| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 36.8 | Very low | 43.7 | Very low | 250 Ų | 250 | 162 Ų | 162 | 100% | 1.232 | 87% | 0.873 | S | S | * | * | 0 | 113.8 | 0 | -73.7 | -166.1 | -90.7 | 0 | 0 | 107.8 | |||||
| 2 | S | 38.8 | Very low | 44 | Very low | 127 Ų | 127 | 160.8 Ų | 160.8 | 89% | 0.888 | 87% | 0.866 | S | S | * | * | trans | -100.4 | 124 | -173.7 | -170.5 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 3 | A | 46.4 | Very low | 43.8 | Very low | 92 Ų | 92 | 160.4 Ų | 160.4 | 76% | 0.76 | 86% | 0.862 | S | S | * | * | trans | -82.2 | 136.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 4 | K | 47.7 | Very low | 43.7 | Very low | 205 Ų | 205 | 160.9 Ų | 160.9 | 89% | 0.891 | 85% | 0.852 | S | S | * | * | trans | -135.2 | 108.8 | 164.1 | -106.1 | -178.1 | 177.6 | 177 | 0 | 109.8 | ||||
| 5 | N | 45.2 | Very low | 44 | Very low | 161 Ų | 161 | 164.1 Ų | 164.1 | 86% | 0.861 | 86% | 0.856 | S | S | * | * | trans | -66.4 | 142.6 | 158.8 | -68 | -37.9 | 0 | 0 | 0 | 109.1 | ||||
| 6 | A | 48.2 | Very low | 44.1 | Very low | 102 Ų | 102 | 161.4 Ų | 161.4 | 84% | 0.843 | 84% | 0.843 | S | S | * | * | trans | -144.7 | 126.5 | 161.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 7 | E | 43.9 | Very low | 43.9 | Very low | 173 Ų | 173 | 163.8 Ų | 163.8 | 81% | 0.808 | 84% | 0.84 | S | S | * | * | trans | -76.7 | 153.6 | -163.3 | -63 | 163.2 | 120.9 | 0 | 0 | 114 | K9 | E7-K9 PolarHBondContact O-N 3.24Š| ||
| 8 | L | 43.7 | Very low | 44.1 | Very low | 161 Ų | 161 | 165.4 Ų | 165.4 | 84% | 0.843 | 84% | 0.84 | S | S | * | * | trans | -57.9 | 118.8 | 160 | -170.5 | 89.9 | 0 | 0 | 0 | 110.8 | ||||
| 9 | K | 44.6 | Very low | 44.4 | Very low | 191 Ų | 191 | 161.3 Ų | 161.3 | 83% | 0.83 | 83% | 0.834 | S | S | * | * | trans | -127.3 | 111.5 | 158.3 | -82 | -172.8 | 177.8 | 178.1 | 0 | 111.1 | E7 | E7-K9 PolarHBondContact O-N 3.24Š| ||
| 10 | K | 46.3 | Very low | 44.3 | Very low | 178 Ų | 178 | 158.8 Ų | 158.8 | 77% | 0.774 | 83% | 0.825 | S | S | * | * | trans | -59.5 | 134.1 | 165.4 | -83 | 174.1 | 170.8 | 174.1 | 0 | 110.4 | ||||
| 11 | T | 39.7 | Very low | 44.5 | Very low | 142 Ų | 142 | 157.5 Ų | 157.5 | 87% | 0.871 | 83% | 0.829 | S | S | * | * | trans | -140 | 101.6 | 142.7 | 40.1 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 12 | N | 47 | Very low | 44.8 | Very low | 147 Ų | 147 | 152.9 Ų | 152.9 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | trans | -59 | 143.9 | 149.4 | -86.6 | -96 | 0 | 0 | 0 | 107.4 | ||||
| 13 | L | 41.4 | Very low | 44.8 | Very low | 156 Ų | 156 | 154.9 Ų | 154.9 | 82% | 0.817 | 80% | 0.801 | S | S | * | * | 168 | 110.6 | 121.8 | -164.7 | 62.4 | 0 | 0 | 0 | 111.3 | |||||
| 14 | K | 41.8 | Very low | 44.6 | Very low | 167 Ų | 167 | 156.7 Ų | 156.7 | 73% | 0.726 | 81% | 0.805 | S | S | * | * | trans | 68.3 | 95.1 | 136 | -150.9 | 173.5 | -169.3 | -178.5 | 0 | 118.2 | N16 | K14-N16 PolarHBondContact O-N 3.4Å; K14-N16 VanDerWaalsContact O-N 3.12Å | ||
| 15 | K | 48.8 | Very low | 43.9 | Very low | 209 Ų | 209 | 156.1 Ų | 156.1 | 91% | 0.909 | 80% | 0.803 | S | S | * | * | trans | -60.1 | 106.3 | 157.4 | -63.7 | 175.4 | -179.7 | 177.8 | 0 | 108.8 | ||||
| 16 | N | 45.2 | Very low | 43.9 | Very low | 122 Ų | 122 | 156.6 Ų | 156.6 | 65% | 0.652 | 80% | 0.804 | S | S | * | * | trans | -97.5 | 93.8 | 169.9 | -142.3 | -36.6 | 0 | 0 | 0 | 107.2 | K14 | K14-N16 PolarHBondContact O-N 3.4Å; K14-N16 VanDerWaalsContact O-N 3.12Å | ||
| 17 | Y | 41.3 | Very low | 43.9 | Very low | 202 Ų | 202 | 157.4 Ų | 157.4 | 79% | 0.792 | 80% | 0.799 | S | S | * | * | trans | -60 | 141 | 156.5 | 69.2 | -80.1 | 0 | 0 | 0 | 106.1 | ||||
| 18 | K | 47.4 | Very low | 43.7 | Very low | 193 Ų | 193 | 157.7 Ų | 157.7 | 84% | 0.839 | 80% | 0.8 | S | S | * | * | trans | 93.6 | 65.3 | -173.3 | -156.8 | -178.1 | -171.2 | 178.3 | 0 | 114.5 | ||||
| 19 | A | 49.6 | Very low | 43.9 | Very low | 87 Ų | 87 | 158.3 Ų | 158.3 | 72% | 0.719 | 80% | 0.803 | S | S | * | * | trans | -145.2 | 137 | 140.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 20 | V | 41.4 | Very low | 43.7 | Very low | 110 Ų | 110 | 158.9 Ų | 158.9 | 67% | 0.667 | 80% | 0.801 | S | S | * | * | trans | 86.3 | 56.8 | 164.7 | -157.3 | 0 | 0 | 0 | 0 | 114.7 | M22 | V20-M22 HydrophobicContact CB-CG 4.4Å; V20-M22 HydrophobicContact CG1-CB 3.9Å; V20-M22 HydrophobicContact CG1-CE 4.21Å; V20-M22 HydrophobicContact CG1-CG 3.11Å; V20-M22 PolarHBondContact O-N 3.01Å; V20-M22 VanDerWaalsContact O-N 3.16Å | ||
| 21 | C | 49.3 | Very low | 43.5 | Very low | 132 Ų | 132 | 157.1 Ų | 157.1 | 89% | 0.892 | 80% | 0.8 | S | S | * | * | trans | -65.6 | 94.8 | 135.6 | -173.2 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 22 | M | 42.5 | Very low | 43.6 | Very low | 153 Ų | 153 | 157.7 Ų | 157.7 | 75% | 0.754 | 79% | 0.791 | S | S | * | * | trans | -101.5 | 115.4 | 165.7 | -77 | -84 | 177.6 | 0 | 0 | 106.8 | V20 | V20-M22 HydrophobicContact CB-CG 4.4Å; V20-M22 HydrophobicContact CG1-CB 3.9Å; V20-M22 HydrophobicContact CG1-CE 4.21Å; V20-M22 HydrophobicContact CG1-CG 3.11Å; V20-M22 PolarHBondContact O-N 3.01Å; V20-M22 VanDerWaalsContact O-N 3.16Å | ||
| 23 | E | 38.8 | Very low | 43.8 | Very low | 170 Ų | 170 | 159.9 Ų | 159.9 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | -47.3 | 130.8 | 169.1 | -59.9 | 178.3 | 156.6 | 0 | 0 | 110.3 | K25 | E23-K25 PolarHBondContact O-N 3.08Š| ||
| 24 | P | 42.6 | Very low | 44 | Very low | 130 Ų | 130 | 156 Ų | 156 | 84% | 0.844 | 79% | 0.791 | S | S | * | * | trans | -74 | 103.9 | 172 | 2.7 | 12 | 0 | 0 | 0 | 108.4 | L26 | P24-L26 PolarHBondContact O-N 3.47Š| ||
| 25 | K | 34.3 | Very low | 44.1 | Very low | 192 Ų | 192 | 157 Ų | 157 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | -58.4 | 122.5 | 162.7 | -89.5 | 177.2 | 178.9 | 169.1 | 0 | 109.1 | E23 T27 | E23-K25 PolarHBondContact O-N 3.08Å; K25-T27 VanDerWaalsContact C-N 3.31Å; K25-T27 PolarHBondContact O-N 2.91Å | ||
| 26 | L | 43.3 | Very low | 44.4 | Very low | 171 Ų | 171 | 153.4 Ų | 153.4 | 90% | 0.895 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -67 | 76.5 | 178.9 | -165.5 | 134.9 | 0 | 0 | 0 | 110.7 | P24 | P24-L26 PolarHBondContact O-N 3.47Š|
| 27 | T | 49.3 | Very low | 44.8 | Very low | 120 Ų | 120 | 155.3 Ų | 155.3 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | trans | -163 | 82.1 | 168.1 | 34 | 0 | 0 | 0 | 0 | 111.9 | K25 | K25-T27 VanDerWaalsContact C-N 3.31Å; K25-T27 PolarHBondContact O-N 2.91Å | ||
| 28 | Q | 38.8 | Very low | 44.9 | Very low | 178 Ų | 178 | 153.9 Ų | 153.9 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | trans | -168.2 | 95.8 | 140.7 | -110 | 170.7 | 78.3 | 0 | 0 | 109.3 | Y30 | Q28-Y30 VanDerWaalsContact C-N 3.31Å; Q28-Y30 PolarHBondContact O-N 3.36Å | ||
| 29 | I | 49.1 | Very low | 44.9 | Very low | 175 Ų | 175 | 146.8 Ų | 146.8 | 90% | 0.897 | 77% | 0.767 | S | S | * | * | trans | -65.1 | 98 | 161.3 | -64.8 | 168.9 | 0 | 0 | 0 | 105.2 | ||||
| 30 | Y | 39.3 | Very low | 44.9 | Very low | 203 Ų | 203 | 147.6 Ų | 147.6 | 80% | 0.796 | 76% | 0.759 | S | S | * | * | trans | -89.7 | 124.4 | 172.2 | -158.1 | -95.1 | 0 | 0 | 0 | 108.5 | Q28 F32 | Q28-Y30 VanDerWaalsContact C-N 3.31Å; Q28-Y30 PolarHBondContact O-N 3.36Å; Y30-F32 PolarHBondContact O-N 3.3Å; Y30-F32 VanDerWaalsContact O-N 3.09Å | ||
| 31 | D | 42 | Very low | 45.3 | Very low | 141 Ų | 141 | 148.5 Ų | 148.5 | 75% | 0.754 | 76% | 0.759 | S | S | * | * | trans | -61.9 | 103.5 | -168.3 | -123.5 | -31 | 0 | 0 | 0 | 112.5 | K33 | D31-K33 PolarHBondContact O-N 3.08Š| ||
| 32 | F | 43 | Very low | 45.3 | Very low | 154 Ų | 154 | 148.4 Ų | 148.4 | 68% | 0.675 | 75% | 0.748 | S | S | * | * | trans | -93.2 | 57 | 179.5 | -172.3 | -105.1 | 0 | 0 | 0 | 111.7 | Y30 K36 | Y30-F32 PolarHBondContact O-N 3.3Å; Y30-F32 VanDerWaalsContact O-N 3.09Å; F32-K36 HydrophobicContact CE1-CD 4.49Å; F32-K36 HydrophobicContact CE1-CG 4.47Å | ||
| 33 | K | 50.3 | Low | 45.9 | Very low | 193 Ų | 193 | 149.8 Ų | 149.8 | 84% | 0.839 | 75% | 0.745 | S | S | * | * | trans | -123.7 | 10.6 | -175.9 | -139.5 | 174.9 | -178.5 | -176.7 | 0 | 117.1 | D31 | D31-K33 PolarHBondContact O-N 3.08Š| ||
| 34 | G | 47 | Very low | 46.6 | Very low | 73 Ų | 73 | 147.9 Ų | 147.9 | 75% | 0.753 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -123.5 | -1.6 | -174.2 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||
| 35 | F | 43.6 | Very low | 47.4 | Very low | 189 Ų | 189 | 143.4 Ų | 143.4 | 83% | 0.829 | 71% | 0.712 | S | S | * | * | trans | -127.4 | 34.6 | -164 | -118.1 | -85.6 | 0 | 0 | 0 | 114.9 | ||||
| 36 | K | 55.2 | Low | 48.5 | Very low | 134 Ų | 134 | 140.8 Ų | 140.8 | 58% | 0.583 | 70% | 0.704 | S | S | * | * | trans | -100.2 | -2.9 | -162.1 | -89 | -169 | 178.3 | -177.2 | 0 | 118.9 | F32 | F32-K36 HydrophobicContact CE1-CD 4.49Å; F32-K36 HydrophobicContact CE1-CG 4.47Å | ||
| 37 | Q | 52.1 | Low | 49.8 | Very low | 161 Ų | 161 | 136.7 Ų | 136.7 | 75% | 0.752 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -117.1 | -43.5 | -172.2 | -148.1 | 158.9 | 6.2 | 0 | 0 | 116 | ||
| 38 | E | 43.1 | Very low | 51.3 | Low | 173 Ų | 173 | 138.9 Ų | 138.9 | 81% | 0.808 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -73.1 | -42.3 | 179.8 | -124.4 | 78.4 | -156.4 | 0 | 0 | 113.4 | L40 | E38-L40 PolarHBondContact O-N 2.91Å |
| 39 | G | 48.1 | Very low | 53.3 | Low | 44 Ų | 44 | 136.2 Ų | 136.2 | 45% | 0.454 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -79.1 | -15.7 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | R43 | G39-R43 WeakPolarHBondContact O-CB 3.34Å; G39-R43 PolarHBondContact O-N 2.93Å |
| 40 | L | 50.8 | Low | 54.9 | Low | 104 Ų | 104 | 133.3 Ų | 133.3 | 55% | 0.545 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -77.1 | -30.4 | -175.9 | -147.4 | 90.7 | 0 | 0 | 0 | 112.1 | E38 K44 | E38-L40 PolarHBondContact O-N 2.91Å; L40-K44 WeakPolarHBondContact O-CB 3.22Å; L40-K44 PolarHBondContact O-N 3.05Å |
| 41 | L | 48.6 | Very low | 57.1 | Low | 128 Ų | 128 | 131 Ų | 131 | 67% | 0.67 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -74.5 | -41.6 | 179 | -75.5 | 166.5 | 0 | 0 | 0 | 111.8 | R43 K44 G45 | L41-R43 VanDerWaalsContact C-N 3.32Å; L41-R43 PolarHBondContact O-N 3.46Å; L41-K44 PolarHBondContact O-N 3.19Å; L41-G45 PolarHBondContact O-N 3Å; L41-G45 VanDerWaalsContact O-N 3.09Å |
