| 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 | 40.2 | Very low | 53.5 | Low | 235 Ų | 235 | 155 Ų | 155 | 100% | 1.158 | 84% | 0.838 | S | S | * | * | 0 | 124.6 | 0 | -76.3 | 154.3 | 165.4 | 0 | 0 | 108.5 | |||||
| 2 | T | 46.5 | Very low | 53.2 | Low | 141 Ų | 141 | 151.3 Ų | 151.3 | 87% | 0.865 | 84% | 0.844 | S | S | * | * | trans | 59.1 | 108.7 | 156.6 | 57.8 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 3 | F | 42.3 | Very low | 52.5 | Low | 194 Ų | 194 | 144.7 Ų | 144.7 | 85% | 0.851 | 83% | 0.832 | S | S | * | * | trans | -78.2 | 139.4 | 170.4 | -82.5 | -105.2 | 0 | 0 | 0 | 112.4 | ||||
| 4 | A | 52.6 | Low | 52.4 | Low | 89 Ų | 89 | 151.8 Ų | 151.8 | 74% | 0.736 | 84% | 0.838 | S | S | * | * | trans | -78 | 123 | 160.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 5 | M | 59.6 | Low | 52.1 | Low | 169 Ų | 169 | 156.3 Ų | 156.3 | 83% | 0.833 | 85% | 0.847 | S | S | * | * | trans | -98.8 | 102.1 | 172.7 | -74.5 | -72.8 | 179.5 | 0 | 0 | 109.3 | R7 | M5-R7 PolarHBondContact O-N 3.2Š| ||
| 6 | L | 55.3 | Low | 52.1 | Low | 160 Ų | 160 | 157.3 Ų | 157.3 | 84% | 0.838 | 85% | 0.85 | S | S | * | * | trans | -61.9 | 125.8 | 159.1 | -86.8 | 68.3 | 0 | 0 | 0 | 107.9 | ||||
| 7 | R | 56.9 | Low | 51.3 | Low | 246 Ų | 246 | 159.3 Ų | 159.3 | 93% | 0.928 | 84% | 0.844 | S | S | * | * | trans | -108.5 | 104.2 | 169.7 | -159.7 | 167.9 | 178.3 | 157.6 | -1.9 | 109.7 | M5 | M5-R7 PolarHBondContact O-N 3.2Š| ||
| 8 | T | 63.9 | Low | 50.9 | Low | 119 Ų | 119 | 154.3 Ų | 154.3 | 73% | 0.73 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 140.2 | 172.5 | -33.5 | 0 | 0 | 0 | 0 | 111.7 | ||
| 9 | P | 59.3 | Low | 50.4 | Low | 109 Ų | 109 | 152.4 Ų | 152.4 | 71% | 0.708 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 143.6 | 171.1 | 29 | -33 | 0 | 0 | 0 | 111.1 | ||
| 10 | P | 59.6 | Low | 50.2 | Low | 120 Ų | 120 | 153.2 Ų | 153.2 | 78% | 0.779 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 147.7 | 178.6 | 30.7 | -32.6 | 0 | 0 | 0 | 111.7 | ||
| 11 | P | 52.5 | Low | 49.8 | Very low | 123 Ų | 123 | 149.5 Ų | 149.5 | 80% | 0.799 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 151.4 | -178.9 | 31.2 | -34.2 | 0 | 0 | 0 | 113 | ||
| 12 | A | 49.8 | Very low | 50.1 | Low | 110 Ų | 110 | 146.2 Ų | 146.2 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 135.8 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 13 | G | 43.9 | Very low | 50.1 | Low | 66 Ų | 66 | 147.1 Ų | 147.1 | 68% | 0.68 | 81% | 0.811 | S | S | * | * | trans | -169.2 | 92.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 14 | R | 51.3 | Low | 50.1 | Low | 244 Ų | 244 | 142 Ų | 142 | 92% | 0.921 | 80% | 0.799 | S | S | * | * | trans | 65.1 | 82.6 | 138.8 | -58.9 | -174.6 | 148.2 | 179.8 | -7.6 | 118.1 | ||||
| 15 | F | 47.9 | Very low | 50 | Low | 220 Ų | 220 | 146 Ų | 146 | 97% | 0.965 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -98.2 | 132.6 | 142.2 | -101.5 | -96.1 | 0 | 0 | 0 | 108.8 | ||
| 16 | L | 52.5 | Low | 49.7 | Very low | 171 Ų | 171 | 145 Ų | 145 | 90% | 0.895 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 135.2 | -171.8 | -68.5 | 168 | 0 | 0 | 0 | 111.7 | ||
| 17 | Y | 37.5 | Very low | 49.5 | Very low | 192 Ų | 192 | 144.6 Ų | 144.6 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 127.7 | 169.6 | -166.4 | -113.6 | 0 | 0 | 0 | 109.6 | D19 | Y17-D19 WeakPolarHBondContact CD1-OD2 3.46Å; Y17-D19 HydrophobicContact CE1-CB 4.27Å; Y17-D19 WeakPolarHBondContact CE1-OD1 3.3Å; Y17-D19 VanDerWaalsContact CE1-OD2 3.29Å; Y17-D19 WeakPolarHBondContact CE1-OD2 3.47Å |
| 18 | G | 44.2 | Very low | 49 | Very low | 70 Ų | 70 | 139.4 Ų | 139.4 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | -110.8 | 99.8 | 161.3 | 0 | 0 | 0 | 0 | 0 | 107.8 | I20 | G18-I20 PolarHBondContact O-N 3.35Š| ||
| 19 | D | 42.6 | Very low | 48.6 | Very low | 118 Ų | 118 | 142.1 Ų | 142.1 | 63% | 0.631 | 80% | 0.795 | S | S | * | * | trans | -49.2 | 122.3 | 168.6 | -93.8 | -66.2 | 0 | 0 | 0 | 111.6 | Y17 | Y17-D19 WeakPolarHBondContact CD1-OD2 3.46Å; Y17-D19 HydrophobicContact CE1-CB 4.27Å; Y17-D19 WeakPolarHBondContact CE1-OD1 3.3Å; Y17-D19 VanDerWaalsContact CE1-OD2 3.29Å; Y17-D19 WeakPolarHBondContact CE1-OD2 3.47Å | ||
| 20 | I | 45.1 | Very low | 48 | Very low | 168 Ų | 168 | 143.5 Ų | 143.5 | 86% | 0.862 | 80% | 0.796 | S | S | * | * | trans | -147.9 | 105.8 | 142.4 | 35.6 | 167.9 | 0 | 0 | 0 | 109.2 | G18 | G18-I20 PolarHBondContact O-N 3.35Š| ||
| 21 | G | 42.5 | Very low | 47.4 | Very low | 76 Ų | 76 | 143.7 Ų | 143.7 | 78% | 0.784 | 80% | 0.799 | S | S | * | * | trans | 81.2 | 86.2 | 131.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 22 | L | 46.2 | Very low | 47.3 | Very low | 165 Ų | 165 | 142.1 Ų | 142.1 | 86% | 0.864 | 79% | 0.79 | S | S | * | * | trans | -85.8 | 104.8 | 161.6 | -157.2 | 148.6 | 0 | 0 | 0 | 108.6 | ||||
| 23 | L | 46.4 | Very low | 47.3 | Very low | 160 Ų | 160 | 145.9 Ų | 145.9 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | trans | -144.9 | 91.3 | 159.4 | -71 | 174.4 | 0 | 0 | 0 | 104 | ||||
| 24 | S | 42.8 | Very low | 47.1 | Very low | 88 Ų | 88 | 146.7 Ų | 146.7 | 62% | 0.615 | 80% | 0.798 | S | S | * | * | 44.8 | 110.7 | 83.5 | -152.6 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 25 | E | 49.2 | Very low | 46.9 | Very low | 173 Ų | 173 | 141.4 Ų | 141.4 | 81% | 0.808 | 80% | 0.798 | S | S | * | * | 157.5 | 125.7 | 122.5 | -82 | 160.1 | 116.1 | 0 | 0 | 111 | |||||
| 26 | D | 54.4 | Low | 46.3 | Very low | 146 Ų | 146 | 134.6 Ų | 134.6 | 78% | 0.781 | 79% | 0.79 | S | S | * | * | trans | -52.7 | 150.8 | 169.5 | -52.5 | -95.7 | 0 | 0 | 0 | 112.3 | ||||
| 27 | D | 50.1 | Low | 46.1 | Very low | 152 Ų | 152 | 132 Ų | 132 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | trans | -175.2 | 109.6 | 144.2 | -87.3 | -38.2 | 0 | 0 | 0 | 111.1 | ||||
| 28 | D | 47.6 | Very low | 46.4 | Very low | 138 Ų | 138 | 130.3 Ų | 130.3 | 74% | 0.738 | 79% | 0.785 | S | S | * | * | 56.3 | 122.2 | 129.4 | -63.5 | -37.4 | 0 | 0 | 0 | 123.8 | |||||
| 29 | E | 54.5 | Low | 46.4 | Very low | 176 Ų | 176 | 134.6 Ų | 134.6 | 82% | 0.822 | 79% | 0.791 | S | S | * | * | 44.1 | 106.1 | 124.8 | -64.4 | -88.4 | 113.6 | 0 | 0 | 118.7 | |||||
| 30 | N | 48.3 | Very low | 46.2 | Very low | 137 Ų | 137 | 139 Ų | 139 | 73% | 0.733 | 80% | 0.799 | S | S | * | * | trans | -154.6 | 76.8 | 134 | -171.2 | 32.2 | 0 | 0 | 0 | 111.2 | S32 | N30-S32 VanDerWaalsContact C-N 3.3Å; N30-S32 VanDerWaalsContact CG-OG 3.27Å; N30-S32 PolarHBondContact ND2-OG 3.06Å; N30-S32 PolarHBondContact O-N 3.07Å; N30-S32 PolarHBondContact OD1-OG 2.96Å | ||
| 31 | C | 46.6 | Very low | 46.2 | Very low | 124 Ų | 124 | 137.7 Ų | 137.7 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | trans | -84 | 81 | 160.3 | -120.2 | 0 | 0 | 0 | 0 | 107.4 | E33 | C31-E33 PolarHBondContact O-N 3.17Š| ||
| 32 | S | 49.2 | Very low | 45.9 | Very low | 90 Ų | 90 | 139 Ų | 139 | 63% | 0.629 | 80% | 0.796 | S | S | * | * | trans | -65.7 | 100.9 | 174.7 | -64.7 | 0 | 0 | 0 | 0 | 110.2 | N30 | N30-S32 VanDerWaalsContact C-N 3.3Å; N30-S32 VanDerWaalsContact CG-OG 3.27Å; N30-S32 PolarHBondContact ND2-OG 3.06Å; N30-S32 PolarHBondContact O-N 3.07Å; N30-S32 PolarHBondContact OD1-OG 2.96Å | ||
| 33 | E | 50 | Low | 46.1 | Very low | 189 Ų | 189 | 137 Ų | 137 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | trans | -62.8 | 134.6 | 154.7 | 55.6 | -168.9 | 134 | 0 | 0 | 110.3 | C31 | C31-E33 PolarHBondContact O-N 3.17Š| ||
| 34 | G | 39.2 | Very low | 45.8 | Very low | 83 Ų | 83 | 134.8 Ų | 134.8 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | trans | -150.6 | 75.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 35 | S | 48.1 | Very low | 46.4 | Very low | 133 Ų | 133 | 136 Ų | 136 | 93% | 0.93 | 80% | 0.803 | S | S | * | * | trans | -100.2 | 118.7 | 163.9 | -167.6 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 36 | G | 35.3 | Very low | 46.2 | Very low | 77 Ų | 77 | 135.9 Ų | 135.9 | 79% | 0.794 | 81% | 0.808 | S | S | * | * | trans | 172.3 | 105.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 37 | S | 49.4 | Very low | 45.7 | Very low | 117 Ų | 117 | 133.7 Ų | 133.7 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | -72.2 | 141.7 | 171.6 | 57.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 38 | E | 43.2 | Very low | 45.2 | Very low | 156 Ų | 156 | 130.7 Ų | 130.7 | 73% | 0.729 | 80% | 0.801 | S | S | * | * | trans | -154.4 | 131.6 | 136.4 | 55.2 | 176.6 | 122.4 | 0 | 0 | 111.6 | R40 | E38-R40 PolarHBondContact O-N 3.4Å; E38-R40 IonicContact OE2-NE 2.61Å | ||
| 39 | D | 43.7 | Very low | 44.6 | Very low | 160 Ų | 160 | 127.9 Ų | 127.9 | 86% | 0.856 | 79% | 0.792 | S | S | * | * | trans | -66.9 | 117.3 | 173.2 | -63.9 | -84.7 | 0 | 0 | 0 | 110.8 | ||||
| 40 | R | 38.3 | Very low | 43.5 | Very low | 210 Ų | 210 | 129.2 Ų | 129.2 | 79% | 0.792 | 80% | 0.795 | S | S | * | * | trans | -135.2 | 108.8 | 156.1 | -67.5 | -160.8 | 178.9 | -134.3 | -3.8 | 111.2 | E38 S42 | E38-R40 PolarHBondContact O-N 3.4Å; E38-R40 IonicContact OE2-NE 2.61Å; R40-S42 PolarHBondContact O-N 3.33Å | ||
| 41 | T | 45.9 | Very low | 43 | Very low | 141 Ų | 141 | 133 Ų | 133 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | trans | -58.8 | 113.2 | 161.3 | 47.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 42 | S | 35.4 | Very low | 42.4 | Very low | 103 Ų | 103 | 135.4 Ų | 135.4 | 72% | 0.72 | 80% | 0.803 | S | S | * | * | trans | -151.6 | 100.2 | 163.6 | -66.3 | 0 | 0 | 0 | 0 | 108.5 | R40 S44 | R40-S42 PolarHBondContact O-N 3.33Å; S42-S44 PolarHBondContact O-N 3.41Å; S42-S44 VanDerWaalsContact O-N 3.07Å | ||
| 43 | S | 51.4 | Low | 41.9 | Very low | 125 Ų | 125 | 136.5 Ų | 136.5 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | trans | -48.5 | 107.5 | 167.1 | -29.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 44 | S | 40.1 | Very low | 41.1 | Very low | 113 Ų | 113 | 133 Ų | 133 | 79% | 0.79 | 81% | 0.807 | S | S | * | * | trans | -158.5 | 109 | 163.1 | -85.4 | 0 | 0 | 0 | 0 | 110.5 | S42 N46 | S42-S44 PolarHBondContact O-N 3.41Å; S42-S44 VanDerWaalsContact O-N 3.07Å; S44-N46 PolarHBondContact O-N 3.02Å | ||
| 45 | S | 54 | Low | 41.5 | Very low | 114 Ų | 114 | 134.4 Ų | 134.4 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | trans | -47.8 | 122.5 | 172.9 | -43 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 46 | N | 44.5 | Very low | 41.1 | Very low | 169 Ų | 169 | 133.8 Ų | 133.8 | 90% | 0.904 | 80% | 0.799 | S | S | * | * | trans | -160.1 | 72 | 152.6 | -86 | -31.9 | 0 | 0 | 0 | 109.2 | S44 A48 | S44-N46 PolarHBondContact O-N 3.02Å; N46-A48 PolarHBondContact O-N 3.28Å | ||
| 47 | S | 43.9 | Very low | 41.9 | Very low | 100 Ų | 100 | 139.7 Ų | 139.7 | 70% | 0.699 | 81% | 0.806 | S | S | * | * | trans | -72.1 | 110.7 | 163 | 52.7 | 0 | 0 | 0 | 0 | 108.2 | S49 | S47-S49 PolarHBondContact O-N 2.94Å; S47-S49 PolarHBondContact O-OG 2.75Å | ||
| 48 | A | 39.9 | Very low | 41.8 | Very low | 90 Ų | 90 | 139 Ų | 139 | 74% | 0.744 | 80% | 0.802 | S | S | * | * | trans | -55 | 103.1 | 166.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | N46 | N46-A48 PolarHBondContact O-N 3.28Š| ||
