44% | 0.438 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.7 | -36.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | E263 E264 E265 E270 E271 | E263-A267 WeakPolarHBondContact O-CB 3.44Å; E263-A267 PolarHBondContact O-N 2.99Å; E264-A267 PolarHBondContact O-N 3.39Å; E265-A267 VanDerWaalsContact C-N 3.34Å; A267-E270 PolarHBondContact O-N 2.96Å; A267-E271 PolarHBondContact O-N 3.02Å |
| 268 | L | 89.2 | Confident | 79.8 | Confident | 103 Ų | 103 | 117.4 Ų | 117.4 | 54% | 0.539 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -70.2 | -38.1 | 178.2 | -76.3 | 177.8 | 0 | 0 | 0 | 111 | E264 E265 K266 E270 E271 L272 | E264-L268 WeakPolarHBondContact O-CG 3.13Å; E264-L268 PolarHBondContact O-N 3.06Å; E265-L268 PolarHBondContact O-N 2.9Å; K266-L268 VanDerWaalsContact C-N 3.26Å; K266-L268 PolarHBondContact O-N 3.42Å; L268-E270 PolarHBondContact O-N 3.39Å; L268-E271 PolarHBondContact O-N 3.48Å; L268-L272 WeakPolarHBondContact O-CG 3.26Å; L268-L272 PolarHBondContact O-N 2.68Å |
| 269 | R | 87 | Confident | 80.9 | Confident | 145 Ų | 145 | 120.1 Ų | 120.1 | 55% | 0.547 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65.5 | -38.1 | 177.7 | -167.5 | 171.2 | -177.4 | -170.7 | 0.2 | 110.5 | E261 E265 K266 E271 L272 E273 | E261-R269 IonicContact OE1-NH1 3.06Å; E265-R269 WeakPolarHBondContact O-CB 3.4Å; E265-R269 PolarHBondContact O-N 3.28Å; K266-R269 PolarHBondContact O-N 3.36Å; R269-E271 VanDerWaalsContact C-N 3.29Å; R269-L272 PolarHBondContact O-N 2.86Å; R269-E273 IonicContact NE-OE1 3.6Å; R269-E273 WeakPolarHBondContact O-CB 3.18Å; R269-E273 WeakPolarHBondContact O-CG 3.35Å; R269-E273 PolarHBondContact O-N 3.21Å |
| 270 | E | 89.9 | Confident | 82 | Confident | 113 Ų | 113 | 114.7 Ų | 114.7 | 53% | 0.528 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -68.4 | -38.3 | 179.3 | -73.4 | 179.4 | -178.8 | 0 | 0 | 110.9 | K266 A267 L268 L272 E273 K274 | K266-E270 WeakPolarHBondContact O-CG 3.36Å; K266-E270 PolarHBondContact O-N 2.57Å; A267-E270 PolarHBondContact O-N 2.96Å; L268-E270 PolarHBondContact O-N 3.39Å; E270-L272 VanDerWaalsContact C-N 3.27Å; E270-L272 PolarHBondContact O-N 1.89Å; E270-E273 PolarHBondContact O-N 2.92Å; E270-K274 WeakPolarHBondContact O-CB 3.15Å; E270-K274 WeakPolarHBondContact O-CG 3.1Å; E270-K274 PolarHBondContact O-N 3.38Å |
| 271 | E | 89.6 | Confident | 82.9 | Confident | 87 Ų | 87 | 110.8 Ų | 110.8 | 41% | 0.407 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.6 | -40.1 | 176.8 | -171.3 | 169.6 | -173.8 | 0 | 0 | 111.4 | A267 L268 R269 E273 K274 R275 | A267-E271 PolarHBondContact O-N 3.02Å; L268-E271 PolarHBondContact O-N 3.48Å; R269-E271 VanDerWaalsContact C-N 3.29Å; E271-E273 VanDerWaalsContact C-N 3.25Å; E271-E273 PolarHBondContact O-N 3.44Å; E271-K274 PolarHBondContact O-N 3.26Å; E271-R275 WeakPolarHBondContact O-CG 3.44Å; E271-R275 PolarHBondContact O-N 3.42Å; E271-R275 IonicContact OE1-CZ 2.68Å; E271-R275 IonicContact OE1-NE 3.88Å; E271-R275 IonicContact OE1-NH2 3.96Å; E271-R275 PolarHBondContact OE1-NH2 2.99Å |
| 272 | L | 89.5 | Confident | 83.3 | Confident | 112 Ų | 112 | 110 Ų | 110 | 59% | 0.586 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -67.9 | -37.3 | 178.9 | -75.5 | 179.3 | 0 | 0 | 0 | 110.5 | L268 R269 E270 K274 R275 F276 | L268-L272 WeakPolarHBondContact O-CG 3.26Å; L268-L272 PolarHBondContact O-N 2.68Å; R269-L272 PolarHBondContact O-N 2.86Å; E270-L272 VanDerWaalsContact C-N 3.27Å; E270-L272 PolarHBondContact O-N 1.89Å; L272-K274 PolarHBondContact O-N 2.87Å; L272-R275 PolarHBondContact O-N 2.84Å; L272-F276 VanDerWaalsContact O-CB 3.26Å; L272-F276 WeakPolarHBondContact O-CB 3.09Å; L272-F276 PolarHBondContact O-N 3.47Å |
| 273 | E | 88.9 | Confident | 82.7 | Confident | 109 Ų | 109 | 108.7 Ų | 108.7 | 51% | 0.509 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67 | -35.9 | 179.5 | -78.9 | 177.6 | -173.9 | 0 | 0 | 110.4 | R269 E270 E271 R275 F276 A277 | R269-E273 IonicContact NE-OE1 3.6Å; R269-E273 WeakPolarHBondContact O-CB 3.18Å; R269-E273 WeakPolarHBondContact O-CG 3.35Å; R269-E273 PolarHBondContact O-N 3.21Å; E270-E273 PolarHBondContact O-N 2.92Å; E271-E273 VanDerWaalsContact C-N 3.25Å; E271-E273 PolarHBondContact O-N 3.44Å; E273-R275 VanDerWaalsContact C-N 3.28Å; E273-F276 PolarHBondContact O-N 3.25Å; E273-A277 WeakPolarHBondContact O-CB 0.72Å; E273-A277 PolarHBondContact O-N 2.87Å |
| 274 | K | 88.2 | Confident | 82.3 | Confident | 144 Ų | 144 | 104 Ų | 104 | 63% | 0.626 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.9 | -42.4 | 177.1 | -72.1 | -178.7 | -177.2 | 177 | 0 | 111 | E270 E271 L272 F276 A277 V278 Y283 | E270-K274 WeakPolarHBondContact O-CB 3.15Å; E270-K274 WeakPolarHBondContact O-CG 3.1Å; E270-K274 PolarHBondContact O-N 3.38Å; E271-K274 PolarHBondContact O-N 3.26Å; L272-K274 PolarHBondContact O-N 2.87Å; K274-F276 PolarHBondContact O-N 2.68Å; K274-A277 PolarHBondContact O-N 3.3Å; K274-V278 VanDerWaalsContact O-CG2 3.24Å; K274-V278 WeakPolarHBondContact O-CG2 3.22Å; K274-V278 PolarHBondContact O-N 3.37Å; K274-Y283 PolarHBondContact O-OH 3.24Å |
| 275 | R | 84.7 | Confident | 82.1 | Confident | 158 Ų | 158 | 103.9 Ų | 103.9 | 60% | 0.596 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.6 | -39 | 177.7 | -69.9 | -171.5 | 179.9 | -177.3 | 1.4 | 111 | E271 L272 E273 A277 V278 W279 Y283 | E271-R275 WeakPolarHBondContact O-CG 3.44Å; E271-R275 PolarHBondContact O-N 3.42Å; E271-R275 IonicContact OE1-CZ 2.68Å; E271-R275 IonicContact OE1-NE 3.88Å; E271-R275 IonicContact OE1-NH2 3.96Å; E271-R275 PolarHBondContact OE1-NH2 2.99Å; L272-R275 PolarHBondContact O-N 2.84Å; E273-R275 VanDerWaalsContact C-N 3.28Å; R275-A277 PolarHBondContact O-N 3.48Å; R275-V278 PolarHBondContact O-N 2.83Å; R275-W279 WeakPolarHBondContact O-CB 2.9Å; R275-W279 PolarHBondContact O-N 3.22Å; R275-Y283 VanDerWaalsContact O-CZ 3.26Å; R275-Y283 PolarHBondContact O-OH 2.84Å |
| 276 | F | 86.7 | Confident | 82.2 | Confident | 139 Ų | 139 | 104.5 Ų | 104.5 | 61% | 0.61 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -69.9 | -35 | 180 | -175.1 | -104.4 | 0 | 0 | 0 | 109.8 | L272 E273 K274 V278 W279 S280 | L272-F276 VanDerWaalsContact O-CB 3.26Å; L272-F276 WeakPolarHBondContact O-CB 3.09Å; L272-F276 PolarHBondContact O-N 3.47Å; E273-F276 PolarHBondContact O-N 3.25Å; K274-F276 PolarHBondContact O-N 2.68Å; F276-V278 VanDerWaalsContact C-N 3.26Å; F276-V278 PolarHBondContact O-N 3.49Å; F276-W279 PolarHBondContact O-N 3.05Å; F276-S280 WeakPolarHBondContact CD1-OG 3.25Å; F276-S280 WeakPolarHBondContact CE1-OG 1.37Å; F276-S280 WeakPolarHBondContact CZ-OG 3.45Å; F276-S280 VanDerWaalsContact O-CB 3.25Å; F276-S280 WeakPolarHBondContact O-CB 3.31Å; F276-S280 PolarHBondContact O-N 3.24Å; F276-S280 PolarHBondContact O-OG 3.38Å |
| 277 | A | 86.1 | Confident | 82.2 | Confident | 38 Ų | 38 | 101.2 Ų | 101.2 | 31% | 0.314 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.2 | -43.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | E273 K274 R275 W279 S280 K281 Y283 | E273-A277 WeakPolarHBondContact O-CB 0.72Å; E273-A277 PolarHBondContact O-N 2.87Å; K274-A277 PolarHBondContact O-N 3.3Å; R275-A277 PolarHBondContact O-N 3.48Å; A277-W279 VanDerWaalsContact C-N 3.26Å; A277-S280 PolarHBondContact O-N 2.48Å; A277-K281 WeakPolarHBondContact O-CD 3.38Å; A277-K281 WeakPolarHBondContact O-CG 2.91Å; A277-K281 PolarHBondContact O-N 3.41Å; A277-Y283 WeakPolarHBondContact O-CE2 2.96Å |
| 278 | V | 83.5 | Confident | 82.2 | Confident | 56 Ų | 56 | 105 Ų | 105 | 34% | 0.339 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66 | -38.7 | 178.2 | 175.7 | 0 | 0 | 0 | 0 | 109.9 | K274 R275 F276 S280 K281 Y283 V287 | K274-V278 VanDerWaalsContact O-CG2 3.24Å; K274-V278 WeakPolarHBondContact O-CG2 3.22Å; K274-V278 PolarHBondContact O-N 3.37Å; R275-V278 PolarHBondContact O-N 2.83Å; F276-V278 VanDerWaalsContact C-N 3.26Å; F276-V278 PolarHBondContact O-N 3.49Å; V278-S280 VanDerWaalsContact C-N 3.33Å; V278-K281 PolarHBondContact O-N 3.42Å; V278-Y283 CovalentContact CA-CE2 1.43Å; V278-Y283 CovalentContact CA-CZ 1.41Å; V278-Y283 WeakPolarHBondContact CA-OH 3.49Å; V278-Y283 HydrophobicContact CB-CD1 3.13Å; V278-Y283 HydrophobicContact CB-CD2 3.49Å; V278-Y283 VanDerWaalsContact CB-CD2 3.49Å; V278-Y283 HydrophobicContact CB-CE1 1.87Å; V278-Y283 HydrophobicContact CB-CE2 2.42Å; V278-Y283 HydrophobicContact CB-CG 3.76Å; V278-Y283 CovalentContact CB-CZ 1.22Å; V278-Y283 CovalentContact CB-OH 1.02Å; V278-Y283 WeakPolarHBondContact CB-OH 3.2Å; V278-Y283 HydrophobicContact CG1-CD1 2.16Å; V278-Y283 HydrophobicContact CG1-CD2 3.34Å; V278-Y283 CovalentContact CG1-CE1 1.33Å; V278-Y283 HydrophobicContact CG1-CE1 1.33Å; V278-Y283 HydrophobicContact CG1-CE2 2.88Å; V278-Y283 HydrophobicContact CG1-CG 3.06Å; V278-Y283 WeakPolarHBondContact CG1-OH 3.18Å; V278-Y283 HydrophobicContact CG2-CE1 3.29Å; V278-Y283 HydrophobicContact CG2-CE2 3.79Å; V278-Y283 WeakPolarHBondContact CG2-OH 3.41Å; V278-Y283 PolarHBondContact N-OH 2.76Å; V278-Y283 WeakPolarHBondContact O-CA 3.03Å; V278-Y283 WeakPolarHBondContact O-CB 3.01Å; V278-Y283 WeakPolarHBondContact O-CD1 1.02Å; V278-Y283 CovalentContact O-CD2 0.72Å; V278-Y283 WeakPolarHBondContact O-CD2 1.61Å; V278-Y283 WeakPolarHBondContact O-CE1 3.24Å; V278-Y283 WeakPolarHBondContact O-CE2 2.72Å; V278-V287 HydrophobicContact CG1-CG2 4.46Å |