| 42 | I | 50.2 | Low | 59.4 | Low | 131 Ų | 131 | 128.1 Ų | 128.1 | 67% | 0.672 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -64.2 | -40.2 | 173.3 | -57.9 | 178.6 | 0 | 0 | 0 | 110.2 | K44 G45 M46 | I42-K44 PolarHBondContact O-N 3.2Å; I42-G45 PolarHBondContact O-N 2.73Å; I42-M46 WeakPolarHBondContact O-CB 3.35Å; I42-M46 PolarHBondContact O-N 3.13Å |
| 43 | R | 54.8 | Low | 61.7 | Low | 182 Ų | 182 | 125.5 Ų | 125.5 | 69% | 0.687 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -64.3 | -38.3 | 176 | -165 | 174.1 | -174.6 | 171.8 | 1.9 | 112.8 | G39 L41 T47 | G39-R43 WeakPolarHBondContact O-CB 3.34Å; G39-R43 PolarHBondContact O-N 2.93Å; L41-R43 VanDerWaalsContact C-N 3.32Å; L41-R43 PolarHBondContact O-N 3.46Å; R43-T47 WeakPolarHBondContact O-CB 3.11Å; R43-T47 PolarHBondContact O-N 3.3Å; R43-T47 PolarHBondContact O-OG1 2.94Å |
| 44 | K | 53.6 | Low | 63.6 | Low | 129 Ų | 129 | 120.8 Ų | 120.8 | 56% | 0.561 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -73.2 | -31.6 | 179.8 | -160.9 | 174.1 | -174.3 | 177.7 | 0 | 112.6 | L40 L41 I42 R48 | L40-K44 WeakPolarHBondContact O-CB 3.22Å; L40-K44 PolarHBondContact O-N 3.05Å; L41-K44 PolarHBondContact O-N 3.19Å; I42-K44 PolarHBondContact O-N 3.2Å; K44-R48 WeakPolarHBondContact O-CG 3.31Å; K44-R48 PolarHBondContact O-N 3.19Å |
| 45 | G | 59.1 | Low | 65.8 | Low | 37 Ų | 37 | 123.9 Ų | 123.9 | 38% | 0.381 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -66.4 | -51.6 | 169.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L41 I42 T47 R48 E49 | L41-G45 PolarHBondContact O-N 3Å; L41-G45 VanDerWaalsContact O-N 3.09Å; I42-G45 PolarHBondContact O-N 2.73Å; G45-T47 VanDerWaalsContact C-N 3.26Å; G45-T47 PolarHBondContact O-N 3.03Å; G45-R48 PolarHBondContact O-N 3.41Å; G45-E49 PolarHBondContact O-N 3.49Å |
| 46 | M | 58.2 | Low | 68.2 | Low | 136 Ų | 136 | 119.9 Ų | 119.9 | 67% | 0.67 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -60.7 | -32.7 | 178.7 | -167.4 | 168.2 | -170.5 | 0 | 0 | 113 | I42 L50 | I42-M46 WeakPolarHBondContact O-CB 3.35Å; I42-M46 PolarHBondContact O-N 3.13Å; M46-L50 VanDerWaalsContact O-CB 3.28Å; M46-L50 WeakPolarHBondContact O-CB 3.49Å; M46-L50 PolarHBondContact O-N 2.91Å |
| 47 | T | 70.6 | Confident | 70.1 | Confident | 85 Ų | 85 | 117.6 Ų | 117.6 | 52% | 0.521 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -71.7 | -29.7 | 175.8 | -48.3 | 0 | 0 | 0 | 0 | 112.6 | R43 G45 K51 | R43-T47 WeakPolarHBondContact O-CB 3.11Å; R43-T47 PolarHBondContact O-N 3.3Å; R43-T47 PolarHBondContact O-OG1 2.94Å; G45-T47 VanDerWaalsContact C-N 3.26Å; G45-T47 PolarHBondContact O-N 3.03Å; T47-K51 VanDerWaalsContact O-CB 3.29Å; T47-K51 WeakPolarHBondContact O-CB 3.35Å; T47-K51 PolarHBondContact O-N 3.44Å |
| 48 | R | 79.5 | Confident | 72 | Confident | 166 Ų | 166 | 117.7 Ų | 117.7 | 63% | 0.626 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -78.7 | -39.6 | 177.3 | -75 | 176.8 | 176.4 | -178.9 | -2.8 | 111.7 | K44 G45 K51 N52 | K44-R48 WeakPolarHBondContact O-CG 3.31Å; K44-R48 PolarHBondContact O-N 3.19Å; G45-R48 PolarHBondContact O-N 3.41Å; R48-K51 PolarHBondContact O-N 3.36Å; R48-N52 VanDerWaalsContact O-CG 3.28Å; R48-N52 PolarHBondContact O-N 3.17Å |
| 49 | E | 81.3 | Confident | 74.5 | Confident | 122 Ų | 122 | 115.1 Ų | 115.1 | 57% | 0.57 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -62.4 | -52.3 | 175.4 | -168.5 | 165.9 | -153.9 | 0 | 0 | 110.7 | G45 K51 N52 E53 | G45-E49 PolarHBondContact O-N 3.49Å; E49-K51 PolarHBondContact O-N 3.41Å; E49-N52 WeakPolarHBondContact O-CA 3.41Å; E49-N52 WeakPolarHBondContact O-CB 3.35Å; E49-N52 PolarHBondContact O-N 3.39Å; E49-E53 PolarHBondContact O-N 3.47Å |
| 50 | L | 82.5 | Confident | 76.7 | Confident | 114 Ų | 114 | 117.5 Ų | 117.5 | 60% | 0.597 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -56.3 | -36.5 | 174.3 | -174.7 | 70.9 | 0 | 0 | 0 | 112.7 | M46 L54 | M46-L50 VanDerWaalsContact O-CB 3.28Å; M46-L50 WeakPolarHBondContact O-CB 3.49Å; M46-L50 PolarHBondContact O-N 2.91Å; L50-L54 VanDerWaalsContact O-CB 3.25Å; L50-L54 WeakPolarHBondContact O-CB 3.37Å; L50-L54 PolarHBondContact O-N 2.92Å |
| 51 | K | 86.6 | Confident | 78.8 | Confident | 154 Ų | 154 | 118.4 Ų | 118.4 | 67% | 0.67 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -68.8 | -35.7 | 176.8 | -175.7 | 179 | 178.6 | -178.2 | 0 | 112.3 | T47 R48 E49 R55 | T47-K51 VanDerWaalsContact O-CB 3.29Å; T47-K51 WeakPolarHBondContact O-CB 3.35Å; T47-K51 PolarHBondContact O-N 3.44Å; R48-K51 PolarHBondContact O-N 3.36Å; E49-K51 PolarHBondContact O-N 3.41Å; K51-R55 PolarHBondContact O-N 2.88Å |
| 52 | N | 90 | Very high | 80.9 | Confident | 82 Ų | 82 | 117 Ų | 117 | 44% | 0.439 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -72.2 | -45.1 | 176.8 | -70.6 | -18.4 | 0 | 0 | 0 | 110.8 | R48 E49 L54 R55 E56 | R48-N52 VanDerWaalsContact O-CG 3.28Å; R48-N52 PolarHBondContact O-N 3.17Å; E49-N52 WeakPolarHBondContact O-CA 3.41Å; E49-N52 WeakPolarHBondContact O-CB 3.35Å; E49-N52 PolarHBondContact O-N 3.39Å; N52-L54 VanDerWaalsContact C-N 3.33Å; N52-L54 PolarHBondContact O-N 3.37Å; N52-R55 WeakPolarHBondContact O-CB 3.33Å; N52-R55 PolarHBondContact O-N 3.18Å; N52-R55 VanDerWaalsContact O-N 3.15Å; N52-R55 PolarHBondContact OD1-NH2 3.24Å; N52-E56 PolarHBondContact O-N 2.88Å |
| 53 | E | 91.6 | Very high | 83.1 | Confident | 98 Ų | 98 | 116.4 Ų | 116.4 | 46% | 0.458 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -58.5 | -44.2 | 173.6 | -69.6 | 177.8 | 176.9 | 0 | 0 | 111.2 | E49 R55 E56 V57 | E49-E53 PolarHBondContact O-N 3.47Å; E53-R55 VanDerWaalsContact C-N 3.26Å; E53-R55 PolarHBondContact O-N 2.96Å; E53-E56 WeakPolarHBondContact O-CB 3.42Å; E53-E56 PolarHBondContact O-N 3.5Å; E53-E56 VanDerWaalsContact O-N 3.13Å; E53-V57 WeakPolarHBondContact O-CG2 3.36Å; E53-V57 PolarHBondContact O-N 2.97Å |
| 54 | L | 89.8 | Confident | 85 | Confident | 94 Ų | 94 | 112.8 Ų | 112.8 | 49% | 0.492 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.5 | -35.5 | 177.2 | -176.5 | 64.6 | 0 | 0 | 0 | 112.5 | L50 N52 R58 | L50-L54 VanDerWaalsContact O-CB 3.25Å; L50-L54 WeakPolarHBondContact O-CB 3.37Å; L50-L54 PolarHBondContact O-N 2.92Å; N52-L54 VanDerWaalsContact C-N 3.33Å; N52-L54 PolarHBondContact O-N 3.37Å; L54-R58 VanDerWaalsContact O-CG 3.28Å; L54-R58 WeakPolarHBondContact O-CG 3.43Å; L54-R58 PolarHBondContact O-N 3.49Å |
| 55 | R | 92.8 | Very high | 87 | Confident | 138 Ų | 138 | 112.9 Ų | 112.9 | 52% | 0.521 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -68.8 | -44.1 | 173.9 | 173.7 | -175.6 | 54.2 | -177.5 | -4.4 | 110.8 | K51 N52 E53 R58 E59 | K51-R55 PolarHBondContact O-N 2.88Å; N52-R55 WeakPolarHBondContact O-CB 3.33Å; N52-R55 PolarHBondContact O-N 3.18Å; N52-R55 VanDerWaalsContact O-N 3.15Å; N52-R55 PolarHBondContact OD1-NH2 3.24Å; E53-R55 VanDerWaalsContact C-N 3.26Å; E53-R55 PolarHBondContact O-N 2.96Å; R55-R58 WeakPolarHBondContact O-CB 3.35Å; R55-R58 PolarHBondContact O-N 3.35Å; R55-R58 VanDerWaalsContact O-N 3.16Å; R55-E59 WeakPolarHBondContact CG-OE1 3.42Å; R55-E59 WeakPolarHBondContact O-CG 3.42Å; R55-E59 PolarHBondContact O-N 2.98Å |
| 56 | E | 93.3 | Very high | 88.8 | Confident | 105 Ų | 105 | 115.3 Ų | 115.3 | 49% | 0.491 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -60.7 | -45.9 | 177.3 | -176 | 178.8 | 171.3 | 0 | 0 | 111.6 | N52 E53 R58 E59 Q60 | N52-E56 PolarHBondContact O-N 2.88Å; E53-E56 WeakPolarHBondContact O-CB 3.42Å; E53-E56 PolarHBondContact O-N 3.5Å; E53-E56 VanDerWaalsContact O-N 3.13Å; E56-R58 VanDerWaalsContact C-N 3.26Å; E56-R58 PolarHBondContact O-N 3.15Å; E56-E59 PolarHBondContact O-N 2.92Å; E56-E59 VanDerWaalsContact O-N 3.14Å; E56-Q60 WeakPolarHBondContact O-CG 3.32Å; E56-Q60 PolarHBondContact O-N 2.89Å; E56-Q60 PolarHBondContact OE1-NE2 3.33Å; E56-Q60 VanDerWaalsContact OE1-NE2 3.17Å |
| 57 | V | 95.6 | Very high | 90.6 | Very high | 87 Ų | 87 | 112.4 Ų | 112.4 | 53% | 0.527 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -60.4 | -35.8 | 175.4 | 171 | 0 | 0 | 0 | 0 | 111.6 | E53 L61 | E53-V57 WeakPolarHBondContact O-CG2 3.36Å; E53-V57 PolarHBondContact O-N 2.97Å; V57-L61 VanDerWaalsContact O-CB 3.24Å; V57-L61 WeakPolarHBondContact O-CB 3.39Å; V57-L61 PolarHBondContact O-N 3.45Å |
| 58 | R | 92.1 | Very high | 91.8 | Very high | 162 Ų | 162 | 112.5 Ų | 112.5 | 61% | 0.611 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -68.2 | -40.4 | 175 | -77.1 | 174.6 | 178.9 | -161.5 | -1.9 | 112.6 | L54 R55 E56 T62 | L54-R58 VanDerWaalsContact O-CG 3.28Å; L54-R58 WeakPolarHBondContact O-CG 3.43Å; L54-R58 PolarHBondContact O-N 3.49Å; R55-R58 WeakPolarHBondContact O-CB 3.35Å; R55-R58 PolarHBondContact O-N 3.35Å; R55-R58 VanDerWaalsContact O-N 3.16Å; E56-R58 VanDerWaalsContact C-N 3.26Å; E56-R58 PolarHBondContact O-N 3.15Å; R58-T62 PolarHBondContact O-N 3.41Å; R58-T62 PolarHBondContact O-OG1 3.37Å |
| 59 | E | 95.6 | Very high | 92.6 | Very high | 119 Ų | 119 | 109.7 Ų | 109.7 | 56% | 0.556 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.3 | -47.6 | 176.3 | -72.3 | 168.5 | -167.9 | 0 | 0 | 110.3 | R55 E56 L61 T62 E63 | R55-E59 WeakPolarHBondContact CG-OE1 3.42Å; R55-E59 WeakPolarHBondContact O-CG 3.42Å; R55-E59 PolarHBondContact O-N 2.98Å; E56-E59 PolarHBondContact O-N 2.92Å; E56-E59 VanDerWaalsContact O-N 3.14Å; E59-L61 VanDerWaalsContact C-N 3.35Å; E59-L61 PolarHBondContact O-N 3.2Å; E59-T62 WeakPolarHBondContact O-CB 3.46Å; E59-T62 PolarHBondContact O-N 3.42Å; E59-T62 VanDerWaalsContact O-N 3.12Å; E59-E63 PolarHBondContact O-N 3.37Å |
| 60 | Q | 94.4 | Very high | 93.4 | Very high | 95 Ų | 95 | 109.2 Ų | 109.2 | 44% | 0.444 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.6 | -40.8 | 175.4 | -69.8 | -178.7 | 21.2 | 0 | 0 | 112.5 | E56 T62 E63 K64 | E56-Q60 WeakPolarHBondContact O-CG 3.32Å; E56-Q60 PolarHBondContact O-N 2.89Å; E56-Q60 PolarHBondContact OE1-NE2 3.33Å; E56-Q60 VanDerWaalsContact OE1-NE2 3.17Å; Q60-T62 VanDerWaalsContact C-N 3.29Å; Q60-T62 PolarHBondContact O-N 3.03Å; Q60-E63 PolarHBondContact O-N 2.95Å; Q60-K64 WeakPolarHBondContact O-CB 3.4Å; Q60-K64 VanDerWaalsContact O-CG 3.31Å; Q60-K64 WeakPolarHBondContact O-CG 3.37Å; Q60-K64 PolarHBondContact O-N 2.91Å |