| 49 | S | 36 | Very low | 41.7 | Very low | 79 Ų | 79 | 136.3 Ų | 136.3 | 55% | 0.552 | 81% | 0.806 | S | S | * | * | trans | -90.5 | 106.2 | -175.7 | -60.1 | 0 | 0 | 0 | 0 | 107.5 | S47 R51 | S47-S49 PolarHBondContact O-N 2.94Å; S47-S49 PolarHBondContact O-OG 2.75Å; S49-R51 VanDerWaalsContact C-N 3.31Å; S49-R51 PolarHBondContact O-N 3.49Å | ||
| 50 | F | 31.9 | Very low | 41.4 | Very low | 204 Ų | 204 | 138.3 Ų | 138.3 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | trans | -72.8 | 93.8 | 162 | -67.8 | -76.7 | 0 | 0 | 0 | 107.6 | L52 | F50-L52 PolarHBondContact O-N 2.68Š| ||
| 51 | R | 37.4 | Very low | 41.9 | Very low | 217 Ų | 217 | 135.5 Ų | 135.5 | 82% | 0.819 | 80% | 0.803 | S | S | * | * | trans | -79.8 | 107.1 | 172.6 | -68.8 | -144.4 | 177.5 | -140.7 | 2.9 | 109.1 | S49 | S49-R51 VanDerWaalsContact C-N 3.31Å; S49-R51 PolarHBondContact O-N 3.49Å | ||
| 52 | L | 33.8 | Very low | 42.3 | Very low | 173 Ų | 173 | 135.8 Ų | 135.8 | 91% | 0.906 | 80% | 0.798 | S | S | * | * | trans | -98.2 | 103.9 | 154.1 | -119.9 | 72.8 | 0 | 0 | 0 | 107.3 | F50 S54 | F50-L52 PolarHBondContact O-N 2.68Å; L52-S54 PolarHBondContact O-N 2.94Å | ||
| 53 | S | 37.7 | Very low | 42.8 | Very low | 114 Ų | 114 | 139.6 Ų | 139.6 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | trans | -80.2 | 108.9 | 162.7 | -67.3 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 54 | S | 34 | Very low | 42.7 | Very low | 115 Ų | 115 | 139.3 Ų | 139.3 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | -153.1 | 124.6 | 145.2 | -157.7 | 0 | 0 | 0 | 0 | 110.2 | L52 | L52-S54 PolarHBondContact O-N 2.94Š| ||
| 55 | S | 48.3 | Very low | 42.9 | Very low | 112 Ų | 112 | 140.8 Ų | 140.8 | 78% | 0.783 | 79% | 0.793 | S | S | * | * | trans | -57 | 128.7 | -174.5 | -48.7 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 56 | S | 39.6 | Very low | 42.6 | Very low | 121 Ų | 121 | 146 Ų | 146 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | trans | -175.8 | 125.5 | 139.2 | -80.8 | 0 | 0 | 0 | 0 | 110.2 | S58 | S56-S58 PolarHBondContact O-N 3.43Š| ||
| 57 | Q | 51.8 | Low | 42.7 | Very low | 200 Ų | 200 | 146.5 Ų | 146.5 | 94% | 0.935 | 79% | 0.789 | S | S | * | * | trans | -75.6 | 104 | -174.6 | -65.9 | 163.5 | 55.4 | 0 | 0 | 110.6 | ||||
| 58 | S | 47.2 | Very low | 43 | Very low | 104 Ų | 104 | 152.1 Ų | 152.1 | 73% | 0.727 | 80% | 0.795 | S | S | * | * | trans | -179.1 | 72.2 | 148.5 | 59.9 | 0 | 0 | 0 | 0 | 110.6 | S56 | S56-S58 PolarHBondContact O-N 3.43Š| ||
| 59 | A | 41.8 | Very low | 43.8 | Very low | 99 Ų | 99 | 157.2 Ų | 157.2 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | trans | -99.2 | 97 | 178 | 0 | 0 | 0 | 0 | 0 | 110.5 | H61 | A59-H61 PolarHBondContact O-N 3.47Å; A59-H61 VanDerWaalsContact O-N 3.13Å | ||
| 60 | F | 37.2 | Very low | 44.1 | Very low | 201 Ų | 201 | 161 Ų | 161 | 88% | 0.882 | 81% | 0.812 | S | S | * | * | trans | -64 | 109.6 | 162.2 | -72.2 | -82.7 | 0 | 0 | 0 | 108.5 | I62 | F60-I62 PolarHBondContact O-N 3.03Å; F60-I62 VanDerWaalsContact O-N 3.17Å | ||
| 61 | H | 48.6 | Very low | 44.5 | Very low | 152 Ų | 152 | 158 Ų | 158 | 70% | 0.704 | 81% | 0.814 | S | S | * | * | trans | -79.8 | 95.7 | -174 | -164.3 | -75.2 | 0 | 0 | 0 | 110.7 | A59 K63 | A59-H61 PolarHBondContact O-N 3.47Å; A59-H61 VanDerWaalsContact O-N 3.13Å; H61-K63 PolarHBondContact O-N 3.18Å | ||
| 62 | I | 54.6 | Low | 44.5 | Very low | 147 Ų | 147 | 151.1 Ų | 151.1 | 75% | 0.754 | 81% | 0.811 | S | S | * | * | trans | -74.5 | 97.1 | 172.1 | -59.5 | 175.8 | 0 | 0 | 0 | 108.6 | F60 V64 | F60-I62 PolarHBondContact O-N 3.03Å; F60-I62 VanDerWaalsContact O-N 3.17Å; I62-V64 PolarHBondContact O-N 3.4Å | ||
| 63 | K | 45.6 | Very low | 44.8 | Very low | 182 Ų | 182 | 147 Ų | 147 | 79% | 0.791 | 81% | 0.81 | S | S | * | * | trans | -73.7 | 90.3 | 177.3 | -128.2 | 158.4 | -175.3 | 161.3 | 0 | 109.3 | H61 N65 | H61-K63 PolarHBondContact O-N 3.18Å; K63-N65 PolarHBondContact O-N 2.95Å; K63-N65 VanDerWaalsContact O-N 3.1Å | ||
| 64 | V | 48.4 | Very low | 44.9 | Very low | 120 Ų | 120 | 146.5 Ų | 146.5 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | trans | -72.9 | 98.2 | 168.9 | -83.8 | 0 | 0 | 0 | 0 | 109.8 | I62 R66 | I62-V64 PolarHBondContact O-N 3.4Å; V64-R66 PolarHBondContact O-N 2.89Å | ||
| 65 | N | 43.7 | Very low | 45.4 | Very low | 144 Ų | 144 | 144.6 Ų | 144.6 | 77% | 0.77 | 81% | 0.812 | S | S | * | * | trans | -71.6 | 92.4 | 171.3 | -170.4 | 29.3 | 0 | 0 | 0 | 109.5 | K63 K67 | K63-N65 PolarHBondContact O-N 2.95Å; K63-N65 VanDerWaalsContact O-N 3.1Å; N65-K67 PolarHBondContact O-N 3Å | ||
| 66 | R | 48.4 | Very low | 45.1 | Very low | 224 Ų | 224 | 145.5 Ų | 145.5 | 85% | 0.845 | 81% | 0.812 | S | S | * | * | trans | -72.3 | 79 | 169.5 | -82.5 | -174.9 | -178.5 | 144.9 | -0.7 | 109.9 | V64 R68 | V64-R66 PolarHBondContact O-N 2.89Å; R66-R68 PolarHBondContact O-N 3.16Å; R66-R68 VanDerWaalsContact O-N 3.09Å | ||
| 67 | K | 47.2 | Very low | 45.3 | Very low | 178 Ų | 178 | 145.4 Ų | 145.4 | 77% | 0.774 | 81% | 0.811 | S | S | * | * | trans | -73.5 | 92.4 | 161.6 | -168.1 | 88.9 | 172.4 | 179.5 | 0 | 107.3 | N65 K69 | N65-K67 PolarHBondContact O-N 3Å; K67-K69 PolarHBondContact O-N 3.39Å | ||
| 68 | R | 50.1 | Low | 45 | Very low | 218 Ų | 218 | 141.8 Ų | 141.8 | 82% | 0.823 | 80% | 0.803 | S | S | * | * | trans | -64.2 | 103.7 | 167.4 | -72 | -175 | -103.8 | 167.5 | -5.5 | 107.5 | R66 M70 | R66-R68 PolarHBondContact O-N 3.16Å; R66-R68 VanDerWaalsContact O-N 3.09Å; R68-M70 PolarHBondContact O-N 3.01Å | ||
| 69 | K | 55.8 | Low | 45.3 | Very low | 197 Ų | 197 | 142.4 Ų | 142.4 | 86% | 0.857 | 80% | 0.802 | S | S | * | * | trans | -83.3 | 109.5 | 173 | -176.7 | 160.8 | 179 | 167.4 | 0 | 107.8 | K67 | K67-K69 PolarHBondContact O-N 3.39Š| ||
| 70 | M | 43.2 | Very low | 45.6 | Very low | 160 Ų | 160 | 145.4 Ų | 145.4 | 79% | 0.788 | 80% | 0.804 | S | S | * | * | trans | -64 | 133 | 167.3 | -63.3 | -61.6 | -171.7 | 0 | 0 | 108.9 | R68 G72 | R68-M70 PolarHBondContact O-N 3.01Å; M70-G72 PolarHBondContact O-N 3.02Å | ||
| 71 | C | 38.9 | Very low | 46.4 | Very low | 139 Ų | 139 | 142.5 Ų | 142.5 | 94% | 0.939 | 80% | 0.797 | S | S | * | * | trans | -78.6 | 89.9 | 171.3 | 35.7 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 72 | G | 37.6 | Very low | 46.4 | Very low | 74 Ų | 74 | 142.1 Ų | 142.1 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | -104.6 | 124.5 | 165 | 0 | 0 | 0 | 0 | 0 | 109.7 | M70 | M70-G72 PolarHBondContact O-N 3.02Š| ||
| 73 | G | 41.8 | Very low | 46 | Very low | 85 Ų | 85 | 138.5 Ų | 138.5 | 88% | 0.876 | 81% | 0.805 | S | S | * | * | trans | -74.3 | 150.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 74 | A | 39.9 | Very low | 46.1 | Very low | 104 Ų | 104 | 141.8 Ų | 141.8 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | trans | -152.5 | 122.8 | 155.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 75 | G | 42.7 | Very low | 46.2 | Very low | 76 Ų | 76 | 145.4 Ų | 145.4 | 78% | 0.784 | 83% | 0.827 | S | S | * | * | trans | -74.2 | 148.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 76 | V | 42 | Very low | 46.5 | Very low | 130 Ų | 130 | 141.2 Ų | 141.2 | 79% | 0.788 | 82% | 0.818 | S | S | * | * | trans | -141.9 | 111.2 | 150.1 | 175.5 | 0 | 0 | 0 | 0 | 106.5 | V78 | V76-V78 HydrophobicContact CG1-CG1 4.3Å; V76-V78 HydrophobicContact CG1-CG2 4.3Å | ||
| 77 | S | 44.3 | Very low | 47 | Very low | 119 Ų | 119 | 136.6 Ų | 136.6 | 83% | 0.832 | 82% | 0.817 | S | S | * | * | trans | -84.1 | 112.8 | 166.7 | -169 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 78 | V | 46.8 | Very low | 47.2 | Very low | 125 Ų | 125 | 134.2 Ų | 134.2 | 76% | 0.758 | 82% | 0.82 | S | S | * | * | trans | -140.9 | 125.7 | 157.3 | -71.8 | 0 | 0 | 0 | 0 | 108.8 | V76 | V76-V78 HydrophobicContact CG1-CG1 4.3Å; V76-V78 HydrophobicContact CG1-CG2 4.3Å | ||
| 79 | T | 53.7 | Low | 47.4 | Very low | 117 Ų | 117 | 127 Ų | 127 | 72% | 0.718 | 81% | 0.813 | S | S | * | * | trans | -58.7 | 143.3 | -176 | 48.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 80 | N | 47.2 | Very low | 47.6 | Very low | 161 Ų | 161 | 123 Ų | 123 | 86% | 0.861 | 81% | 0.809 | S | S | * | * | -156.8 | 138.1 | 129.2 | -108.7 | -4.3 | 0 | 0 | 0 | 114.5 | |||||
| 81 | L | 54.1 | Low | 48.4 | Very low | 140 Ų | 140 | 117.9 Ų | 117.9 | 73% | 0.733 | 79% | 0.789 | S | S | * | * | trans | -69.4 | 141.6 | -179.8 | -74.8 | 61.4 | 0 | 0 | 0 | 110.7 | ||||
| 82 | T | 47.8 | Very low | 49.5 | Very low | 144 Ų | 144 | 115 Ų | 115 | 88% | 0.883 | 77% | 0.769 | S | S | * | * | 158.1 | 126.5 | 118 | 44 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 83 | G | 47.1 | Very low | 50.8 | Low | 72 Ų | 72 | 116.7 Ų | 116.7 | 74% | 0.742 | 77% | 0.767 | S | S | * | * | trans | 94.5 | 89.5 | 148.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 84 | R | 46.8 | Very low | 52 | Low | 251 Ų | 251 | 115 Ų | 115 | 95% | 0.947 | 75% | 0.75 | S | S | * | * | 160.3 | 108.7 | 115.2 | -76 | -100.9 | 163.1 | -138.1 | -5.3 | 109.4 | G86 | R84-G86 PolarHBondContact O-N 3.48Š| |||
| 85 | L | 52 | Low | 53.6 | Low | 195 Ų | 195 | 115.1 Ų | 115.1 | 100% | 1.021 | 73% | 0.733 | S | S | * | * | trans | -65.7 | 109.6 | 171.6 | -69 | 162.5 | 0 | 0 | 0 | 109.3 | ||||
| 86 | G | 48.8 | Very low | 55.4 | Low | 57 Ų | 57 | 114 Ų | 114 | 59% | 0.588 | 71% | 0.71 | S | S | * | * | trans | -133 | 143.2 | 158.8 | 0 | 0 | 0 | 0 | 0 | 107.6 | R84 | R84-G86 PolarHBondContact O-N 3.48Š| ||
| 87 | P | 58.3 | Low | 57.3 | Low | 126 Ų | 126 | 117.1 Ų | 117.1 | 82% | 0.818 | 71% | 0.708 | S | S | * | * | trans | -59.2 | 142.6 | -176.2 | 24.1 | -31.8 | 0 | 0 | 0 | 110.5 | G89 | P87-G89 VanDerWaalsContact C-N 3.25Å; P87-G89 PolarHBondContact O-N 3.13Å | ||
| 88 | P | 51.9 | Low | 59.4 | Low | 129 Ų | 129 | 117.9 Ų | 117.9 | 84% | 0.838 | 70% | 0.698 | S | S | * | * | trans | -73.1 | 85.2 | 177.5 | 31 | -31.9 | 0 | 0 | 0 | 108.5 | S90 | P88-S90 VanDerWaalsContact C-N 3.32Å; P88-S90 PolarHBondContact O-N 3.05Å | ||
| 89 | G | 53.7 | Low | 61.6 | Low | 65 Ų | 65 | 119.2 Ų | 119.2 | 67% | 0.67 | 69% | 0.69 | S | S | * | * | trans | -63.7 | 99.7 | 158.1 | 0 | 0 | 0 | 0 | 0 | 107.1 | P87 S91 | P87-G89 VanDerWaalsContact C-N 3.25Å; P87-G89 PolarHBondContact O-N 3.13Å; G89-S91 PolarHBondContact O-N 3.32Å | ||
| 90 | S | 61.8 | Low | 63.5 | Low | 113 Ų | 113 | 117.4 Ų | 117.4 | 79% | 0.79 | 68% | 0.679 | S | S | * | * | trans | -65.1 | 77.1 | 178.2 | 54.1 | 0 | 0 | 0 | 0 | 110.3 | P88 | P88-S90 VanDerWaalsContact C-N 3.32Å; P88-S90 PolarHBondContact O-N 3.05Å | ||
| 91 | S | 59.5 | Low | 65.6 | Low | 53 Ų | 53 | 111.9 Ų | 111.9 | 37% | 0.371 | 66% | 0.655 | S | S | . | * | trans | -62 | 127.8 | 156 | 47.7 | 0 | 0 | 0 | 0 | 107.1 | G89 V96 | G89-S91 PolarHBondContact O-N 3.32Å; S91-V96 WeakPolarHBondContact OG-CG2 3.39Å | ||