| 279 | W | 81.3 | Confident | 82.2 | Confident | 197 Ų | 197 | 106.2 Ų | 106.2 | 75% | 0.746 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -68.3 | -39 | -179.6 | 178.3 | -61.2 | 0 | 0 | 0 | 110.1 | R275 F276 A277 K281 G282 Y283 | R275-W279 WeakPolarHBondContact O-CB 2.9Å; R275-W279 PolarHBondContact O-N 3.22Å; F276-W279 PolarHBondContact O-N 3.05Å; A277-W279 VanDerWaalsContact C-N 3.26Å; W279-K281 VanDerWaalsContact C-N 3.26Å; W279-K281 PolarHBondContact O-N 3.27Å; W279-G282 PolarHBondContact O-N 2.69Å; W279-Y283 HydrophobicContact CB-CD2 3.67Å; W279-Y283 HydrophobicContact CB-CE2 3.74Å; W279-Y283 HydrophobicContact CB-CG 4.12Å; W279-Y283 CovalentContact N-CE2 1.33Å; W279-Y283 PolarHBondContact N-OH 3.41Å; W279-Y283 WeakPolarHBondContact O-CD2 1.92Å |
| 280 | S | 80.1 | Confident | 82.4 | Confident | 67 Ų | 67 | 106.8 Ų | 106.8 | 47% | 0.469 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -70.9 | -25.8 | -176.1 | -65 | 0 | 0 | 0 | 0 | 110.4 | F276 A277 V278 G282 Y283 | F276-S280 WeakPolarHBondContact CD1-OG 3.25Å; F276-S280 WeakPolarHBondContact CE1-OG 1.37Å; F276-S280 WeakPolarHBondContact CZ-OG 3.45Å; F276-S280 VanDerWaalsContact O-CB 3.25Å; F276-S280 WeakPolarHBondContact O-CB 3.31Å; F276-S280 PolarHBondContact O-N 3.24Å; F276-S280 PolarHBondContact O-OG 3.38Å; A277-S280 PolarHBondContact O-N 2.48Å; V278-S280 VanDerWaalsContact C-N 3.33Å; S280-G282 PolarHBondContact O-N 3.04Å; S280-Y283 VanDerWaalsContact N-CD2 3.33Å |
| 281 | K | 74.6 | Confident | 82.5 | Confident | 115 Ų | 115 | 106.5 Ų | 106.5 | 50% | 0.5 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.5 | 0 | -176.5 | -69.9 | 178 | -177.5 | 178.2 | 0 | 111.3 | A277 V278 W279 Y283 Q286 | A277-K281 WeakPolarHBondContact O-CD 3.38Å; A277-K281 WeakPolarHBondContact O-CG 2.91Å; A277-K281 PolarHBondContact O-N 3.41Å; V278-K281 PolarHBondContact O-N 3.42Å; W279-K281 VanDerWaalsContact C-N 3.26Å; W279-K281 PolarHBondContact O-N 3.27Å; K281-Y283 HydrophobicContact CB-CD2 4.41Å; K281-Q286 PolarHBondContact O-OE1 3.44Å |
| 282 | G | 66.7 | Low | 82.7 | Confident | 57 Ų | 57 | 104.2 Ų | 104.2 | 59% | 0.588 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 111.4 | W279 S280 | W279-G282 PolarHBondContact O-N 2.69Å; S280-G282 PolarHBondContact O-N 3.04Å | |
| 283 | Y | 56.7 | Low | 83 | Confident | 51 Ų | 51 | 105.1 Ų | 105.1 | 20% | 0.2 | 50% | 0.502 | C | S | . | . | T | Hydrogen-bonded Turn | 0 | 0 | 0 | -132.2 | -94.4 | 0 | 0 | 0 | 109.7 | K274 R275 A277 V278 W279 S280 K281 | K274-Y283 PolarHBondContact O-OH 3.24Å; R275-Y283 VanDerWaalsContact O-CZ 3.26Å; R275-Y283 PolarHBondContact O-OH 2.84Å; A277-Y283 WeakPolarHBondContact O-CE2 2.96Å; V278-Y283 CovalentContact CA-CE2 1.43Å; V278-Y283 CovalentContact CA-CZ 1.41Å; V278-Y283 WeakPolarHBondContact CA-OH 3.49Å; V278-Y283 HydrophobicContact CB-CD1 3.13Å; V278-Y283 HydrophobicContact CB-CD2 3.49Å; V278-Y283 VanDerWaalsContact CB-CD2 3.49Å; V278-Y283 HydrophobicContact CB-CE1 1.87Å; V278-Y283 HydrophobicContact CB-CE2 2.42Å; V278-Y283 HydrophobicContact CB-CG 3.76Å; V278-Y283 CovalentContact CB-CZ 1.22Å; V278-Y283 CovalentContact CB-OH 1.02Å; V278-Y283 WeakPolarHBondContact CB-OH 3.2Å; V278-Y283 HydrophobicContact CG1-CD1 2.16Å; V278-Y283 HydrophobicContact CG1-CD2 3.34Å; V278-Y283 CovalentContact CG1-CE1 1.33Å; V278-Y283 HydrophobicContact CG1-CE1 1.33Å; V278-Y283 HydrophobicContact CG1-CE2 2.88Å; V278-Y283 HydrophobicContact CG1-CG 3.06Å; V278-Y283 WeakPolarHBondContact CG1-OH 3.18Å; V278-Y283 HydrophobicContact CG2-CE1 3.29Å; V278-Y283 HydrophobicContact CG2-CE2 3.79Å; V278-Y283 WeakPolarHBondContact CG2-OH 3.41Å; V278-Y283 PolarHBondContact N-OH 2.76Å; V278-Y283 WeakPolarHBondContact O-CA 3.03Å; V278-Y283 WeakPolarHBondContact O-CB 3.01Å; V278-Y283 WeakPolarHBondContact O-CD1 1.02Å; V278-Y283 CovalentContact O-CD2 0.72Å; V278-Y283 WeakPolarHBondContact O-CD2 1.61Å; V278-Y283 WeakPolarHBondContact O-CE1 3.24Å; V278-Y283 WeakPolarHBondContact O-CE2 2.72Å; W279-Y283 HydrophobicContact CB-CD2 3.67Å; W279-Y283 HydrophobicContact CB-CE2 3.74Å; W279-Y283 HydrophobicContact CB-CG 4.12Å; W279-Y283 CovalentContact N-CE2 1.33Å; W279-Y283 PolarHBondContact N-OH 3.41Å; W279-Y283 WeakPolarHBondContact O-CD2 1.92Å; S280-Y283 VanDerWaalsContact N-CD2 3.33Å; K281-Y283 HydrophobicContact CB-CD2 4.41Å | |
| 284 | V | 68.4 | Low | 83.3 | Confident | 75 Ų | 75 | 104.3 Ų | 104.3 | 46% | 0.455 | 50% | 0.501 | S | S | . | . | T | Hydrogen-bonded Turn | 0 | 0 | 0 | 175.1 | 0 | 0 | 0 | 0 | 108.2 | K288 | V284-K288 HydrophobicContact CG1-CD 3.3Å; V284-K288 HydrophobicContact CG1-CG 3.81Å; V284-K288 WeakPolarHBondContact O-CA 2.52Å; V284-K288 WeakPolarHBondContact O-CB 3.38Å; V284-K288 WeakPolarHBondContact O-CD 3.48Å; V284-K288 WeakPolarHBondContact O-CG 3.4Å; V284-K288 PolarHBondContact O-N 3.04Å | |
| 285 | K | 76.9 | Confident | 83.7 | Confident | 147 Ų | 147 | 103.2 Ų | 103.2 | 64% | 0.639 | 50% | 0.498 | S | S | * | . | H | α-helix | 0 | -34 | 0 | -76.7 | -171.9 | -176.1 | -175.8 | 0 | 110.7 | K288 E289 | K285-K288 PolarHBondContact O-N 3.44Å; K285-E289 WeakPolarHBondContact O-CA 3.31Å; K285-E289 WeakPolarHBondContact O-CB 3.41Å; K285-E289 WeakPolarHBondContact O-CG 3.08Å; K285-E289 PolarHBondContact O-N 3.23Å | |
| 286 | Q | 84.5 | Confident | 84.1 | Confident | 121 Ų | 121 | 101.1 Ų | 101.1 | 57% | 0.565 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -73.7 | 0 | -178.1 | -70.3 | 179 | 11.9 | 0 | 0 | 110.6 | K281 K288 E289 R290 | K281-Q286 PolarHBondContact O-OE1 3.44Å; Q286-K288 VanDerWaalsContact C-N 3.3Å; Q286-E289 PolarHBondContact O-N 2.77Å; Q286-R290 VanDerWaalsContact O-CB 3.32Å; Q286-R290 WeakPolarHBondContact O-CB 3.19Å; Q286-R290 PolarHBondContact O-N 3.4Å |
| 287 | V | 85.5 | Confident | 84.6 | Confident | 38 Ų | 38 | 98.5 Ų | 98.5 | 23% | 0.23 | 49% | 0.486 | C | S | . | . | H | α-helix | 0 | -42.1 | 0 | 172.5 | 0 | 0 | 0 | 0 | 109.7 | V278 E289 R290 E291 | V278-V287 HydrophobicContact CG1-CG2 4.46Å; V287-E289 PolarHBondContact O-N 3.39Å; V287-R290 WeakPolarHBondContact O-CB 3.39Å; V287-R290 PolarHBondContact O-N 3.08Å; V287-R290 VanDerWaalsContact O-N 3.13Å; V287-E291 HydrophobicContact CG1-CG 4.28Å; V287-E291 WeakPolarHBondContact O-CB 3.23Å; V287-E291 VanDerWaalsContact O-CG 3.26Å; V287-E291 WeakPolarHBondContact O-CG 3.4Å; V287-E291 PolarHBondContact O-N 3.38Å | |
| 288 | K | 87.9 | Confident | 85 | Confident | 132 Ų | 132 | 99 Ų | 99 | 57% | 0.574 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64 | -39.8 | 179.5 | -74.1 | -175.6 | -177.9 | 174.7 | 0 | 110.9 | V284 K285 Q286 R290 E291 A292 | V284-K288 HydrophobicContact CG1-CD 3.3Å; V284-K288 HydrophobicContact CG1-CG 3.81Å; V284-K288 WeakPolarHBondContact O-CA 2.52Å; V284-K288 WeakPolarHBondContact O-CB 3.38Å; V284-K288 WeakPolarHBondContact O-CD 3.48Å; V284-K288 WeakPolarHBondContact O-CG 3.4Å; V284-K288 PolarHBondContact O-N 3.04Å; K285-K288 PolarHBondContact O-N 3.44Å; Q286-K288 VanDerWaalsContact C-N 3.3Å; K288-R290 PolarHBondContact O-N 2.87Å; K288-E291 PolarHBondContact O-N 3.07Å; K288-A292 VanDerWaalsContact O-CB 3.27Å; K288-A292 WeakPolarHBondContact O-CB 2.59Å; K288-A292 PolarHBondContact O-N 2.9Å |
| 289 | E | 90 | Very high | 85.4 | Confident | 129 Ų | 129 | 102.3 Ų | 102.3 | 60% | 0.603 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.6 | -37.6 | -179.7 | -75 | 177.5 | 178.3 | 0 | 0 | 110.2 | K285 Q286 V287 A292 K293 | K285-E289 WeakPolarHBondContact O-CA 3.31Å; K285-E289 WeakPolarHBondContact O-CB 3.41Å; K285-E289 WeakPolarHBondContact O-CG 3.08Å; K285-E289 PolarHBondContact O-N 3.23Å; Q286-E289 PolarHBondContact O-N 2.77Å; V287-E289 PolarHBondContact O-N 3.39Å; E289-A292 PolarHBondContact O-N 2.85Å; E289-K293 WeakPolarHBondContact O-CB 3.27Å; E289-K293 PolarHBondContact O-N 3.41Å |
| 290 | R | 90.2 | Very high | 85.9 | Confident | 158 Ų | 158 | 97.8 Ų | 97.8 | 60% | 0.596 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -65.6 | -46.3 | 179.7 | -177.2 | -175.8 | -178.9 | 160.8 | -0.3 | 110.2 | Q286 V287 K288 A292 K293 L294 | Q286-R290 VanDerWaalsContact O-CB 3.32Å; Q286-R290 WeakPolarHBondContact O-CB 3.19Å; Q286-R290 PolarHBondContact O-N 3.4Å; V287-R290 WeakPolarHBondContact O-CB 3.39Å; V287-R290 PolarHBondContact O-N 3.08Å; V287-R290 VanDerWaalsContact O-N 3.13Å; K288-R290 PolarHBondContact O-N 2.87Å; R290-A292 PolarHBondContact O-N 2.65Å; R290-K293 WeakPolarHBondContact O-CB 2.62Å; R290-K293 PolarHBondContact O-N 2.29Å; R290-K293 VanDerWaalsContact O-N 3.13Å; R290-L294 WeakPolarHBondContact O-CG 3.5Å; R290-L294 PolarHBondContact O-N 2.93Å |
| 291 | E | 92.9 | Very high | 86.6 | Confident | 106 Ų | 106 | 101.3 Ų | 101.3 | 50% | 0.495 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.2 | -42.8 | 177.4 | -71.4 | 177 | 175 | 0 | 0 | 111.5 | V287 K288 K293 L294 E295 | V287-E291 HydrophobicContact CG1-CG 4.28Å; V287-E291 WeakPolarHBondContact O-CB 3.23Å; V287-E291 VanDerWaalsContact O-CG 3.26Å; V287-E291 WeakPolarHBondContact O-CG 3.4Å; V287-E291 PolarHBondContact O-N 3.38Å; K288-E291 PolarHBondContact O-N 3.07Å; E291-K293 PolarHBondContact O-N 2.93Å; E291-L294 PolarHBondContact O-N 2.88Å; E291-E295 VanDerWaalsContact O-CG 3.32Å; E291-E295 WeakPolarHBondContact O-CG 2.83Å; E291-E295 PolarHBondContact O-N 3.43Å |
| 292 | A | 94.4 | Very high | 87.4 | Confident | 39 Ų | 39 | 103.8 Ų | 103.8 | 32% | 0.322 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.7 | -37.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | K288 E289 R290 L294 E295 E296 | K288-A292 VanDerWaalsContact O-CB 3.27Å; K288-A292 WeakPolarHBondContact O-CB 2.59Å; K288-A292 PolarHBondContact O-N 2.9Å; E289-A292 PolarHBondContact O-N 2.85Å; R290-A292 PolarHBondContact O-N 2.65Å; A292-L294 VanDerWaalsContact C-N 3.31Å; A292-L294 PolarHBondContact O-N 2.76Å; A292-E295 PolarHBondContact O-N 3.41Å; A292-E296 WeakPolarHBondContact O-CG 3.3Å; A292-E296 PolarHBondContact O-N 3.13Å |