| 61 | L | 94.3 | Very high | 94 | Very high | 123 Ų | 123 | 109 Ų | 109 | 64% | 0.644 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -61.9 | -40.2 | 175.6 | 179.6 | 64.8 | 0 | 0 | 0 | 111.5 | V57 E59 M65 | V57-L61 VanDerWaalsContact O-CB 3.24Å; V57-L61 WeakPolarHBondContact O-CB 3.39Å; V57-L61 PolarHBondContact O-N 3.45Å; E59-L61 VanDerWaalsContact C-N 3.35Å; E59-L61 PolarHBondContact O-N 3.2Å; L61-M65 WeakPolarHBondContact O-CB 3.46Å; L61-M65 PolarHBondContact O-N 3.09Å |
| 62 | T | 93.6 | Very high | 94.4 | Very high | 98 Ų | 98 | 106.1 Ų | 106.1 | 60% | 0.601 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -68 | -42.9 | 178.6 | -53.5 | 0 | 0 | 0 | 0 | 111 | R58 E59 Q60 M65 E66 | R58-T62 PolarHBondContact O-N 3.41Å; R58-T62 PolarHBondContact O-OG1 3.37Å; E59-T62 WeakPolarHBondContact O-CB 3.46Å; E59-T62 PolarHBondContact O-N 3.42Å; E59-T62 VanDerWaalsContact O-N 3.12Å; Q60-T62 VanDerWaalsContact C-N 3.29Å; Q60-T62 PolarHBondContact O-N 3.03Å; T62-M65 WeakPolarHBondContact O-CB 3.44Å; T62-M65 PolarHBondContact O-N 3.28Å; T62-E66 PolarHBondContact O-N 3.02Å; T62-E66 VanDerWaalsContact O-N 3.12Å |
| 63 | E | 95.9 | Very high | 94.7 | Very high | 119 Ų | 119 | 106.2 Ų | 106.2 | 56% | 0.556 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61 | -47.5 | 175 | -177.9 | 179.8 | -167.1 | 0 | 0 | 111.3 | E59 Q60 M65 E66 E67 | E59-E63 PolarHBondContact O-N 3.37Å; Q60-E63 PolarHBondContact O-N 2.95Å; E63-M65 VanDerWaalsContact C-N 3.28Å; E63-M65 PolarHBondContact O-N 3.39Å; E63-E66 PolarHBondContact O-N 3.43Å; E63-E66 VanDerWaalsContact O-N 3.09Å; E63-E67 PolarHBondContact O-N 3.05Å |
| 64 | K | 95 | Very high | 95 | Very high | 106 Ų | 106 | 106.6 Ų | 106.6 | 46% | 0.461 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.2 | -34.5 | 177.4 | -72.8 | -72.3 | 168.6 | -133.2 | 0 | 112.7 | Q60 E66 E67 I68 | Q60-K64 WeakPolarHBondContact O-CB 3.4Å; Q60-K64 VanDerWaalsContact O-CG 3.31Å; Q60-K64 WeakPolarHBondContact O-CG 3.37Å; Q60-K64 PolarHBondContact O-N 2.91Å; K64-E66 VanDerWaalsContact C-N 3.33Å; K64-E67 IonicContact NZ-OE1 2.79Å; K64-E67 PolarHBondContact NZ-OE1 3.47Å; K64-E67 IonicContact NZ-OE2 2.71Å; K64-E67 PolarHBondContact NZ-OE2 2.92Å; K64-E67 PolarHBondContact O-N 3.33Å; K64-I68 WeakPolarHBondContact O-CB 3.38Å; K64-I68 WeakPolarHBondContact O-CD1 3.43Å; K64-I68 WeakPolarHBondContact O-CG1 3.5Å; K64-I68 PolarHBondContact O-N 3.47Å |
| 65 | M | 96.1 | Very high | 95.2 | Very high | 130 Ų | 130 | 106.2 Ų | 106.2 | 64% | 0.64 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.7 | -41.7 | 173.4 | -173.4 | 64.2 | 120 | 0 | 0 | 111.4 | L61 T62 E63 I68 K69 | L61-M65 WeakPolarHBondContact O-CB 3.46Å; L61-M65 PolarHBondContact O-N 3.09Å; T62-M65 WeakPolarHBondContact O-CB 3.44Å; T62-M65 PolarHBondContact O-N 3.28Å; E63-M65 VanDerWaalsContact C-N 3.28Å; E63-M65 PolarHBondContact O-N 3.39Å; M65-I68 PolarHBondContact O-N 3.14Å; M65-K69 WeakPolarHBondContact O-CB 3.47Å; M65-K69 PolarHBondContact O-N 2.94Å |
| 66 | E | 96.3 | Very high | 95.4 | Very high | 89 Ų | 89 | 102.7 Ų | 102.7 | 42% | 0.416 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -71.1 | -38.4 | 178.4 | -166.8 | 61.7 | -156.9 | 0 | 0 | 112.2 | T62 E63 K64 I68 K69 Q70 | T62-E66 PolarHBondContact O-N 3.02Å; T62-E66 VanDerWaalsContact O-N 3.12Å; E63-E66 PolarHBondContact O-N 3.43Å; E63-E66 VanDerWaalsContact O-N 3.09Å; K64-E66 VanDerWaalsContact C-N 3.33Å; E66-I68 VanDerWaalsContact C-N 3.35Å; E66-I68 PolarHBondContact O-N 2.9Å; E66-K69 WeakPolarHBondContact O-CB 3.48Å; E66-K69 PolarHBondContact O-N 3.13Å; E66-K69 IonicContact OE2-NZ 4Å; E66-Q70 WeakPolarHBondContact O-CG 3.44Å; E66-Q70 PolarHBondContact O-N 3.42Å |
| 67 | E | 96.6 | Very high | 95.5 | Very high | 74 Ų | 74 | 104.1 Ų | 104.1 | 35% | 0.346 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.2 | -46.8 | 171.1 | -73 | 178.1 | -150.9 | 0 | 0 | 111.4 | E63 K64 K69 Q70 I71 | E63-E67 PolarHBondContact O-N 3.05Å; K64-E67 IonicContact NZ-OE1 2.79Å; K64-E67 PolarHBondContact NZ-OE1 3.47Å; K64-E67 IonicContact NZ-OE2 2.71Å; K64-E67 PolarHBondContact NZ-OE2 2.92Å; K64-E67 PolarHBondContact O-N 3.33Å; E67-K69 VanDerWaalsContact C-N 3.27Å; E67-K69 PolarHBondContact O-N 2.99Å; E67-Q70 PolarHBondContact O-N 3.27Å; E67-I71 WeakPolarHBondContact O-CG1 3.42Å; E67-I71 PolarHBondContact O-N 3.46Å |
| 68 | I | 94.4 | Very high | 95.5 | Very high | 87 Ų | 87 | 103.9 Ų | 103.9 | 45% | 0.446 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -40.3 | 177.7 | -71.8 | 166.5 | 0 | 0 | 0 | 110.7 | K64 M65 E66 I71 K72 | K64-I68 WeakPolarHBondContact O-CB 3.38Å; K64-I68 WeakPolarHBondContact O-CD1 3.43Å; K64-I68 WeakPolarHBondContact O-CG1 3.5Å; K64-I68 PolarHBondContact O-N 3.47Å; M65-I68 PolarHBondContact O-N 3.14Å; E66-I68 VanDerWaalsContact C-N 3.35Å; E66-I68 PolarHBondContact O-N 2.9Å; I68-I71 PolarHBondContact O-N 3.21Å; I68-K72 PolarHBondContact O-N 2.8Å |
| 69 | K | 96.9 | Very high | 95.7 | Very high | 108 Ų | 108 | 101.3 Ų | 101.3 | 47% | 0.47 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.5 | -42.1 | 177.7 | -171.7 | -178.1 | 171.5 | -162.2 | 0 | 112 | M65 E66 E67 I71 K72 D73 | M65-K69 WeakPolarHBondContact O-CB 3.47Å; M65-K69 PolarHBondContact O-N 2.94Å; E66-K69 WeakPolarHBondContact O-CB 3.48Å; E66-K69 PolarHBondContact O-N 3.13Å; E66-K69 IonicContact OE2-NZ 4Å; E67-K69 VanDerWaalsContact C-N 3.27Å; E67-K69 PolarHBondContact O-N 2.99Å; K69-I71 PolarHBondContact O-N 3.46Å; K69-K72 WeakPolarHBondContact O-CB 3.3Å; K69-K72 PolarHBondContact O-N 3.35Å; K69-D73 PolarHBondContact O-N 3.29Å |
| 70 | Q | 97.5 | Very high | 95.6 | Very high | 112 Ų | 112 | 101.2 Ų | 101.2 | 52% | 0.523 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.2 | -40.1 | 175.4 | -69.7 | 176.6 | 20.4 | 0 | 0 | 112.3 | E66 E67 K72 D73 I74 | E66-Q70 WeakPolarHBondContact O-CG 3.44Å; E66-Q70 PolarHBondContact O-N 3.42Å; E67-Q70 PolarHBondContact O-N 3.27Å; Q70-K72 VanDerWaalsContact C-N 3.3Å; Q70-K72 PolarHBondContact O-N 2.98Å; Q70-D73 PolarHBondContact O-N 3.48Å; Q70-I74 WeakPolarHBondContact O-CG1 3.47Å; Q70-I74 PolarHBondContact O-N 3.29Å |
| 71 | I | 95.6 | Very high | 95.6 | Very high | 110 Ų | 110 | 101.5 Ų | 101.5 | 56% | 0.564 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61 | -44 | 174.6 | -67.6 | 165.9 | 0 | 0 | 0 | 110 | E67 I68 K69 I74 M75 | E67-I71 WeakPolarHBondContact O-CG1 3.42Å; E67-I71 PolarHBondContact O-N 3.46Å; I68-I71 PolarHBondContact O-N 3.21Å; K69-I71 PolarHBondContact O-N 3.46Å; I71-I74 PolarHBondContact O-N 3.42Å; I71-M75 WeakPolarHBondContact O-CB 3.04Å; I71-M75 PolarHBondContact O-N 3.45Å |
| 72 | K | 96 | Very high | 95.6 | Very high | 92 Ų | 92 | 100.4 Ų | 100.4 | 40% | 0.4 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.8 | -46.1 | 176.1 | -173.8 | -169.3 | 173.2 | -167.4 | 0 | 111.6 | I68 K69 Q70 I74 M75 D76 | I68-K72 PolarHBondContact O-N 2.8Å; K69-K72 WeakPolarHBondContact O-CB 3.3Å; K69-K72 PolarHBondContact O-N 3.35Å; Q70-K72 VanDerWaalsContact C-N 3.3Å; Q70-K72 PolarHBondContact O-N 2.98Å; K72-I74 VanDerWaalsContact C-N 3.31Å; K72-I74 PolarHBondContact O-N 3.44Å; K72-M75 HydrophobicContact CG-CE 4.29Å; K72-M75 WeakPolarHBondContact O-CB 3.32Å; K72-M75 PolarHBondContact O-N 3.24Å; K72-M75 VanDerWaalsContact O-N 3.11Å; K72-D76 PolarHBondContact O-N 3.12Å |
| 73 | D | 96.3 | Very high | 95.6 | Very high | 84 Ų | 84 | 103.3 Ų | 103.3 | 45% | 0.449 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.7 | -37.2 | 179.8 | -69 | -18.1 | 0 | 0 | 0 | 112.1 | K69 Q70 K77 | K69-D73 PolarHBondContact O-N 3.29Å; Q70-D73 PolarHBondContact O-N 3.48Å; D73-K77 VanDerWaalsContact O-CG 3.3Å; D73-K77 WeakPolarHBondContact O-CG 3.38Å; D73-K77 PolarHBondContact O-N 3.06Å |
| 74 | I | 96.3 | Very high | 95.6 | Very high | 107 Ų | 107 | 103.5 Ų | 103.5 | 55% | 0.549 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.9 | -45.7 | 173 | -66.6 | 166.1 | 0 | 0 | 0 | 110.3 | Q70 I71 K72 D76 K77 D78 | Q70-I74 WeakPolarHBondContact O-CG1 3.47Å; Q70-I74 PolarHBondContact O-N 3.29Å; I71-I74 PolarHBondContact O-N 3.42Å; K72-I74 VanDerWaalsContact C-N 3.31Å; K72-I74 PolarHBondContact O-N 3.44Å; I74-D76 PolarHBondContact O-N 3.25Å; I74-K77 PolarHBondContact O-N 3.05Å; I74-D78 PolarHBondContact O-N 3.48Å |
| 75 | M | 95.8 | Very high | 95.5 | Very high | 86 Ų | 86 | 104.5 Ų | 104.5 | 42% | 0.424 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.2 | -46 | -180 | -176.5 | -176.1 | 70.1 | 0 | 0 | 111.5 | I71 K72 K77 D78 F79 | I71-M75 WeakPolarHBondContact O-CB 3.04Å; I71-M75 PolarHBondContact O-N 3.45Å; K72-M75 HydrophobicContact CG-CE 4.29Å; K72-M75 WeakPolarHBondContact O-CB 3.32Å; K72-M75 PolarHBondContact O-N 3.24Å; K72-M75 VanDerWaalsContact O-N 3.11Å; M75-K77 VanDerWaalsContact C-N 3.33Å; M75-K77 PolarHBondContact O-N 3.34Å; M75-D78 PolarHBondContact O-N 3.31Å; M75-F79 HydrophobicContact CE-CE2 4.31Å; M75-F79 HydrophobicContact CG-CD2 3.7Å; M75-F79 HydrophobicContact CG-CE2 3.43Å; M75-F79 VanDerWaalsContact CG-CE2 3.43Å; M75-F79 WeakPolarHBondContact O-CD2 3.4Å; M75-F79 PolarHBondContact O-N 3.03Å; M75-F79 HydrophobicContact SD-CE2 3.87Å |
| 76 | D | 95.4 | Very high | 95.5 | Very high | 64 Ų | 64 | 102.2 Ų | 102.2 | 34% | 0.342 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.2 | -43.3 | 178.4 | -70.8 | -16.1 | 0 | 0 | 0 | 110.8 | K72 I74 D78 F79 D80 | K72-D76 PolarHBondContact O-N 3.12Å; I74-D76 PolarHBondContact O-N 3.25Å; D76-D78 VanDerWaalsContact C-N 3.33Å; D76-D78 PolarHBondContact O-N 3.06Å; D76-F79 WeakPolarHBondContact O-CB 3.4Å; D76-F79 PolarHBondContact O-N 3.25Å; D76-D80 PolarHBondContact O-N 2.9Å |
| 77 | K | 96.1 | Very high | 95.4 | Very high | 135 Ų | 135 | 101 Ų | 101 | 59% | 0.587 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.6 | -35.2 | 176.3 | -71.7 | 174 | 69.4 | 175.5 | 0 | 113.6 | D73 I74 M75 K81 | D73-K77 VanDerWaalsContact O-CG 3.3Å; D73-K77 WeakPolarHBondContact O-CG 3.38Å; D73-K77 PolarHBondContact O-N 3.06Å; I74-K77 PolarHBondContact O-N 3.05Å; M75-K77 VanDerWaalsContact C-N 3.33Å; M75-K77 PolarHBondContact O-N 3.34Å; K77-K81 WeakPolarHBondContact O-CG 3.49Å; K77-K81 PolarHBondContact O-N 3.37Å |