| 92 | P | 62.7 | Low | 67.5 | Low | 78 Ų | 78 | 107 Ų | 107 | 51% | 0.506 | 64% | 0.635 | S | S | . | * | trans | -53.4 | 138.4 | -176.2 | 16.4 | -28.4 | 0 | 0 | 0 | 110.1 | G94 E95 | P92-G94 PolarHBondContact O-N 3.42Å; P92-E95 WeakPolarHBondContact CD-OE2 3.38Å; P92-E95 HydrophobicContact CG-CB 4.01Å; P92-E95 WeakPolarHBondContact O-CB 3.28Å; P92-E95 PolarHBondContact O-N 3.02Å | ||
| 93 | P | 63.2 | Low | 69.9 | Low | 110 Ų | 110 | 105 Ų | 105 | 71% | 0.714 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -52.7 | -24.7 | -176.9 | -28.3 | 33.8 | 0 | 0 | 0 | 114.5 | R97 | P93-R97 WeakPolarHBondContact O-CG 3.46Å; P93-R97 PolarHBondContact O-N 3.02Å |
| 94 | G | 68.2 | Low | 72.3 | Confident | 51 Ų | 51 | 103.9 Ų | 103.9 | 53% | 0.526 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -68.1 | -37.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114 | P92 R97 Q98 | P92-G94 PolarHBondContact O-N 3.42Å; G94-R97 PolarHBondContact O-N 3.17Å; G94-Q98 WeakPolarHBondContact O-CB 3.31Å; G94-Q98 PolarHBondContact O-N 3.01Å |
| 95 | E | 72.7 | Confident | 74.7 | Confident | 106 Ų | 106 | 99.5 Ų | 99.5 | 50% | 0.495 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -71.3 | -39.7 | -177.8 | -171.7 | -179.2 | 172.6 | 0 | 0 | 111.4 | P92 R97 Q98 R99 | P92-E95 WeakPolarHBondContact CD-OE2 3.38Å; P92-E95 HydrophobicContact CG-CB 4.01Å; P92-E95 WeakPolarHBondContact O-CB 3.28Å; P92-E95 PolarHBondContact O-N 3.02Å; E95-R97 PolarHBondContact O-N 3.29Å; E95-Q98 PolarHBondContact O-N 3.48Å; E95-R99 VanDerWaalsContact O-CB 3.3Å; E95-R99 WeakPolarHBondContact O-CB 3.07Å; E95-R99 PolarHBondContact O-N 2.96Å |
| 96 | V | 81.8 | Confident | 76.9 | Confident | 52 Ų | 52 | 94.3 Ų | 94.3 | 32% | 0.315 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.6 | -41.9 | 175.3 | -178.2 | 0 | 0 | 0 | 0 | 111 | S91 R99 T100 | S91-V96 WeakPolarHBondContact OG-CG2 3.39Å; V96-R99 PolarHBondContact O-N 3.49Å; V96-T100 WeakPolarHBondContact O-CG2 3.35Å; V96-T100 PolarHBondContact O-N 3.3Å; V96-T100 PolarHBondContact O-OG1 2.92Å |
| 97 | R | 80.9 | Confident | 79.3 | Confident | 196 Ų | 196 | 100.3 Ų | 100.3 | 74% | 0.74 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.9 | -38 | 177.4 | -68 | 176.6 | 83.7 | -176.9 | 5.9 | 112.4 | P93 G94 E95 T100 A101 | P93-R97 WeakPolarHBondContact O-CG 3.46Å; P93-R97 PolarHBondContact O-N 3.02Å; G94-R97 PolarHBondContact O-N 3.17Å; E95-R97 PolarHBondContact O-N 3.29Å; R97-T100 WeakPolarHBondContact CA-OG1 3.39Å; R97-T100 PolarHBondContact O-OG1 3.17Å; R97-A101 VanDerWaalsContact O-CB 3.3Å; R97-A101 WeakPolarHBondContact O-CB 3.48Å; R97-A101 PolarHBondContact O-N 2.95Å |
| 98 | Q | 87.6 | Confident | 81.2 | Confident | 135 Ų | 135 | 98.6 Ų | 98.6 | 63% | 0.631 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.5 | -41.9 | 175 | -169.5 | 178.8 | 31.9 | 0 | 0 | 111.2 | G94 E95 A101 A102 | G94-Q98 WeakPolarHBondContact O-CB 3.31Å; G94-Q98 PolarHBondContact O-N 3.01Å; E95-Q98 PolarHBondContact O-N 3.48Å; Q98-A101 PolarHBondContact O-N 3.13Å; Q98-A102 WeakPolarHBondContact O-CB 3.43Å; Q98-A102 PolarHBondContact O-N 3.46Å |
| 99 | R | 93.1 | Very high | 83.4 | Confident | 152 Ų | 152 | 99.2 Ų | 99.2 | 57% | 0.574 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -63.9 | -44.9 | 176.3 | -171.7 | 175.8 | 69.7 | 178.8 | 0.6 | 112.1 | E95 V96 A102 N103 | E95-R99 VanDerWaalsContact O-CB 3.3Å; E95-R99 WeakPolarHBondContact O-CB 3.07Å; E95-R99 PolarHBondContact O-N 2.96Å; V96-R99 PolarHBondContact O-N 3.49Å; R99-A102 PolarHBondContact O-N 2.92Å; R99-N103 WeakPolarHBondContact O-CB 3.33Å; R99-N103 PolarHBondContact O-N 3.38Å; R99-N103 PolarHBondContact O-OD1 3.4Å |
| 100 | T | 93.4 | Very high | 85.5 | Confident | 80 Ų | 80 | 98.7 Ų | 98.7 | 49% | 0.491 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.6 | -39.9 | 176.8 | 55.2 | 0 | 0 | 0 | 0 | 112.1 | V96 R97 N103 A104 | V96-T100 WeakPolarHBondContact O-CG2 3.35Å; V96-T100 PolarHBondContact O-N 3.3Å; V96-T100 PolarHBondContact O-OG1 2.92Å; R97-T100 WeakPolarHBondContact CA-OG1 3.39Å; R97-T100 PolarHBondContact O-OG1 3.17Å; T100-N103 PolarHBondContact O-N 3.46Å; T100-A104 WeakPolarHBondContact O-CB 3.09Å; T100-A104 PolarHBondContact O-N 3.07Å |
| 101 | A | 92 | Very high | 87.2 | Confident | 44 Ų | 44 | 98 Ų | 98 | 36% | 0.364 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.2 | -40.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | R97 Q98 A104 R105 | R97-A101 VanDerWaalsContact O-CB 3.3Å; R97-A101 WeakPolarHBondContact O-CB 3.48Å; R97-A101 PolarHBondContact O-N 2.95Å; Q98-A101 PolarHBondContact O-N 3.13Å; A101-A104 PolarHBondContact O-N 3.34Å; A101-R105 WeakPolarHBondContact O-CG 3.46Å; A101-R105 PolarHBondContact O-N 3.42Å; A101-R105 VanDerWaalsContact O-N 3.13Å |
| 102 | A | 94.7 | Very high | 89.1 | Confident | 38 Ų | 38 | 99.4 Ų | 99.4 | 31% | 0.314 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.9 | -45.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q98 R99 A104 R105 E106 | Q98-A102 WeakPolarHBondContact O-CB 3.43Å; Q98-A102 PolarHBondContact O-N 3.46Å; R99-A102 PolarHBondContact O-N 2.92Å; A102-A104 VanDerWaalsContact C-N 3.31Å; A102-A104 PolarHBondContact O-N 2.98Å; A102-R105 WeakPolarHBondContact O-CB 3.35Å; A102-R105 PolarHBondContact O-N 3.05Å; A102-E106 PolarHBondContact O-N 3.37Å |
| 103 | N | 97.8 | Very high | 90.8 | Very high | 102 Ų | 102 | 98.5 Ų | 98.5 | 55% | 0.545 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.4 | -38.6 | 177.1 | -70.3 | -7.8 | 0 | 0 | 0 | 112.1 | R99 T100 E106 R107 | R99-N103 WeakPolarHBondContact O-CB 3.33Å; R99-N103 PolarHBondContact O-N 3.38Å; R99-N103 PolarHBondContact O-OD1 3.4Å; T100-N103 PolarHBondContact O-N 3.46Å; N103-E106 PolarHBondContact O-N 2.95Å; N103-R107 PolarHBondContact O-N 3.1Å |
| 104 | A | 97 | Very high | 92.4 | Very high | 48 Ų | 48 | 96.1 Ų | 96.1 | 40% | 0.397 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.8 | -46.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | T100 A101 A102 E106 R107 D108 | T100-A104 WeakPolarHBondContact O-CB 3.09Å; T100-A104 PolarHBondContact O-N 3.07Å; A101-A104 PolarHBondContact O-N 3.34Å; A102-A104 VanDerWaalsContact C-N 3.31Å; A102-A104 PolarHBondContact O-N 2.98Å; A104-E106 PolarHBondContact O-N 3.32Å; A104-R107 WeakPolarHBondContact O-CB 3.42Å; A104-R107 PolarHBondContact O-N 2.84Å; A104-D108 PolarHBondContact O-N 3.26Å |
| 105 | R | 97.8 | Very high | 93.8 | Very high | 160 Ų | 160 | 97.7 Ų | 97.7 | 60% | 0.604 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -60.5 | -41.8 | 176.3 | -70 | -177.3 | -66.5 | -137 | 2 | 112.6 | A101 A102 R107 D108 R109 | A101-R105 WeakPolarHBondContact O-CG 3.46Å; A101-R105 PolarHBondContact O-N 3.42Å; A101-R105 VanDerWaalsContact O-N 3.13Å; A102-R105 WeakPolarHBondContact O-CB 3.35Å; A102-R105 PolarHBondContact O-N 3.05Å; R105-R107 VanDerWaalsContact C-N 3.33Å; R105-R107 PolarHBondContact O-N 3.12Å; R105-D108 PolarHBondContact O-N 3.37Å; R105-R109 PolarHBondContact O-N 3.13Å |
| 106 | E | 98.1 | Very high | 95 | Very high | 86 Ų | 86 | 95.6 Ų | 95.6 | 40% | 0.402 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.8 | -35.8 | 178.8 | -179.8 | 53.6 | -157.6 | 0 | 0 | 112.3 | A102 N103 A104 D108 R109 T110 | A102-E106 PolarHBondContact O-N 3.37Å; N103-E106 PolarHBondContact O-N 2.95Å; A104-E106 PolarHBondContact O-N 3.32Å; E106-D108 VanDerWaalsContact C-N 3.33Å; E106-R109 PolarHBondContact O-N 3.16Å; E106-R109 IonicContact OE1-CZ 2.77Å; E106-R109 IonicContact OE1-NE 3Å; E106-R109 PolarHBondContact OE1-NE 2.97Å; E106-R109 IonicContact OE1-NH2 3.38Å; E106-R109 PolarHBondContact OE1-NH2 2.81Å; E106-R109 IonicContact OE2-CZ 3.44Å; E106-R109 IonicContact OE2-NE 3.63Å; E106-R109 PolarHBondContact OE2-NE 3.06Å; E106-R109 IonicContact OE2-NH2 3.7Å; E106-T110 WeakPolarHBondContact O-CB 3.36Å; E106-T110 PolarHBondContact O-N 3.48Å; E106-T110 PolarHBondContact O-OG1 3.26Å; E106-T110 PolarHBondContact OE1-OG1 3.04Å |
| 107 | R | 98.3 | Very high | 95.8 | Very high | 182 Ų | 182 | 94.8 Ų | 94.8 | 69% | 0.687 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -61.7 | -43.4 | 172.5 | -164.8 | -171.3 | 75.9 | 140.6 | 3.8 | 111.1 | N103 A104 R105 T110 N111 | N103-R107 PolarHBondContact O-N 3.1Å; A104-R107 WeakPolarHBondContact O-CB 3.42Å; A104-R107 PolarHBondContact O-N 2.84Å; R105-R107 VanDerWaalsContact C-N 3.33Å; R105-R107 PolarHBondContact O-N 3.12Å; R107-T110 PolarHBondContact O-N 2.61Å; R107-N111 WeakPolarHBondContact O-CB 3.38Å; R107-N111 PolarHBondContact O-N 2.77Å |
| 108 | D | 98.1 | Very high | 96.5 | Very high | 90 Ų | 90 | 89.2 Ų | 89.2 | 48% | 0.481 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -66.7 | -41 | 178.8 | -66.9 | -17.8 | 0 | 0 | 0 | 111.7 | A104 R105 E106 T110 N111 S112 | A104-D108 PolarHBondContact O-N 3.26Å; R105-D108 PolarHBondContact O-N 3.37Å; E106-D108 VanDerWaalsContact C-N 3.33Å; D108-T110 PolarHBondContact O-N 3.04Å; D108-N111 PolarHBondContact O-N 2.91Å; D108-S112 PolarHBondContact O-N 3.31Å |
| 109 | R | 98.4 | Very high | 96.9 | Very high | 143 Ų | 143 | 85.2 Ų | 85.2 | 54% | 0.54 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -58.6 | -48 | 172.6 | -167.2 | -169 | 74.6 | 84.5 | 2.1 | 111.2 | R105 E106 N111 S112 V113 | R105-R109 PolarHBondContact O-N 3.13Å; E106-R109 PolarHBondContact O-N 3.16Å; E106-R109 IonicContact OE1-CZ 2.77Å; E106-R109 IonicContact OE1-NE 3Å; E106-R109 PolarHBondContact OE1-NE 2.97Å; E106-R109 IonicContact OE1-NH2 3.38Å; E106-R109 PolarHBondContact OE1-NH2 2.81Å; E106-R109 IonicContact OE2-CZ 3.44Å; E106-R109 IonicContact OE2-NE 3.63Å; E106-R109 PolarHBondContact OE2-NE 3.06Å; E106-R109 IonicContact OE2-NH2 3.7Å; R109-N111 VanDerWaalsContact C-N 3.33Å; R109-N111 PolarHBondContact O-N 3.41Å; R109-S112 WeakPolarHBondContact O-CB 3.35Å; R109-S112 PolarHBondContact O-N 2.82Å; R109-V113 WeakPolarHBondContact O-CG2 3.32Å; R109-V113 PolarHBondContact O-N 3.09Å; R109-V113 VanDerWaalsContact O-N 3.13Å |
| 110 | T | 98.4 | Very high | 97 | Very high | 54 Ų | 54 | 80.6 Ų | 80.6 | 33% | 0.331 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.5 | -39.4 | 177.8 | -63.7 | 0 | 0 | 0 | 0 | 111.6 | E106 R107 D108 V113 N114 | E106-T110 WeakPolarHBondContact O-CB 3.36Å; E106-T110 PolarHBondContact O-N 3.48Å; E106-T110 PolarHBondContact O-OG1 3.26Å; E106-T110 PolarHBondContact OE1-OG1 3.04Å; R107-T110 PolarHBondContact O-N 2.61Å; D108-T110 PolarHBondContact O-N 3.04Å; T110-V113 PolarHBondContact O-N 3.02Å; T110-N114 VanDerWaalsContact O-CG 3.3Å; T110-N114 PolarHBondContact O-N 3.44Å; T110-N114 PolarHBondContact O-ND2 3.23Å |
| 111 | N | 98.3 | Very high | 97.1 | Very high | 98 Ų | 98 | 80 Ų | 80 | 52% | 0.524 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.8 | -45.4 | 175.8 | -171.9 | 55.4 | 0 | 0 | 0 | 111.2 | R107 D108 R109 V113 N114 T115 | R107-N111 WeakPolarHBondContact O-CB 3.38Å; R107-N111 PolarHBondContact O-N 2.77Å; D108-N111 PolarHBondContact O-N 2.91Å; R109-N111 VanDerWaalsContact C-N 3.33Å; R109-N111 PolarHBondContact O-N 3.41Å; N111-V113 VanDerWaalsContact C-N 3.3Å; N111-V113 PolarHBondContact O-N 2.95Å; N111-N114 PolarHBondContact O-N 3.42Å; N111-N114 VanDerWaalsContact O-N 3.12Å; N111-T115 PolarHBondContact O-N 3.18Å; N111-T115 PolarHBondContact O-OG1 2.84Å; N111-T115 VanDerWaalsContact O-OG1 3.07Å |