| 293 | K | 94.5 | Very high | 88.6 | Confident | 131 Ų | 131 | 104 Ų | 104 | 57% | 0.57 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.7 | -41.4 | 179.4 | -171.7 | 175.3 | 178.7 | 176.2 | 0 | 110.3 | E289 R290 E291 E295 E296 M297 | E289-K293 WeakPolarHBondContact O-CB 3.27Å; E289-K293 PolarHBondContact O-N 3.41Å; R290-K293 WeakPolarHBondContact O-CB 2.62Å; R290-K293 PolarHBondContact O-N 2.29Å; R290-K293 VanDerWaalsContact O-N 3.13Å; E291-K293 PolarHBondContact O-N 2.93Å; K293-E295 PolarHBondContact O-N 3.35Å; K293-E296 PolarHBondContact O-N 3.03Å; K293-M297 VanDerWaalsContact O-CG 3.28Å; K293-M297 WeakPolarHBondContact O-CG 3.4Å; K293-M297 PolarHBondContact O-N 2.94Å |
| 294 | L | 96.3 | Very high | 90.4 | Very high | 93 Ų | 93 | 106 Ų | 106 | 49% | 0.487 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.3 | -39.9 | 179.1 | -73.9 | 178.3 | 0 | 0 | 0 | 111 | R290 E291 A292 E296 M297 A298 | R290-L294 WeakPolarHBondContact O-CG 3.5Å; R290-L294 PolarHBondContact O-N 2.93Å; E291-L294 PolarHBondContact O-N 2.88Å; A292-L294 VanDerWaalsContact C-N 3.31Å; A292-L294 PolarHBondContact O-N 2.76Å; L294-E296 VanDerWaalsContact C-N 3.26Å; L294-E296 PolarHBondContact O-N 3.46Å; L294-M297 HydrophobicContact CB-CE 4.34Å; L294-M297 HydrophobicContact CD2-CE 2.99Å; L294-M297 HydrophobicContact CG-CE 4.03Å; L294-M297 PolarHBondContact O-N 3.48Å; L294-A298 PolarHBondContact O-N 3.43Å |
| 295 | E | 96.1 | Very high | 91.5 | Very high | 120 Ų | 120 | 111.4 Ų | 111.4 | 56% | 0.561 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64.7 | -41.4 | 177.7 | -72.2 | 175.3 | -176.8 | 0 | 0 | 111.1 | E291 A292 K293 M297 A298 K299 | E291-E295 VanDerWaalsContact O-CG 3.32Å; E291-E295 WeakPolarHBondContact O-CG 2.83Å; E291-E295 PolarHBondContact O-N 3.43Å; A292-E295 PolarHBondContact O-N 3.41Å; K293-E295 PolarHBondContact O-N 3.35Å; E295-M297 PolarHBondContact O-N 3.44Å; E295-A298 PolarHBondContact O-N 2.71Å; E295-K299 WeakPolarHBondContact O-CG 3.08Å; E295-K299 PolarHBondContact O-N 2.94Å |
| 296 | E | 93.6 | Very high | 92.3 | Very high | 115 Ų | 115 | 106.9 Ų | 106.9 | 54% | 0.537 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.8 | -38.7 | 178.3 | -73.1 | 176.9 | -176.9 | 0 | 0 | 110.8 | A292 K293 L294 A298 K299 E300 | A292-E296 WeakPolarHBondContact O-CG 3.3Å; A292-E296 PolarHBondContact O-N 3.13Å; K293-E296 PolarHBondContact O-N 3.03Å; L294-E296 VanDerWaalsContact C-N 3.26Å; L294-E296 PolarHBondContact O-N 3.46Å; E296-A298 VanDerWaalsContact C-N 3.3Å; E296-A298 PolarHBondContact O-N 3.35Å; E296-K299 WeakPolarHBondContact O-CB 3.43Å; E296-K299 PolarHBondContact O-N 3.4Å; E296-E300 WeakPolarHBondContact O-CB 3.43Å; E296-E300 PolarHBondContact O-N 2.87Å |
| 297 | M | 96.5 | Very high | 92.6 | Very high | 83 Ų | 83 | 108.5 Ų | 108.5 | 41% | 0.409 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.6 | -41.9 | 179.2 | -73.6 | -168.1 | -69.8 | 0 | 0 | 110.3 | K293 L294 E295 K299 E300 I301 | K293-M297 VanDerWaalsContact O-CG 3.28Å; K293-M297 WeakPolarHBondContact O-CG 3.4Å; K293-M297 PolarHBondContact O-N 2.94Å; L294-M297 HydrophobicContact CB-CE 4.34Å; L294-M297 HydrophobicContact CD2-CE 2.99Å; L294-M297 HydrophobicContact CG-CE 4.03Å; L294-M297 PolarHBondContact O-N 3.48Å; E295-M297 PolarHBondContact O-N 3.44Å; M297-K299 PolarHBondContact O-N 3.49Å; M297-E300 PolarHBondContact O-N 3.23Å; M297-E300 VanDerWaalsContact O-N 3.08Å; M297-I301 WeakPolarHBondContact O-CG1 2.82Å; M297-I301 PolarHBondContact O-N 3.46Å |
| 298 | A | 95.6 | Very high | 93 | Very high | 49 Ų | 49 | 114.9 Ų | 114.9 | 41% | 0.405 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -59 | -39.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | L294 E295 E296 E300 I301 | L294-A298 PolarHBondContact O-N 3.43Å; E295-A298 PolarHBondContact O-N 2.71Å; E296-A298 VanDerWaalsContact C-N 3.3Å; E296-A298 PolarHBondContact O-N 3.35Å; A298-E300 VanDerWaalsContact C-N 3.25Å; A298-E300 PolarHBondContact O-N 3.18Å; A298-I301 PolarHBondContact O-N 2.56Å |
| 299 | K | 91.4 | Very high | 93.2 | Very high | 126 Ų | 126 | 113.7 Ų | 113.7 | 55% | 0.548 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -70.4 | -34.1 | 178.4 | -69.5 | 179.8 | -176.8 | 177 | 0 | 110.9 | E295 E296 M297 I301 E302 K303 | E295-K299 WeakPolarHBondContact O-CG 3.08Å; E295-K299 PolarHBondContact O-N 2.94Å; E296-K299 WeakPolarHBondContact O-CB 3.43Å; E296-K299 PolarHBondContact O-N 3.4Å; M297-K299 PolarHBondContact O-N 3.49Å; K299-I301 PolarHBondContact O-N 3.47Å; K299-E302 PolarHBondContact O-N 3.32Å; K299-K303 VanDerWaalsContact O-CG 3.25Å; K299-K303 WeakPolarHBondContact O-CG 3.26Å; K299-K303 PolarHBondContact O-N 3.44Å |
| 300 | E | 91.4 | Very high | 93.3 | Very high | 101 Ų | 101 | 110.5 Ų | 110.5 | 47% | 0.472 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -72 | -31.7 | -177.5 | -112.2 | 95.9 | -162.4 | 0 | 0 | 110.8 | E296 M297 A298 E302 K303 | E296-E300 WeakPolarHBondContact O-CB 3.43Å; E296-E300 PolarHBondContact O-N 2.87Å; M297-E300 PolarHBondContact O-N 3.23Å; M297-E300 VanDerWaalsContact O-N 3.08Å; A298-E300 VanDerWaalsContact C-N 3.25Å; A298-E300 PolarHBondContact O-N 3.18Å; E300-E302 PolarHBondContact O-N 3.27Å; E300-K303 PolarHBondContact O-N 3.35Å; E300-K303 VanDerWaalsContact O-N 3.12Å; E300-K303 IonicContact OE1-NZ 3.89Å |
| 301 | I | 94.5 | Very high | 93.4 | Very high | 141 Ų | 141 | 104.5 Ų | 104.5 | 72% | 0.723 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.4 | -29.8 | 179.7 | -69.9 | 171.8 | 0 | 0 | 0 | 109.2 | M297 A298 K299 K303 | M297-I301 WeakPolarHBondContact O-CG1 2.82Å; M297-I301 PolarHBondContact O-N 3.46Å; A298-I301 PolarHBondContact O-N 2.56Å; K299-I301 PolarHBondContact O-N 3.47Å; I301-K303 VanDerWaalsContact C-N 3.26Å; I301-K303 PolarHBondContact O-N 2.78Å |
| 302 | E | 91.9 | Very high | 93.4 | Very high | 168 Ų | 168 | 106.8 Ų | 106.8 | 79% | 0.785 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -80.9 | -13.4 | -178 | -68.9 | 175.4 | -177.2 | 0 | 0 | 111 | K299 E300 | K299-E302 PolarHBondContact O-N 3.32Å; E300-E302 PolarHBondContact O-N 3.27Å |
| 303 | K | 91.6 | Very high | 93.3 | Very high | 60 Ų | 60 | 108.2 Ų | 108.2 | 26% | 0.261 | 56% | 0.563 | S | S | . | * | S | Bend | trans | -88.9 | 151.5 | -175.4 | -65.8 | 175.7 | -176.5 | 173.1 | 0 | 109.8 | K299 E300 I301 D313 | K299-K303 VanDerWaalsContact O-CG 3.25Å; K299-K303 WeakPolarHBondContact O-CG 3.26Å; K299-K303 PolarHBondContact O-N 3.44Å; E300-K303 PolarHBondContact O-N 3.35Å; E300-K303 VanDerWaalsContact O-N 3.12Å; E300-K303 IonicContact OE1-NZ 3.89Å; I301-K303 VanDerWaalsContact C-N 3.26Å; I301-K303 PolarHBondContact O-N 2.78Å; K303-D313 WeakPolarHBondContact CE-OD2 3.45Å; K303-D313 IonicContact NZ-OD2 2.09Å; K303-D313 PolarHBondContact NZ-OD2 3.36Å |
| 304 | P | 93.5 | Very high | 93.1 | Very high | 95 Ų | 95 | 104.6 Ų | 104.6 | 62% | 0.617 | 55% | 0.55 | S | S | * | * | trans | -66.9 | 152.6 | 177 | 29.2 | -34.8 | 0 | 0 | 0 | 111.9 | A306 | P304-A306 PolarHBondContact O-N 3.42Š| ||
| 305 | L | 92.7 | Very high | 93.1 | Very high | 188 Ų | 188 | 106.4 Ų | 106.4 | 98% | 0.984 | 56% | 0.556 | S | S | * | * | S | Bend | trans | -52.2 | 0 | -173.3 | 177.9 | 60.4 | 0 | 0 | 0 | 111.2 | ||
| 306 | A | 93 | Very high | 93 | Very high | 52 Ų | 52 | 103.7 Ų | 103.7 | 43% | 0.43 | 55% | 0.554 | S | S | . | * | S | Bend | 0 | 140.6 | 0 | 0 | 0 | 0 | 0 | 0 | 110 | P304 | P304-A306 PolarHBondContact O-N 3.42Š| |
| 307 | R | 92 | Very high | 93 | Very high | 155 Ų | 155 | 103 Ų | 103 | 59% | 0.585 | 55% | 0.551 | S | S | * | * | trans | -85.2 | 0 | 172.8 | -64.1 | 177.1 | 76 | 156.1 | -0.8 | 109.9 | D311 | R307-D311 IonicContact NE-OD2 3.59Š| ||
| 308 | Y | 92.8 | Very high | 92.9 | Very high | 171 Ų | 171 | 103.3 Ų | 103.3 | 67% | 0.671 | 55% | 0.553 | S | S | * | * | 0 | 167.2 | 0 | -70.4 | -78.7 | 0 | 0 | 0 | 110.1 | G310 D311 | Y308-G310 PolarHBondContact O-N 3.3Å; Y308-G310 VanDerWaalsContact O-N 3.13Å; Y308-D311 WeakPolarHBondContact O-CB 3.46Å; Y308-D311 PolarHBondContact O-N 3.3Å; Y308-D311 VanDerWaalsContact O-N 3.16Å | |||
| 309 | A | 92 | Very high | 92.8 | Very high | 108 Ų | 108 | 109.9 Ų | 109.9 | 89% | 0.893 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.6 | 0 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 310 | G | 91.5 | Very high | 92.8 | Very high | 62 Ų | 62 | 107.4 Ų | 107.4 | 64% | 0.639 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | 0 | 16.2 | 0 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y308 E312 | Y308-G310 PolarHBondContact O-N 3.3Å; Y308-G310 VanDerWaalsContact O-N 3.13Å; G310-E312 PolarHBondContact O-N 3.48Å | |
| 311 | D | 93 | Very high | 92.9 | Very high | 32 Ų | 32 | 106.2 Ų | 106.2 | 17% | 0.171 | 57% | 0.566 | C | S | . | * | trans | -68.6 | 121.7 | 179.2 | -153.9 | -0.6 | 0 | 0 | 0 | 111.1 | R307 Y308 D313 L314 E315 | R307-D311 IonicContact NE-OD2 3.59Å; Y308-D311 WeakPolarHBondContact O-CB 3.46Å; Y308-D311 PolarHBondContact O-N 3.3Å; Y308-D311 VanDerWaalsContact O-N 3.16Å; D311-D313 VanDerWaalsContact C-N 3.26Å; D311-D313 PolarHBondContact O-N 2.96Å; D311-L314 HydrophobicContact CB-CB 4.07Å; D311-E315 PolarHBondContact O-N 3.13Å | ||
| 312 | E | 92.6 | Very high | 92.8 | Very high | 154 Ų | 154 | 102 Ų | 102 | 72% | 0.72 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.7 | -38.2 | -174.9 | -67 | 177 | -179.6 | 0 | 0 | 110.9 | G310 L314 E315 A316 | G310-E312 PolarHBondContact O-N 3.48Å; E312-L314 VanDerWaalsContact C-N 3.33Å; E312-L314 PolarHBondContact O-N 2.78Å; E312-E315 PolarHBondContact O-N 3.23Å; E312-A316 WeakPolarHBondContact O-CB 3.32Å; E312-A316 PolarHBondContact O-N 2.93Å |