| 78 | D | 94.9 | Very high | 95.3 | Very high | 81 Ų | 81 | 101.5 Ų | 101.5 | 43% | 0.433 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -78.6 | -29 | 178 | -74.6 | -16 | 0 | 0 | 0 | 111.7 | I74 M75 D76 K81 L82 | I74-D78 PolarHBondContact O-N 3.48Å; M75-D78 PolarHBondContact O-N 3.31Å; D76-D78 VanDerWaalsContact C-N 3.33Å; D76-D78 PolarHBondContact O-N 3.06Å; D78-K81 IonicContact OD1-NZ 2.8Å; D78-K81 PolarHBondContact OD1-NZ 3.22Å; D78-L82 WeakPolarHBondContact O-CB 3.37Å; D78-L82 PolarHBondContact O-N 2.92Å |
| 79 | F | 96 | Very high | 95.2 | Very high | 109 Ų | 109 | 102.6 Ų | 102.6 | 48% | 0.478 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.9 | -43.2 | 168.2 | -86.6 | -65.9 | 0 | 0 | 0 | 112.1 | M75 D76 K81 L82 Y83 | M75-F79 HydrophobicContact CE-CE2 4.31Å; M75-F79 HydrophobicContact CG-CD2 3.7Å; M75-F79 HydrophobicContact CG-CE2 3.43Å; M75-F79 VanDerWaalsContact CG-CE2 3.43Å; M75-F79 WeakPolarHBondContact O-CD2 3.4Å; M75-F79 PolarHBondContact O-N 3.03Å; M75-F79 HydrophobicContact SD-CE2 3.87Å; D76-F79 WeakPolarHBondContact O-CB 3.4Å; D76-F79 PolarHBondContact O-N 3.25Å; F79-K81 PolarHBondContact O-N 2.92Å; F79-L82 WeakPolarHBondContact O-CB 3.41Å; F79-L82 PolarHBondContact O-N 2.83Å; F79-Y83 PolarHBondContact O-N 3.18Å |
| 80 | D | 94.5 | Very high | 95.1 | Very high | 116 Ų | 116 | 103.2 Ų | 103.2 | 62% | 0.62 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.4 | -44.5 | 177.1 | -71.7 | -23.2 | 0 | 0 | 0 | 111.9 | D76 L82 Y83 E84 | D76-D80 PolarHBondContact O-N 2.9Å; D80-L82 VanDerWaalsContact C-N 3.35Å; D80-L82 PolarHBondContact O-N 2.91Å; D80-Y83 WeakPolarHBondContact O-CB 3.2Å; D80-Y83 PolarHBondContact O-N 3.38Å; D80-E84 PolarHBondContact O-N 3.24Å; D80-E84 VanDerWaalsContact O-N 3.09Å |
| 81 | K | 93.8 | Very high | 95 | Very high | 102 Ų | 102 | 103.7 Ų | 103.7 | 44% | 0.443 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.6 | -41.1 | 175.2 | -66.3 | 173.5 | -159.7 | 154.6 | 0 | 111.9 | K77 D78 F79 Y83 E84 F85 | K77-K81 WeakPolarHBondContact O-CG 3.49Å; K77-K81 PolarHBondContact O-N 3.37Å; D78-K81 IonicContact OD1-NZ 2.8Å; D78-K81 PolarHBondContact OD1-NZ 3.22Å; F79-K81 PolarHBondContact O-N 2.92Å; K81-Y83 VanDerWaalsContact C-N 3.26Å; K81-Y83 PolarHBondContact O-N 3.11Å; K81-E84 WeakPolarHBondContact O-CB 3.38Å; K81-E84 PolarHBondContact O-N 3.49Å; K81-F85 HydrophobicContact CB-CE2 4.48Å; K81-F85 WeakPolarHBondContact O-CD2 3.34Å; K81-F85 PolarHBondContact O-N 3.24Å; K81-F85 VanDerWaalsContact O-N 3.12Å |
| 82 | L | 94.7 | Very high | 94.9 | Very high | 100 Ų | 100 | 103.9 Ų | 103.9 | 52% | 0.524 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.6 | -39.7 | 177.1 | -178.1 | 61.2 | 0 | 0 | 0 | 110.9 | D78 F79 D80 E84 F85 V86 | D78-L82 WeakPolarHBondContact O-CB 3.37Å; D78-L82 PolarHBondContact O-N 2.92Å; F79-L82 WeakPolarHBondContact O-CB 3.41Å; F79-L82 PolarHBondContact O-N 2.83Å; D80-L82 VanDerWaalsContact C-N 3.35Å; D80-L82 PolarHBondContact O-N 2.91Å; L82-E84 VanDerWaalsContact C-N 3.35Å; L82-F85 PolarHBondContact O-N 3.48Å; L82-V86 WeakPolarHBondContact O-CG2 3.39Å; L82-V86 PolarHBondContact O-N 3.31Å |
| 83 | Y | 94.6 | Very high | 94.8 | Very high | 158 Ų | 158 | 105.1 Ų | 105.1 | 62% | 0.62 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.4 | -42.9 | 175.7 | -168.4 | -92.2 | 0 | 0 | 0 | 111.8 | F79 D80 K81 F85 V86 E87 | F79-Y83 PolarHBondContact O-N 3.18Å; D80-Y83 WeakPolarHBondContact O-CB 3.2Å; D80-Y83 PolarHBondContact O-N 3.38Å; K81-Y83 VanDerWaalsContact C-N 3.26Å; K81-Y83 PolarHBondContact O-N 3.11Å; Y83-F85 VanDerWaalsContact C-N 3.34Å; Y83-F85 PolarHBondContact O-N 3.32Å; Y83-V86 WeakPolarHBondContact O-CB 3.43Å; Y83-V86 PolarHBondContact O-N 2.94Å; Y83-V86 VanDerWaalsContact O-N 3.14Å; Y83-E87 WeakPolarHBondContact CE1-OE2 3.45Å; Y83-E87 PolarHBondContact O-N 3.48Å |
| 84 | E | 95.1 | Very high | 94.8 | Very high | 123 Ų | 123 | 106.9 Ų | 106.9 | 58% | 0.575 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -58.8 | -43.5 | 175 | -170.9 | 178.3 | -173 | 0 | 0 | 112.1 | D80 K81 L82 V86 E87 I88 | D80-E84 PolarHBondContact O-N 3.24Å; D80-E84 VanDerWaalsContact O-N 3.09Å; K81-E84 WeakPolarHBondContact O-CB 3.38Å; K81-E84 PolarHBondContact O-N 3.49Å; L82-E84 VanDerWaalsContact C-N 3.35Å; E84-V86 VanDerWaalsContact C-N 3.32Å; E84-V86 PolarHBondContact O-N 2.98Å; E84-E87 PolarHBondContact O-N 3.39Å; E84-I88 HydrophobicContact CG-CD1 4.28Å; E84-I88 WeakPolarHBondContact O-CG1 3.45Å; E84-I88 PolarHBondContact O-N 3.02Å |
| 85 | F | 92.4 | Very high | 94.8 | Very high | 128 Ų | 128 | 105 Ų | 105 | 56% | 0.561 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.1 | -38.4 | 175.2 | -69.9 | -61.2 | 0 | 0 | 0 | 112.8 | K81 L82 Y83 I88 M89 | K81-F85 HydrophobicContact CB-CE2 4.48Å; K81-F85 WeakPolarHBondContact O-CD2 3.34Å; K81-F85 PolarHBondContact O-N 3.24Å; K81-F85 VanDerWaalsContact O-N 3.12Å; L82-F85 PolarHBondContact O-N 3.48Å; Y83-F85 VanDerWaalsContact C-N 3.34Å; Y83-F85 PolarHBondContact O-N 3.32Å; F85-I88 PolarHBondContact O-N 3.49Å; F85-M89 VanDerWaalsContact O-CG 3.32Å; F85-M89 WeakPolarHBondContact O-CG 3.49Å; F85-M89 PolarHBondContact O-N 3.42Å |
| 86 | V | 95.7 | Very high | 94.7 | Very high | 82 Ų | 82 | 106.4 Ų | 106.4 | 50% | 0.497 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.4 | -40.9 | 176.7 | 171.3 | 0 | 0 | 0 | 0 | 111.1 | L82 Y83 E84 M89 K90 | L82-V86 WeakPolarHBondContact O-CG2 3.39Å; L82-V86 PolarHBondContact O-N 3.31Å; Y83-V86 WeakPolarHBondContact O-CB 3.43Å; Y83-V86 PolarHBondContact O-N 2.94Å; Y83-V86 VanDerWaalsContact O-N 3.14Å; E84-V86 VanDerWaalsContact C-N 3.32Å; E84-V86 PolarHBondContact O-N 2.98Å; V86-M89 PolarHBondContact O-N 3.22Å; V86-K90 WeakPolarHBondContact O-CB 3.25Å; V86-K90 PolarHBondContact O-N 3.12Å |
| 87 | E | 94.8 | Very high | 94.7 | Very high | 64 Ų | 64 | 108.2 Ų | 108.2 | 30% | 0.299 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.5 | -46 | 176.2 | -157.7 | 81.4 | -119.5 | 0 | 0 | 111 | Y83 E84 M89 K90 E91 | Y83-E87 WeakPolarHBondContact CE1-OE2 3.45Å; Y83-E87 PolarHBondContact O-N 3.48Å; E84-E87 PolarHBondContact O-N 3.39Å; E87-M89 VanDerWaalsContact C-N 3.33Å; E87-M89 PolarHBondContact O-N 3.46Å; E87-K90 WeakPolarHBondContact O-CB 3.33Å; E87-K90 PolarHBondContact O-N 2.98Å; E87-K90 VanDerWaalsContact O-N 3.13Å; E87-K90 IonicContact OE1-NZ 3.47Å; E87-K90 PolarHBondContact OE1-NZ 3.32Å; E87-E91 PolarHBondContact O-N 3.43Å |
| 88 | I | 94.1 | Very high | 94.6 | Very high | 83 Ų | 83 | 107.6 Ų | 107.6 | 43% | 0.426 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.5 | -43.3 | 176.9 | -66.5 | 164.9 | 0 | 0 | 0 | 111.4 | E84 F85 K90 E91 M92 | E84-I88 HydrophobicContact CG-CD1 4.28Å; E84-I88 WeakPolarHBondContact O-CG1 3.45Å; E84-I88 PolarHBondContact O-N 3.02Å; F85-I88 PolarHBondContact O-N 3.49Å; I88-K90 VanDerWaalsContact C-N 3.3Å; I88-K90 PolarHBondContact O-N 2.94Å; I88-E91 PolarHBondContact O-N 2.99Å; I88-M92 WeakPolarHBondContact O-CB 3.44Å; I88-M92 PolarHBondContact O-N 2.98Å |
| 89 | M | 91.9 | Very high | 94.5 | Very high | 111 Ų | 111 | 109.5 Ų | 109.5 | 55% | 0.547 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63 | -38.6 | 178.1 | -74.7 | 180 | 64.7 | 0 | 0 | 112.1 | F85 V86 E87 M92 Q93 | F85-M89 VanDerWaalsContact O-CG 3.32Å; F85-M89 WeakPolarHBondContact O-CG 3.49Å; F85-M89 PolarHBondContact O-N 3.42Å; V86-M89 PolarHBondContact O-N 3.22Å; E87-M89 VanDerWaalsContact C-N 3.33Å; E87-M89 PolarHBondContact O-N 3.46Å; M89-M92 PolarHBondContact O-N 2.79Å; M89-Q93 WeakPolarHBondContact O-CG 3.41Å; M89-Q93 PolarHBondContact O-N 3.09Å |
| 90 | K | 96.3 | Very high | 94.5 | Very high | 120 Ų | 120 | 109.4 Ų | 109.4 | 52% | 0.522 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -68.2 | -43.4 | 177.2 | -178.4 | -175.8 | 164.7 | -154.8 | 0 | 111.6 | V86 E87 I88 M92 Q93 Q94 | V86-K90 WeakPolarHBondContact O-CB 3.25Å; V86-K90 PolarHBondContact O-N 3.12Å; E87-K90 WeakPolarHBondContact O-CB 3.33Å; E87-K90 PolarHBondContact O-N 2.98Å; E87-K90 VanDerWaalsContact O-N 3.13Å; E87-K90 IonicContact OE1-NZ 3.47Å; E87-K90 PolarHBondContact OE1-NZ 3.32Å; I88-K90 VanDerWaalsContact C-N 3.3Å; I88-K90 PolarHBondContact O-N 2.94Å; K90-M92 VanDerWaalsContact C-N 3.32Å; K90-M92 PolarHBondContact O-N 3.35Å; K90-Q93 PolarHBondContact O-N 2.71Å; K90-Q94 WeakPolarHBondContact O-CB 3.49Å; K90-Q94 PolarHBondContact O-N 3.31Å |
| 91 | E | 94.6 | Very high | 94.4 | Very high | 122 Ų | 122 | 109 Ų | 109 | 57% | 0.57 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.8 | -42.6 | 173.6 | -74.1 | -176 | 177.1 | 0 | 0 | 111.6 | E87 I88 Q94 D95 | E87-E91 PolarHBondContact O-N 3.43Å; I88-E91 PolarHBondContact O-N 2.99Å; E91-Q94 PolarHBondContact O-N 3.09Å; E91-D95 PolarHBondContact O-N 3.21Å |
| 92 | M | 94.3 | Very high | 94.3 | Very high | 115 Ų | 115 | 107.7 Ų | 107.7 | 57% | 0.567 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67.1 | -39.6 | 178.4 | -175.2 | 163 | 56.1 | 0 | 0 | 112.4 | I88 M89 K90 Q94 M96 | I88-M92 WeakPolarHBondContact O-CB 3.44Å; I88-M92 PolarHBondContact O-N 2.98Å; M89-M92 PolarHBondContact O-N 2.79Å; K90-M92 VanDerWaalsContact C-N 3.32Å; K90-M92 PolarHBondContact O-N 3.35Å; M92-Q94 VanDerWaalsContact C-N 3.33Å; M92-M96 WeakPolarHBondContact O-CG 3.45Å; M92-M96 PolarHBondContact O-N 2.98Å; M92-M96 VanDerWaalsContact O-N 3.15Å |
| 93 | Q | 94.1 | Very high | 94.1 | Very high | 118 Ų | 118 | 108.6 Ų | 108.6 | 55% | 0.551 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.2 | -44.1 | 171.6 | -79.1 | 177.8 | -15.8 | 0 | 0 | 111.2 | M89 K90 M96 D97 | M89-Q93 WeakPolarHBondContact O-CG 3.41Å; M89-Q93 PolarHBondContact O-N 3.09Å; K90-Q93 PolarHBondContact O-N 2.71Å; Q93-M96 PolarHBondContact O-N 3.39Å; Q93-D97 WeakPolarHBondContact O-CB 3.36Å; Q93-D97 VanDerWaalsContact O-CG 3.31Å; Q93-D97 PolarHBondContact O-N 2.76Å |
| 94 | Q | 95.6 | Very high | 93.9 | Very high | 121 Ų | 121 | 104 Ų | 104 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.2 | -43.1 | 178.6 | -174.1 | 177.9 | -17.7 | 0 | 0 | 112.8 | K90 E91 M92 M96 D97 E98 | K90-Q94 WeakPolarHBondContact O-CB 3.49Å; K90-Q94 PolarHBondContact O-N 3.31Å; E91-Q94 PolarHBondContact O-N 3.09Å; M92-Q94 VanDerWaalsContact C-N 3.33Å; Q94-M96 PolarHBondContact O-N 2.91Å; Q94-D97 PolarHBondContact O-N 3.45Å; Q94-E98 WeakPolarHBondContact O-CB 3.31Å; Q94-E98 PolarHBondContact O-N 3.12Å |