| 112 | S | 98.3 | Very high | 97 | Very high | 82 Ų | 82 | 83.3 Ų | 83.3 | 57% | 0.573 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -56.4 | -43.6 | 175.2 | -172.8 | 0 | 0 | 0 | 0 | 112.3 | D108 R109 T115 A116 | D108-S112 PolarHBondContact O-N 3.31Å; R109-S112 WeakPolarHBondContact O-CB 3.35Å; R109-S112 PolarHBondContact O-N 2.82Å; S112-T115 PolarHBondContact O-N 3.34Å; S112-A116 PolarHBondContact O-N 2.9Å; S112-A116 VanDerWaalsContact O-N 3.11Å |
| 113 | V | 98.1 | Very high | 96.9 | Very high | 60 Ų | 60 | 87.3 Ų | 87.3 | 36% | 0.364 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -64.1 | -43.2 | 176.6 | 173.1 | 0 | 0 | 0 | 0 | 111 | R109 T110 N111 T115 A116 F117 | R109-V113 WeakPolarHBondContact O-CG2 3.32Å; R109-V113 PolarHBondContact O-N 3.09Å; R109-V113 VanDerWaalsContact O-N 3.13Å; T110-V113 PolarHBondContact O-N 3.02Å; N111-V113 VanDerWaalsContact C-N 3.3Å; N111-V113 PolarHBondContact O-N 2.95Å; V113-T115 VanDerWaalsContact C-N 3.35Å; V113-T115 PolarHBondContact O-N 3.49Å; V113-A116 PolarHBondContact O-N 3.45Å; V113-F117 HydrophobicContact CG1-CD2 4.02Å; V113-F117 HydrophobicContact CG1-CE2 4.26Å; V113-F117 PolarHBondContact O-N 2.89Å |
| 114 | N | 97.8 | Very high | 96.6 | Very high | 59 Ų | 59 | 83 Ų | 83 | 32% | 0.316 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -66 | -37.6 | 179 | -70.4 | -29.3 | 0 | 0 | 0 | 112 | T110 N111 F117 T118 K135 | T110-N114 VanDerWaalsContact O-CG 3.3Å; T110-N114 PolarHBondContact O-N 3.44Å; T110-N114 PolarHBondContact O-ND2 3.23Å; N111-N114 PolarHBondContact O-N 3.42Å; N111-N114 VanDerWaalsContact O-N 3.12Å; N114-F117 PolarHBondContact O-N 3.39Å; N114-T118 PolarHBondContact O-N 3.11Å; N114-T118 PolarHBondContact O-OG1 3.26Å; N114-T118 VanDerWaalsContact O-OG1 3.13Å; N114-K135 PolarHBondContact OD1-NZ 3.45Å |
| 115 | T | 97.8 | Very high | 96 | Very high | 84 Ų | 84 | 83.4 Ų | 83.4 | 52% | 0.515 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60 | -46 | 172.9 | -57.7 | 0 | 0 | 0 | 0 | 111.2 | N111 S112 V113 F117 T118 A119 | N111-T115 PolarHBondContact O-N 3.18Å; N111-T115 PolarHBondContact O-OG1 2.84Å; N111-T115 VanDerWaalsContact O-OG1 3.07Å; S112-T115 PolarHBondContact O-N 3.34Å; V113-T115 VanDerWaalsContact C-N 3.35Å; V113-T115 PolarHBondContact O-N 3.49Å; T115-F117 VanDerWaalsContact C-N 3.34Å; T115-F117 PolarHBondContact O-N 3.12Å; T115-T118 PolarHBondContact O-N 3.49Å; T115-A119 PolarHBondContact O-N 3.44Å |
| 116 | A | 97.9 | Very high | 95.4 | Very high | 62 Ų | 62 | 76.7 Ų | 76.7 | 51% | 0.512 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.4 | -41.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | S112 V113 T118 A119 L120 | S112-A116 PolarHBondContact O-N 2.9Å; S112-A116 VanDerWaalsContact O-N 3.11Å; V113-A116 PolarHBondContact O-N 3.45Å; A116-T118 VanDerWaalsContact C-N 3.33Å; A116-T118 PolarHBondContact O-N 3.28Å; A116-A119 PolarHBondContact O-N 3.44Å; A116-L120 PolarHBondContact O-N 3.32Å |
| 117 | F | 97.8 | Very high | 94.4 | Very high | 35 Ų | 35 | 77.3 Ų | 77.3 | 15% | 0.154 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -61.6 | -38.6 | 174.5 | -102.9 | -81.4 | 0 | 0 | 0 | 112.7 | V113 N114 T115 L120 R121 K135 T138 L139 | V113-F117 HydrophobicContact CG1-CD2 4.02Å; V113-F117 HydrophobicContact CG1-CE2 4.26Å; V113-F117 PolarHBondContact O-N 2.89Å; N114-F117 PolarHBondContact O-N 3.39Å; T115-F117 VanDerWaalsContact C-N 3.34Å; T115-F117 PolarHBondContact O-N 3.12Å; F117-L120 PolarHBondContact O-N 3.11Å; F117-R121 WeakPolarHBondContact O-CG 2.73Å; F117-R121 PolarHBondContact O-N 2.07Å; F117-R121 VanDerWaalsContact O-N 3.09Å; F117-R121 PolarHBondContact O-NH1 3.37Å; F117-K135 HydrophobicContact CD1-CG 4.23Å; F117-K135 HydrophobicContact CE1-CB 3.93Å; F117-K135 HydrophobicContact CE1-CG 4.04Å; F117-K135 HydrophobicContact CZ-CB 4.24Å; F117-K135 HydrophobicContact CZ-CG 4.33Å; F117-T138 HydrophobicContact CD1-CG2 4.18Å; F117-T138 HydrophobicContact CE1-CG2 4.44Å; F117-L139 HydrophobicContact CE1-CD2 4.11Å; F117-L139 HydrophobicContact CE1-CG 4.1Å; F117-L139 HydrophobicContact CZ-CD1 4.26Å; F117-L139 HydrophobicContact CZ-CD2 4.03Å; F117-L139 HydrophobicContact CZ-CG 4.16Å |
| 118 | T | 95.7 | Very high | 93.6 | Very high | 79 Ų | 79 | 72.5 Ų | 72.5 | 49% | 0.485 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -67.6 | -43.3 | 176.6 | -60.7 | 0 | 0 | 0 | 0 | 111.4 | N114 T115 A116 L120 R121 T122 | N114-T118 PolarHBondContact O-N 3.11Å; N114-T118 PolarHBondContact O-OG1 3.26Å; N114-T118 VanDerWaalsContact O-OG1 3.13Å; T115-T118 PolarHBondContact O-N 3.49Å; A116-T118 VanDerWaalsContact C-N 3.33Å; A116-T118 PolarHBondContact O-N 3.28Å; T118-L120 VanDerWaalsContact C-N 3.32Å; T118-L120 PolarHBondContact O-N 3.2Å; T118-R121 WeakPolarHBondContact O-CB 3.28Å; T118-R121 PolarHBondContact O-N 2.65Å; T118-T122 PolarHBondContact O-N 3.33Å |
| 119 | A | 95.8 | Very high | 92.4 | Very high | 52 Ų | 52 | 72.8 Ų | 72.8 | 43% | 0.43 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -59 | -44.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | T115 A116 R121 T122 L123 | T115-A119 PolarHBondContact O-N 3.44Å; A116-A119 PolarHBondContact O-N 3.44Å; A119-R121 VanDerWaalsContact C-N 3.31Å; A119-R121 PolarHBondContact O-N 3.44Å; A119-T122 PolarHBondContact O-N 2.92Å; A119-T122 VanDerWaalsContact O-N 3.11Å; A119-T122 PolarHBondContact O-OG1 3.15Å; A119-L123 PolarHBondContact O-N 3.23Å |
| 120 | L | 96 | Very high | 91.4 | Very high | 54 Ų | 54 | 72 Ų | 72 | 28% | 0.283 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -57.9 | -41.8 | 176.4 | -178.5 | 58.7 | 0 | 0 | 0 | 112.3 | A116 F117 T118 T122 L123 I124 T138 A142 | A116-L120 PolarHBondContact O-N 3.32Å; F117-L120 PolarHBondContact O-N 3.11Å; T118-L120 VanDerWaalsContact C-N 3.32Å; T118-L120 PolarHBondContact O-N 3.2Å; L120-T122 VanDerWaalsContact C-N 3.28Å; L120-T122 PolarHBondContact O-N 3.29Å; L120-L123 PolarHBondContact O-N 3.19Å; L120-L123 VanDerWaalsContact O-N 3.11Å; L120-I124 HydrophobicContact CG-CD1 4.38Å; L120-I124 WeakPolarHBondContact O-CG1 3.24Å; L120-I124 PolarHBondContact O-N 3.2Å; L120-T138 HydrophobicContact CB-CG2 4.3Å; L120-T138 HydrophobicContact CD2-CG2 3.7Å; L120-T138 HydrophobicContact CG-CG2 3.78Å; L120-A142 HydrophobicContact CD1-CB 4.06Å; L120-A142 HydrophobicContact CD2-CB 4.29Å; L120-A142 HydrophobicContact CG-CB 4.47Å |
| 121 | R | 94.2 | Very high | 90.9 | Very high | 69 Ų | 69 | 73.3 Ų | 73.3 | 26% | 0.26 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.3 | -37.7 | 177 | -71.4 | -178.6 | -168.2 | 93.3 | -1.5 | 112.9 | F117 T118 A119 L123 I124 L133 T138 | F117-R121 WeakPolarHBondContact O-CG 2.73Å; F117-R121 PolarHBondContact O-N 2.07Å; F117-R121 VanDerWaalsContact O-N 3.09Å; F117-R121 PolarHBondContact O-NH1 3.37Å; T118-R121 WeakPolarHBondContact O-CB 3.28Å; T118-R121 PolarHBondContact O-N 2.65Å; A119-R121 VanDerWaalsContact C-N 3.31Å; A119-R121 PolarHBondContact O-N 3.44Å; R121-L123 PolarHBondContact O-N 3.32Å; R121-I124 PolarHBondContact O-N 3.15Å; R121-L133 HydrophobicContact CG-CB 4.38Å; R121-L133 PolarHBondContact NE-O 3.12Å; R121-L133 PolarHBondContact NH2-O 3.11Å; R121-T138 HydrophobicContact CG-CG2 3.84Å |
| 122 | T | 91.7 | Very high | 90.3 | Very high | 113 Ų | 113 | 78 Ų | 78 | 69% | 0.693 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -67.6 | -19.7 | 179.2 | 64.1 | 0 | 0 | 0 | 0 | 113.7 | T118 A119 L120 | T118-T122 PolarHBondContact O-N 3.33Å; A119-T122 PolarHBondContact O-N 2.92Å; A119-T122 VanDerWaalsContact O-N 3.11Å; A119-T122 PolarHBondContact O-OG1 3.15Å; L120-T122 VanDerWaalsContact C-N 3.28Å; L120-T122 PolarHBondContact O-N 3.29Å |
| 123 | L | 92.5 | Very high | 89.9 | Confident | 121 Ų | 121 | 74.6 Ų | 74.6 | 63% | 0.634 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -90.4 | -12.5 | 177.7 | -60.2 | 175.4 | 0 | 0 | 0 | 112.8 | A119 L120 R121 P125 | A119-L123 PolarHBondContact O-N 3.23Å; L120-L123 PolarHBondContact O-N 3.19Å; L120-L123 VanDerWaalsContact O-N 3.11Å; R121-L123 PolarHBondContact O-N 3.32Å; L123-P125 WeakPolarHBondContact O-CD 3.31Å |
| 124 | I | 90.8 | Very high | 89.7 | Confident | 12 Ų | 12 | 74 Ų | 74 | 6% | 0.062 | 42% | 0.421 | C | S | . | . | S | Bend | trans | -88.1 | 118.2 | -179.2 | -64 | 170.4 | 0 | 0 | 0 | 108.7 | L120 R121 T126 L133 T138 L141 A142 | L120-I124 HydrophobicContact CG-CD1 4.38Å; L120-I124 WeakPolarHBondContact O-CG1 3.24Å; L120-I124 PolarHBondContact O-N 3.2Å; R121-I124 PolarHBondContact O-N 3.15Å; I124-T126 HydrophobicContact CG2-CG2 4.08Å; I124-T126 PolarHBondContact O-N 3.11Å; I124-L133 HydrophobicContact CB-CD1 4.26Å; I124-L133 HydrophobicContact CD1-CD1 4.06Å; I124-L133 HydrophobicContact CG2-CD1 4Å; I124-T138 HydrophobicContact CD1-CG2 3.6Å; I124-T138 VanDerWaalsContact CD1-O 3.3Å; I124-T138 WeakPolarHBondContact CD1-O 3.29Å; I124-L141 HydrophobicContact CD1-CB 4.25Å; I124-L141 HydrophobicContact CG2-CB 3.81Å; I124-L141 HydrophobicContact CG2-CD1 4.13Å; I124-A142 HydrophobicContact CD1-CB 4.21Å |
| 125 | P | 84.8 | Confident | 89.6 | Confident | 56 Ų | 56 | 76.4 Ų | 76.4 | 36% | 0.364 | 43% | 0.428 | S | S | . | . | trans | -69.1 | 116.3 | 177.5 | -18.6 | 32.9 | 0 | 0 | 0 | 111.4 | L123 Y145 | L123-P125 WeakPolarHBondContact O-CD 3.31Å; P125-Y145 HydrophobicContact CG-CD2 4.33Å; P125-Y145 HydrophobicContact CG-CE1 4.08Å; P125-Y145 HydrophobicContact CG-CE2 3.82Å | ||
| 126 | T | 84.4 | Confident | 89.4 | Confident | 20 Ų | 20 | 76.7 Ų | 76.7 | 12% | 0.123 | 43% | 0.426 | C | S | . | . | trans | -129.2 | 159 | 175.1 | 63.2 | 0 | 0 | 0 | 0 | 112.2 | I124 P128 L133 | I124-T126 HydrophobicContact CG2-CG2 4.08Å; I124-T126 PolarHBondContact O-N 3.11Å; T126-P128 CarbonylContact C-O 3.4Å; T126-P128 CarbonylContact O-C 3.44Å; T126-P128 PolarHBondContact OG1-O 3.45Å; T126-L133 HydrophobicContact CG2-CD1 3.96Å; T126-L133 HydrophobicContact CG2-CD2 4.23Å; T126-L133 HydrophobicContact CG2-CG 4.37Å | ||
| 127 | E | 78.2 | Confident | 89.1 | Confident | 99 Ų | 99 | 76.9 Ų | 76.9 | 46% | 0.463 | 42% | 0.416 | S | S | . | . | S | Bend | trans | -127.9 | 117 | 172.3 | -167.1 | 166.7 | 158.6 | 0 | 0 | 108.6 | T194 R201 | E127-T194 HydrophobicContact CB-CG2 3.5Å; E127-T194 VanDerWaalsContact CB-CG2 3.5Å; E127-R201 VanDerWaalsContact CD-NH2 3.34Å; E127-R201 IonicContact OE1-CZ 3.48Å; E127-R201 IonicContact OE1-NH1 2.72Å; E127-R201 PolarHBondContact OE1-NH1 3.23Å; E127-R201 IonicContact OE1-NH2 3.42Å; E127-R201 PolarHBondContact OE1-NH2 3.42Å; E127-R201 IonicContact OE2-CZ 3.2Å; E127-R201 IonicContact OE2-NH1 2.8Å; E127-R201 PolarHBondContact OE2-NH1 2.88Å; E127-R201 IonicContact OE2-NH2 3.74Å; E127-R201 PolarHBondContact OE2-NH2 3.42Å |
| 128 | P | 79.9 | Confident | 88.9 | Confident | 80 Ų | 80 | 75.2 Ų | 75.2 | 52% | 0.519 | 41% | 0.409 | S | S | . | . | S | Bend | cis | -69.2 | 161.7 | -3.7 | 34.3 | -38.5 | 0 | 0 | 0 | 112.9 | T126 D130 R131 | T126-P128 CarbonylContact C-O 3.4Å; T126-P128 CarbonylContact O-C 3.44Å; T126-P128 PolarHBondContact OG1-O 3.45Å; P128-D130 VanDerWaalsContact CB-OD1 3.28Å; P128-D130 WeakPolarHBondContact CB-OD1 2.89Å; P128-D130 WeakPolarHBondContact CG-OD1 2.88Å; P128-D130 PolarHBondContact O-N 2.75Å; P128-R131 VanDerWaalsContact O-CB 3.31Å; P128-R131 WeakPolarHBondContact O-CB 3.33Å; P128-R131 PolarHBondContact O-N 3.03Å; P128-R131 VanDerWaalsContact O-N 3.11Å |