| 313 | D | 92.2 | Very high | 92.9 | Very high | 68 Ų | 68 | 101.1 Ų | 101.1 | 36% | 0.364 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.4 | -43.4 | -178 | -72.5 | -6.8 | 0 | 0 | 0 | 111 | K303 D311 E315 A316 H317 | K303-D313 WeakPolarHBondContact CE-OD2 3.45Å; K303-D313 IonicContact NZ-OD2 2.09Å; K303-D313 PolarHBondContact NZ-OD2 3.36Å; D311-D313 VanDerWaalsContact C-N 3.26Å; D311-D313 PolarHBondContact O-N 2.96Å; D313-E315 VanDerWaalsContact C-N 3.3Å; D313-A316 PolarHBondContact O-N 3.25Å; D313-H317 PolarHBondContact O-N 3.37Å |
| 314 | L | 91.5 | Very high | 93.1 | Very high | 56 Ų | 56 | 105.6 Ų | 105.6 | 29% | 0.293 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.8 | -43.5 | 178.7 | 177.7 | 62.5 | 0 | 0 | 0 | 110.9 | D311 E312 A316 H317 L318 | D311-L314 HydrophobicContact CB-CB 4.07Å; E312-L314 VanDerWaalsContact C-N 3.33Å; E312-L314 PolarHBondContact O-N 2.78Å; L314-A316 VanDerWaalsContact C-N 3.29Å; L314-A316 PolarHBondContact O-N 2.91Å; L314-H317 PolarHBondContact O-N 2.95Å; L314-L318 HydrophobicContact CD1-CD1 4.44Å; L314-L318 HydrophobicContact CD1-CG 4.36Å; L314-L318 HydrophobicContact CG-CD1 4.21Å; L314-L318 WeakPolarHBondContact O-CG 3.34Å; L314-L318 PolarHBondContact O-N 2.78Å |
| 315 | E | 95.3 | Very high | 93.1 | Very high | 131 Ų | 131 | 108.7 Ų | 108.7 | 61% | 0.612 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62.5 | -42.5 | 179.8 | -171 | 169 | -177.1 | 0 | 0 | 111.1 | D311 E312 D313 H317 L318 K319 | D311-E315 PolarHBondContact O-N 3.13Å; E312-E315 PolarHBondContact O-N 3.23Å; D313-E315 VanDerWaalsContact C-N 3.3Å; E315-H317 VanDerWaalsContact C-N 3.3Å; E315-H317 PolarHBondContact O-N 3.36Å; E315-L318 PolarHBondContact O-N 2.8Å; E315-K319 WeakPolarHBondContact O-CB 3.4Å; E315-K319 PolarHBondContact O-N 3.47Å |
| 316 | A | 94.7 | Very high | 93.3 | Very high | 62 Ų | 62 | 103.1 Ų | 103.1 | 51% | 0.512 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61 | -42.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | E312 D313 L314 K319 S320 | E312-A316 WeakPolarHBondContact O-CB 3.32Å; E312-A316 PolarHBondContact O-N 2.93Å; D313-A316 PolarHBondContact O-N 3.25Å; L314-A316 VanDerWaalsContact C-N 3.29Å; L314-A316 PolarHBondContact O-N 2.91Å; A316-K319 PolarHBondContact O-N 3.42Å; A316-S320 PolarHBondContact O-N 3.19Å; A316-S320 VanDerWaalsContact O-N 3.08Å |
| 317 | H | 92.9 | Very high | 93.4 | Very high | 102 Ų | 102 | 106.9 Ų | 106.9 | 47% | 0.472 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.7 | -42.5 | 179.8 | 178.1 | -108.8 | 0 | 0 | 0 | 111 | D313 L314 E315 K319 S320 Q321 | D313-H317 PolarHBondContact O-N 3.37Å; L314-H317 PolarHBondContact O-N 2.95Å; E315-H317 VanDerWaalsContact C-N 3.3Å; E315-H317 PolarHBondContact O-N 3.36Å; H317-K319 PolarHBondContact O-N 3.45Å; H317-S320 PolarHBondContact O-N 3.32Å; H317-S320 PolarHBondContact O-OG 3.02Å; H317-Q321 PolarHBondContact CE1-NE2 3.31Å; H317-Q321 PolarHBondContact O-N 3.34Å |
| 318 | L | 93.8 | Very high | 93.6 | Very high | 89 Ų | 89 | 103.8 Ų | 103.8 | 47% | 0.466 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -69 | -33.8 | -178.4 | -70.7 | 177.7 | 0 | 0 | 0 | 110.6 | L314 E315 S320 Q321 | L314-L318 HydrophobicContact CD1-CD1 4.44Å; L314-L318 HydrophobicContact CD1-CG 4.36Å; L314-L318 HydrophobicContact CG-CD1 4.21Å; L314-L318 WeakPolarHBondContact O-CG 3.34Å; L314-L318 PolarHBondContact O-N 2.78Å; E315-L318 PolarHBondContact O-N 2.8Å; L318-S320 PolarHBondContact O-N 3.36Å; L318-Q321 PolarHBondContact O-N 3.18Å |
| 319 | K | 93.4 | Very high | 93.7 | Very high | 187 Ų | 187 | 97.9 Ų | 97.9 | 81% | 0.813 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -69.5 | -30 | 177.9 | -169.5 | 172.5 | 180 | 175.9 | 0 | 111.1 | E315 A316 H317 Q321 | E315-K319 WeakPolarHBondContact O-CB 3.4Å; E315-K319 PolarHBondContact O-N 3.47Å; A316-K319 PolarHBondContact O-N 3.42Å; H317-K319 PolarHBondContact O-N 3.45Å; K319-Q321 VanDerWaalsContact C-N 3.31Å; K319-Q321 PolarHBondContact O-N 3Å |
| 320 | S | 92.5 | Very high | 93.9 | Very high | 73 Ų | 73 | 99.6 Ų | 99.6 | 51% | 0.51 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -76.4 | -20.3 | -178.7 | 67.8 | 0 | 0 | 0 | 0 | 111 | A316 H317 L318 L322 | A316-S320 PolarHBondContact O-N 3.19Å; A316-S320 VanDerWaalsContact O-N 3.08Å; H317-S320 PolarHBondContact O-N 3.32Å; H317-S320 PolarHBondContact O-OG 3.02Å; L318-S320 PolarHBondContact O-N 3.36Å; S320-L322 PolarHBondContact O-N 3.49Å |
| 321 | Q | 93.6 | Very high | 94.1 | Very high | 77 Ų | 77 | 102.5 Ų | 102.5 | 36% | 0.36 | 51% | 0.512 | S | S | . | . | P | Polyproline II helix | trans | -72.5 | 124.7 | -178.4 | -71 | -177.6 | -11.2 | 0 | 0 | 110.5 | H317 L318 K319 | H317-Q321 PolarHBondContact CE1-NE2 3.31Å; H317-Q321 PolarHBondContact O-N 3.34Å; L318-Q321 PolarHBondContact O-N 3.18Å; K319-Q321 VanDerWaalsContact C-N 3.31Å; K319-Q321 PolarHBondContact O-N 3Å |
| 322 | L | 93.2 | Very high | 94.1 | Very high | 52 Ų | 52 | 103.1 Ų | 103.1 | 27% | 0.272 | 51% | 0.514 | S | S | . | . | P | Polyproline II helix | trans | -96.2 | 129.6 | 178.2 | -67.1 | 171.3 | 0 | 0 | 0 | 109.8 | S320 Y329 M332 M333 | S320-L322 PolarHBondContact O-N 3.49Å; L322-Y329 HydrophobicContact CB-CD2 3.96Å; L322-Y329 HydrophobicContact CB-CE2 3.88Å; L322-M332 HydrophobicContact CD1-CB 4.17Å; L322-M332 HydrophobicContact CD1-CG 4.37Å; L322-M332 HydrophobicContact CD2-CB 3.59Å; L322-M332 HydrophobicContact CD2-CG 3.36Å; L322-M332 HydrophobicContact CG-CG 4.49Å; L322-M333 HydrophobicContact CD1-CG 4.15Å; L322-M333 HydrophobicContact CD1-SD 3.6Å |
| 323 | Y | 93.7 | Very high | 94.1 | Very high | 149 Ų | 149 | 99.3 Ų | 99.3 | 58% | 0.584 | 50% | 0.497 | S | S | * | . | P | Polyproline II helix | trans | -100 | 140.5 | -179.8 | -72 | -71.5 | 0 | 0 | 0 | 110 | D325 D326 Y329 | Y323-D325 PolarHBondContact O-N 3.31Å; Y323-D326 PolarHBondContact O-N 2.96Å; Y323-Y329 WeakPolarHBondContact O-CB 3.27Å; Y323-Y329 WeakPolarHBondContact O-CD2 3.39Å; Y323-Y329 VanDerWaalsContact O-CG 3.29Å |
| 324 | E | 94.3 | Very high | 94.2 | Very high | 154 Ų | 154 | 102.5 Ų | 102.5 | 72% | 0.72 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.1 | -18.7 | -174.4 | -45.9 | 174.9 | -175.8 | 0 | 0 | 110.4 | D326 Y329 | E324-D326 VanDerWaalsContact C-N 3.31Å; E324-D326 PolarHBondContact O-N 3.45Å; E324-Y329 HydrophobicContact CG-CE2 4.25Å |
| 325 | D | 94.9 | Very high | 94.3 | Very high | 160 Ų | 160 | 104.2 Ų | 104.2 | 86% | 0.856 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.7 | 2.5 | -174.8 | -65.9 | -29.1 | 0 | 0 | 0 | 110.7 | Y323 | Y323-D325 PolarHBondContact O-N 3.31Š|
| 326 | D | 95.5 | Very high | 94.2 | Very high | 72 Ų | 72 | 105.3 Ų | 105.3 | 39% | 0.385 | 51% | 0.507 | S | S | . | . | S | Bend | trans | -83 | 131.1 | 178.1 | -174.6 | -5.4 | 0 | 0 | 0 | 111 | Y323 E324 M328 Y329 | Y323-D326 PolarHBondContact O-N 2.96Å; E324-D326 VanDerWaalsContact C-N 3.31Å; E324-D326 PolarHBondContact O-N 3.45Å; D326-M328 PolarHBondContact O-N 2.97Å; D326-M328 PolarHBondContact OD1-N 2.91Å; D326-Y329 WeakPolarHBondContact O-CB 3.34Å; D326-Y329 PolarHBondContact O-N 3.32Å |
| 327 | P | 96.9 | Very high | 94 | Very high | 131 Ų | 131 | 112.2 Ų | 112.2 | 85% | 0.851 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | -22.4 | 179.8 | -23.2 | 28.2 | 0 | 0 | 0 | 111.8 | Y329 | P327-Y329 VanDerWaalsContact C-N 3.32Š|
| 328 | M | 95.1 | Very high | 93.9 | Very high | 89 Ų | 89 | 115.8 Ų | 115.8 | 44% | 0.438 | 53% | 0.53 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.5 | 7.6 | -179 | -166.4 | 168.7 | 53.4 | 0 | 0 | 110.8 | D326 E330 Y331 M332 | D326-M328 PolarHBondContact O-N 2.97Å; D326-M328 PolarHBondContact OD1-N 2.91Å; M328-E330 VanDerWaalsContact C-N 3.34Å; M328-E330 PolarHBondContact O-N 3.49Å; M328-Y331 HydrophobicContact CG-CD1 4.01Å; M328-Y331 PolarHBondContact O-N 3.5Å; M328-Y331 HydrophobicContact SD-CD1 4.49Å; M328-M332 HydrophobicContact CB-CE 4.31Å; M328-M332 HydrophobicContact CE-CE 2.7Å; M328-M332 HydrophobicContact CG-CE 3.39Å; M328-M332 PolarHBondContact O-N 3.42Å; M328-M332 HydrophobicContact SD-CE 3.1Å; M328-M332 WeakPolarHBondContact SD-CE 3.43Å |
| 329 | Y | 95.6 | Very high | 93.8 | Very high | 48 Ų | 48 | 117.4 Ų | 117.4 | 19% | 0.188 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -59.9 | -45.3 | -173.9 | 175.6 | -105.2 | 0 | 0 | 0 | 111.2 | L322 Y323 E324 D326 P327 Y331 M332 M333 | L322-Y329 HydrophobicContact CB-CD2 3.96Å; L322-Y329 HydrophobicContact CB-CE2 3.88Å; Y323-Y329 WeakPolarHBondContact O-CB 3.27Å; Y323-Y329 WeakPolarHBondContact O-CD2 3.39Å; Y323-Y329 VanDerWaalsContact O-CG 3.29Å; E324-Y329 HydrophobicContact CG-CE2 4.25Å; D326-Y329 WeakPolarHBondContact O-CB 3.34Å; D326-Y329 PolarHBondContact O-N 3.32Å; P327-Y329 VanDerWaalsContact C-N 3.32Å; Y329-Y331 VanDerWaalsContact C-N 3.35Å; Y329-Y331 PolarHBondContact O-N 3.49Å; Y329-M332 PolarHBondContact O-N 2.93Å; Y329-M333 HydrophobicContact CD1-CG 4.28Å; Y329-M333 HydrophobicContact CD2-CG 4.27Å; Y329-M333 HydrophobicContact CE1-CG 3.88Å; Y329-M333 HydrophobicContact CE2-CG 3.88Å; Y329-M333 HydrophobicContact CE2-SD 4.34Å; Y329-M333 HydrophobicContact CG-CG 4.46Å; Y329-M333 WeakPolarHBondContact O-CB 3.49Å; Y329-M333 WeakPolarHBondContact O-CG 3.41Å; Y329-M333 PolarHBondContact O-N 2.85Å |