| 95 | D | 96.1 | Very high | 93.6 | Very high | 68 Ų | 68 | 102.4 Ų | 102.4 | 36% | 0.364 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 176.6 | 171.5 | 80.6 | 0 | 0 | 0 | 111.9 | E91 E98 K99 | E91-D95 PolarHBondContact O-N 3.21Å; D95-E98 PolarHBondContact O-N 3.06Å; D95-K99 VanDerWaalsContact CG-NZ 3.29Å; D95-K99 WeakPolarHBondContact O-CB 3.4Å; D95-K99 WeakPolarHBondContact O-CG 3.46Å; D95-K99 PolarHBondContact O-N 3.14Å; D95-K99 VanDerWaalsContact OD1-CE 3.31Å; D95-K99 WeakPolarHBondContact OD1-CE 3.22Å; D95-K99 IonicContact OD1-NZ 3Å; D95-K99 PolarHBondContact OD1-NZ 2.9Å; D95-K99 WeakPolarHBondContact OD2-CE 3.46Å; D95-K99 IonicContact OD2-NZ 2.73Å; D95-K99 PolarHBondContact OD2-NZ 2.96Å |
| 96 | M | 94.5 | Very high | 93.2 | Very high | 114 Ų | 114 | 100 Ų | 100 | 56% | 0.562 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.9 | -41.8 | 176.4 | -69.8 | -164.7 | -37.9 | 0 | 0 | 111.9 | M92 Q93 Q94 K99 M100 | M92-M96 WeakPolarHBondContact O-CG 3.45Å; M92-M96 PolarHBondContact O-N 2.98Å; M92-M96 VanDerWaalsContact O-N 3.15Å; Q93-M96 PolarHBondContact O-N 3.39Å; Q94-M96 PolarHBondContact O-N 2.91Å; M96-K99 PolarHBondContact O-N 2.96Å; M96-M100 WeakPolarHBondContact O-CB 3.21Å; M96-M100 PolarHBondContact O-N 3.01Å |
| 97 | D | 94.7 | Very high | 92.4 | Very high | 103 Ų | 103 | 101.2 Ų | 101.2 | 55% | 0.551 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.8 | -44 | 177.3 | -74 | -15.6 | 0 | 0 | 0 | 110.9 | Q93 Q94 K99 M100 D101 | Q93-D97 WeakPolarHBondContact O-CB 3.36Å; Q93-D97 VanDerWaalsContact O-CG 3.31Å; Q93-D97 PolarHBondContact O-N 2.76Å; Q94-D97 PolarHBondContact O-N 3.45Å; D97-K99 PolarHBondContact O-N 3.43Å; D97-M100 WeakPolarHBondContact O-CB 3.4Å; D97-M100 PolarHBondContact O-N 3.28Å; D97-D101 PolarHBondContact O-N 3.42Å |
| 98 | E | 94.3 | Very high | 91.6 | Very high | 122 Ų | 122 | 104.5 Ų | 104.5 | 57% | 0.57 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.3 | -44.7 | 176.1 | -175.3 | 173.2 | -178.3 | 0 | 0 | 111.6 | Q94 D95 M100 D101 V102 | Q94-E98 WeakPolarHBondContact O-CB 3.31Å; Q94-E98 PolarHBondContact O-N 3.12Å; D95-E98 PolarHBondContact O-N 3.06Å; E98-M100 VanDerWaalsContact C-N 3.32Å; E98-M100 PolarHBondContact O-N 2.9Å; E98-D101 PolarHBondContact O-N 3.41Å; E98-V102 WeakPolarHBondContact O-CG2 3.44Å; E98-V102 PolarHBondContact O-N 2.85Å |
| 99 | K | 93.1 | Very high | 90.5 | Very high | 121 Ų | 121 | 104.9 Ų | 104.9 | 53% | 0.526 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.7 | -38 | 175.8 | -77.3 | 172.7 | 179.3 | 154.7 | 0 | 112.3 | D95 M96 D97 L103 | D95-K99 VanDerWaalsContact CG-NZ 3.29Å; D95-K99 WeakPolarHBondContact O-CB 3.4Å; D95-K99 WeakPolarHBondContact O-CG 3.46Å; D95-K99 PolarHBondContact O-N 3.14Å; D95-K99 VanDerWaalsContact OD1-CE 3.31Å; D95-K99 WeakPolarHBondContact OD1-CE 3.22Å; D95-K99 IonicContact OD1-NZ 3Å; D95-K99 PolarHBondContact OD1-NZ 2.9Å; D95-K99 WeakPolarHBondContact OD2-CE 3.46Å; D95-K99 IonicContact OD2-NZ 2.73Å; D95-K99 PolarHBondContact OD2-NZ 2.96Å; M96-K99 PolarHBondContact O-N 2.96Å; D97-K99 PolarHBondContact O-N 3.43Å; K99-L103 WeakPolarHBondContact O-CG 3.34Å; K99-L103 PolarHBondContact O-N 3.31Å; K99-L103 VanDerWaalsContact O-N 3.13Å |
| 100 | M | 94.4 | Very high | 89 | Confident | 106 Ų | 106 | 105.3 Ų | 105.3 | 52% | 0.522 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.7 | -46.8 | 175.1 | -176.8 | 62.9 | 68.1 | 0 | 0 | 111.1 | M96 D97 E98 V102 L103 I104 | M96-M100 WeakPolarHBondContact O-CB 3.21Å; M96-M100 PolarHBondContact O-N 3.01Å; D97-M100 WeakPolarHBondContact O-CB 3.4Å; D97-M100 PolarHBondContact O-N 3.28Å; E98-M100 VanDerWaalsContact C-N 3.32Å; E98-M100 PolarHBondContact O-N 2.9Å; M100-V102 VanDerWaalsContact C-N 3.33Å; M100-V102 PolarHBondContact O-N 3.19Å; M100-L103 PolarHBondContact O-N 3.2Å; M100-I104 HydrophobicContact CG-CD1 3.92Å; M100-I104 WeakPolarHBondContact O-CG1 3.29Å; M100-I104 PolarHBondContact O-N 3.35Å; M100-I104 HydrophobicContact SD-CD1 4.33Å; M100-I104 HydrophobicContact SD-CG1 4.5Å |
| 101 | D | 93.3 | Very high | 87.2 | Confident | 107 Ų | 107 | 106 Ų | 106 | 57% | 0.572 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.9 | -40.7 | 179.8 | -81.8 | -16.9 | 0 | 0 | 0 | 112.1 | D97 E98 L103 I104 N105 | D97-D101 PolarHBondContact O-N 3.42Å; E98-D101 PolarHBondContact O-N 3.41Å; D101-L103 PolarHBondContact O-N 2.94Å; D101-I104 PolarHBondContact O-N 3.45Å; D101-N105 WeakPolarHBondContact O-CB 3.18Å; D101-N105 PolarHBondContact O-N 2.83Å |
| 102 | V | 92.4 | Very high | 85.3 | Confident | 76 Ų | 76 | 106.7 Ų | 106.7 | 46% | 0.461 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | 174.7 | 171.4 | 0 | 0 | 0 | 0 | 111.4 | E98 M100 N105 N106 | E98-V102 WeakPolarHBondContact O-CG2 3.44Å; E98-V102 PolarHBondContact O-N 2.85Å; M100-V102 VanDerWaalsContact C-N 3.33Å; M100-V102 PolarHBondContact O-N 3.19Å; V102-N105 PolarHBondContact O-N 2.95Å; V102-N106 VanDerWaalsContact CG1-ND2 3.34Å; V102-N106 WeakPolarHBondContact CG1-ND2 3.38Å; V102-N106 WeakPolarHBondContact O-CB 3.41Å; V102-N106 VanDerWaalsContact O-CG 3.32Å; V102-N106 PolarHBondContact O-N 3.14Å; V102-N106 PolarHBondContact O-ND2 2.9Å |
| 103 | L | 90.2 | Very high | 83.3 | Confident | 118 Ų | 118 | 105.1 Ų | 105.1 | 62% | 0.618 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.3 | -43.3 | 177.1 | -70.8 | 174.3 | 0 | 0 | 0 | 112 | K99 M100 D101 N106 Q107 | K99-L103 WeakPolarHBondContact O-CG 3.34Å; K99-L103 PolarHBondContact O-N 3.31Å; K99-L103 VanDerWaalsContact O-N 3.13Å; M100-L103 PolarHBondContact O-N 3.2Å; D101-L103 PolarHBondContact O-N 2.94Å; L103-N106 PolarHBondContact O-N 3.45Å; L103-Q107 WeakPolarHBondContact O-CB 3.37Å; L103-Q107 PolarHBondContact O-N 2.75Å |
| 104 | I | 90.1 | Very high | 81 | Confident | 61 Ų | 61 | 107.2 Ų | 107.2 | 31% | 0.313 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61.6 | -45.2 | 176.3 | -69.6 | 170.5 | 0 | 0 | 0 | 110.5 | M100 D101 Q107 K108 | M100-I104 HydrophobicContact CG-CD1 3.92Å; M100-I104 WeakPolarHBondContact O-CG1 3.29Å; M100-I104 PolarHBondContact O-N 3.35Å; M100-I104 HydrophobicContact SD-CD1 4.33Å; M100-I104 HydrophobicContact SD-CG1 4.5Å; D101-I104 PolarHBondContact O-N 3.45Å; I104-Q107 PolarHBondContact O-N 2.93Å; I104-K108 HydrophobicContact CG2-CD 4.06Å; I104-K108 WeakPolarHBondContact O-CG 3.41Å; I104-K108 PolarHBondContact O-N 2.95Å |
| 105 | N | 88.4 | Confident | 78.9 | Confident | 90 Ų | 90 | 109.2 Ų | 109.2 | 48% | 0.481 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -65.5 | -45.9 | -179.7 | -169.3 | 37.8 | 0 | 0 | 0 | 111.3 | D101 V102 Q107 K108 N109 | D101-N105 WeakPolarHBondContact O-CB 3.18Å; D101-N105 PolarHBondContact O-N 2.83Å; V102-N105 PolarHBondContact O-N 2.95Å; N105-Q107 VanDerWaalsContact C-N 3.31Å; N105-Q107 PolarHBondContact O-N 3.38Å; N105-K108 PolarHBondContact O-N 2.95Å; N105-N109 PolarHBondContact O-N 3.4Å; N105-N109 PolarHBondContact O-ND2 3.32Å; N105-N109 PolarHBondContact OD1-ND2 3.46Å; N105-N109 VanDerWaalsContact OD1-ND2 3.08Å |
| 106 | N | 84.5 | Confident | 76.5 | Confident | 78 Ų | 78 | 112.3 Ų | 112.3 | 42% | 0.417 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.9 | -39.8 | 175.4 | -76 | -41.6 | 0 | 0 | 0 | 112 | V102 L103 N109 N110 | V102-N106 VanDerWaalsContact CG1-ND2 3.34Å; V102-N106 WeakPolarHBondContact CG1-ND2 3.38Å; V102-N106 WeakPolarHBondContact O-CB 3.41Å; V102-N106 VanDerWaalsContact O-CG 3.32Å; V102-N106 PolarHBondContact O-N 3.14Å; V102-N106 PolarHBondContact O-ND2 2.9Å; L103-N106 PolarHBondContact O-N 3.45Å; N106-N109 PolarHBondContact O-N 2.89Å; N106-N110 WeakPolarHBondContact O-CB 3.41Å; N106-N110 PolarHBondContact O-N 3.34Å; N106-N110 PolarHBondContact O-ND2 3.1Å; N106-N110 VanDerWaalsContact O-ND2 3.08Å |
| 107 | Q | 78.4 | Confident | 74.2 | Confident | 108 Ų | 108 | 112.6 Ų | 112.6 | 51% | 0.505 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.2 | -39.7 | 175.3 | -167.3 | -173.2 | 33.5 | 0 | 0 | 112.5 | L103 I104 N105 K111 | L103-Q107 WeakPolarHBondContact O-CB 3.37Å; L103-Q107 PolarHBondContact O-N 2.75Å; I104-Q107 PolarHBondContact O-N 2.93Å; N105-Q107 VanDerWaalsContact C-N 3.31Å; N105-Q107 PolarHBondContact O-N 3.38Å; Q107-K111 HydrophobicContact CG-CD 4.42Å; Q107-K111 WeakPolarHBondContact O-CB 3.39Å; Q107-K111 WeakPolarHBondContact O-CG 3.07Å; Q107-K111 PolarHBondContact O-N 3.41Å |
| 108 | K | 78.8 | Confident | 71.7 | Confident | 133 Ų | 133 | 110.6 Ų | 110.6 | 58% | 0.578 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -65.8 | -42.7 | 176.8 | -76.3 | 173.9 | 179.7 | 172.9 | 0 | 111.7 | I104 N105 K111 | I104-K108 HydrophobicContact CG2-CD 4.06Å; I104-K108 WeakPolarHBondContact O-CG 3.41Å; I104-K108 PolarHBondContact O-N 2.95Å; N105-K108 PolarHBondContact O-N 2.95Å; K108-K111 PolarHBondContact O-N 3.45Å |
| 109 | N | 70.1 | Confident | 69.4 | Low | 90 Ų | 90 | 112.2 Ų | 112.2 | 48% | 0.481 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -70.7 | -35.8 | 178.4 | -65.9 | -43.7 | 0 | 0 | 0 | 112.2 | N105 N106 | N105-N109 PolarHBondContact O-N 3.4Å; N105-N109 PolarHBondContact O-ND2 3.32Å; N105-N109 PolarHBondContact OD1-ND2 3.46Å; N105-N109 VanDerWaalsContact OD1-ND2 3.08Å; N106-N109 PolarHBondContact O-N 2.89Å |
| 110 | N | 59.9 | Low | 67.2 | Low | 121 Ų | 121 | 113.4 Ų | 113.4 | 65% | 0.647 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -77.5 | -17.8 | 176.9 | -67.4 | -23.8 | 0 | 0 | 0 | 114.2 | N106 P113 | N106-N110 WeakPolarHBondContact O-CB 3.41Å; N106-N110 PolarHBondContact O-N 3.34Å; N106-N110 PolarHBondContact O-ND2 3.1Å; N106-N110 VanDerWaalsContact O-ND2 3.08Å; N110-P113 WeakPolarHBondContact O-CD 3.43Å |
| 111 | K | 58.8 | Low | 64.8 | Low | 133 Ų | 133 | 115.5 Ų | 115.5 | 58% | 0.578 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -84.5 | -14 | 174.1 | -84.5 | -177.3 | 177.6 | -176.7 | 0 | 113.6 | Q107 K108 F114 | Q107-K111 HydrophobicContact CG-CD 4.42Å; Q107-K111 WeakPolarHBondContact O-CB 3.39Å; Q107-K111 WeakPolarHBondContact O-CG 3.07Å; Q107-K111 PolarHBondContact O-N 3.41Å; K108-K111 PolarHBondContact O-N 3.45Å; K111-F114 PolarHBondContact O-N 3.29Å |
| 112 | L | 55 | Low | 62.7 | Low | 138 Ų | 138 | 116.7 Ų | 116.7 | 72% | 0.723 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -19.7 | 179.6 | -121.9 | 87.8 | 0 | 0 | 0 | 116.2 | ||
| 113 | P | 52.1 | Low | 60.4 | Low | 82 Ų | 82 | 121.1 Ų | 121.1 | 53% | 0.532 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.9 | -22.1 | 170.7 | -7.9 | 25.4 | 0 | 0 | 0 | 113.3 | N110 | N110-P113 WeakPolarHBondContact O-CD 3.43Š|