| 129 | A | 72.6 | Confident | 88.8 | Confident | 96 Ų | 96 | 75.6 Ų | 75.6 | 79% | 0.793 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.4 | -20.1 | -173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 130 | D | 78.9 | Confident | 88.5 | Confident | 127 Ų | 127 | 81.4 Ų | 81.4 | 68% | 0.679 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.5 | 12.6 | 177.2 | 65.8 | -37.4 | 0 | 0 | 0 | 113.1 | P128 K132 | P128-D130 VanDerWaalsContact CB-OD1 3.28Å; P128-D130 WeakPolarHBondContact CB-OD1 2.89Å; P128-D130 WeakPolarHBondContact CG-OD1 2.88Å; P128-D130 PolarHBondContact O-N 2.75Å; D130-K132 PolarHBondContact O-N 3.16Å; D130-K132 VanDerWaalsContact O-N 3.15Å |
| 131 | R | 86.7 | Confident | 88.1 | Confident | 82 Ų | 82 | 80.7 Ų | 80.7 | 31% | 0.309 | 41% | 0.414 | S | S | . | . | trans | -55.2 | 123.1 | 176.6 | 179.4 | -178.6 | 165.8 | -164.8 | -6 | 110.4 | P128 L133 E137 | P128-R131 VanDerWaalsContact O-CB 3.31Å; P128-R131 WeakPolarHBondContact O-CB 3.33Å; P128-R131 PolarHBondContact O-N 3.03Å; P128-R131 VanDerWaalsContact O-N 3.11Å; R131-L133 HydrophobicContact CG-CD2 4.21Å; R131-L133 PolarHBondContact O-N 3.35Å; R131-E137 IonicContact NH2-OE1 3.52Å; R131-E137 PolarHBondContact NH2-OE1 3.47Å | ||
| 132 | K | 86.8 | Confident | 88.1 | Confident | 197 Ų | 197 | 78.1 Ų | 78.1 | 86% | 0.857 | 41% | 0.407 | S | S | * | . | trans | -75.3 | 106.9 | 176 | -63.4 | -177.3 | -177.8 | 174.9 | 0 | 110.3 | D130 | D130-K132 PolarHBondContact O-N 3.16Å; D130-K132 VanDerWaalsContact O-N 3.15Å | ||
| 133 | L | 89.3 | Confident | 88 | Confident | 9 Ų | 9 | 76.2 Ų | 76.2 | 5% | 0.047 | 40% | 0.399 | C | S | . | . | trans | -90.3 | 131.4 | 175.6 | -60.2 | 175.6 | 0 | 0 | 0 | 111.6 | R121 I124 T126 R131 E137 T138 L141 | R121-L133 HydrophobicContact CG-CB 4.38Å; R121-L133 PolarHBondContact NE-O 3.12Å; R121-L133 PolarHBondContact NH2-O 3.11Å; I124-L133 HydrophobicContact CB-CD1 4.26Å; I124-L133 HydrophobicContact CD1-CD1 4.06Å; I124-L133 HydrophobicContact CG2-CD1 4Å; T126-L133 HydrophobicContact CG2-CD1 3.96Å; T126-L133 HydrophobicContact CG2-CD2 4.23Å; T126-L133 HydrophobicContact CG2-CG 4.37Å; R131-L133 HydrophobicContact CG-CD2 4.21Å; R131-L133 PolarHBondContact O-N 3.35Å; L133-E137 HydrophobicContact CD2-CB 4.49Å; L133-T138 WeakPolarHBondContact CB-OG1 3.46Å; L133-L141 HydrophobicContact CD1-CD1 3.86Å; L133-L141 HydrophobicContact CD2-CD1 3.63Å; L133-L141 HydrophobicContact CG-CD1 4.39Å | ||
| 134 | S | 94.8 | Very high | 87.6 | Confident | 48 Ų | 48 | 72.2 Ų | 72.2 | 34% | 0.336 | 38% | 0.381 | S | S | . | . | trans | -65.2 | 165.3 | 168.5 | 68.4 | 0 | 0 | 0 | 0 | 111.5 | I136 E137 T138 | S134-I136 VanDerWaalsContact C-N 3.32Å; S134-I136 PolarHBondContact O-N 3.22Å; S134-I136 WeakPolarHBondContact OG-CG2 3.31Å; S134-E137 VanDerWaalsContact CB-OE2 3.23Å; S134-E137 WeakPolarHBondContact CB-OE2 3.44Å; S134-E137 PolarHBondContact N-OE2 2.87Å; S134-E137 PolarHBondContact O-N 2.87Å; S134-E137 WeakPolarHBondContact OG-CB 3.3Å; S134-E137 WeakPolarHBondContact OG-CG 3.47Å; S134-E137 PolarHBondContact OG-N 3.12Å; S134-E137 PolarHBondContact OG-OE2 3.49Å; S134-T138 WeakPolarHBondContact O-CB 3.37Å; S134-T138 PolarHBondContact O-N 3.33Å; S134-T138 PolarHBondContact O-OG1 2.94Å | ||
| 135 | K | 94.6 | Very high | 87.6 | Confident | 109 Ų | 109 | 74.8 Ų | 74.8 | 47% | 0.474 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -57.7 | -44.9 | 178.9 | -71.6 | -175.1 | 176.8 | -177.4 | 0 | 111.6 | N114 F117 T138 L139 | N114-K135 PolarHBondContact OD1-NZ 3.45Å; F117-K135 HydrophobicContact CD1-CG 4.23Å; F117-K135 HydrophobicContact CE1-CB 3.93Å; F117-K135 HydrophobicContact CE1-CG 4.04Å; F117-K135 HydrophobicContact CZ-CB 4.24Å; F117-K135 HydrophobicContact CZ-CG 4.33Å; K135-T138 PolarHBondContact O-N 2.99Å; K135-L139 WeakPolarHBondContact O-CG 3.42Å; K135-L139 PolarHBondContact O-N 3.46Å |
| 136 | I | 94.9 | Very high | 87.9 | Confident | 90 Ų | 90 | 77.7 Ų | 77.7 | 46% | 0.462 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -68.5 | -41.9 | -179.7 | -174.7 | 59.6 | 0 | 0 | 0 | 112.2 | S134 T138 L139 R140 | S134-I136 VanDerWaalsContact C-N 3.32Å; S134-I136 PolarHBondContact O-N 3.22Å; S134-I136 WeakPolarHBondContact OG-CG2 3.31Å; I136-T138 VanDerWaalsContact C-N 3.34Å; I136-T138 PolarHBondContact O-N 3.43Å; I136-L139 PolarHBondContact O-N 3.28Å; I136-R140 HydrophobicContact CD1-CG 4.41Å; I136-R140 WeakPolarHBondContact O-CG 3.25Å; I136-R140 PolarHBondContact O-N 3.29Å |
| 137 | E | 90.2 | Very high | 87.9 | Confident | 67 Ų | 67 | 78.7 Ų | 78.7 | 31% | 0.313 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.5 | -42 | 175.9 | -72.4 | 170 | 114.5 | 0 | 0 | 111.5 | R131 L133 S134 L139 R140 L141 | R131-E137 IonicContact NH2-OE1 3.52Å; R131-E137 PolarHBondContact NH2-OE1 3.47Å; L133-E137 HydrophobicContact CD2-CB 4.49Å; S134-E137 VanDerWaalsContact CB-OE2 3.23Å; S134-E137 WeakPolarHBondContact CB-OE2 3.44Å; S134-E137 PolarHBondContact N-OE2 2.87Å; S134-E137 PolarHBondContact O-N 2.87Å; S134-E137 WeakPolarHBondContact OG-CB 3.3Å; S134-E137 WeakPolarHBondContact OG-CG 3.47Å; S134-E137 PolarHBondContact OG-N 3.12Å; S134-E137 PolarHBondContact OG-OE2 3.49Å; E137-L139 VanDerWaalsContact C-N 3.31Å; E137-L139 PolarHBondContact O-N 3.43Å; E137-R140 PolarHBondContact O-N 3.07Å; E137-L141 WeakPolarHBondContact O-CB 3.35Å; E137-L141 WeakPolarHBondContact O-CG 3.48Å; E137-L141 PolarHBondContact O-N 3.13Å |
| 138 | T | 93.4 | Very high | 88.1 | Confident | 0 Ų | 0 | 74.5 Ų | 74.5 | 0% | 0 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -56.2 | -47.2 | 177.3 | -55.6 | 0 | 0 | 0 | 0 | 110.4 | F117 L120 R121 I124 L133 S134 K135 I136 A142 | F117-T138 HydrophobicContact CD1-CG2 4.18Å; F117-T138 HydrophobicContact CE1-CG2 4.44Å; L120-T138 HydrophobicContact CB-CG2 4.3Å; L120-T138 HydrophobicContact CD2-CG2 3.7Å; L120-T138 HydrophobicContact CG-CG2 3.78Å; R121-T138 HydrophobicContact CG-CG2 3.84Å; I124-T138 HydrophobicContact CD1-CG2 3.6Å; I124-T138 VanDerWaalsContact CD1-O 3.3Å; I124-T138 WeakPolarHBondContact CD1-O 3.29Å; L133-T138 WeakPolarHBondContact CB-OG1 3.46Å; S134-T138 WeakPolarHBondContact O-CB 3.37Å; S134-T138 PolarHBondContact O-N 3.33Å; S134-T138 PolarHBondContact O-OG1 2.94Å; K135-T138 PolarHBondContact O-N 2.99Å; I136-T138 VanDerWaalsContact C-N 3.34Å; I136-T138 PolarHBondContact O-N 3.43Å; T138-A142 VanDerWaalsContact O-CB 3.25Å; T138-A142 WeakPolarHBondContact O-CB 3.47Å; T138-A142 PolarHBondContact O-N 3.19Å |
| 139 | L | 95.3 | Very high | 88.4 | Confident | 86 Ų | 86 | 74 Ų | 74 | 45% | 0.45 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -65.3 | -45.2 | 178.8 | -65.7 | 176.8 | 0 | 0 | 0 | 112.1 | F117 K135 I136 E137 A142 S143 | F117-L139 HydrophobicContact CE1-CD2 4.11Å; F117-L139 HydrophobicContact CE1-CG 4.1Å; F117-L139 HydrophobicContact CZ-CD1 4.26Å; F117-L139 HydrophobicContact CZ-CD2 4.03Å; F117-L139 HydrophobicContact CZ-CG 4.16Å; K135-L139 WeakPolarHBondContact O-CG 3.42Å; K135-L139 PolarHBondContact O-N 3.46Å; I136-L139 PolarHBondContact O-N 3.28Å; E137-L139 VanDerWaalsContact C-N 3.31Å; E137-L139 PolarHBondContact O-N 3.43Å; L139-A142 PolarHBondContact O-N 2.96Å; L139-S143 PolarHBondContact O-N 3.32Å; L139-S143 VanDerWaalsContact O-N 3.12Å; L139-S143 PolarHBondContact O-OG 2.86Å |
| 140 | R | 87.9 | Confident | 89 | Confident | 175 Ų | 175 | 71.2 Ų | 71.2 | 66% | 0.66 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -62.3 | -45.3 | 179.3 | -72.2 | 177.4 | 177.2 | 177.6 | -0.1 | 112.1 | I136 E137 S144 | I136-R140 HydrophobicContact CD1-CG 4.41Å; I136-R140 WeakPolarHBondContact O-CG 3.25Å; I136-R140 PolarHBondContact O-N 3.29Å; E137-R140 PolarHBondContact O-N 3.07Å; R140-S144 PolarHBondContact O-N 3.26Å; R140-S144 VanDerWaalsContact O-N 3.11Å |
| 141 | L | 89.3 | Confident | 89.1 | Confident | 39 Ų | 39 | 67 Ų | 67 | 20% | 0.204 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -68.5 | -39.4 | 179.5 | -71.7 | 173.4 | 0 | 0 | 0 | 111.9 | I124 L133 E137 S144 Y145 | I124-L141 HydrophobicContact CD1-CB 4.25Å; I124-L141 HydrophobicContact CG2-CB 3.81Å; I124-L141 HydrophobicContact CG2-CD1 4.13Å; L133-L141 HydrophobicContact CD1-CD1 3.86Å; L133-L141 HydrophobicContact CD2-CD1 3.63Å; L133-L141 HydrophobicContact CG-CD1 4.39Å; E137-L141 WeakPolarHBondContact O-CB 3.35Å; E137-L141 WeakPolarHBondContact O-CG 3.48Å; E137-L141 PolarHBondContact O-N 3.13Å; L141-S144 PolarHBondContact O-N 3.39Å; L141-Y145 VanDerWaalsContact O-CB 3.31Å; L141-Y145 WeakPolarHBondContact O-CB 3.27Å; L141-Y145 PolarHBondContact O-N 3.2Å |
| 142 | A | 92.8 | Very high | 88.8 | Confident | 14 Ų | 14 | 65.9 Ų | 65.9 | 12% | 0.116 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -59.7 | -47.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L120 I124 T138 L139 S144 Y145 I146 | L120-A142 HydrophobicContact CD1-CB 4.06Å; L120-A142 HydrophobicContact CD2-CB 4.29Å; L120-A142 HydrophobicContact CG-CB 4.47Å; I124-A142 HydrophobicContact CD1-CB 4.21Å; T138-A142 VanDerWaalsContact O-CB 3.25Å; T138-A142 WeakPolarHBondContact O-CB 3.47Å; T138-A142 PolarHBondContact O-N 3.19Å; L139-A142 PolarHBondContact O-N 2.96Å; A142-S144 PolarHBondContact O-N 3.09Å; A142-Y145 PolarHBondContact O-N 2.88Å; A142-I146 WeakPolarHBondContact O-CG1 3.49Å; A142-I146 PolarHBondContact O-N 2.69Å |
| 143 | S | 89.7 | Confident | 88.7 | Confident | 74 Ų | 74 | 63.9 Ų | 63.9 | 52% | 0.517 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -62 | -42.5 | 177.6 | -60.5 | 0 | 0 | 0 | 0 | 112.5 | L139 Y145 S147 | L139-S143 PolarHBondContact O-N 3.32Å; L139-S143 VanDerWaalsContact O-N 3.12Å; L139-S143 PolarHBondContact O-OG 2.86Å; S143-Y145 VanDerWaalsContact C-N 3.32Å; S143-Y145 PolarHBondContact O-N 2.7Å; S143-S147 PolarHBondContact O-N 3.08Å; S143-S147 VanDerWaalsContact O-N 3.12Å; S143-S147 PolarHBondContact O-OG 2.95Å |
| 144 | S | 85.5 | Confident | 88.2 | Confident | 37 Ų | 37 | 70.3 Ų | 70.3 | 26% | 0.259 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.3 | -40.6 | 174.9 | -176.6 | 0 | 0 | 0 | 0 | 111.7 | R140 L141 A142 S147 H148 | R140-S144 PolarHBondContact O-N 3.26Å; R140-S144 VanDerWaalsContact O-N 3.11Å; L141-S144 PolarHBondContact O-N 3.39Å; A142-S144 PolarHBondContact O-N 3.09Å; S144-S147 PolarHBondContact O-N 3.19Å; S144-H148 VanDerWaalsContact O-CB 3.27Å; S144-H148 WeakPolarHBondContact O-CB 3.31Å; S144-H148 PolarHBondContact O-N 3.49Å |