| 330 | E | 95.6 | Very high | 93.5 | Very high | 144 Ų | 144 | 114 Ų | 114 | 67% | 0.673 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67 | -44 | -176 | -69.4 | -71.7 | 157.1 | 0 | 0 | 110.8 | M328 M332 M333 R334 | M328-E330 VanDerWaalsContact C-N 3.34Å; M328-E330 PolarHBondContact O-N 3.49Å; E330-M332 VanDerWaalsContact C-N 3.29Å; E330-M333 PolarHBondContact O-N 3.46Å; E330-R334 PolarHBondContact O-N 3.3Å |
| 331 | Y | 95.3 | Very high | 93.3 | Very high | 123 Ų | 123 | 115.6 Ų | 115.6 | 48% | 0.482 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.3 | -45.4 | 179.5 | 171.1 | -103.6 | 0 | 0 | 0 | 110.9 | M328 Y329 M333 R334 K335 | M328-Y331 HydrophobicContact CG-CD1 4.01Å; M328-Y331 PolarHBondContact O-N 3.5Å; M328-Y331 HydrophobicContact SD-CD1 4.49Å; Y329-Y331 VanDerWaalsContact C-N 3.35Å; Y329-Y331 PolarHBondContact O-N 3.49Å; Y331-M333 VanDerWaalsContact C-N 3.33Å; Y331-M333 PolarHBondContact O-N 3.18Å; Y331-R334 PolarHBondContact O-N 3.46Å; Y331-K335 HydrophobicContact CE1-CD 4.45Å; Y331-K335 WeakPolarHBondContact O-CB 3.15Å; Y331-K335 PolarHBondContact O-N 3.22Å |
| 332 | M | 93.9 | Very high | 92.7 | Very high | 45 Ų | 45 | 114.5 Ų | 114.5 | 22% | 0.222 | 54% | 0.543 | C | S | . | . | H | α-helix | trans | -66.5 | -38 | -177.6 | -140.7 | 61.8 | 73.2 | 0 | 0 | 110.8 | L322 M328 Y329 E330 R334 K335 R336 | L322-M332 HydrophobicContact CD1-CB 4.17Å; L322-M332 HydrophobicContact CD1-CG 4.37Å; L322-M332 HydrophobicContact CD2-CB 3.59Å; L322-M332 HydrophobicContact CD2-CG 3.36Å; L322-M332 HydrophobicContact CG-CG 4.49Å; M328-M332 HydrophobicContact CB-CE 4.31Å; M328-M332 HydrophobicContact CE-CE 2.7Å; M328-M332 HydrophobicContact CG-CE 3.39Å; M328-M332 PolarHBondContact O-N 3.42Å; M328-M332 HydrophobicContact SD-CE 3.1Å; M328-M332 WeakPolarHBondContact SD-CE 3.43Å; Y329-M332 PolarHBondContact O-N 2.93Å; E330-M332 VanDerWaalsContact C-N 3.29Å; M332-R334 VanDerWaalsContact C-N 3.34Å; M332-K335 WeakPolarHBondContact O-CB 3.38Å; M332-K335 PolarHBondContact O-N 3.25Å; M332-K335 HydrophobicContact SD-CD 4.5Å; M332-R336 PolarHBondContact O-N 2.89Å |
| 333 | M | 92.7 | Very high | 92.3 | Very high | 73 Ų | 73 | 116.4 Ų | 116.4 | 36% | 0.36 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.1 | -44.6 | 177.5 | -79.9 | -62.6 | -97.1 | 0 | 0 | 110.7 | L322 Y329 E330 Y331 K335 R336 R337 | L322-M333 HydrophobicContact CD1-CG 4.15Å; L322-M333 HydrophobicContact CD1-SD 3.6Å; Y329-M333 HydrophobicContact CD1-CG 4.28Å; Y329-M333 HydrophobicContact CD2-CG 4.27Å; Y329-M333 HydrophobicContact CE1-CG 3.88Å; Y329-M333 HydrophobicContact CE2-CG 3.88Å; Y329-M333 HydrophobicContact CE2-SD 4.34Å; Y329-M333 HydrophobicContact CG-CG 4.46Å; Y329-M333 WeakPolarHBondContact O-CB 3.49Å; Y329-M333 WeakPolarHBondContact O-CG 3.41Å; Y329-M333 PolarHBondContact O-N 2.85Å; E330-M333 PolarHBondContact O-N 3.46Å; Y331-M333 VanDerWaalsContact C-N 3.33Å; Y331-M333 PolarHBondContact O-N 3.18Å; M333-K335 PolarHBondContact O-N 3.44Å; M333-R336 PolarHBondContact O-N 3.13Å; M333-R337 PolarHBondContact O-N 3.34Å |
| 334 | R | 93.5 | Very high | 91.9 | Very high | 135 Ų | 135 | 114.4 Ų | 114.4 | 51% | 0.509 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -60.3 | -45.1 | 177.5 | -176.4 | 167.5 | 67.5 | 170 | -0.6 | 110.9 | E330 Y331 M332 R336 R337 R338 | E330-R334 PolarHBondContact O-N 3.3Å; Y331-R334 PolarHBondContact O-N 3.46Å; M332-R334 VanDerWaalsContact C-N 3.34Å; R334-R336 VanDerWaalsContact C-N 3.27Å; R334-R336 PolarHBondContact O-N 2.97Å; R334-R337 PolarHBondContact O-N 2.86Å; R334-R338 VanDerWaalsContact O-CG 3.32Å; R334-R338 WeakPolarHBondContact O-CG 3.47Å; R334-R338 PolarHBondContact O-N 3.42Å |
| 335 | K | 94.4 | Very high | 91.4 | Very high | 92 Ų | 92 | 115.3 Ų | 115.3 | 40% | 0.4 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -59.6 | -42.2 | 178.6 | -174.6 | 177.6 | 179.3 | -178 | 0 | 110.5 | Y331 M332 M333 R337 R338 E339 | Y331-K335 HydrophobicContact CE1-CD 4.45Å; Y331-K335 WeakPolarHBondContact O-CB 3.15Å; Y331-K335 PolarHBondContact O-N 3.22Å; M332-K335 WeakPolarHBondContact O-CB 3.38Å; M332-K335 PolarHBondContact O-N 3.25Å; M332-K335 HydrophobicContact SD-CD 4.5Å; M333-K335 PolarHBondContact O-N 3.44Å; K335-R337 VanDerWaalsContact C-N 3.34Å; K335-R337 PolarHBondContact O-N 3.35Å; K335-R338 PolarHBondContact O-N 2.93Å; K335-E339 WeakPolarHBondContact CE-OE1 3.32Å; K335-E339 PolarHBondContact O-N 3.35Å |
| 336 | R | 91.9 | Very high | 91 | Very high | 154 Ų | 154 | 108 Ų | 108 | 58% | 0.581 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.7 | -40.8 | 178.8 | -168 | 177 | 148.5 | -174.5 | -0.9 | 111.5 | M332 M333 R334 R338 E339 N340 | M332-R336 PolarHBondContact O-N 2.89Å; M333-R336 PolarHBondContact O-N 3.13Å; R334-R336 VanDerWaalsContact C-N 3.27Å; R334-R336 PolarHBondContact O-N 2.97Å; R336-R338 PolarHBondContact O-N 3.19Å; R336-E339 PolarHBondContact O-N 3.02Å; R336-N340 PolarHBondContact O-N 3.23Å |
| 337 | R | 90.9 | Very high | 90.5 | Very high | 207 Ų | 207 | 109.3 Ų | 109.3 | 78% | 0.781 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.3 | -31.1 | 180 | -170.6 | 177.2 | 167.5 | -175.2 | 0.4 | 111.2 | M333 R334 K335 P341 | M333-R337 PolarHBondContact O-N 3.34Å; R334-R337 PolarHBondContact O-N 2.86Å; K335-R337 VanDerWaalsContact C-N 3.34Å; K335-R337 PolarHBondContact O-N 3.35Å; R337-P341 WeakPolarHBondContact O-CA 3.36Å |
| 338 | R | 91.8 | Very high | 90 | Very high | 177 Ų | 177 | 107.3 Ų | 107.3 | 67% | 0.668 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -77.4 | -37.9 | 179.9 | -75.2 | -177.7 | -175 | 171.8 | 1 | 110.5 | R334 K335 R336 | R334-R338 VanDerWaalsContact O-CG 3.32Å; R334-R338 WeakPolarHBondContact O-CG 3.47Å; R334-R338 PolarHBondContact O-N 3.42Å; K335-R338 PolarHBondContact O-N 2.93Å; R336-R338 PolarHBondContact O-N 3.19Å |
| 339 | E | 92.2 | Very high | 89.4 | Confident | 123 Ų | 123 | 105 Ų | 105 | 58% | 0.575 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -76.8 | -31.8 | -174.9 | -76.5 | 179 | -179.4 | 0 | 0 | 110.8 | K335 R336 | K335-E339 WeakPolarHBondContact CE-OE1 3.32Å; K335-E339 PolarHBondContact O-N 3.35Å; R336-E339 PolarHBondContact O-N 3.02Å |
| 340 | N | 87 | Confident | 88.9 | Confident | 116 Ų | 116 | 114 Ų | 114 | 62% | 0.62 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -138.9 | 80.9 | -179.2 | -66.4 | -64.6 | 0 | 0 | 0 | 109.7 | R336 G342 | R336-N340 PolarHBondContact O-N 3.23Å; N340-G342 VanDerWaalsContact C-N 3.3Å; N340-G342 PolarHBondContact O-N 3.45Å |
| 341 | P | 86.9 | Confident | 88.4 | Confident | 106 Ų | 106 | 113.2 Ų | 113.2 | 69% | 0.688 | 55% | 0.551 | S | S | * | * | trans | -66.6 | 93.2 | 179.8 | 22.5 | -27.8 | 0 | 0 | 0 | 111.7 | R337 | R337-P341 WeakPolarHBondContact O-CA 3.36Š| ||
| 342 | G | 82.3 | Confident | 88.1 | Confident | 54 Ų | 54 | 108.8 Ų | 108.8 | 56% | 0.557 | 54% | 0.539 | S | S | * | . | P | Polyproline II helix | trans | -46.4 | 172.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | N340 | N340-G342 VanDerWaalsContact C-N 3.3Å; N340-G342 PolarHBondContact O-N 3.45Å |
| 343 | P | 84.3 | Confident | 87.9 | Confident | 92 Ų | 92 | 111.1 Ų | 111.1 | 60% | 0.597 | 55% | 0.553 | S | S | * | * | S | Bend | trans | -59.4 | 145.1 | 176.2 | 20.9 | -25.6 | 0 | 0 | 0 | 111.9 | Q345 | P343-Q345 PolarHBondContact O-N 3.48Å; P343-Q345 VanDerWaalsContact O-N 3.08Å |
| 344 | P | 85.5 | Confident | 87.9 | Confident | 107 Ų | 107 | 112 Ų | 112 | 70% | 0.695 | 56% | 0.564 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 124.3 | 179.5 | 21.5 | -27.1 | 0 | 0 | 0 | 111.6 | A363 | P344-A363 HydrophobicContact CB-CB 3.49Å; P344-A363 VanDerWaalsContact CB-CB 3.49Å; P344-A363 HydrophobicContact CG-CB 3.83Å; P344-A363 VanDerWaalsContact O-CB 3.31Å; P344-A363 WeakPolarHBondContact O-CB 3.47Å |
| 345 | Q | 84 | Confident | 87.9 | Confident | 173 Ų | 173 | 107.9 Ų | 107.9 | 81% | 0.808 | 55% | 0.552 | S | S | * | * | P | Polyproline II helix | trans | -93 | 153 | 179.3 | -63.2 | -175.5 | -15.5 | 0 | 0 | 109.9 | P343 S347 | P343-Q345 PolarHBondContact O-N 3.48Å; P343-Q345 VanDerWaalsContact O-N 3.08Å; Q345-S347 PolarHBondContact O-N 2.87Å |
| 346 | C | 85.1 | Confident | 87.9 | Confident | 7 Ų | 7 | 110.3 Ų | 110.3 | 5% | 0.047 | 56% | 0.558 | C | S | . | * | P | Polyproline II helix | trans | -68.5 | 129.1 | 178.7 | 178.4 | 0 | 0 | 0 | 0 | 110.2 | K348 A349 P361 G362 | C346-K348 PolarHBondContact O-N 2.87Å; C346-K348 PolarHBondContact SG-N 3.3Å; C346-K348 VanDerWaalsContact SG-N 3.4Å; C346-A349 HydrophobicContact CB-CB 4.31Å; C346-A349 WeakPolarHBondContact O-CB 3.46Å; C346-A349 PolarHBondContact O-N 3.38Å; C346-P361 HydrophobicContact CB-CB 4.34Å; C346-P361 HydrophobicContact CB-CG 3.93Å; C346-G362 WeakPolarHBondContact CB-O 3.48Å |
| 347 | S | 85.4 | Confident | 87.9 | Confident | 99 Ų | 99 | 109 Ų | 109 | 69% | 0.692 | 56% | 0.557 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -22.6 | 179.3 | 60.2 | 0 | 0 | 0 | 0 | 111.4 | Q345 | Q345-S347 PolarHBondContact O-N 2.87Š|
| 348 | K | 86.6 | Confident | 87.9 | Confident | 90 Ų | 90 | 104.1 Ų | 104.1 | 39% | 0.391 | 56% | 0.555 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -108.9 | 22.8 | -175.2 | -62.8 | 169.1 | -168.6 | 173.4 | 0 | 109.8 | C346 R350 L351 D366 | C346-K348 PolarHBondContact O-N 2.87Å; C346-K348 PolarHBondContact SG-N 3.3Å; C346-K348 VanDerWaalsContact SG-N 3.4Å; K348-R350 PolarHBondContact O-N 2.91Å; K348-L351 HydrophobicContact CB-CD1 4.36Å; K348-L351 WeakPolarHBondContact O-CB 3.21Å; K348-L351 PolarHBondContact O-N 2.86Å; K348-D366 WeakPolarHBondContact CD-O 3.14Å; K348-D366 PolarHBondContact NZ-O 3.43Å |