| 114 | F | 47.3 | Very low | 57.8 | Low | 161 Ų | 161 | 124 Ų | 124 | 71% | 0.706 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -83.8 | -18.2 | -163.6 | -142.2 | -90.3 | 0 | 0 | 0 | 114.6 | K111 | K111-F114 PolarHBondContact O-N 3.29Å |
| 115 | Q | 50 | Low | 55.4 | Low | 164 Ų | 164 | 132.5 Ų | 132.5 | 77% | 0.766 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -85.1 | -18.5 | -177.8 | -157.6 | 172.5 | 13.2 | 0 | 0 | 113.6 | ||
| 116 | N | 46.9 | Very low | 53.4 | Low | 133 Ų | 133 | 135.7 Ų | 135.7 | 71% | 0.711 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -98.9 | -21.2 | 179.1 | -74.9 | -25.9 | 0 | 0 | 0 | 114 | ||
| 117 | Q | 44.6 | Very low | 51.5 | Low | 119 Ų | 119 | 140 Ų | 140 | 56% | 0.556 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -86.4 | -25.6 | -178 | -157.1 | 174.4 | 20.7 | 0 | 0 | 114 | K119 E120 | Q117-K119 PolarHBondContact O-N 3.25Å; Q117-E120 PolarHBondContact O-N 3.02Å |
| 118 | A | 43.4 | Very low | 49.7 | Very low | 61 Ų | 61 | 137.8 Ų | 137.8 | 50% | 0.504 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -66.5 | -16.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 119 | K | 45.2 | Very low | 47.7 | Very low | 156 Ų | 156 | 141.5 Ų | 141.5 | 68% | 0.678 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -87.3 | -11.8 | 176.7 | -71.6 | -176.2 | 179.3 | 176.6 | 0 | 114.2 | Q117 | Q117-K119 PolarHBondContact O-N 3.25Å |
| 120 | E | 46.6 | Very low | 46 | Very low | 146 Ų | 146 | 146 Ų | 146 | 68% | 0.682 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -98.2 | -37.7 | 179 | -87 | -170.4 | 143.5 | 0 | 0 | 113.6 | Q117 Q122 K123 | Q117-E120 PolarHBondContact O-N 3.02Å; E120-Q122 VanDerWaalsContact C-N 3.34Å; E120-Q122 PolarHBondContact O-N 3.25Å; E120-K123 PolarHBondContact O-N 3.3Å |
| 121 | Q | 44.8 | Very low | 44.9 | Very low | 150 Ų | 150 | 146.2 Ų | 146.2 | 70% | 0.701 | 71% | 0.711 | S | S | * | * | H | α-helix | trans | -68.6 | -30.3 | 178.9 | -75.4 | -154.1 | -2.7 | 0 | 0 | 113.7 | K123 F124 | Q121-K123 VanDerWaalsContact C-N 3.26Å; Q121-K123 PolarHBondContact O-N 3.16Å; Q121-F124 PolarHBondContact O-N 3.17Å |
| 122 | Q | 49.5 | Very low | 43.8 | Very low | 132 Ų | 132 | 148.7 Ų | 148.7 | 62% | 0.617 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -69.3 | -22.7 | 176.6 | -170.4 | 175.5 | -5.9 | 0 | 0 | 112.9 | E120 | E120-Q122 VanDerWaalsContact C-N 3.34Å; E120-Q122 PolarHBondContact O-N 3.25Å |
| 123 | K | 43 | Very low | 42.7 | Very low | 169 Ų | 169 | 145.5 Ų | 145.5 | 74% | 0.735 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -80.2 | -21.6 | 176.4 | -70.5 | -177.8 | -179.6 | -179.6 | 0 | 113.1 | E120 Q121 | E120-K123 PolarHBondContact O-N 3.3Å; Q121-K123 VanDerWaalsContact C-N 3.26Å; Q121-K123 PolarHBondContact O-N 3.16Å |
| 124 | F | 36.1 | Very low | 42 | Very low | 180 Ų | 180 | 147.9 Ų | 147.9 | 79% | 0.789 | 74% | 0.741 | S | S | * | * | H | α-helix | trans | -81.2 | -32.1 | 179 | -165.1 | -100.4 | 0 | 0 | 0 | 112.5 | Q121 | Q121-F124 PolarHBondContact O-N 3.17Å |
| 125 | W | 39.4 | Very low | 41.7 | Very low | 239 Ų | 239 | 149.5 Ų | 149.5 | 91% | 0.905 | 75% | 0.751 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | -13.6 | -173.8 | -138.4 | 46.2 | 0 | 0 | 0 | 114.7 | ||
| 126 | Q | 47.6 | Very low | 40.8 | Very low | 156 Ų | 156 | 146.8 Ų | 146.8 | 73% | 0.729 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | 1.5 | -179.3 | -67.2 | -163.1 | 7.4 | 0 | 0 | 114.8 | ||
| 127 | L | 44.2 | Very low | 40.1 | Very low | 168 Ų | 168 | 148.1 Ų | 148.1 | 88% | 0.88 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -112.6 | 62.5 | -180 | -156.4 | 75.3 | 0 | 0 | 0 | 111.2 | ||
| 128 | G | 39.6 | Very low | 39.5 | Very low | 62 Ų | 62 | 150.7 Ų | 150.7 | 64% | 0.639 | 78% | 0.776 | S | S | * | * | trans | -170.5 | 84.2 | -177.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 129 | K | 38 | Very low | 38.8 | Very low | 212 Ų | 212 | 152 Ų | 152 | 92% | 0.922 | 78% | 0.778 | S | S | * | * | trans | 92.5 | 124.9 | 139.5 | -61.7 | -89.4 | -179.1 | 169.6 | 0 | 120.3 | ||||
| 130 | M | 34.7 | Very low | 37.9 | Very low | 184 Ų | 184 | 153.3 Ų | 153.3 | 91% | 0.906 | 79% | 0.787 | S | S | * | * | trans | -74.2 | 147.1 | 165.6 | -87.6 | 149.3 | 106 | 0 | 0 | 114.1 | ||||
| 131 | D | 35.8 | Very low | 37.3 | Very low | 126 Ų | 126 | 154.6 Ų | 154.6 | 67% | 0.674 | 79% | 0.793 | S | S | * | * | 74.2 | 143.8 | 129 | -152.4 | 26.2 | 0 | 0 | 0 | 123.8 | |||||
| 132 | K | 36.2 | Very low | 37.6 | Very low | 184 Ų | 184 | 152.5 Ų | 152.5 | 80% | 0.8 | 79% | 0.792 | S | S | * | * | trans | 76 | 113.1 | 159.5 | -81 | 156.6 | -174.5 | 169 | 0 | 122.9 | ||||
| 133 | G | 31.5 | Very low | 36.6 | Very low | 71 Ų | 71 | 153.7 Ų | 153.7 | 73% | 0.732 | 80% | 0.803 | S | S | * | * | 105.2 | 121.8 | 104.5 | 0 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 134 | S | 37.5 | Very low | 35.9 | Very low | 133 Ų | 133 | 148.9 Ų | 148.9 | 93% | 0.93 | 80% | 0.801 | S | S | * | * | trans | 108.8 | 127.9 | 136.1 | -55.6 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 135 | Q | 40.5 | Very low | 36 | Very low | 194 Ų | 194 | 145 Ų | 145 | 91% | 0.907 | 80% | 0.802 | S | S | * | * | trans | -59.7 | 159.5 | 170 | -92.5 | 171.2 | 18.3 | 0 | 0 | 115.1 | ||||
| 136 | A | 31.7 | Very low | 36.1 | Very low | 108 Ų | 108 | 139 Ų | 139 | 89% | 0.893 | 79% | 0.794 | S | S | * | * | 174.4 | 153.3 | 112.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 137 | M | 31.8 | Very low | 35.3 | Very low | 160 Ų | 160 | 139.8 Ų | 139.8 | 79% | 0.788 | 80% | 0.802 | S | S | * | * | trans | -106.3 | 145.1 | -169.1 | 175.2 | -165.9 | -160.7 | 0 | 0 | 109.5 | ||||
| 138 | I | 31.5 | Very low | 34.7 | Very low | 174 Ų | 174 | 136.3 Ų | 136.3 | 89% | 0.892 | 80% | 0.797 | S | S | * | * | trans | -143 | 136.8 | 154.5 | -59.8 | -174.8 | 0 | 0 | 0 | 109.9 | ||||
| 139 | T | 29.2 | Very low | 34.3 | Very low | 87 Ų | 87 | 138.6 Ų | 138.6 | 53% | 0.534 | 80% | 0.803 | S | S | . | * | trans | -115.4 | 153.5 | -172.9 | -31.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 140 | E | 27.7 | Very low | 34 | Very low | 185 Ų | 185 | 133.8 Ų | 133.8 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | 97.5 | 134.6 | 146.1 | -50.3 | -133.8 | 161.8 | 0 | 0 | 123.5 | ||||
| 141 | E | 32.8 | Very low | 34.3 | Very low | 173 Ų | 173 | 133.4 Ų | 133.4 | 81% | 0.808 | 78% | 0.78 | S | S | * | * | trans | -74.9 | -160.2 | 175.5 | -134.4 | -148.8 | 125.6 | 0 | 0 | 111.3 | ||||
| 142 | P | 50.7 | Low | 34.2 | Very low | 105 Ų | 105 | 134.1 Ų | 134.1 | 68% | 0.682 | 78% | 0.784 | S | S | * | * | cis | -140.2 | 179.5 | -5.7 | 35.6 | -13.6 | 0 | 0 | 0 | 116.9 | ||||
| 143 | D | 28.5 | Very low | 34 | Very low | 158 Ų | 158 | 131.6 Ų | 131.6 | 85% | 0.845 | 78% | 0.784 | S | S | * | * | trans | 127.3 | 130.6 | 132.3 | -153.1 | 17.1 | 0 | 0 | 0 | 117.6 | ||||
| 144 | G | 29.2 | Very low | 34.5 | Very low | 68 Ų | 68 | 134.4 Ų | 134.4 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | 157.8 | 21.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 145 | A | 37 | Very low | 34.8 | Very low | 97 Ų | 97 | 133.5 Ų | 133.5 | 80% | 0.802 | 78% | 0.777 | S | S | * | * | trans | 63.3 | 154.7 | 151.6 | 0 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 146 | P | 42.8 | Very low | 34.6 | Very low | 114 Ų | 114 | 130.2 Ų | 130.2 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | trans | -127.4 | -180 | -137.1 | 43.2 | -29 | 0 | 0 | 0 | 115.7 | ||||
| 147 | L | 29.9 | Very low | 34.8 | Very low | 172 Ų | 172 | 134.7 Ų | 134.7 | 90% | 0.901 | 77% | 0.772 | S | S | * | * | trans | 144.7 | 119 | 149.8 | -78.8 | 155.5 | 0 | 0 | 0 | 107.9 | ||||
| 148 | A | 32.3 | Very low | 35.1 | Very low | 95 Ų | 95 | 132.5 Ų | 132.5 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | cis | -144.6 | 130.9 | 29.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 149 | C | 30.4 | Very low | 35.3 | Very low | 111 Ų | 111 | 130.2 Ų | 130.2 | 75% | 0.75 | 76% | 0.764 | S | S | * | * | trans | -33.9 | 156.7 | 149 | -68.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 150 | D | 32.9 | Very low | 35.2 | Very low | 111 Ų | 111 | 137.6 Ų | 137.6 | 59% | 0.594 | 78% | 0.782 | S | S | * | * | cis | 176.7 | 161.8 | 8.8 | -111 | -36.8 | 0 | 0 | 0 | 103.1 | ||||
| 151 | K | 39.4 | Very low | 35.6 | Very low | 175 Ų | 175 | 136.4 Ų | 136.4 | 76% | 0.761 | 78% | 0.782 | S | S | * | * | cis | -167.3 | 153.1 | 27 | -124.9 | 155.2 | -136.4 | -175 | 0 | 107.5 | ||||
| 152 | N | 34.2 | Very low | 36 | Very low | 142 Ų | 142 | 133.6 Ų | 133.6 | 76% | 0.759 | 78% | 0.779 | S | S | * | * | trans | -97.4 | -168.9 | -162.7 | -57.9 | -58.1 | 0 | 0 | 0 | 114.3 | ||||
| 153 | V | 33.3 | Very low | 35.5 | Very low | 131 Ų | 131 | 136.2 Ų | 136.2 | 79% | 0.794 | 79% | 0.786 | S | S | * | * | trans | 115.2 | 96 | 145.7 | -174.5 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 154 | V | 40.6 | Very low | 35.7 | Very low | 129 Ų | 129 | 137 Ų | 137 | 78% | 0.782 | 79% | 0.785 | S | S | * | * | 75.7 | 135.1 | 69.1 | 175 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 155 | P | 44.1 | Very low | 36.4 | Very low | 114 Ų | 114 | 139.2 Ų | 139.2 | 74% | 0.74 | 79% | 0.789 | S | S | * | * | trans | -100 | 167.8 | -160.7 | 39.1 | -30.1 | 0 | 0 | 0 | 113.9 | ||||
| 156 | P | 36.3 | Very low | 36.4 | Very low | 126 Ų | 126 | 142.6 Ų | 142.6 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -126.6 | 144 | 155.7 | 34.9 | -21 | 0 | 0 | 0 | 113.7 | ||||
| 157 | K | 36.6 | Very low | 36.8 | Very low | 202 Ų | 202 | 145 Ų | 145 | 88% | 0.878 | 79% | 0.794 | S | S | * | * | trans | -112.4 | 139.2 | 152.8 | -103.6 | -179.5 | 178.5 | 173.3 | 0 | 106.5 | ||||
| 158 | P | 37.8 | Very low | 37.3 | Very low | 113 Ų | 113 | 142.1 Ų | 142.1 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | -152.5 | 147.4 | 96.1 | 33.1 | -12 | 0 | 0 | 0 | 117.1 | |||||
| 159 | T | 35.2 | Very low | 37.5 | Very low | 127 Ų | 127 | 142.5 Ų | 142.5 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | trans | 52.3 | 112.2 | 141.3 | -29.1 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 160 | R | 27.8 | Very low | 38.2 | Very low | 242 Ų | 242 | 145.8 Ų | 145.8 | 91% | 0.913 | 79% | 0.786 | S | S | * | * | 175.3 | 119.1 | 125.6 | -93.9 | 165 | -170.2 | 151.8 | 2.7 | 110.6 | |||||