| 145 | Y | 90 | Very high | 87.1 | Confident | 65 Ų | 65 | 72.3 Ų | 72.3 | 26% | 0.255 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -68.3 | -42.2 | -179.7 | -174.6 | -134.4 | 0 | 0 | 0 | 112.5 | P125 L141 A142 S143 S147 H148 L149 F195 | P125-Y145 HydrophobicContact CG-CD2 4.33Å; P125-Y145 HydrophobicContact CG-CE1 4.08Å; P125-Y145 HydrophobicContact CG-CE2 3.82Å; L141-Y145 VanDerWaalsContact O-CB 3.31Å; L141-Y145 WeakPolarHBondContact O-CB 3.27Å; L141-Y145 PolarHBondContact O-N 3.2Å; A142-Y145 PolarHBondContact O-N 2.88Å; S143-Y145 VanDerWaalsContact C-N 3.32Å; S143-Y145 PolarHBondContact O-N 2.7Å; Y145-S147 VanDerWaalsContact C-N 3.33Å; Y145-S147 PolarHBondContact O-N 3.19Å; Y145-H148 WeakPolarHBondContact O-CB 3.47Å; Y145-H148 PolarHBondContact O-N 3Å; Y145-L149 HydrophobicContact CD1-CD1 4.26Å; Y145-L149 HydrophobicContact CD2-CD1 4.42Å; Y145-L149 HydrophobicContact CD2-CG 4.14Å; Y145-L149 HydrophobicContact CE1-CD1 3.83Å; Y145-L149 HydrophobicContact CE2-CD1 4Å; Y145-L149 HydrophobicContact CE2-CD2 3.8Å; Y145-L149 HydrophobicContact CE2-CG 3.78Å; Y145-L149 WeakPolarHBondContact O-CG 3.3Å; Y145-L149 PolarHBondContact O-N 2.93Å; Y145-F195 HydrophobicContact CD2-CD2 4.31Å; Y145-F195 HydrophobicContact CE2-CD2 4.05Å |
| 146 | I | 90.5 | Very high | 85.5 | Confident | 118 Ų | 118 | 68.9 Ų | 68.9 | 61% | 0.605 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -58.4 | -47.4 | 173.6 | -66.9 | 164.8 | 0 | 0 | 0 | 110.5 | A142 H148 L149 G150 | A142-I146 WeakPolarHBondContact O-CG1 3.49Å; A142-I146 PolarHBondContact O-N 2.69Å; I146-H148 VanDerWaalsContact C-N 3.29Å; I146-H148 PolarHBondContact O-N 2.85Å; I146-L149 PolarHBondContact O-N 2.82Å; I146-G150 PolarHBondContact O-N 3.13Å |
| 147 | S | 85.8 | Confident | 83.8 | Confident | 41 Ų | 41 | 72.9 Ų | 72.9 | 29% | 0.287 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62.9 | -40.6 | 180 | -54.9 | 0 | 0 | 0 | 0 | 111.3 | S143 S144 Y145 G150 N151 | S143-S147 PolarHBondContact O-N 3.08Å; S143-S147 VanDerWaalsContact O-N 3.12Å; S143-S147 PolarHBondContact O-OG 2.95Å; S144-S147 PolarHBondContact O-N 3.19Å; Y145-S147 VanDerWaalsContact C-N 3.33Å; Y145-S147 PolarHBondContact O-N 3.19Å; S147-G150 PolarHBondContact O-N 3.35Å; S147-N151 PolarHBondContact O-N 3.42Å |
| 148 | H | 82.1 | Confident | 82 | Confident | 11 Ų | 11 | 72.8 Ų | 72.8 | 5% | 0.051 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -61.5 | -50.7 | 176.6 | 174.9 | 61.2 | 0 | 0 | 0 | 111.9 | S144 Y145 I146 G150 N151 V152 P164 F195 | S144-H148 VanDerWaalsContact O-CB 3.27Å; S144-H148 WeakPolarHBondContact O-CB 3.31Å; S144-H148 PolarHBondContact O-N 3.49Å; Y145-H148 WeakPolarHBondContact O-CB 3.47Å; Y145-H148 PolarHBondContact O-N 3Å; I146-H148 VanDerWaalsContact C-N 3.29Å; I146-H148 PolarHBondContact O-N 2.85Å; H148-G150 VanDerWaalsContact C-N 3.27Å; H148-G150 PolarHBondContact O-N 3.3Å; H148-N151 PolarHBondContact O-N 3.11Å; H148-N151 VanDerWaalsContact O-N 3.12Å; H148-V152 WeakPolarHBondContact CE1-CG2 3.49Å; H148-V152 WeakPolarHBondContact NE2-CG2 3.31Å; H148-V152 PolarHBondContact O-N 3.46Å; H148-P164 WeakPolarHBondContact ND1-CG 3.11Å; H148-F195 AromaticContact CD2-CD1 3.48Å; H148-F195 VanDerWaalsContact CD2-CD1 3.48Å; H148-F195 WeakPolarHBondContact CD2-CD1 3.43Å; H148-F195 AromaticContact CD2-CD2 3.61Å; H148-F195 AromaticContact CD2-CE1 3.3Å; H148-F195 WeakPolarHBondContact CD2-CE1 3.45Å; H148-F195 AromaticContact CD2-CE2 3.33Å; H148-F195 WeakPolarHBondContact CD2-CE2 3.23Å; H148-F195 AromaticContact CD2-CG 3.72Å; H148-F195 AromaticContact CD2-CZ 3.24Å; H148-F195 WeakPolarHBondContact CD2-CZ 3.21Å; H148-F195 AromaticContact CE1-CD1 3.57Å; H148-F195 AromaticContact CE1-CE1 2.88Å; H148-F195 WeakPolarHBondContact CE1-CE1 3.35Å; H148-F195 AromaticContact CE1-CZ 3.28Å; H148-F195 WeakPolarHBondContact CE1-CZ 3.4Å; H148-F195 AromaticContact CG-CD1 3.46Å; H148-F195 VanDerWaalsContact CG-CD1 3.46Å; H148-F195 AromaticContact CG-CE1 3.59Å; H148-F195 AromaticContact CG-CG 3.94Å; H148-F195 AromaticContact ND1-CD1 3.47Å; H148-F195 WeakPolarHBondContact ND1-CD1 3.43Å; H148-F195 AromaticContact ND1-CE1 3.31Å; H148-F195 VanDerWaalsContact ND1-CE1 3.31Å; H148-F195 WeakPolarHBondContact ND1-CE1 3.38Å; H148-F195 AromaticContact NE2-CD1 3.6Å; H148-F195 AromaticContact NE2-CE1 2.89Å; H148-F195 WeakPolarHBondContact NE2-CE1 3.37Å; H148-F195 AromaticContact NE2-CE2 3.31Å; H148-F195 VanDerWaalsContact NE2-CE2 3.31Å; H148-F195 WeakPolarHBondContact NE2-CE2 3.45Å; H148-F195 AromaticContact NE2-CZ 2.73Å; H148-F195 WeakPolarHBondContact NE2-CZ 3.4Å |
| 149 | L | 85.6 | Confident | 80 | Confident | 70 Ų | 70 | 78.8 Ų | 78.8 | 37% | 0.366 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -60 | -39.3 | 177.1 | -68.1 | 177 | 0 | 0 | 0 | 111.5 | Y145 I146 N151 V152 L153 | Y145-L149 HydrophobicContact CD1-CD1 4.26Å; Y145-L149 HydrophobicContact CD2-CD1 4.42Å; Y145-L149 HydrophobicContact CD2-CG 4.14Å; Y145-L149 HydrophobicContact CE1-CD1 3.83Å; Y145-L149 HydrophobicContact CE2-CD1 4Å; Y145-L149 HydrophobicContact CE2-CD2 3.8Å; Y145-L149 HydrophobicContact CE2-CG 3.78Å; Y145-L149 WeakPolarHBondContact O-CG 3.3Å; Y145-L149 PolarHBondContact O-N 2.93Å; I146-L149 PolarHBondContact O-N 2.82Å; L149-N151 VanDerWaalsContact C-N 3.32Å; L149-N151 PolarHBondContact O-N 3.28Å; L149-V152 PolarHBondContact O-N 3.26Å; L149-L153 VanDerWaalsContact O-CG 3.31Å; L149-L153 WeakPolarHBondContact O-CG 3.42Å; L149-L153 PolarHBondContact O-N 2.82Å |
| 150 | G | 85.6 | Confident | 78.1 | Confident | 36 Ų | 36 | 77.6 Ų | 77.6 | 37% | 0.371 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -57.9 | -43.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | I146 S147 H148 L153 L154 | I146-G150 PolarHBondContact O-N 3.13Å; S147-G150 PolarHBondContact O-N 3.35Å; H148-G150 VanDerWaalsContact C-N 3.27Å; H148-G150 PolarHBondContact O-N 3.3Å; G150-L153 PolarHBondContact O-N 3.29Å; G150-L154 WeakPolarHBondContact O-CB 3.14Å; G150-L154 PolarHBondContact O-N 3.45Å |
| 151 | N | 80 | Confident | 76.3 | Confident | 38 Ų | 38 | 76.6 Ų | 76.6 | 20% | 0.203 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -66.8 | -39.5 | 177.1 | -68.9 | -17.6 | 0 | 0 | 0 | 112.4 | S147 H148 L149 L153 L154 L155 | S147-N151 PolarHBondContact O-N 3.42Å; H148-N151 PolarHBondContact O-N 3.11Å; H148-N151 VanDerWaalsContact O-N 3.12Å; L149-N151 VanDerWaalsContact C-N 3.32Å; L149-N151 PolarHBondContact O-N 3.28Å; N151-L153 VanDerWaalsContact C-N 3.33Å; N151-L153 PolarHBondContact O-N 2.95Å; N151-L154 PolarHBondContact O-N 3.18Å; N151-L155 HydrophobicContact CB-CD1 4.12Å; N151-L155 WeakPolarHBondContact O-CD1 3.49Å; N151-L155 PolarHBondContact O-N 3.36Å |
| 152 | V | 81.4 | Confident | 74.7 | Confident | 60 Ų | 60 | 77.4 Ų | 77.4 | 36% | 0.364 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -61.4 | -43.4 | 176 | 170.6 | 0 | 0 | 0 | 0 | 111.3 | H148 L149 L154 G156 | H148-V152 WeakPolarHBondContact CE1-CG2 3.49Å; H148-V152 WeakPolarHBondContact NE2-CG2 3.31Å; H148-V152 PolarHBondContact O-N 3.46Å; L149-V152 PolarHBondContact O-N 3.26Å; V152-L154 VanDerWaalsContact C-N 3.34Å; V152-G156 PolarHBondContact O-N 3.12Å |
| 153 | L | 83.7 | Confident | 72.7 | Confident | 154 Ų | 154 | 80.4 Ų | 80.4 | 81% | 0.806 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -68.8 | -33 | 179.3 | -66.3 | 174.3 | 0 | 0 | 0 | 112.4 | L149 G150 N151 | L149-L153 VanDerWaalsContact O-CG 3.31Å; L149-L153 WeakPolarHBondContact O-CG 3.42Å; L149-L153 PolarHBondContact O-N 2.82Å; G150-L153 PolarHBondContact O-N 3.29Å; N151-L153 VanDerWaalsContact C-N 3.33Å; N151-L153 PolarHBondContact O-N 2.95Å |
| 154 | L | 79.4 | Confident | 71 | Confident | 144 Ų | 144 | 78.3 Ų | 78.3 | 75% | 0.754 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -87.4 | -43 | -174.9 | -175.6 | 62.8 | 0 | 0 | 0 | 114 | G150 N151 V152 | G150-L154 WeakPolarHBondContact O-CB 3.14Å; G150-L154 PolarHBondContact O-N 3.45Å; N151-L154 PolarHBondContact O-N 3.18Å; V152-L154 VanDerWaalsContact C-N 3.34Å |
| 155 | L | 70.8 | Confident | 69.5 | Low | 90 Ų | 90 | 78.1 Ų | 78.1 | 47% | 0.471 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -90.1 | -9.4 | -176.4 | -71.1 | 97.9 | 0 | 0 | 0 | 113.3 | N151 L159 | N151-L155 HydrophobicContact CB-CD1 4.12Å; N151-L155 WeakPolarHBondContact O-CD1 3.49Å; N151-L155 PolarHBondContact O-N 3.36Å; L155-L159 HydrophobicContact CD2-CB 4.48Å; L155-L159 HydrophobicContact CD2-CD2 3.95Å |
| 156 | G | 62.2 | Low | 67.6 | Low | 38 Ų | 38 | 81 Ų | 81 | 39% | 0.392 | 47% | 0.469 | S | S | . | . | trans | 65.2 | 166.6 | -170.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V152 G158 | V152-G156 PolarHBondContact O-N 3.12Å; G156-G158 PolarHBondContact O-N 3.5Å | ||
| 157 | E | 57.8 | Low | 65.9 | Low | 173 Ų | 173 | 77.9 Ų | 77.9 | 81% | 0.808 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | 26.4 | 179.9 | -59.6 | -171.4 | 155.6 | 0 | 0 | 113.9 | H160 | E157-H160 VanDerWaalsContact C-CD2 3.45Å; E157-H160 PolarHBondContact O-CD2 3.45Å; E157-H160 PolarHBondContact O-NE2 2.91Å |
| 158 | G | 54.1 | Low | 64.2 | Low | 65 Ų | 65 | 81.9 Ų | 81.9 | 67% | 0.67 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -113.8 | -13.8 | -170.8 | 0 | 0 | 0 | 0 | 0 | 117.2 | G156 | G156-G158 PolarHBondContact O-N 3.5Š|
| 159 | L | 50.6 | Low | 62.8 | Low | 126 Ų | 126 | 84.1 Ų | 84.1 | 66% | 0.66 | 50% | 0.503 | S | S | * | . | trans | -135.3 | 55.8 | -173.1 | -159.3 | 79.9 | 0 | 0 | 0 | 113.1 | L155 | L155-L159 HydrophobicContact CD2-CB 4.48Å; L155-L159 HydrophobicContact CD2-CD2 3.95Å | ||
| 160 | H | 54.7 | Low | 61.1 | Low | 62 Ų | 62 | 83.4 Ų | 83.4 | 29% | 0.287 | 50% | 0.503 | S | S | . | . | trans | -119.2 | 27.1 | -176.3 | 43.1 | 109.8 | 0 | 0 | 0 | 113.6 | E157 G162 N199 | E157-H160 VanDerWaalsContact C-CD2 3.45Å; E157-H160 PolarHBondContact O-CD2 3.45Å; E157-H160 PolarHBondContact O-NE2 2.91Å; H160-G162 PolarHBondContact O-N 3.39Å; H160-N199 PolarHBondContact ND1-ND2 2.89Å | ||
| 161 | D | 50.3 | Low | 59.5 | Low | 153 Ų | 153 | 87.1 Ų | 87.1 | 82% | 0.818 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -67.8 | -14.8 | 166.1 | -65.6 | -49.3 | 0 | 0 | 0 | 112.6 | ||
| 162 | G | 55.3 | Low | 58.1 | Low | 57 Ų | 57 | 93.5 Ų | 93.5 | 59% | 0.588 | 55% | 0.547 | S | S | * | . | S | Bend | trans | -105.9 | 102.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | H160 P164 | H160-G162 PolarHBondContact O-N 3.39Å; G162-P164 VanDerWaalsContact O-CD 3.29Å; G162-P164 WeakPolarHBondContact O-CD 3.28Å |
| 163 | Q | 51.9 | Low | 56.6 | Low | 77 Ų | 77 | 98.1 Ų | 98.1 | 36% | 0.36 | 56% | 0.562 | S | S | . | * | trans | -26.6 | 98.5 | 171.7 | -168.2 | 159.1 | -109.2 | 0 | 0 | 114.5 | C165 H166 C196 | Q163-C165 WeakPolarHBondContact CG-SG 3.25Å; Q163-C165 PolarHBondContact O-N 3.46Å; Q163-C165 VanDerWaalsContact O-N 3.15Å; Q163-H166 PolarHBondContact NE2-CD2 2.9Å; Q163-H166 PolarHBondContact O-N 2.66Å; Q163-H166 VanDerWaalsContact O-N 3.12Å; Q163-C196 HydrophobicContact CG-CB 4.42Å | ||
| 164 | P | 53.6 | Low | 54.8 | Low | 30 Ų | 30 | 98.6 Ų | 98.6 | 20% | 0.195 | 56% | 0.56 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -71.4 | -14.2 | -170.9 | 26.3 | -34.3 | 0 | 0 | 0 | 113.2 | H148 G162 H166 | H148-P164 WeakPolarHBondContact ND1-CG 3.11Å; G162-P164 VanDerWaalsContact O-CD 3.29Å; G162-P164 WeakPolarHBondContact O-CD 3.28Å; P164-H166 PolarHBondContact O-N 3.02Å |