| 349 | A | 82.6 | Confident | 87.8 | Confident | 40 Ų | 40 | 101 Ų | 101 | 33% | 0.331 | 55% | 0.55 | S | S | . | * | G | 310 helix | trans | -58.2 | -24.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | C346 L351 A352 P361 | C346-A349 HydrophobicContact CB-CB 4.31Å; C346-A349 WeakPolarHBondContact O-CB 3.46Å; C346-A349 PolarHBondContact O-N 3.38Å; A349-L351 PolarHBondContact O-N 3.08Å; A349-A352 VanDerWaalsContact O-CB 3.27Å; A349-A352 WeakPolarHBondContact O-CB 3.32Å; A349-A352 PolarHBondContact O-N 3.18Å; A349-P361 HydrophobicContact CB-CG 4.4Å |
| 350 | R | 84.8 | Confident | 87.8 | Confident | 236 Ų | 236 | 100 Ų | 100 | 89% | 0.891 | 55% | 0.554 | S | S | * | * | G | 310 helix | trans | -70.6 | -18.9 | -177.7 | -74.3 | -167.6 | -81.5 | -89.3 | 0.8 | 111.1 | K348 A352 | K348-R350 PolarHBondContact O-N 2.91Å; R350-A352 PolarHBondContact O-N 3.04Å |
| 351 | L | 86.4 | Confident | 88.1 | Confident | 129 Ų | 129 | 96.1 Ų | 96.1 | 68% | 0.675 | 54% | 0.535 | S | S | * | . | G | 310 helix | trans | -95.3 | -1.3 | -175.3 | -63.6 | 173 | 0 | 0 | 0 | 109.8 | K348 A349 L353 | K348-L351 HydrophobicContact CB-CD1 4.36Å; K348-L351 WeakPolarHBondContact O-CB 3.21Å; K348-L351 PolarHBondContact O-N 2.86Å; A349-L351 PolarHBondContact O-N 3.08Å; L351-L353 PolarHBondContact O-N 3.49Å |
| 352 | A | 89.1 | Confident | 88.3 | Confident | 29 Ų | 29 | 93.5 Ų | 93.5 | 24% | 0.24 | 53% | 0.528 | C | S | . | . | P | Polyproline II helix | trans | -76.1 | 134.4 | -173.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | A349 R350 P361 W365 | A349-A352 VanDerWaalsContact O-CB 3.27Å; A349-A352 WeakPolarHBondContact O-CB 3.32Å; A349-A352 PolarHBondContact O-N 3.18Å; R350-A352 PolarHBondContact O-N 3.04Å; A352-P361 HydrophobicContact CB-CG 3.82Å; A352-W365 VanDerWaalsContact CA-CH2 3.45Å; A352-W365 HydrophobicContact CB-CE3 4.32Å; A352-W365 HydrophobicContact CB-CH2 3.55Å; A352-W365 HydrophobicContact CB-CZ3 3.24Å |
| 353 | L | 89.7 | Confident | 88.8 | Confident | 95 Ų | 95 | 92.7 Ų | 92.7 | 50% | 0.497 | 52% | 0.516 | S | S | . | . | P | Polyproline II helix | trans | -69.9 | 144.1 | 176.7 | -65 | 172.1 | 0 | 0 | 0 | 110.1 | L351 D369 | L351-L353 PolarHBondContact O-N 3.49Å; L353-D369 WeakPolarHBondContact CD1-OD2 3.48Å |
| 354 | P | 92.1 | Very high | 89.2 | Confident | 91 Ų | 91 | 100 Ų | 100 | 59% | 0.591 | 53% | 0.532 | S | S | * | . | P | Polyproline II helix | trans | -67.2 | 142.2 | -178.2 | 25.9 | -32.1 | 0 | 0 | 0 | 111.8 | L379 | P354-L379 HydrophobicContact CG-CD2 4.02Š|
| 355 | N | 92.3 | Very high | 89.6 | Confident | 49 Ų | 49 | 98.6 Ų | 98.6 | 26% | 0.262 | 51% | 0.512 | S | S | . | . | trans | -116.4 | 160.5 | 178.7 | 65.9 | 7.8 | 0 | 0 | 0 | 110.3 | F357 S358 I359 | N355-F357 PolarHBondContact O-N 3.35Å; N355-F357 VanDerWaalsContact OD1-C 3.25Å; N355-F357 PolarHBondContact OD1-N 3.43Å; N355-S358 VanDerWaalsContact CG-N 3.33Å; N355-S358 PolarHBondContact O-N 3.47Å; N355-S358 WeakPolarHBondContact OD1-CA 3.32Å; N355-S358 PolarHBondContact OD1-N 3.41Å; N355-I359 VanDerWaalsContact CG-N 3.31Å; N355-I359 WeakPolarHBondContact ND2-CA 3.28Å; N355-I359 VanDerWaalsContact ND2-CB 3.3Å; N355-I359 WeakPolarHBondContact ND2-CB 3.42Å; N355-I359 PolarHBondContact ND2-N 3.31Å; N355-I359 PolarHBondContact ND2-O 2.87Å; N355-I359 PolarHBondContact OD1-N 3.35Å | ||
| 356 | R | 94.3 | Very high | 90 | Very high | 143 Ų | 143 | 93.1 Ų | 93.1 | 54% | 0.54 | 49% | 0.489 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.3 | -31.1 | -176.2 | -179.2 | 175.1 | 69.8 | -150.8 | -2.6 | 110.8 | E375 | R356-E375 PolarHBondContact N-OE2 3.37Š|
| 357 | F | 92.1 | Very high | 90.3 | Very high | 126 Ų | 126 | 94 Ų | 94 | 55% | 0.553 | 50% | 0.499 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.5 | 16.8 | -173.9 | -56.4 | -69.7 | 0 | 0 | 0 | 109.9 | N355 I359 | N355-F357 PolarHBondContact O-N 3.35Å; N355-F357 VanDerWaalsContact OD1-C 3.25Å; N355-F357 PolarHBondContact OD1-N 3.43Å; F357-I359 HydrophobicContact CB-CD1 3.73Å; F357-I359 HydrophobicContact CB-CG1 3.8Å; F357-I359 HydrophobicContact CG-CD1 4.5Å; F357-I359 WeakPolarHBondContact O-CG1 3.48Å; F357-I359 PolarHBondContact O-N 2.83Å |
| 358 | S | 91.7 | Very high | 90.6 | Very high | 105 Ų | 105 | 93.3 Ų | 93.3 | 73% | 0.734 | 49% | 0.49 | S | S | * | . | trans | 44.2 | 33.2 | 177.6 | -58.3 | 0 | 0 | 0 | 0 | 111.6 | N355 | N355-S358 VanDerWaalsContact CG-N 3.33Å; N355-S358 PolarHBondContact O-N 3.47Å; N355-S358 WeakPolarHBondContact OD1-CA 3.32Å; N355-S358 PolarHBondContact OD1-N 3.41Å | ||
| 359 | I | 90.2 | Very high | 90.8 | Very high | 111 Ų | 111 | 93.7 Ų | 93.7 | 57% | 0.569 | 50% | 0.497 | S | S | * | . | P | Polyproline II helix | trans | -80.3 | 125.9 | 174 | -62.1 | 168.2 | 0 | 0 | 0 | 109.4 | N355 F357 | N355-I359 VanDerWaalsContact CG-N 3.31Å; N355-I359 WeakPolarHBondContact ND2-CA 3.28Å; N355-I359 VanDerWaalsContact ND2-CB 3.3Å; N355-I359 WeakPolarHBondContact ND2-CB 3.42Å; N355-I359 PolarHBondContact ND2-N 3.31Å; N355-I359 PolarHBondContact ND2-O 2.87Å; N355-I359 PolarHBondContact OD1-N 3.35Å; F357-I359 HydrophobicContact CB-CD1 3.73Å; F357-I359 HydrophobicContact CB-CG1 3.8Å; F357-I359 HydrophobicContact CG-CD1 4.5Å; F357-I359 WeakPolarHBondContact O-CG1 3.48Å; F357-I359 PolarHBondContact O-N 2.83Å |
| 360 | P | 90.6 | Very high | 91.3 | Very high | 101 Ų | 101 | 100.5 Ų | 100.5 | 66% | 0.656 | 51% | 0.514 | S | S | * | . | P | Polyproline II helix | trans | -77.2 | 146.3 | 179.1 | 25.3 | -30.9 | 0 | 0 | 0 | 111.8 | ||
| 361 | P | 93.6 | Very high | 91.7 | Very high | 35 Ų | 35 | 92.1 Ų | 92.1 | 23% | 0.227 | 49% | 0.492 | C | S | . | . | P | Polyproline II helix | trans | -59.8 | 150.4 | 179.3 | 27.1 | -34.5 | 0 | 0 | 0 | 111.8 | C346 A349 A352 W365 | C346-P361 HydrophobicContact CB-CB 4.34Å; C346-P361 HydrophobicContact CB-CG 3.93Å; A349-P361 HydrophobicContact CB-CG 4.4Å; A352-P361 HydrophobicContact CB-CG 3.82Å; P361-W365 HydrophobicContact CB-CB 3.84Å; P361-W365 HydrophobicContact CB-CD2 3.52Å; P361-W365 HydrophobicContact CB-CE3 3.08Å; P361-W365 HydrophobicContact CB-CG 3.87Å; P361-W365 HydrophobicContact CB-CZ3 3.8Å; P361-W365 HydrophobicContact CG-CD2 4.22Å; P361-W365 HydrophobicContact CG-CE3 3.28Å; P361-W365 HydrophobicContact CG-CZ3 3.61Å |
| 362 | G | 91.6 | Very high | 92.1 | Very high | 51 Ų | 51 | 92.9 Ų | 92.9 | 53% | 0.526 | 50% | 0.497 | S | S | . | . | P | Polyproline II helix | trans | -66.9 | 165.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | C346 R364 W365 | C346-G362 WeakPolarHBondContact CB-O 3.48Å; G362-R364 PolarHBondContact O-N 3.46Å; G362-W365 WeakPolarHBondContact O-CB 3.47Å; G362-W365 PolarHBondContact O-N 3.29Å |
| 363 | A | 92.1 | Very high | 92.3 | Very high | 38 Ų | 38 | 92.6 Ų | 92.6 | 31% | 0.314 | 50% | 0.496 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.8 | -20.8 | -175.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | P344 W365 | P344-A363 HydrophobicContact CB-CB 3.49Å; P344-A363 VanDerWaalsContact CB-CB 3.49Å; P344-A363 HydrophobicContact CG-CB 3.83Å; P344-A363 VanDerWaalsContact O-CB 3.31Å; P344-A363 WeakPolarHBondContact O-CB 3.47Å; A363-W365 VanDerWaalsContact C-N 3.32Å; A363-W365 PolarHBondContact O-N 3.17Å |
| 364 | R | 92.6 | Very high | 92.6 | Very high | 245 Ų | 245 | 93.1 Ų | 93.1 | 93% | 0.925 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104 | 2.3 | -172.3 | -63.5 | 173.9 | 77.8 | 175 | -1 | 110.4 | G362 D366 | G362-R364 PolarHBondContact O-N 3.46Å; R364-D366 PolarHBondContact O-N 3.11Å |
| 365 | W | 93.9 | Very high | 92.8 | Very high | 77 Ų | 77 | 92 Ų | 92 | 29% | 0.292 | 48% | 0.482 | S | S | . | . | trans | -61.7 | 133.9 | 178.9 | -175.8 | 46.7 | 0 | 0 | 0 | 111.1 | A352 P361 G362 A363 | A352-W365 VanDerWaalsContact CA-CH2 3.45Å; A352-W365 HydrophobicContact CB-CE3 4.32Å; A352-W365 HydrophobicContact CB-CH2 3.55Å; A352-W365 HydrophobicContact CB-CZ3 3.24Å; P361-W365 HydrophobicContact CB-CB 3.84Å; P361-W365 HydrophobicContact CB-CD2 3.52Å; P361-W365 HydrophobicContact CB-CE3 3.08Å; P361-W365 HydrophobicContact CB-CG 3.87Å; P361-W365 HydrophobicContact CB-CZ3 3.8Å; P361-W365 HydrophobicContact CG-CD2 4.22Å; P361-W365 HydrophobicContact CG-CE3 3.28Å; P361-W365 HydrophobicContact CG-CZ3 3.61Å; G362-W365 WeakPolarHBondContact O-CB 3.47Å; G362-W365 PolarHBondContact O-N 3.29Å; A363-W365 VanDerWaalsContact C-N 3.32Å; A363-W365 PolarHBondContact O-N 3.17Å | ||
| 366 | D | 92.5 | Very high | 92.9 | Very high | 59 Ų | 59 | 93.3 Ų | 93.3 | 32% | 0.316 | 49% | 0.491 | S | S | . | . | trans | -88.4 | 0 | -170 | 62.2 | -1.6 | 0 | 0 | 0 | 110.7 | K348 R364 V368 R370 | K348-D366 WeakPolarHBondContact CD-O 3.14Å; K348-D366 PolarHBondContact NZ-O 3.43Å; R364-D366 PolarHBondContact O-N 3.11Å; D366-V368 PolarHBondContact OD1-N 2.81Å; D366-R370 IonicContact OD1-NH1 2.96Å; D366-R370 PolarHBondContact OD1-NH1 3.34Å; D366-R370 IonicContact OD2-CZ 3.75Å; D366-R370 VanDerWaalsContact OD2-CZ 3.24Å; D366-R370 IonicContact OD2-NH1 3.18Å; D366-R370 PolarHBondContact OD2-NH1 3.45Å; D366-R370 IonicContact OD2-NH2 3.24Å; D366-R370 PolarHBondContact OD2-NH2 3.27Å | ||
| 367 | G | 91.7 | Very high | 93 | Very high | 26 Ų | 26 | 94.4 Ų | 94.4 | 27% | 0.268 | 50% | 0.495 | S | S | . | . | S | Bend | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 111.5 | |||
| 368 | V | 91.7 | Very high | 93.1 | Very high | 83 Ų | 83 | 91 Ų | 91 | 50% | 0.503 | 48% | 0.483 | S | S | . | . | 0 | 131.5 | 0 | 176.8 | 0 | 0 | 0 | 0 | 107.8 | D366 R370 | D366-V368 PolarHBondContact OD1-N 2.81Å; V368-R370 PolarHBondContact O-N 2.71Å | |||