| 161 | N | 35.3 | Very low | 39 | Very low | 160 Ų | 160 | 145.6 Ų | 145.6 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | -74.5 | 159.7 | 153.6 | -62.4 | -29.2 | 0 | 0 | 0 | 107.4 | ||||
| 162 | P | 41 | Very low | 39.2 | Very low | 114 Ų | 114 | 142.3 Ų | 142.3 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | cis | -146.2 | 169.2 | 33.6 | 39.4 | -18.4 | 0 | 0 | 0 | 117.1 | ||||
| 163 | L | 40.4 | Very low | 39.5 | Very low | 159 Ų | 159 | 141.3 Ų | 141.3 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | trans | 71 | 143.6 | 162.1 | -118.4 | 83 | 0 | 0 | 0 | 118.9 | ||||
| 164 | E | 33.3 | Very low | 40.2 | Very low | 176 Ų | 176 | 144.4 Ų | 144.4 | 82% | 0.822 | 80% | 0.799 | S | S | * | * | trans | 70 | 100 | 164.1 | -66.8 | -174.4 | 146 | 0 | 0 | 118.9 | ||||
| 165 | S | 44.7 | Very low | 40.7 | Very low | 114 Ų | 114 | 143.2 Ų | 143.2 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | 159.6 | 108.6 | 103.6 | 53.7 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 166 | L | 36.9 | Very low | 40.8 | Very low | 167 Ų | 167 | 146.9 Ų | 146.9 | 87% | 0.874 | 80% | 0.797 | S | S | * | * | trans | -160.6 | 81 | 157.1 | -97.5 | 171.7 | 0 | 0 | 0 | 106.7 | ||||
| 167 | H | 49.5 | Very low | 41.7 | Very low | 165 Ų | 165 | 147.4 Ų | 147.4 | 76% | 0.764 | 80% | 0.798 | S | S | * | * | trans | -69.8 | 132 | 150.2 | -108.2 | -79.5 | 0 | 0 | 0 | 106.9 | ||||
| 168 | P | 41.9 | Very low | 42.6 | Very low | 111 Ų | 111 | 141.1 Ų | 141.1 | 72% | 0.721 | 78% | 0.778 | S | S | * | * | -145.2 | 163.1 | 114.5 | 33.5 | -16.7 | 0 | 0 | 0 | 114.7 | |||||
| 169 | C | 35.2 | Very low | 43.7 | Very low | 103 Ų | 103 | 140.4 Ų | 140.4 | 70% | 0.696 | 78% | 0.775 | S | S | * | * | trans | 88.9 | 64.2 | 165.9 | -146.2 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 170 | Q | 46.5 | Very low | 45.2 | Very low | 181 Ų | 181 | 140.4 Ų | 140.4 | 85% | 0.846 | 77% | 0.769 | S | S | * | * | trans | -97.7 | 68.9 | 157.4 | -173.6 | 178.3 | -0.2 | 0 | 0 | 109.2 | ||||
| 171 | S | 49.8 | Very low | 47.1 | Very low | 107 Ų | 107 | 130.6 Ų | 130.6 | 75% | 0.748 | 74% | 0.744 | S | S | * | * | trans | -167 | 24.3 | 163.4 | 89 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 172 | C | 43.9 | Very low | 49.1 | Very low | 106 Ų | 106 | 124.9 Ų | 124.9 | 72% | 0.716 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -132 | 48.4 | -176.5 | -74.9 | 0 | 0 | 0 | 0 | 114.5 | ||
| 173 | C | 39.3 | Very low | 51 | Low | 121 Ų | 121 | 124.7 Ų | 124.7 | 82% | 0.818 | 71% | 0.707 | S | S | * | * | trans | -166.1 | 67.7 | 159.2 | -115.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 174 | E | 48.4 | Very low | 52.8 | Low | 195 Ų | 195 | 123.4 Ų | 123.4 | 91% | 0.911 | 69% | 0.694 | S | S | * | * | trans | -100.9 | 72.7 | 160.3 | -82.1 | -175.8 | 156.2 | 0 | 0 | 108.9 | ||||
| 175 | T | 50.5 | Low | 55.2 | Low | 104 Ų | 104 | 118.4 Ų | 118.4 | 64% | 0.638 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -156 | 106.4 | 161 | 33.7 | 0 | 0 | 0 | 0 | 110.4 | ||
| 176 | F | 47.2 | Very low | 57.3 | Low | 191 Ų | 191 | 118.5 Ų | 118.5 | 84% | 0.838 | 67% | 0.667 | S | S | * | * | trans | 55.8 | 77.7 | 156.8 | -54 | -79.6 | 0 | 0 | 0 | 117.2 | P178 | F176-P178 VanDerWaalsContact O-CD 3.28Å; F176-P178 WeakPolarHBondContact O-CD 3.23Å | ||
| 177 | T | 54.5 | Low | 59.8 | Low | 137 Ų | 137 | 114.5 Ų | 114.5 | 84% | 0.84 | 65% | 0.649 | S | S | * | * | trans | -83.5 | 104 | 140.3 | 25.2 | 0 | 0 | 0 | 0 | 107.4 | C179 | T177-C179 PolarHBondContact O-N 2.86Š| ||
| 178 | P | 54.9 | Low | 61.8 | Low | 71 Ų | 71 | 111.2 Ų | 111.2 | 46% | 0.461 | 64% | 0.641 | S | S | . | * | trans | -60.9 | 116.6 | 160.2 | -6 | 23.3 | 0 | 0 | 0 | 104.3 | F176 L180 F183 | F176-P178 VanDerWaalsContact O-CD 3.28Å; F176-P178 WeakPolarHBondContact O-CD 3.23Å; P178-L180 PolarHBondContact O-N 2.83Å; P178-F183 HydrophobicContact CB-CD2 4.12Å; P178-F183 HydrophobicContact CB-CE2 3.49Å; P178-F183 VanDerWaalsContact CB-CE2 3.49Å; P178-F183 HydrophobicContact CB-CZ 3.98Å; P178-F183 HydrophobicContact CG-CE2 3.48Å; P178-F183 VanDerWaalsContact CG-CE2 3.48Å; P178-F183 HydrophobicContact CG-CZ 3.62Å | ||
| 179 | C | 60.9 | Low | 64.2 | Low | 98 Ų | 98 | 113.7 Ų | 113.7 | 66% | 0.662 | 64% | 0.636 | S | S | * | * | trans | -45.4 | 132.9 | -178.2 | -173.3 | 0 | 0 | 0 | 0 | 108.4 | T177 G181 A182 | T177-C179 PolarHBondContact O-N 2.86Å; C179-G181 CarbonylContact O-C 3.58Å; C179-G181 PolarHBondContact O-N 3.13Å; C179-A182 WeakPolarHBondContact O-CB 3.39Å; C179-A182 PolarHBondContact O-N 3.31Å | ||
| 180 | L | 66.8 | Low | 66.7 | Low | 126 Ų | 126 | 111.3 Ų | 111.3 | 66% | 0.66 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -46.5 | -32.2 | -177.9 | -153.6 | 76.6 | 0 | 0 | 0 | 111.7 | P178 A182 F183 F184 | P178-L180 PolarHBondContact O-N 2.83Å; L180-A182 PolarHBondContact O-N 3.15Å; L180-F183 PolarHBondContact O-N 3.21Å; L180-F184 HydrophobicContact CD2-CE2 3.79Å; L180-F184 HydrophobicContact CG-CD2 4.19Å; L180-F184 HydrophobicContact CG-CE2 3.73Å; L180-F184 WeakPolarHBondContact O-CD2 3.16Å; L180-F184 PolarHBondContact O-N 3.23Å; L180-F184 VanDerWaalsContact O-N 3.1Å |
| 181 | G | 68.2 | Low | 68.7 | Low | 37 Ų | 37 | 106.2 Ų | 106.2 | 38% | 0.381 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -60.8 | -34.8 | 173 | 0 | 0 | 0 | 0 | 0 | 115.7 | C179 F184 T185 | C179-G181 CarbonylContact O-C 3.58Å; C179-G181 PolarHBondContact O-N 3.13Å; G181-F184 PolarHBondContact O-N 3.44Å; G181-T185 WeakPolarHBondContact O-CG2 3.28Å; G181-T185 PolarHBondContact O-N 2.93Å; G181-T185 PolarHBondContact O-OG1 3.1Å |
| 182 | A | 78.2 | Confident | 70.4 | Confident | 40 Ų | 40 | 106 Ų | 106 | 33% | 0.331 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -69.7 | -35 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | C179 L180 T185 L186 | C179-A182 WeakPolarHBondContact O-CB 3.39Å; C179-A182 PolarHBondContact O-N 3.31Å; L180-A182 PolarHBondContact O-N 3.15Å; A182-T185 WeakPolarHBondContact CA-OG1 3.24Å; A182-T185 PolarHBondContact O-OG1 3.31Å; A182-L186 WeakPolarHBondContact O-CB 3.2Å; A182-L186 WeakPolarHBondContact O-CG 3.4Å; A182-L186 PolarHBondContact O-N 3.46Å |
| 183 | F | 79.1 | Confident | 72.5 | Confident | 110 Ų | 110 | 106.2 Ų | 106.2 | 48% | 0.482 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -67.7 | -44.6 | 172 | -75.3 | -73.5 | 0 | 0 | 0 | 111.3 | P178 L180 T185 L186 V187 | P178-F183 HydrophobicContact CB-CD2 4.12Å; P178-F183 HydrophobicContact CB-CE2 3.49Å; P178-F183 VanDerWaalsContact CB-CE2 3.49Å; P178-F183 HydrophobicContact CB-CZ 3.98Å; P178-F183 HydrophobicContact CG-CE2 3.48Å; P178-F183 VanDerWaalsContact CG-CE2 3.48Å; P178-F183 HydrophobicContact CG-CZ 3.62Å; L180-F183 PolarHBondContact O-N 3.21Å; F183-T185 VanDerWaalsContact C-N 3.33Å; F183-T185 PolarHBondContact O-N 2.9Å; F183-L186 PolarHBondContact O-N 3Å; F183-V187 WeakPolarHBondContact O-CB 3.44Å; F183-V187 WeakPolarHBondContact O-CG2 3.39Å; F183-V187 PolarHBondContact O-N 2.97Å |
| 184 | F | 79.6 | Confident | 74.8 | Confident | 131 Ų | 131 | 104.5 Ų | 104.5 | 58% | 0.575 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -61.3 | -40.9 | 176 | -79.1 | -65.9 | 0 | 0 | 0 | 112.4 | L180 G181 V188 | L180-F184 HydrophobicContact CD2-CE2 3.79Å; L180-F184 HydrophobicContact CG-CD2 4.19Å; L180-F184 HydrophobicContact CG-CE2 3.73Å; L180-F184 WeakPolarHBondContact O-CD2 3.16Å; L180-F184 PolarHBondContact O-N 3.23Å; L180-F184 VanDerWaalsContact O-N 3.1Å; G181-F184 PolarHBondContact O-N 3.44Å; F184-V188 WeakPolarHBondContact O-CB 3.33Å; F184-V188 WeakPolarHBondContact O-CG2 3.42Å; F184-V188 PolarHBondContact O-N 2.93Å |
| 185 | T | 83.6 | Confident | 76.5 | Confident | 71 Ų | 71 | 102.1 Ų | 102.1 | 44% | 0.436 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -65.8 | -47.2 | 175.8 | 55.5 | 0 | 0 | 0 | 0 | 110.9 | G181 A182 F183 V187 V188 W189 | G181-T185 WeakPolarHBondContact O-CG2 3.28Å; G181-T185 PolarHBondContact O-N 2.93Å; G181-T185 PolarHBondContact O-OG1 3.1Å; A182-T185 WeakPolarHBondContact CA-OG1 3.24Å; A182-T185 PolarHBondContact O-OG1 3.31Å; F183-T185 VanDerWaalsContact C-N 3.33Å; F183-T185 PolarHBondContact O-N 2.9Å; T185-V187 VanDerWaalsContact C-N 3.31Å; T185-V187 PolarHBondContact O-N 2.72Å; T185-V188 PolarHBondContact O-N 2.87Å; T185-W189 WeakPolarHBondContact O-CB 3.1Å; T185-W189 PolarHBondContact O-N 2.93Å |
| 186 | L | 87.9 | Confident | 78 | Confident | 117 Ų | 117 | 101 Ų | 101 | 61% | 0.613 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -59.3 | -40.6 | 178.4 | -72 | 172.1 | 0 | 0 | 0 | 112.7 | A182 F183 S190 | A182-L186 WeakPolarHBondContact O-CB 3.2Å; A182-L186 WeakPolarHBondContact O-CG 3.4Å; A182-L186 PolarHBondContact O-N 3.46Å; F183-L186 PolarHBondContact O-N 3Å; L186-S190 VanDerWaalsContact O-CB 3.29Å; L186-S190 WeakPolarHBondContact O-CB 3.28Å; L186-S190 PolarHBondContact O-N 3.17Å; L186-S190 PolarHBondContact O-OG 2.91Å; L186-S190 VanDerWaalsContact O-OG 3.14Å |
| 187 | V | 90 | Very high | 79.4 | Confident | 82 Ų | 82 | 98.2 Ų | 98.2 | 50% | 0.497 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.8 | -41.1 | 176.6 | 172.4 | 0 | 0 | 0 | 0 | 111.5 | F183 T185 S190 C191 | F183-V187 WeakPolarHBondContact O-CB 3.44Å; F183-V187 WeakPolarHBondContact O-CG2 3.39Å; F183-V187 PolarHBondContact O-N 2.97Å; T185-V187 VanDerWaalsContact C-N 3.31Å; T185-V187 PolarHBondContact O-N 2.72Å; V187-S190 WeakPolarHBondContact CA-OG 3.31Å; V187-S190 PolarHBondContact O-OG 3.46Å; V187-C191 WeakPolarHBondContact O-CB 3.41Å; V187-C191 PolarHBondContact O-N 2.96Å; V187-C191 PolarHBondContact O-SG 3.17Å |
| 188 | V | 91.9 | Very high | 80.2 | Confident | 96 Ų | 96 | 98.7 Ų | 98.7 | 58% | 0.582 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -68 | -42.1 | 177.2 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | F184 T185 F192 | F184-V188 WeakPolarHBondContact O-CB 3.33Å; F184-V188 WeakPolarHBondContact O-CG2 3.42Å; F184-V188 PolarHBondContact O-N 2.93Å; T185-V188 PolarHBondContact O-N 2.87Å; V188-F192 WeakPolarHBondContact O-CB 3.37Å; V188-F192 PolarHBondContact O-N 3.25Å |