| 165 | C | 53.3 | Low | 53.2 | Low | 32 Ų | 32 | 97.7 Ų | 97.7 | 22% | 0.216 | 56% | 0.56 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -73.4 | -7 | 173.9 | 41.4 | 0 | 0 | 0 | 0 | 113.9 | Q163 C193 C196 | Q163-C165 WeakPolarHBondContact CG-SG 3.25Å; Q163-C165 PolarHBondContact O-N 3.46Å; Q163-C165 VanDerWaalsContact O-N 3.15Å; C165-C193 HydrophobicContact CB-CB 3.84Å; C165-C196 WeakPolarHBondContact CB-SG 3.49Å; C165-C196 WeakPolarHBondContact SG-CB 3.41Å; C165-C196 CovalentContact SG-SG 2.07Å; C165-C196 PolarHBondContact SG-SG 3.23Å |
| 166 | H | 52 | Low | 51.9 | Low | 125 Ų | 125 | 98.4 Ų | 98.4 | 58% | 0.579 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -117.1 | -3.1 | 175.7 | -80.5 | -86.3 | 0 | 0 | 0 | 114.1 | Q163 P164 | Q163-H166 PolarHBondContact NE2-CD2 2.9Å; Q163-H166 PolarHBondContact O-N 2.66Å; Q163-H166 VanDerWaalsContact O-N 3.12Å; P164-H166 PolarHBondContact O-N 3.02Å |
| 167 | A | 53.9 | Low | 51 | Low | 54 Ų | 54 | 101.7 Ų | 101.7 | 45% | 0.446 | 59% | 0.589 | S | S | . | * | S | Bend | trans | -65.4 | 132.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | S169 | A167-S169 PolarHBondContact O-N 3.27Å; A167-S169 VanDerWaalsContact O-N 3.16Å |
| 168 | P | 50.2 | Low | 49.8 | Very low | 124 Ų | 124 | 98.6 Ų | 98.6 | 81% | 0.805 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 126.7 | 165.3 | -19.3 | 30.5 | 0 | 0 | 0 | 107.6 | ||
| 169 | S | 53 | Low | 49.5 | Very low | 59 Ų | 59 | 101.2 Ų | 101.2 | 41% | 0.413 | 59% | 0.592 | S | S | . | * | P | Polyproline II helix | trans | -46.7 | 147.5 | 177.7 | 46.5 | 0 | 0 | 0 | 0 | 111.2 | A167 | A167-S169 PolarHBondContact O-N 3.27Å; A167-S169 VanDerWaalsContact O-N 3.16Å |
| 170 | P | 50.4 | Low | 48.9 | Very low | 54 Ų | 54 | 101.8 Ų | 101.8 | 35% | 0.351 | 60% | 0.601 | S | S | . | * | P | Polyproline II helix | trans | -54.4 | 152.7 | 170.8 | 22.1 | -30.6 | 0 | 0 | 0 | 110.6 | F172 F173 | P170-F172 PolarHBondContact O-N 3.37Å; P170-F173 PolarHBondContact O-N 3.5Å |
| 171 | P | 51.8 | Low | 48.5 | Very low | 114 Ų | 114 | 110.3 Ų | 110.3 | 74% | 0.74 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.3 | 0.7 | -162.5 | 22.2 | -33.4 | 0 | 0 | 0 | 116.4 | ||
| 172 | F | 50.1 | Low | 48 | Very low | 173 Ų | 173 | 106.6 Ų | 106.6 | 76% | 0.759 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | -13 | -178.4 | -62.5 | -72.9 | 0 | 0 | 0 | 114.7 | P170 | P170-F172 PolarHBondContact O-N 3.37Š|
| 173 | F | 49.8 | Very low | 47.1 | Very low | 157 Ų | 157 | 108.8 Ų | 108.8 | 69% | 0.689 | 64% | 0.635 | S | S | * | * | trans | -130.3 | 64.1 | -177 | -60.2 | -77.7 | 0 | 0 | 0 | 112 | P170 V175 | P170-F173 PolarHBondContact O-N 3.5Å; F173-V175 PolarHBondContact O-N 3.34Å; F173-V175 VanDerWaalsContact O-N 3.08Å | ||
| 174 | H | 44.7 | Very low | 46.5 | Very low | 164 Ų | 164 | 111.5 Ų | 111.5 | 76% | 0.759 | 65% | 0.652 | S | S | * | * | trans | -77.2 | 92.3 | 174.4 | -141.8 | -95.1 | 0 | 0 | 0 | 110.2 | ||||
| 175 | V | 46.9 | Very low | 46.1 | Very low | 125 Ų | 125 | 116.6 Ų | 116.6 | 76% | 0.758 | 67% | 0.673 | S | S | * | * | trans | -87.3 | 114.6 | 152.2 | 165.5 | 0 | 0 | 0 | 0 | 105.9 | F173 S177 | F173-V175 PolarHBondContact O-N 3.34Å; F173-V175 VanDerWaalsContact O-N 3.08Å; V175-S177 PolarHBondContact O-N 2.73Å | ||
| 176 | S | 43.7 | Very low | 45.6 | Very low | 105 Ų | 105 | 119.7 Ų | 119.7 | 73% | 0.734 | 70% | 0.695 | S | S | * | * | trans | -56.4 | 97.6 | 179.3 | -57.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 177 | S | 42.6 | Very low | 45.4 | Very low | 106 Ų | 106 | 118.3 Ų | 118.3 | 74% | 0.741 | 71% | 0.705 | S | S | * | * | trans | -121.5 | 105 | 159.6 | 32.3 | 0 | 0 | 0 | 0 | 107.5 | V175 | V175-S177 PolarHBondContact O-N 2.73Š| ||
| 178 | S | 33.3 | Very low | 44.6 | Very low | 108 Ų | 108 | 122.3 Ų | 122.3 | 76% | 0.755 | 72% | 0.715 | S | S | * | * | trans | -53.5 | 145.3 | 177.2 | -54.1 | 0 | 0 | 0 | 0 | 111.8 | T180 | S178-T180 PolarHBondContact O-N 2.87Š| ||
| 179 | P | 46.7 | Very low | 44 | Very low | 121 Ų | 121 | 121 Ų | 121 | 79% | 0.786 | 71% | 0.706 | S | S | * | * | trans | -83 | 100.2 | 177.7 | 32.3 | -29.1 | 0 | 0 | 0 | 109.5 | R181 | P179-R181 PolarHBondContact O-N 3.05Å; P179-R181 VanDerWaalsContact O-N 3.16Å | ||
| 180 | T | 39.1 | Very low | 43.6 | Very low | 138 Ų | 138 | 125.9 Ų | 125.9 | 85% | 0.847 | 72% | 0.72 | S | S | * | * | trans | -76.7 | 99.3 | 162.7 | 54.7 | 0 | 0 | 0 | 0 | 108.2 | S178 | S178-T180 PolarHBondContact O-N 2.87Š| ||
| 181 | R | 46.2 | Very low | 43.8 | Very low | 240 Ų | 240 | 131 Ų | 131 | 91% | 0.906 | 74% | 0.739 | S | S | * | * | trans | -72.6 | 126 | 166 | -79.3 | 176 | 131.3 | -121.7 | 1.1 | 109 | P179 | P179-R181 PolarHBondContact O-N 3.05Å; P179-R181 VanDerWaalsContact O-N 3.16Å | ||
| 182 | G | 40.8 | Very low | 43.9 | Very low | 75 Ų | 75 | 128.6 Ų | 128.6 | 77% | 0.773 | 72% | 0.719 | S | S | * | * | trans | 95.1 | 99 | 158.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 183 | S | 36.1 | Very low | 44.6 | Very low | 103 Ų | 103 | 121.5 Ų | 121.5 | 72% | 0.72 | 69% | 0.691 | S | S | * | * | trans | -167.4 | 142 | 134.6 | 57.4 | 0 | 0 | 0 | 0 | 110.4 | Q185 | S183-Q185 PolarHBondContact O-N 3.13Š| ||
| 184 | D | 39.5 | Very low | 45.3 | Very low | 134 Ų | 134 | 115 Ų | 115 | 72% | 0.717 | 66% | 0.664 | S | S | * | * | trans | -42.4 | 118 | 170.5 | -159.4 | -57.7 | 0 | 0 | 0 | 111.9 | S186 | D184-S186 PolarHBondContact OD1-N 2.93Å; D184-S186 PolarHBondContact OD1-OG 3.2Å | ||
| 185 | Q | 44.5 | Very low | 46.4 | Very low | 138 Ų | 138 | 109.3 Ų | 109.3 | 65% | 0.645 | 64% | 0.637 | S | S | * | * | trans | -131.5 | 61.8 | 172.9 | -66.1 | -91 | 89.7 | 0 | 0 | 107.5 | S183 | S183-Q185 PolarHBondContact O-N 3.13Š| ||
| 186 | S | 42 | Very low | 47.3 | Very low | 97 Ų | 97 | 103.9 Ų | 103.9 | 68% | 0.678 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | 135.8 | 148.5 | 46.7 | 0 | 0 | 0 | 0 | 108.8 | D184 | D184-S186 PolarHBondContact OD1-N 2.93Å; D184-S186 PolarHBondContact OD1-OG 3.2Å |
| 187 | A | 48.7 | Very low | 48.4 | Very low | 95 Ų | 95 | 101.5 Ų | 101.5 | 79% | 0.785 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 75.6 | 40.6 | 172 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||
| 188 | Q | 36.9 | Very low | 49.4 | Very low | 138 Ų | 138 | 99 Ų | 99 | 65% | 0.645 | 57% | 0.566 | S | S | * | * | S | Bend | trans | -124.7 | 127.8 | 148.4 | -69.6 | -66 | -21.1 | 0 | 0 | 108.3 | K190 | Q188-K190 PolarHBondContact O-N 3.41Š|
| 189 | P | 37.4 | Very low | 50.8 | Low | 98 Ų | 98 | 96.5 Ų | 96.5 | 64% | 0.636 | 54% | 0.544 | S | S | * | . | trans | -61.9 | 105 | 174.7 | 25.1 | -29.5 | 0 | 0 | 0 | 106.6 | H191 | P189-H191 PolarHBondContact O-CD2 3.5Å; P189-H191 PolarHBondContact O-N 3.25Å | ||
| 190 | K | 45.1 | Very low | 51.7 | Low | 160 Ų | 160 | 95.9 Ų | 95.9 | 70% | 0.696 | 53% | 0.531 | S | S | * | . | trans | -56.1 | 108.2 | 172.1 | -60.8 | -179.8 | -175.5 | 179.2 | 0 | 104.4 | Q188 I192 | Q188-K190 PolarHBondContact O-N 3.41Å; K190-I192 HydrophobicContact CB-CG1 4.21Å; K190-I192 WeakPolarHBondContact O-CG1 3.3Å; K190-I192 PolarHBondContact O-N 3.43Å | ||
| 191 | H | 53.2 | Low | 53 | Low | 163 Ų | 163 | 94.5 Ų | 94.5 | 76% | 0.755 | 51% | 0.51 | S | S | * | . | trans | -68.9 | 76.7 | 175.7 | -78.5 | -82.7 | 0 | 0 | 0 | 107.1 | P189 C193 | P189-H191 PolarHBondContact O-CD2 3.5Å; P189-H191 PolarHBondContact O-N 3.25Å; H191-C193 PolarHBondContact O-N 3.04Å | ||
| 192 | I | 54.8 | Low | 54 | Low | 62 Ų | 62 | 89.5 Ų | 89.5 | 32% | 0.318 | 50% | 0.495 | S | S | . | . | trans | -62.6 | 129.9 | 176.9 | -61.9 | 144.4 | 0 | 0 | 0 | 105.4 | K190 T194 C196 L197 | K190-I192 HydrophobicContact CB-CG1 4.21Å; K190-I192 WeakPolarHBondContact O-CG1 3.3Å; K190-I192 PolarHBondContact O-N 3.43Å; I192-T194 PolarHBondContact O-N 3.25Å; I192-C196 HydrophobicContact CG2-CB 3.91Å; I192-L197 HydrophobicContact CB-CD1 3.26Å; I192-L197 HydrophobicContact CD1-CD1 4.06Å; I192-L197 HydrophobicContact CG1-CD1 4.24Å; I192-L197 HydrophobicContact CG2-CD1 3.05Å | ||
| 193 | C | 64.1 | Low | 55 | Low | 24 Ų | 24 | 89.8 Ų | 89.8 | 16% | 0.162 | 48% | 0.477 | C | S | . | . | trans | -51.3 | 126.6 | 179.8 | -176.1 | 0 | 0 | 0 | 0 | 108.5 | C165 H191 F195 C196 L197 | C165-C193 HydrophobicContact CB-CB 3.84Å; H191-C193 PolarHBondContact O-N 3.04Å; C193-F195 HydrophobicContact CB-CB 4.47Å; C193-F195 PolarHBondContact O-N 2.8Å; C193-F195 WeakPolarHBondContact SG-CB 3.36Å; C193-C196 WeakPolarHBondContact O-CB 3.38Å; C193-C196 PolarHBondContact O-N 3.2Å; C193-L197 PolarHBondContact O-N 3.16Å; C193-L197 VanDerWaalsContact O-N 3.16Å | ||
| 194 | T | 65.1 | Low | 56.7 | Low | 21 Ų | 21 | 87.6 Ų | 87.6 | 13% | 0.129 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -48.5 | -34.8 | 178.6 | -57.5 | 0 | 0 | 0 | 0 | 110.7 | E127 I192 C196 L197 S198 | E127-T194 HydrophobicContact CB-CG2 3.5Å; E127-T194 VanDerWaalsContact CB-CG2 3.5Å; I192-T194 PolarHBondContact O-N 3.25Å; T194-C196 PolarHBondContact O-N 2.97Å; T194-L197 WeakPolarHBondContact O-CB 3.35Å; T194-L197 PolarHBondContact O-N 2.99Å; T194-L197 VanDerWaalsContact O-N 3.13Å; T194-S198 WeakPolarHBondContact O-CB 3.44Å; T194-S198 PolarHBondContact O-N 2.89Å; T194-S198 PolarHBondContact O-OG 3.35Å; T194-S198 VanDerWaalsContact O-OG 3.06Å |
| 195 | F | 68.3 | Low | 58.1 | Low | 45 Ų | 45 | 87.2 Ų | 87.2 | 20% | 0.197 | 45% | 0.449 | C | S | . | . | H | α-helix | trans | -49.6 | -53.2 | 172.1 | -176.4 | -82.6 | 0 | 0 | 0 | 113.5 | Y145 H148 C193 N199 | Y145-F195 HydrophobicContact CD2-CD2 4.31Å; Y145-F195 HydrophobicContact CE2-CD2 4.05Å; H148-F195 AromaticContact CD2-CD1 3.48Å; H148-F195 VanDerWaalsContact CD2-CD1 3.48Å; H148-F195 WeakPolarHBondContact CD2-CD1 3.43Å; H148-F195 AromaticContact CD2-CD2 3.61Å; H148-F195 AromaticContact CD2-CE1 3.3Å; H148-F195 WeakPolarHBondContact CD2-CE1 3.45Å; H148-F195 AromaticContact CD2-CE2 3.33Å; H148-F195 WeakPolarHBondContact CD2-CE2 3.23Å; H148-F195 AromaticContact CD2-CG 3.72Å; H148-F195 AromaticContact CD2-CZ 3.24Å; H148-F195 WeakPolarHBondContact CD2-CZ 3.21Å; H148-F195 AromaticContact CE1-CD1 3.57Å; H148-F195 AromaticContact CE1-CE1 2.88Å; H148-F195 WeakPolarHBondContact CE1-CE1 3.35Å; H148-F195 AromaticContact CE1-CZ 3.28Å; H148-F195 WeakPolarHBondContact CE1-CZ 3.4Å; H148-F195 AromaticContact CG-CD1 3.46Å; H148-F195 VanDerWaalsContact CG-CD1 3.46Å; H148-F195 AromaticContact CG-CE1 3.59Å; H148-F195 AromaticContact CG-CG 3.94Å; H148-F195 AromaticContact ND1-CD1 3.47Å; H148-F195 WeakPolarHBondContact ND1-CD1 3.43Å; H148-F195 AromaticContact ND1-CE1 3.31Å; H148-F195 VanDerWaalsContact ND1-CE1 3.31Å; H148-F195 WeakPolarHBondContact ND1-CE1 3.38Å; H148-F195 AromaticContact NE2-CD1 3.6Å; H148-F195 AromaticContact NE2-CE1 2.89Å; H148-F195 WeakPolarHBondContact NE2-CE1 3.37Å; H148-F195 AromaticContact NE2-CE2 3.31Å; H148-F195 VanDerWaalsContact NE2-CE2 3.31Å; H148-F195 WeakPolarHBondContact NE2-CE2 3.45Å; H148-F195 AromaticContact NE2-CZ 2.73Å; H148-F195 WeakPolarHBondContact NE2-CZ 3.4Å; C193-F195 HydrophobicContact CB-CB 4.47Å; C193-F195 PolarHBondContact O-N 2.8Å; C193-F195 WeakPolarHBondContact SG-CB 3.36Å; F195-N199 PolarHBondContact O-N 3.4Å |