| 369 | D | 91.9 | Very high | 93.3 | Very high | 99 Ų | 99 | 89.5 Ų | 89.5 | 53% | 0.529 | 47% | 0.466 | S | S | . | . | trans | -76.3 | 0 | 179.7 | -177.3 | 16.1 | 0 | 0 | 0 | 110.6 | L353 S371 | L353-D369 WeakPolarHBondContact CD1-OD2 3.48Å; D369-S371 VanDerWaalsContact OD1-CB 3.23Å; D369-S371 WeakPolarHBondContact OD1-CB 3.32Å; D369-S371 PolarHBondContact OD1-N 3.32Å; D369-S371 PolarHBondContact OD1-OG 3.39Å; D369-S371 PolarHBondContact OD2-OG 3.45Å | ||
| 370 | R | 93 | Very high | 93.6 | Very high | 182 Ų | 182 | 86.7 Ų | 86.7 | 69% | 0.687 | 46% | 0.456 | S | S | * | . | 0 | 34 | 0 | -60.2 | -179 | 168.1 | 76.2 | 0.2 | 109.6 | D366 V368 | D366-R370 IonicContact OD1-NH1 2.96Å; D366-R370 PolarHBondContact OD1-NH1 3.34Å; D366-R370 IonicContact OD2-CZ 3.75Å; D366-R370 VanDerWaalsContact OD2-CZ 3.24Å; D366-R370 IonicContact OD2-NH1 3.18Å; D366-R370 PolarHBondContact OD2-NH1 3.45Å; D366-R370 IonicContact OD2-NH2 3.24Å; D366-R370 PolarHBondContact OD2-NH2 3.27Å; V368-R370 PolarHBondContact O-N 2.71Å | |||
| 371 | S | 92.2 | Very high | 93.9 | Very high | 60 Ų | 60 | 85 Ų | 85 | 42% | 0.42 | 44% | 0.439 | S | S | . | . | trans | -92.3 | 157.7 | -174.5 | 64.8 | 0 | 0 | 0 | 0 | 110.3 | D369 | D369-S371 VanDerWaalsContact OD1-CB 3.23Å; D369-S371 WeakPolarHBondContact OD1-CB 3.32Å; D369-S371 PolarHBondContact OD1-N 3.32Å; D369-S371 PolarHBondContact OD1-OG 3.39Å; D369-S371 PolarHBondContact OD2-OG 3.45Å | ||
| 372 | N | 94.8 | Very high | 94 | Very high | 146 Ų | 146 | 89.9 Ų | 89.9 | 78% | 0.781 | 46% | 0.457 | S | S | * | . | trans | -83.7 | 0 | 173.5 | 66.1 | 3.9 | 0 | 0 | 0 | 111.3 | F374 | N372-F374 VanDerWaalsContact OD1-CA 3.31Å; N372-F374 WeakPolarHBondContact OD1-CA 3.49Å; N372-F374 WeakPolarHBondContact OD1-CB 3.05Å; N372-F374 PolarHBondContact OD1-N 3.04Å | ||
| 373 | G | 94.2 | Very high | 94.3 | Very high | 22 Ų | 22 | 92.3 Ų | 92.3 | 23% | 0.227 | 46% | 0.458 | C | S | . | . | S | Bend | 0 | 0.9 | 0 | 0 | 0 | 0 | 0 | 0 | 111.3 | E375 T376 R377 | G373-E375 VanDerWaalsContact C-N 3.28Å; G373-E375 PolarHBondContact O-N 3.31Å; G373-T376 VanDerWaalsContact C-OG1 3.27Å; G373-T376 PolarHBondContact O-N 3.06Å; G373-T376 PolarHBondContact O-OG1 3.41Å; G373-R377 PolarHBondContact O-N 3.45Å | |
| 374 | F | 96.3 | Very high | 94.5 | Very high | 107 Ų | 107 | 95.5 Ų | 95.5 | 47% | 0.469 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -60.5 | -41.3 | -176 | 173.4 | -101.7 | 0 | 0 | 0 | 109.4 | N372 T376 R377 L378 | N372-F374 VanDerWaalsContact OD1-CA 3.31Å; N372-F374 WeakPolarHBondContact OD1-CA 3.49Å; N372-F374 WeakPolarHBondContact OD1-CB 3.05Å; N372-F374 PolarHBondContact OD1-N 3.04Å; F374-T376 VanDerWaalsContact C-N 3.3Å; F374-T376 PolarHBondContact O-N 3.27Å; F374-R377 PolarHBondContact O-N 3.43Å; F374-L378 HydrophobicContact CE1-CD2 4.26Å; F374-L378 WeakPolarHBondContact O-CB 3.26Å; F374-L378 PolarHBondContact O-N 3.35Å |
| 375 | E | 95.5 | Very high | 94.8 | Very high | 68 Ų | 68 | 92.2 Ų | 92.2 | 32% | 0.318 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -67 | -38.5 | -176.4 | -69 | -72 | 168.3 | 0 | 0 | 111 | R356 G373 L378 L379 | R356-E375 PolarHBondContact N-OE2 3.37Å; G373-E375 VanDerWaalsContact C-N 3.28Å; G373-E375 PolarHBondContact O-N 3.31Å; E375-L378 PolarHBondContact O-N 3.31Å; E375-L379 PolarHBondContact O-N 3.08Å |
| 376 | T | 94.5 | Very high | 95 | Very high | 76 Ų | 76 | 93.4 Ų | 93.4 | 47% | 0.466 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -65.9 | -45.7 | 177.5 | 57.3 | 0 | 0 | 0 | 0 | 110.7 | G373 F374 L378 L379 S380 | G373-T376 VanDerWaalsContact C-OG1 3.27Å; G373-T376 PolarHBondContact O-N 3.06Å; G373-T376 PolarHBondContact O-OG1 3.41Å; F374-T376 VanDerWaalsContact C-N 3.3Å; F374-T376 PolarHBondContact O-N 3.27Å; T376-L378 PolarHBondContact O-N 3.44Å; T376-L379 PolarHBondContact O-N 3.35Å; T376-S380 PolarHBondContact O-N 3.39Å; T376-S380 PolarHBondContact O-OG 2.5Å |
| 377 | R | 95.6 | Very high | 95.2 | Very high | 166 Ų | 166 | 92.5 Ų | 92.5 | 63% | 0.626 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -61.2 | -41.2 | 179.2 | -177 | 178.1 | 176.2 | 179.4 | -1 | 110.2 | G373 F374 L379 S380 Q381 | G373-R377 PolarHBondContact O-N 3.45Å; F374-R377 PolarHBondContact O-N 3.43Å; R377-L379 VanDerWaalsContact C-N 3.33Å; R377-L379 PolarHBondContact O-N 3.37Å; R377-S380 VanDerWaalsContact C-OG 3.29Å; R377-S380 WeakPolarHBondContact CA-OG 3.39Å; R377-S380 PolarHBondContact O-N 3.03Å; R377-S380 PolarHBondContact O-OG 3.24Å; R377-Q381 WeakPolarHBondContact O-CG 3.45Å; R377-Q381 PolarHBondContact O-N 3.18Å |
| 378 | L | 95.9 | Very high | 95.5 | Very high | 54 Ų | 54 | 97 Ų | 97 | 28% | 0.283 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.4 | -46.8 | -179.3 | -175.9 | 65.1 | 0 | 0 | 0 | 110.5 | F374 E375 T376 S380 Q381 K382 | F374-L378 HydrophobicContact CE1-CD2 4.26Å; F374-L378 WeakPolarHBondContact O-CB 3.26Å; F374-L378 PolarHBondContact O-N 3.35Å; E375-L378 PolarHBondContact O-N 3.31Å; T376-L378 PolarHBondContact O-N 3.44Å; L378-S380 VanDerWaalsContact C-N 3.31Å; L378-S380 PolarHBondContact O-N 2.94Å; L378-Q381 PolarHBondContact O-N 3.35Å; L378-K382 PolarHBondContact O-N 3.47Å |
| 379 | L | 94.6 | Very high | 95.7 | Very high | 73 Ų | 73 | 100.1 Ų | 100.1 | 38% | 0.382 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.4 | -40.4 | 178.8 | -153.6 | 57.4 | 0 | 0 | 0 | 111.5 | P354 E375 T376 R377 Q381 K382 N383 | P354-L379 HydrophobicContact CG-CD2 4.02Å; E375-L379 PolarHBondContact O-N 3.08Å; T376-L379 PolarHBondContact O-N 3.35Å; R377-L379 VanDerWaalsContact C-N 3.33Å; R377-L379 PolarHBondContact O-N 3.37Å; L379-Q381 VanDerWaalsContact C-N 3.33Å; L379-K382 PolarHBondContact O-N 3.12Å; L379-N383 VanDerWaalsContact O-CG 3.24Å; L379-N383 PolarHBondContact O-N 3.23Å; L379-N383 PolarHBondContact O-ND2 3.49Å |
| 380 | S | 95.9 | Very high | 95.9 | Very high | 52 Ų | 52 | 100 Ų | 100 | 36% | 0.364 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.4 | -43.1 | 177.8 | 68 | 0 | 0 | 0 | 0 | 111 | T376 R377 L378 K382 N383 L384 | T376-S380 PolarHBondContact O-N 3.39Å; T376-S380 PolarHBondContact O-OG 2.5Å; R377-S380 VanDerWaalsContact C-OG 3.29Å; R377-S380 WeakPolarHBondContact CA-OG 3.39Å; R377-S380 PolarHBondContact O-N 3.03Å; R377-S380 PolarHBondContact O-OG 3.24Å; L378-S380 VanDerWaalsContact C-N 3.31Å; L378-S380 PolarHBondContact O-N 2.94Å; S380-K382 VanDerWaalsContact C-N 3.33Å; S380-N383 WeakPolarHBondContact O-CB 3.43Å; S380-N383 PolarHBondContact O-N 3.26Å; S380-L384 WeakPolarHBondContact O-CB 3.33Å; S380-L384 WeakPolarHBondContact O-CG 3.32Å; S380-L384 PolarHBondContact O-N 3.48Å |
| 381 | Q | 97.3 | Very high | 96.1 | Very high | 65 Ų | 65 | 96.1 Ų | 96.1 | 30% | 0.304 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.4 | -47.1 | 179.1 | -77.3 | -178.1 | -0.4 | 0 | 0 | 110.3 | R377 L378 L379 N383 L384 R385 | R377-Q381 WeakPolarHBondContact O-CG 3.45Å; R377-Q381 PolarHBondContact O-N 3.18Å; L378-Q381 PolarHBondContact O-N 3.35Å; L379-Q381 VanDerWaalsContact C-N 3.33Å; Q381-N383 PolarHBondContact O-N 3.31Å; Q381-L384 WeakPolarHBondContact O-CB 3.16Å; Q381-L384 PolarHBondContact O-N 3.28Å; Q381-L384 VanDerWaalsContact O-N 3.13Å; Q381-R385 WeakPolarHBondContact O-CG 3.1Å; Q381-R385 PolarHBondContact O-N 2.09Å |
| 382 | K | 96.6 | Very high | 96.2 | Very high | 139 Ų | 139 | 100.6 Ų | 100.6 | 60% | 0.604 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -54.6 | -44.7 | 176.1 | -172.3 | 176.7 | 177 | 178.8 | 0 | 111.6 | L378 L379 S380 L384 R385 Q386 | L378-K382 PolarHBondContact O-N 3.47Å; L379-K382 PolarHBondContact O-N 3.12Å; S380-K382 VanDerWaalsContact C-N 3.33Å; K382-L384 PolarHBondContact O-N 2.72Å; K382-R385 PolarHBondContact O-N 3.38Å; K382-Q386 PolarHBondContact O-N 3.45Å |
| 383 | N | 96.8 | Very high | 96.2 | Very high | 101 Ų | 101 | 101.8 Ų | 101.8 | 54% | 0.54 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.8 | -39 | 178.1 | -71.4 | -14.6 | 0 | 0 | 0 | 111.7 | L379 S380 Q381 R385 Q386 A387 | L379-N383 VanDerWaalsContact O-CG 3.24Å; L379-N383 PolarHBondContact O-N 3.23Å; L379-N383 PolarHBondContact O-ND2 3.49Å; S380-N383 WeakPolarHBondContact O-CB 3.43Å; S380-N383 PolarHBondContact O-N 3.26Å; Q381-N383 PolarHBondContact O-N 3.31Å; N383-R385 VanDerWaalsContact C-N 3.27Å; N383-R385 PolarHBondContact O-N 2.87Å; N383-Q386 PolarHBondContact O-N 3.29Å; N383-A387 WeakPolarHBondContact O-CB 2.8Å; N383-A387 PolarHBondContact O-N 2.7Å |
| 384 | L | 97.9 | Very high | 96.3 | Very high | 105 Ų | 105 | 105.7 Ų | 105.7 | 55% | 0.55 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.5 | -44.3 | 179.1 | -75.2 | 177.1 | 0 | 0 | 0 | 110.3 | S380 Q381 K382 Q386 A387 E388 | S380-L384 WeakPolarHBondContact O-CB 3.33Å; S380-L384 WeakPolarHBondContact O-CG 3.32Å; S380-L384 PolarHBondContact O-N 3.48Å; Q381-L384 WeakPolarHBondContact O-CB 3.16Å; Q381-L384 PolarHBondContact O-N 3.28Å; Q381-L384 VanDerWaalsContact O-N 3.13Å; K382-L384 PolarHBondContact O-N 2.72Å; L384-Q386 PolarHBondContact O-N 3.42Å; L384-A387 PolarHBondContact O-N 3.24Å; L384-E388 VanDerWaalsContact O-CG 3.32Å; L384-E388 WeakPolarHBondContact O-CG 3.41Å; L384-E388 PolarHBondContact O-N 3.48Å |
| 385 | R | 97.7 | Very high | 96.3 | Very high | 176 Ų | 176 | 109.2 Ų | 109.2 | 66% | 0.664 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -60.8 | -44 | 179.4 | -78.3 | -177 | -175 | 164.8 | 1.1 | 110.5 | Q381 K382 N383 A387 E388 K389 | Q381-R385 WeakPolarHBondContact O-CG 3.1Å; Q381-R385 PolarHBondContact O-N 2.09Å; K382-R385 PolarHBondContact O-N 3.38Å; N383-R385 VanDerWaalsContact C-N 3.27Å; N383-R385 PolarHBondContact O-N 2.87Å; R385-A387 VanDerWaalsContact C-N 3.25Å; R385-A387 PolarHBondContact O-N 3.35Å; R385-E388 PolarHBondContact O-N 3.21Å; R385-K389 WeakPolarHBondContact O-CB 3.37Å; R385-K389 PolarHBondContact O-N 3.13Å |