| 189 | W | 91.3 | Very high | 80.8 | Confident | 163 Ų | 163 | 97.6 Ų | 97.6 | 62% | 0.617 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -67.2 | -40.1 | 177 | -76.3 | 111.6 | 0 | 0 | 0 | 112 | T185 F192 L193 | T185-W189 WeakPolarHBondContact O-CB 3.1Å; T185-W189 PolarHBondContact O-N 2.93Å; W189-F192 PolarHBondContact O-N 3.32Å; W189-L193 VanDerWaalsContact O-CG 3.31Å; W189-L193 WeakPolarHBondContact O-CG 3.17Å; W189-L193 PolarHBondContact O-N 2.82Å |
| 190 | S | 88.8 | Confident | 80.8 | Confident | 53 Ų | 53 | 99.6 Ų | 99.6 | 37% | 0.371 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.2 | -43.9 | 175.9 | 66.2 | 0 | 0 | 0 | 0 | 111.4 | L186 V187 F192 L193 I194 | L186-S190 VanDerWaalsContact O-CB 3.29Å; L186-S190 WeakPolarHBondContact O-CB 3.28Å; L186-S190 PolarHBondContact O-N 3.17Å; L186-S190 PolarHBondContact O-OG 2.91Å; L186-S190 VanDerWaalsContact O-OG 3.14Å; V187-S190 WeakPolarHBondContact CA-OG 3.31Å; V187-S190 PolarHBondContact O-OG 3.46Å; S190-F192 VanDerWaalsContact C-N 3.33Å; S190-F192 PolarHBondContact O-N 3.33Å; S190-L193 PolarHBondContact O-N 3.01Å; S190-I194 WeakPolarHBondContact O-CD1 3.45Å; S190-I194 VanDerWaalsContact O-CG1 3.25Å; S190-I194 WeakPolarHBondContact O-CG1 3.4Å; S190-I194 PolarHBondContact O-N 2.93Å |
| 191 | C | 88.4 | Confident | 80.3 | Confident | 74 Ų | 74 | 96.2 Ų | 96.2 | 50% | 0.5 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.9 | -41.2 | 173.5 | -73.1 | 0 | 0 | 0 | 0 | 112.4 | V187 Y195 | V187-C191 WeakPolarHBondContact O-CB 3.41Å; V187-C191 PolarHBondContact O-N 2.96Å; V187-C191 PolarHBondContact O-SG 3.17Å; C191-Y195 WeakPolarHBondContact O-CB 3.45Å; C191-Y195 PolarHBondContact O-N 3.25Å |
| 192 | F | 86.3 | Confident | 79.7 | Confident | 104 Ų | 104 | 101.2 Ų | 101.2 | 46% | 0.456 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.7 | -40 | 177.4 | -172.2 | -105.9 | 0 | 0 | 0 | 112.4 | V188 W189 S190 Y195 L196 | V188-F192 WeakPolarHBondContact O-CB 3.37Å; V188-F192 PolarHBondContact O-N 3.25Å; W189-F192 PolarHBondContact O-N 3.32Å; S190-F192 VanDerWaalsContact C-N 3.33Å; S190-F192 PolarHBondContact O-N 3.33Å; F192-Y195 PolarHBondContact O-N 3.09Å; F192-L196 HydrophobicContact CD1-CD1 3.81Å; F192-L196 HydrophobicContact CD1-CG 4.31Å; F192-L196 HydrophobicContact CE1-CD1 3.39Å; F192-L196 HydrophobicContact CE1-CG 4.02Å; F192-L196 HydrophobicContact CZ-CD1 3.98Å; F192-L196 HydrophobicContact CZ-CD2 4.33Å; F192-L196 HydrophobicContact CZ-CG 4.21Å; F192-L196 WeakPolarHBondContact O-CG 3.37Å; F192-L196 PolarHBondContact O-N 2.64Å |
| 193 | L | 87.4 | Confident | 78.5 | Confident | 110 Ų | 110 | 103.9 Ų | 103.9 | 58% | 0.576 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.1 | -41.6 | 176.1 | -73.3 | 171.9 | 0 | 0 | 0 | 112.2 | W189 S190 Y195 L196 Y197 | W189-L193 VanDerWaalsContact O-CG 3.31Å; W189-L193 WeakPolarHBondContact O-CG 3.17Å; W189-L193 PolarHBondContact O-N 2.82Å; S190-L193 PolarHBondContact O-N 3.01Å; L193-Y195 VanDerWaalsContact C-N 3.35Å; L193-L196 PolarHBondContact O-N 3.03Å; L193-Y197 WeakPolarHBondContact O-CB 3.47Å; L193-Y197 PolarHBondContact O-N 3.02Å |
| 194 | I | 88 | Confident | 77.3 | Confident | 85 Ų | 85 | 105.1 Ų | 105.1 | 44% | 0.436 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.8 | -45.6 | 174.3 | -67.9 | 164.4 | 0 | 0 | 0 | 110 | S190 L196 Y197 F198 | S190-I194 WeakPolarHBondContact O-CD1 3.45Å; S190-I194 VanDerWaalsContact O-CG1 3.25Å; S190-I194 WeakPolarHBondContact O-CG1 3.4Å; S190-I194 PolarHBondContact O-N 2.93Å; I194-L196 PolarHBondContact O-N 3.04Å; I194-Y197 PolarHBondContact O-N 2.99Å; I194-F198 HydrophobicContact CG2-CD2 3.68Å; I194-F198 HydrophobicContact CG2-CE2 3.76Å; I194-F198 WeakPolarHBondContact O-CD2 3.35Å; I194-F198 PolarHBondContact O-N 3.21Å |
| 195 | Y | 83.4 | Confident | 75.8 | Confident | 145 Ų | 145 | 107 Ų | 107 | 57% | 0.569 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -59.4 | -46.3 | 176.2 | -179.9 | -97.3 | 0 | 0 | 0 | 111.6 | C191 F192 L193 Y197 F198 N199 | C191-Y195 WeakPolarHBondContact O-CB 3.45Å; C191-Y195 PolarHBondContact O-N 3.25Å; F192-Y195 PolarHBondContact O-N 3.09Å; L193-Y195 VanDerWaalsContact C-N 3.35Å; Y195-Y197 VanDerWaalsContact C-N 3.34Å; Y195-Y197 PolarHBondContact O-N 3.46Å; Y195-F198 PolarHBondContact O-N 3Å; Y195-N199 WeakPolarHBondContact CD2-ND2 3.25Å; Y195-N199 WeakPolarHBondContact CE1-ND2 3.39Å; Y195-N199 WeakPolarHBondContact CE2-ND2 3.46Å; Y195-N199 WeakPolarHBondContact O-CB 3.49Å; Y195-N199 PolarHBondContact O-N 3.4Å; Y195-N199 PolarHBondContact O-ND2 3.43Å |
| 196 | L | 80.9 | Confident | 74.4 | Confident | 81 Ų | 81 | 109 Ų | 109 | 42% | 0.424 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.4 | -40.1 | 176 | -73.5 | 178.3 | 0 | 0 | 0 | 112.4 | F192 L193 I194 N199 F200 | F192-L196 HydrophobicContact CD1-CD1 3.81Å; F192-L196 HydrophobicContact CD1-CG 4.31Å; F192-L196 HydrophobicContact CE1-CD1 3.39Å; F192-L196 HydrophobicContact CE1-CG 4.02Å; F192-L196 HydrophobicContact CZ-CD1 3.98Å; F192-L196 HydrophobicContact CZ-CD2 4.33Å; F192-L196 HydrophobicContact CZ-CG 4.21Å; F192-L196 WeakPolarHBondContact O-CG 3.37Å; F192-L196 PolarHBondContact O-N 2.64Å; L193-L196 PolarHBondContact O-N 3.03Å; I194-L196 PolarHBondContact O-N 3.04Å; L196-N199 PolarHBondContact O-N 3.06Å; L196-F200 WeakPolarHBondContact O-CB 3.28Å; L196-F200 PolarHBondContact O-N 3.3Å |
| 197 | Y | 77.3 | Confident | 72 | Confident | 132 Ų | 132 | 110.4 Ų | 110.4 | 52% | 0.518 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -61.8 | -47.2 | 177.6 | -179.7 | -99.4 | 0 | 0 | 0 | 112 | L193 I194 Y195 F200 | L193-Y197 WeakPolarHBondContact O-CB 3.47Å; L193-Y197 PolarHBondContact O-N 3.02Å; I194-Y197 PolarHBondContact O-N 2.99Å; Y195-Y197 VanDerWaalsContact C-N 3.34Å; Y195-Y197 PolarHBondContact O-N 3.46Å; Y197-F200 PolarHBondContact O-N 3.49Å |
| 198 | F | 72.3 | Confident | 69.9 | Low | 146 Ų | 146 | 112 Ų | 112 | 64% | 0.64 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -69.8 | -36.3 | 178.3 | -82.5 | -73.8 | 0 | 0 | 0 | 113.1 | I194 Y195 | I194-F198 HydrophobicContact CG2-CD2 3.68Å; I194-F198 HydrophobicContact CG2-CE2 3.76Å; I194-F198 WeakPolarHBondContact O-CD2 3.35Å; I194-F198 PolarHBondContact O-N 3.21Å; Y195-F198 PolarHBondContact O-N 3Å |
| 199 | N | 67.5 | Low | 67.5 | Low | 49 Ų | 49 | 117.6 Ų | 117.6 | 26% | 0.262 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -76.2 | -27 | 176.5 | -74.5 | -89.6 | 0 | 0 | 0 | 112.4 | Y195 L196 A201 E202 V203 | Y195-N199 WeakPolarHBondContact CD2-ND2 3.25Å; Y195-N199 WeakPolarHBondContact CE1-ND2 3.39Å; Y195-N199 WeakPolarHBondContact CE2-ND2 3.46Å; Y195-N199 WeakPolarHBondContact O-CB 3.49Å; Y195-N199 PolarHBondContact O-N 3.4Å; Y195-N199 PolarHBondContact O-ND2 3.43Å; L196-N199 PolarHBondContact O-N 3.06Å; N199-A201 VanDerWaalsContact C-N 3.31Å; N199-A201 PolarHBondContact O-N 3.48Å; N199-E202 WeakPolarHBondContact O-CB 3.29Å; N199-E202 PolarHBondContact O-N 3.3Å; N199-E202 VanDerWaalsContact O-N 3.09Å; N199-V203 WeakPolarHBondContact O-CG2 3.43Å; N199-V203 PolarHBondContact O-N 3.16Å |
| 200 | F | 60.2 | Low | 66.3 | Low | 139 Ų | 139 | 115.3 Ų | 115.3 | 61% | 0.61 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -64.6 | -36.4 | 176.8 | -167.3 | -93.9 | 0 | 0 | 0 | 111.9 | L196 Y197 E202 V203 E204 | L196-F200 WeakPolarHBondContact O-CB 3.28Å; L196-F200 PolarHBondContact O-N 3.3Å; Y197-F200 PolarHBondContact O-N 3.49Å; F200-E202 PolarHBondContact O-N 3.09Å; F200-V203 PolarHBondContact O-N 2.93Å; F200-V203 VanDerWaalsContact O-N 3.1Å; F200-E204 PolarHBondContact O-N 3.24Å |
| 201 | A | 57 | Low | 65.1 | Low | 56 Ų | 56 | 118.6 Ų | 118.6 | 46% | 0.463 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -61 | -23.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | N199 H205 | N199-A201 VanDerWaalsContact C-N 3.31Å; N199-A201 PolarHBondContact O-N 3.48Å; A201-H205 PolarHBondContact O-CD2 3.12Å; A201-H205 VanDerWaalsContact O-CD2 3.31Å |
| 202 | E | 53.9 | Low | 63.8 | Low | 141 Ų | 141 | 121.1 Ų | 121.1 | 66% | 0.659 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -83.7 | -25.4 | 176.9 | -151 | 173.7 | -167.8 | 0 | 0 | 112.3 | N199 F200 | N199-E202 WeakPolarHBondContact O-CB 3.29Å; N199-E202 PolarHBondContact O-N 3.3Å; N199-E202 VanDerWaalsContact O-N 3.09Å; F200-E202 PolarHBondContact O-N 3.09Å |
| 203 | V | 54.4 | Low | 62.5 | Low | 96 Ų | 96 | 122.1 Ų | 122.1 | 58% | 0.582 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -81.6 | -22.8 | 178.9 | -163.2 | 0 | 0 | 0 | 0 | 112.1 | N199 F200 H205 V206 | N199-V203 WeakPolarHBondContact O-CG2 3.43Å; N199-V203 PolarHBondContact O-N 3.16Å; F200-V203 PolarHBondContact O-N 2.93Å; F200-V203 VanDerWaalsContact O-N 3.1Å; V203-H205 PolarHBondContact O-N 3.02Å; V203-V206 PolarHBondContact O-N 3.43Å |
| 204 | E | 52.7 | Low | 61 | Low | 136 Ų | 136 | 122.8 Ų | 122.8 | 64% | 0.636 | 63% | 0.631 | S | S | * | * | G | 310 helix | trans | -72.5 | -14.5 | 179.2 | -144.8 | 170.6 | -158.3 | 0 | 0 | 113.1 | F200 V206 | F200-E204 PolarHBondContact O-N 3.24Å; E204-V206 VanDerWaalsContact C-N 3.28Å; E204-V206 PolarHBondContact O-N 3.05Å |
| 205 | H | 49.2 | Very low | 59.2 | Low | 171 Ų | 171 | 125.3 Ų | 125.3 | 79% | 0.792 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -81.1 | 2.7 | 173.4 | -70.2 | -62.5 | 0 | 0 | 0 | 114.7 | A201 V203 | A201-H205 PolarHBondContact O-CD2 3.12Å; A201-H205 VanDerWaalsContact O-CD2 3.31Å; V203-H205 PolarHBondContact O-N 3.02Å |
| 206 | V | 52.7 | Low | 57.4 | Low | 114 Ų | 114 | 123.9 Ų | 123.9 | 69% | 0.691 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -111.2 | 3.5 | -174.6 | -169.6 | 0 | 0 | 0 | 0 | 113.6 | V203 E204 P208 | V203-V206 PolarHBondContact O-N 3.43Å; E204-V206 VanDerWaalsContact C-N 3.28Å; E204-V206 PolarHBondContact O-N 3.05Å; V206-P208 WeakPolarHBondContact O-CD 3.35Å |
| 207 | L | 37.8 | Very low | 55.6 | Low | 145 Ų | 145 | 127.2 Ų | 127.2 | 76% | 0.759 | 67% | 0.667 | S | S | * | * | trans | -90.5 | 104.9 | 172.8 | -91.1 | 149.3 | 0 | 0 | 0 | 110.5 | ||||
| 208 | P | 47.2 | Very low | 53.8 | Low | 116 Ų | 116 | 126.8 Ų | 126.8 | 75% | 0.753 | 68% | 0.679 | S | S | * | * | trans | -69.6 | 136.3 | 173.3 | 30.6 | -32.7 | 0 | 0 | 0 | 109.4 | V206 | V206-P208 WeakPolarHBondContact O-CD 3.35Š| ||
| 209 | T | 40.8 | Very low | 52.1 | Low | 213 Ų | 213 | 125.1 Ų | 125.1 | 100% | 1.307 | 68% | 0.683 | S | S | * | * | trans | -65.9 | 0 | 177.4 | -16.9 | 0 | 0 | 0 | 0 | 112.4 |
Retrieved 209 of 209 residues in 54.9 ms
(Link to these results)