| 196 | C | 64.7 | Low | 59.3 | Low | 10 Ų | 10 | 84.2 Ų | 84.2 | 7% | 0.068 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -68 | -35.9 | 178.9 | -67.8 | 0 | 0 | 0 | 0 | 111.1 | Q163 C165 I192 C193 T194 Q200 | Q163-C196 HydrophobicContact CG-CB 4.42Å; C165-C196 WeakPolarHBondContact CB-SG 3.49Å; C165-C196 WeakPolarHBondContact SG-CB 3.41Å; C165-C196 CovalentContact SG-SG 2.07Å; C165-C196 PolarHBondContact SG-SG 3.23Å; I192-C196 HydrophobicContact CG2-CB 3.91Å; C193-C196 WeakPolarHBondContact O-CB 3.38Å; C193-C196 PolarHBondContact O-N 3.2Å; T194-C196 PolarHBondContact O-N 2.97Å; C196-Q200 VanDerWaalsContact O-CB 3.25Å; C196-Q200 WeakPolarHBondContact O-CB 3.36Å; C196-Q200 PolarHBondContact O-N 3.38Å |
| 197 | L | 66.8 | Low | 60.6 | Low | 56 Ų | 56 | 86.9 Ų | 86.9 | 29% | 0.293 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -66.8 | -41.1 | 177.3 | -110.1 | 69.7 | 0 | 0 | 0 | 113.5 | I192 C193 T194 R201 | I192-L197 HydrophobicContact CB-CD1 3.26Å; I192-L197 HydrophobicContact CD1-CD1 4.06Å; I192-L197 HydrophobicContact CG1-CD1 4.24Å; I192-L197 HydrophobicContact CG2-CD1 3.05Å; C193-L197 PolarHBondContact O-N 3.16Å; C193-L197 VanDerWaalsContact O-N 3.16Å; T194-L197 WeakPolarHBondContact O-CB 3.35Å; T194-L197 PolarHBondContact O-N 2.99Å; T194-L197 VanDerWaalsContact O-N 3.13Å; L197-R201 WeakPolarHBondContact O-CB 3.46Å; L197-R201 WeakPolarHBondContact O-CG 3.29Å; L197-R201 PolarHBondContact O-N 2.86Å; L197-R201 PolarHBondContact O-NE 3.45Å |
| 198 | S | 63.6 | Low | 61.6 | Low | 54 Ų | 54 | 86.8 Ų | 86.8 | 38% | 0.378 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -71.6 | -41 | 180 | -60.7 | 0 | 0 | 0 | 0 | 110.7 | T194 R201 K202 | T194-S198 WeakPolarHBondContact O-CB 3.44Å; T194-S198 PolarHBondContact O-N 2.89Å; T194-S198 PolarHBondContact O-OG 3.35Å; T194-S198 VanDerWaalsContact O-OG 3.06Å; S198-R201 PolarHBondContact O-N 3.32Å; S198-K202 WeakPolarHBondContact O-CB 3.45Å; S198-K202 PolarHBondContact O-N 2.9Å |
| 199 | N | 64 | Low | 63.3 | Low | 54 Ų | 54 | 87.1 Ų | 87.1 | 29% | 0.289 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.4 | -46.9 | 174.5 | -153.3 | 42.2 | 0 | 0 | 0 | 111 | H160 F195 R201 K202 M203 | H160-N199 PolarHBondContact ND1-ND2 2.89Å; F195-N199 PolarHBondContact O-N 3.4Å; N199-R201 VanDerWaalsContact C-N 3.34Å; N199-R201 PolarHBondContact O-N 3.25Å; N199-K202 WeakPolarHBondContact O-CB 3.19Å; N199-K202 PolarHBondContact O-N 2.91Å; N199-K202 VanDerWaalsContact O-N 3.13Å; N199-M203 WeakPolarHBondContact O-CG 3.43Å; N199-M203 PolarHBondContact O-N 2.99Å |
| 200 | Q | 64.1 | Low | 64.8 | Low | 109 Ų | 109 | 90.6 Ų | 90.6 | 51% | 0.509 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -60.2 | -40.4 | 177.3 | -172.3 | 177.1 | 86.6 | 0 | 0 | 112.9 | C196 M203 N204 | C196-Q200 VanDerWaalsContact O-CB 3.25Å; C196-Q200 WeakPolarHBondContact O-CB 3.36Å; C196-Q200 PolarHBondContact O-N 3.38Å; Q200-M203 PolarHBondContact O-N 3.37Å; Q200-N204 WeakPolarHBondContact O-CB 3.3Å; Q200-N204 VanDerWaalsContact O-CG 3.24Å; Q200-N204 PolarHBondContact O-N 3.41Å; Q200-N204 PolarHBondContact O-ND2 3.31Å |
| 201 | R | 67.5 | Low | 66 | Low | 109 Ų | 109 | 86.8 Ų | 86.8 | 41% | 0.411 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -66.1 | -37.5 | 174.9 | -82.8 | -178.3 | -75.5 | 176.8 | -0.9 | 113 | E127 L197 S198 N199 N204 K205 | E127-R201 VanDerWaalsContact CD-NH2 3.34Å; E127-R201 IonicContact OE1-CZ 3.48Å; E127-R201 IonicContact OE1-NH1 2.72Å; E127-R201 PolarHBondContact OE1-NH1 3.23Å; E127-R201 IonicContact OE1-NH2 3.42Å; E127-R201 PolarHBondContact OE1-NH2 3.42Å; E127-R201 IonicContact OE2-CZ 3.2Å; E127-R201 IonicContact OE2-NH1 2.8Å; E127-R201 PolarHBondContact OE2-NH1 2.88Å; E127-R201 IonicContact OE2-NH2 3.74Å; E127-R201 PolarHBondContact OE2-NH2 3.42Å; L197-R201 WeakPolarHBondContact O-CB 3.46Å; L197-R201 WeakPolarHBondContact O-CG 3.29Å; L197-R201 PolarHBondContact O-N 2.86Å; L197-R201 PolarHBondContact O-NE 3.45Å; S198-R201 PolarHBondContact O-N 3.32Å; N199-R201 VanDerWaalsContact C-N 3.34Å; N199-R201 PolarHBondContact O-N 3.25Å; R201-N204 PolarHBondContact O-N 2.72Å; R201-K205 WeakPolarHBondContact O-CB 3.34Å; R201-K205 PolarHBondContact O-N 3.4Å |
| 202 | K | 66.4 | Low | 66.6 | Low | 134 Ų | 134 | 83 Ų | 83 | 58% | 0.583 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -61.3 | -48.8 | 173.6 | -173.5 | -178 | 176.5 | -170.2 | 0 | 110.6 | S198 N199 N204 K205 D206 | S198-K202 WeakPolarHBondContact O-CB 3.45Å; S198-K202 PolarHBondContact O-N 2.9Å; N199-K202 WeakPolarHBondContact O-CB 3.19Å; N199-K202 PolarHBondContact O-N 2.91Å; N199-K202 VanDerWaalsContact O-N 3.13Å; K202-N204 VanDerWaalsContact C-N 3.34Å; K202-N204 PolarHBondContact O-N 3.01Å; K202-K205 PolarHBondContact O-N 2.94Å; K202-D206 PolarHBondContact O-N 2.96Å |
| 203 | M | 62 | Low | 67.1 | Low | 82 Ų | 82 | 87.1 Ų | 87.1 | 40% | 0.404 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -59.6 | -43.2 | 177.9 | -57.3 | -79.2 | -85.2 | 0 | 0 | 111.7 | N199 Q200 D206 R207 | N199-M203 WeakPolarHBondContact O-CG 3.43Å; N199-M203 PolarHBondContact O-N 2.99Å; Q200-M203 PolarHBondContact O-N 3.37Å; M203-D206 PolarHBondContact O-N 3.03Å; M203-R207 WeakPolarHBondContact O-CB 3.38Å; M203-R207 PolarHBondContact O-N 3.42Å |
| 204 | N | 71.1 | Confident | 66.8 | Low | 57 Ų | 57 | 97.1 Ų | 97.1 | 31% | 0.305 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.2 | -45.2 | 175.9 | -72.5 | -21 | 0 | 0 | 0 | 111.6 | Q200 R201 K202 D206 R207 D208 | Q200-N204 WeakPolarHBondContact O-CB 3.3Å; Q200-N204 VanDerWaalsContact O-CG 3.24Å; Q200-N204 PolarHBondContact O-N 3.41Å; Q200-N204 PolarHBondContact O-ND2 3.31Å; R201-N204 PolarHBondContact O-N 2.72Å; K202-N204 VanDerWaalsContact C-N 3.34Å; K202-N204 PolarHBondContact O-N 3.01Å; N204-D206 PolarHBondContact O-N 3.47Å; N204-R207 WeakPolarHBondContact O-CB 3.35Å; N204-R207 PolarHBondContact O-N 3.45Å; N204-R207 VanDerWaalsContact O-N 3.16Å; N204-D208 VanDerWaalsContact O-CG 3.31Å; N204-D208 PolarHBondContact O-N 3.42Å |
| 205 | K | 70.9 | Confident | 66.3 | Low | 125 Ų | 125 | 103.8 Ų | 103.8 | 54% | 0.543 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.8 | -38.1 | 178.7 | -173.5 | 166 | -176.5 | 168.8 | 0 | 113 | R201 K202 R207 R209 | R201-K205 WeakPolarHBondContact O-CB 3.34Å; R201-K205 PolarHBondContact O-N 3.4Å; K202-K205 PolarHBondContact O-N 2.94Å; K205-R207 VanDerWaalsContact C-N 3.35Å; K205-R209 WeakPolarHBondContact O-CG 3.49Å; K205-R209 PolarHBondContact O-N 3.35Å |
| 206 | D | 68.7 | Low | 66.2 | Low | 75 Ų | 75 | 106.8 Ų | 106.8 | 40% | 0.401 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -69.2 | -35.1 | 175.2 | -71.1 | -36.2 | 0 | 0 | 0 | 111.5 | K202 M203 N204 R209 K210 | K202-D206 PolarHBondContact O-N 2.96Å; M203-D206 PolarHBondContact O-N 3.03Å; N204-D206 PolarHBondContact O-N 3.47Å; D206-R209 IonicContact OD1-NH1 3.94Å; D206-K210 WeakPolarHBondContact O-CB 3.3Å; D206-K210 PolarHBondContact O-N 2.91Å |
| 207 | R | 70.1 | Confident | 66.2 | Low | 154 Ų | 154 | 111.8 Ų | 111.8 | 58% | 0.581 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.3 | -47.8 | 172.2 | -166.5 | 178 | 73.4 | -158.2 | 1.7 | 111.8 | M203 N204 K205 R209 K210 T211 | M203-R207 WeakPolarHBondContact O-CB 3.38Å; M203-R207 PolarHBondContact O-N 3.42Å; N204-R207 WeakPolarHBondContact O-CB 3.35Å; N204-R207 PolarHBondContact O-N 3.45Å; N204-R207 VanDerWaalsContact O-N 3.16Å; K205-R207 VanDerWaalsContact C-N 3.35Å; R207-R209 VanDerWaalsContact C-N 3.29Å; R207-R209 PolarHBondContact O-N 3.22Å; R207-K210 PolarHBondContact O-N 2.82Å; R207-T211 WeakPolarHBondContact O-CG2 3.45Å; R207-T211 PolarHBondContact O-N 2.93Å; R207-T211 PolarHBondContact O-OG1 3.41Å |
| 208 | D | 69.4 | Low | 66.2 | Low | 93 Ų | 93 | 114.9 Ų | 114.9 | 50% | 0.497 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64.3 | -33.3 | 179.3 | -66.4 | -41.7 | 0 | 0 | 0 | 112.3 | N204 T211 S212 | N204-D208 VanDerWaalsContact O-CG 3.31Å; N204-D208 PolarHBondContact O-N 3.42Å; D208-T211 WeakPolarHBondContact CA-OG1 3.44Å; D208-T211 PolarHBondContact O-OG1 2.87Å; D208-S212 VanDerWaalsContact O-CB 3.28Å; D208-S212 WeakPolarHBondContact O-CB 3.36Å; D208-S212 PolarHBondContact O-N 2.77Å |
| 209 | R | 71.4 | Confident | 66.4 | Low | 144 Ų | 144 | 118.5 Ų | 118.5 | 54% | 0.543 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.9 | -41.6 | 170.2 | -78.2 | 172 | 171.8 | 179.2 | -6.5 | 112.2 | K205 D206 R207 T211 S212 I213 | K205-R209 WeakPolarHBondContact O-CG 3.49Å; K205-R209 PolarHBondContact O-N 3.35Å; D206-R209 IonicContact OD1-NH1 3.94Å; R207-R209 VanDerWaalsContact C-N 3.29Å; R207-R209 PolarHBondContact O-N 3.22Å; R209-T211 VanDerWaalsContact C-N 3.34Å; R209-S212 PolarHBondContact O-N 3.23Å; R209-I213 VanDerWaalsContact O-CG1 3.3Å; R209-I213 WeakPolarHBondContact O-CG1 3.37Å; R209-I213 PolarHBondContact O-N 3Å |
| 210 | K | 69.9 | Low | 66.5 | Low | 172 Ų | 172 | 122.6 Ų | 122.6 | 75% | 0.748 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -70.7 | -30.6 | -178.5 | -155.5 | 125.7 | 178.9 | 176.4 | 0 | 112.5 | D206 R207 | D206-K210 WeakPolarHBondContact O-CB 3.3Å; D206-K210 PolarHBondContact O-N 2.91Å; R207-K210 PolarHBondContact O-N 2.82Å |
| 211 | T | 69.3 | Low | 66.7 | Low | 79 Ų | 79 | 123.5 Ų | 123.5 | 49% | 0.485 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -75.3 | -40 | 172.5 | 55.3 | 0 | 0 | 0 | 0 | 111.6 | R207 D208 R209 I213 R214 | R207-T211 WeakPolarHBondContact O-CG2 3.45Å; R207-T211 PolarHBondContact O-N 2.93Å; R207-T211 PolarHBondContact O-OG1 3.41Å; D208-T211 WeakPolarHBondContact CA-OG1 3.44Å; D208-T211 PolarHBondContact O-OG1 2.87Å; R209-T211 VanDerWaalsContact C-N 3.34Å; T211-I213 VanDerWaalsContact C-N 3.31Å; T211-I213 PolarHBondContact O-N 2.82Å; T211-R214 PolarHBondContact O-N 3.48Å |
| 212 | S | 66.4 | Low | 66.6 | Low | 85 Ų | 85 | 124.5 Ų | 124.5 | 59% | 0.594 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -68.1 | -22.4 | 179.3 | -171.7 | 0 | 0 | 0 | 0 | 114.8 | D208 R209 R214 | D208-S212 VanDerWaalsContact O-CB 3.28Å; D208-S212 WeakPolarHBondContact O-CB 3.36Å; D208-S212 PolarHBondContact O-N 2.77Å; R209-S212 PolarHBondContact O-N 3.23Å; S212-R214 VanDerWaalsContact C-N 3.33Å |
| 213 | I | 64.9 | Low | 66.6 | Low | 147 Ų | 147 | 123.8 Ų | 123.8 | 75% | 0.754 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.6 | -13.5 | 176.3 | -66.3 | 170.5 | 0 | 0 | 0 | 111.6 | R209 T211 | R209-I213 VanDerWaalsContact O-CG1 3.3Å; R209-I213 WeakPolarHBondContact O-CG1 3.37Å; R209-I213 PolarHBondContact O-N 3Å; T211-I213 VanDerWaalsContact C-N 3.31Å; T211-I213 PolarHBondContact O-N 2.82Å |
| 214 | R | 58.4 | Low | 67 | Low | 234 Ų | 234 | 127.3 Ų | 127.3 | 88% | 0.883 | 62% | 0.622 | S | S | * | * | trans | -103.4 | 0.4 | -174.6 | -144.6 | 175.8 | -172 | 171.1 | 1.2 | 113.5 | T211 S212 | T211-R214 PolarHBondContact O-N 3.48Å; S212-R214 VanDerWaalsContact C-N 3.33Å | ||
| 215 | S | 53.7 | Low | 66.6 | Low | 162 Ų | 162 | 133.6 Ų | 133.6 | 100% | 1.133 | 65% | 0.651 | S | S | * | * | trans | -109.8 | 0 | 172.8 | -60.2 | 0 | 0 | 0 | 0 | 109.3 |
Retrieved 215 of 215 residues in 111.4 ms
(Link to these results)