| 386 | Q | 97.8 | Very high | 96.2 | Very high | 103 Ų | 103 | 109.1 Ų | 109.1 | 48% | 0.481 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.5 | -40.3 | 176.9 | -174.7 | 66.8 | 10.1 | 0 | 0 | 111.6 | K382 N383 L384 E388 K389 E390 | K382-Q386 PolarHBondContact O-N 3.45Å; N383-Q386 PolarHBondContact O-N 3.29Å; L384-Q386 PolarHBondContact O-N 3.42Å; Q386-E388 VanDerWaalsContact C-N 3.34Å; Q386-K389 PolarHBondContact O-N 2.92Å; Q386-E390 WeakPolarHBondContact O-CG 3.25Å; Q386-E390 PolarHBondContact O-N 3.04Å; Q386-E390 VanDerWaalsContact O-N 3.11Å |
| 387 | A | 97.4 | Very high | 96.2 | Very high | 40 Ų | 40 | 108.2 Ų | 108.2 | 33% | 0.331 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.5 | -42.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | N383 L384 R385 K389 E390 E391 | N383-A387 WeakPolarHBondContact O-CB 2.8Å; N383-A387 PolarHBondContact O-N 2.7Å; L384-A387 PolarHBondContact O-N 3.24Å; R385-A387 VanDerWaalsContact C-N 3.25Å; R385-A387 PolarHBondContact O-N 3.35Å; A387-K389 VanDerWaalsContact C-N 3.32Å; A387-E390 PolarHBondContact O-N 3.08Å; A387-E391 VanDerWaalsContact O-CG 3.26Å; A387-E391 WeakPolarHBondContact O-CG 3.48Å; A387-E391 PolarHBondContact O-N 3.35Å |
| 388 | E | 97.2 | Very high | 95.9 | Very high | 121 Ų | 121 | 103.4 Ų | 103.4 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.9 | -43 | 179.7 | -75.3 | 177.4 | 174.2 | 0 | 0 | 110.4 | L384 R385 Q386 E390 E391 Y392 | L384-E388 VanDerWaalsContact O-CG 3.32Å; L384-E388 WeakPolarHBondContact O-CG 3.41Å; L384-E388 PolarHBondContact O-N 3.48Å; R385-E388 PolarHBondContact O-N 3.21Å; Q386-E388 VanDerWaalsContact C-N 3.34Å; E388-E390 PolarHBondContact O-N 2.97Å; E388-E391 CarbonylContact O-C 3.59Å; E388-E391 WeakPolarHBondContact O-CB 3.5Å; E388-E391 PolarHBondContact O-N 3.45Å; E388-E391 VanDerWaalsContact O-N 3.17Å; E388-Y392 WeakPolarHBondContact O-CB 3.44Å; E388-Y392 PolarHBondContact O-N 3.31Å |
| 389 | K | 97.2 | Very high | 95.4 | Very high | 147 Ų | 147 | 105.1 Ų | 105.1 | 64% | 0.639 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -56.7 | -43.8 | 177.1 | -171.5 | 176.9 | 176.8 | 177.7 | 0 | 111.2 | R385 Q386 A387 E391 Y392 Y393 | R385-K389 WeakPolarHBondContact O-CB 3.37Å; R385-K389 PolarHBondContact O-N 3.13Å; Q386-K389 PolarHBondContact O-N 2.92Å; A387-K389 VanDerWaalsContact C-N 3.32Å; K389-E391 PolarHBondContact O-N 2.84Å; K389-Y392 PolarHBondContact O-N 3.42Å; K389-Y393 WeakPolarHBondContact O-CB 2.45Å; K389-Y393 PolarHBondContact O-N 3.29Å |
| 390 | E | 96.3 | Very high | 94.4 | Very high | 98 Ų | 98 | 108 Ų | 108 | 46% | 0.458 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65 | -41.2 | 178.4 | -71 | 177.2 | -179.3 | 0 | 0 | 111.4 | Q386 A387 E388 Y392 Y393 K394 | Q386-E390 WeakPolarHBondContact O-CG 3.25Å; Q386-E390 PolarHBondContact O-N 3.04Å; Q386-E390 VanDerWaalsContact O-N 3.11Å; A387-E390 PolarHBondContact O-N 3.08Å; E388-E390 PolarHBondContact O-N 2.97Å; E390-Y392 PolarHBondContact O-N 3.42Å; E390-Y393 WeakPolarHBondContact O-CB 3.25Å; E390-Y393 PolarHBondContact O-N 2.93Å; E390-K394 WeakPolarHBondContact O-CB 3.32Å; E390-K394 VanDerWaalsContact O-CG 3.25Å; E390-K394 WeakPolarHBondContact O-CG 3.37Å; E390-K394 PolarHBondContact O-N 2.96Å |
| 391 | E | 95.7 | Very high | 93.3 | Very high | 99 Ų | 99 | 117.3 Ų | 117.3 | 46% | 0.463 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -63.3 | -45.3 | 178.6 | -75.8 | -174.7 | 173.7 | 0 | 0 | 110.7 | A387 E388 K389 Y393 K394 W395 | A387-E391 VanDerWaalsContact O-CG 3.26Å; A387-E391 WeakPolarHBondContact O-CG 3.48Å; A387-E391 PolarHBondContact O-N 3.35Å; E388-E391 CarbonylContact O-C 3.59Å; E388-E391 WeakPolarHBondContact O-CB 3.5Å; E388-E391 PolarHBondContact O-N 3.45Å; E388-E391 VanDerWaalsContact O-N 3.17Å; K389-E391 PolarHBondContact O-N 2.84Å; E391-Y393 PolarHBondContact O-N 3.19Å; E391-K394 PolarHBondContact O-N 3.49Å; E391-W395 WeakPolarHBondContact O-CB 3.35Å; E391-W395 PolarHBondContact O-N 3.36Å |
| 392 | Y | 95.5 | Very high | 93.1 | Very high | 155 Ų | 155 | 119.9 Ų | 119.9 | 61% | 0.608 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -58.6 | -46.5 | 179.8 | 176.7 | -102.3 | 0 | 0 | 0 | 110 | E388 K389 E390 K394 W395 A396 | E388-Y392 WeakPolarHBondContact O-CB 3.44Å; E388-Y392 PolarHBondContact O-N 3.31Å; K389-Y392 PolarHBondContact O-N 3.42Å; E390-Y392 PolarHBondContact O-N 3.42Å; Y392-K394 VanDerWaalsContact C-N 3.29Å; Y392-K394 PolarHBondContact O-N 3.34Å; Y392-W395 HydrophobicContact CD2-CE3 4.34Å; Y392-W395 HydrophobicContact CE2-CE3 4.33Å; Y392-W395 HydrophobicContact CE2-CZ3 4.47Å; Y392-W395 CarbonylContact O-C 3.54Å; Y392-W395 WeakPolarHBondContact O-CB 3.38Å; Y392-W395 PolarHBondContact O-N 3.45Å; Y392-W395 VanDerWaalsContact O-N 3.13Å; Y392-A396 VanDerWaalsContact O-CB 3.32Å; Y392-A396 WeakPolarHBondContact O-CB 3.36Å; Y392-A396 PolarHBondContact O-N 3.32Å |
| 393 | Y | 95.3 | Very high | 92.9 | Very high | 170 Ų | 170 | 118.9 Ų | 118.9 | 67% | 0.667 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -56 | -48.9 | 177.5 | 178.9 | -102.4 | 0 | 0 | 0 | 111.2 | K389 E390 E391 W395 A396 A397 | K389-Y393 WeakPolarHBondContact O-CB 2.45Å; K389-Y393 PolarHBondContact O-N 3.29Å; E390-Y393 WeakPolarHBondContact O-CB 3.25Å; E390-Y393 PolarHBondContact O-N 2.93Å; E391-Y393 PolarHBondContact O-N 3.19Å; Y393-W395 PolarHBondContact O-N 3.36Å; Y393-A396 PolarHBondContact O-N 3.2Å; Y393-A397 WeakPolarHBondContact O-CB 3.39Å; Y393-A397 PolarHBondContact O-N 3.48Å |
| 394 | K | 96.3 | Very high | 92.7 | Very high | 105 Ų | 105 | 119.9 Ų | 119.9 | 46% | 0.457 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -62.1 | 0 | 179.4 | -71.1 | -179.7 | -177.7 | 178 | 0 | 111.2 | E390 E391 Y392 G398 T399 Y400 | E390-K394 WeakPolarHBondContact O-CB 3.32Å; E390-K394 VanDerWaalsContact O-CG 3.25Å; E390-K394 WeakPolarHBondContact O-CG 3.37Å; E390-K394 PolarHBondContact O-N 2.96Å; E391-K394 PolarHBondContact O-N 3.49Å; Y392-K394 VanDerWaalsContact C-N 3.29Å; Y392-K394 PolarHBondContact O-N 3.34Å; K394-G398 PolarHBondContact O-N 3.2Å; K394-T399 PolarHBondContact O-N 3.38Å; K394-T399 VanDerWaalsContact O-N 3.08Å; K394-T399 PolarHBondContact O-OG1 3.16Å; K394-Y400 HydrophobicContact CB-CD2 3.94Å; K394-Y400 PolarHBondContact O-N 2.98Å |
| 395 | W | 94.8 | Very high | 92.4 | Very high | 181 Ų | 181 | 120.8 Ų | 120.8 | 69% | 0.686 | 58% | 0.584 | S | S | * | * | H | α-helix | 0 | -41.6 | 0 | -173.3 | 68 | 0 | 0 | 0 | 110.1 | E391 Y392 Y393 A397 G398 | E391-W395 WeakPolarHBondContact O-CB 3.35Å; E391-W395 PolarHBondContact O-N 3.36Å; Y392-W395 HydrophobicContact CD2-CE3 4.34Å; Y392-W395 HydrophobicContact CE2-CE3 4.33Å; Y392-W395 HydrophobicContact CE2-CZ3 4.47Å; Y392-W395 CarbonylContact O-C 3.54Å; Y392-W395 WeakPolarHBondContact O-CB 3.38Å; Y392-W395 PolarHBondContact O-N 3.45Å; Y392-W395 VanDerWaalsContact O-N 3.13Å; Y393-W395 PolarHBondContact O-N 3.36Å; W395-A397 PolarHBondContact O-N 3.5Å; W395-G398 PolarHBondContact O-N 3.49Å | |
| 396 | A | 93.8 | Very high | 92 | Very high | 66 Ų | 66 | 117.3 Ų | 117.3 | 55% | 0.545 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -70.3 | -36.9 | -177.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | Y392 Y393 G398 | Y392-A396 VanDerWaalsContact O-CB 3.32Å; Y392-A396 WeakPolarHBondContact O-CB 3.36Å; Y392-A396 PolarHBondContact O-N 3.32Å; Y393-A396 PolarHBondContact O-N 3.2Å; A396-G398 PolarHBondContact O-N 3.26Å |
| 397 | A | 94.4 | Very high | 91.6 | Very high | 57 Ų | 57 | 118.3 Ų | 118.3 | 47% | 0.471 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -79 | 0 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y393 W395 T399 | Y393-A397 WeakPolarHBondContact O-CB 3.39Å; Y393-A397 PolarHBondContact O-N 3.48Å; W395-A397 PolarHBondContact O-N 3.5Å; A397-T399 HydrophobicContact CB-CG2 4.27Å; A397-T399 PolarHBondContact O-N 3.2Å |
| 398 | G | 89 | Confident | 91.2 | Very high | 64 Ų | 64 | 123.9 Ų | 123.9 | 66% | 0.66 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | 0 | 8.7 | 0 | 0 | 0 | 0 | 0 | 0 | 112.3 | K394 W395 A396 Y400 | K394-G398 PolarHBondContact O-N 3.2Å; W395-G398 PolarHBondContact O-N 3.49Å; A396-G398 PolarHBondContact O-N 3.26Å; G398-Y400 PolarHBondContact O-N 3.13Å | |
| 399 | T | 84.9 | Confident | 90.8 | Very high | 91 Ų | 91 | 124.1 Ų | 124.1 | 56% | 0.558 | 61% | 0.607 | S | S | * | * | trans | -93.3 | 19.7 | -179 | 53.4 | 0 | 0 | 0 | 0 | 109.9 | K394 A397 E401 | K394-T399 PolarHBondContact O-N 3.38Å; K394-T399 VanDerWaalsContact O-N 3.08Å; K394-T399 PolarHBondContact O-OG1 3.16Å; A397-T399 HydrophobicContact CB-CG2 4.27Å; A397-T399 PolarHBondContact O-N 3.2Å; T399-E401 PolarHBondContact O-N 3.44Å | ||
| 400 | Y | 75.6 | Confident | 90.2 | Very high | 133 Ų | 133 | 122.2 Ų | 122.2 | 52% | 0.522 | 60% | 0.604 | S | S | . | * | trans | -84.3 | 92.9 | -177.1 | -164.7 | -107.1 | 0 | 0 | 0 | 109.6 | K394 G398 | K394-Y400 HydrophobicContact CB-CD2 3.94Å; K394-Y400 PolarHBondContact O-N 2.98Å; G398-Y400 PolarHBondContact O-N 3.13Å | ||
| 401 | E | 71 | Confident | 89.7 | Confident | 247 Ų | 247 | 124.4 Ų | 124.4 | 100% | 1.154 | 62% | 0.617 | S | S | * | * | trans | -56.8 | 0 | 178.6 | -70.3 | -174.5 | 175.2 | 0 | 0 | 110.8 | T399 | T399-E401 PolarHBondContact O-N 3.44Š|
Retrieved 401 of 401 residues in 614.4 ms
(Link to these results)