| 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 | 38 | Very low | 34.6 | Very low | 224 Ų | 224 | 151.5 Ų | 151.5 | 100% | 1.103 | 84% | 0.841 | S | S | * | * | 0 | 151.7 | 0 | -62.8 | 71.3 | 171 | 0 | 0 | 109.2 | |||||
| 2 | K | 31 | Very low | 34.3 | Very low | 207 Ų | 207 | 158.3 Ų | 158.3 | 90% | 0.9 | 84% | 0.844 | S | S | * | * | trans | -118.3 | 126.7 | 164.1 | -77.9 | 179.4 | 175.6 | 176 | 0 | 107.5 | ||||
| 3 | F | 32.2 | Very low | 34 | Very low | 188 Ų | 188 | 163.8 Ų | 163.8 | 83% | 0.825 | 85% | 0.846 | S | S | * | * | trans | -113.5 | 104.7 | 171.8 | -95.3 | -79.9 | 0 | 0 | 0 | 109.9 | ||||
| 4 | T | 35.3 | Very low | 34.1 | Very low | 135 Ų | 135 | 158.5 Ų | 158.5 | 83% | 0.828 | 82% | 0.824 | S | S | * | * | trans | -90.2 | 112 | 165.5 | 44.8 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 5 | L | 44.2 | Very low | 33.6 | Very low | 168 Ų | 168 | 154.5 Ų | 154.5 | 88% | 0.88 | 82% | 0.816 | S | S | * | * | trans | -119.4 | 125.2 | 160.2 | -80 | 170.9 | 0 | 0 | 0 | 107.6 | ||||
| 6 | G | 32.4 | Very low | 33.8 | Very low | 69 Ų | 69 | 159.1 Ų | 159.1 | 71% | 0.711 | 82% | 0.819 | S | S | * | * | trans | -107.7 | 172.5 | -174 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 7 | L | 38 | Very low | 33.8 | Very low | 181 Ų | 181 | 160.9 Ų | 160.9 | 95% | 0.948 | 82% | 0.822 | S | S | * | * | trans | 65 | 73.6 | 158.7 | -62.7 | 161.9 | 0 | 0 | 0 | 116.4 | ||||
| 8 | G | 28.2 | Very low | 33.5 | Very low | 66 Ų | 66 | 156.5 Ų | 156.5 | 68% | 0.68 | 82% | 0.824 | S | S | * | * | trans | -128.3 | 11 | 161.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | R10 | G8-R10 PolarHBondContact O-N 2.72Š| ||
| 9 | S | 33.4 | Very low | 33.3 | Very low | 113 Ų | 113 | 153.7 Ų | 153.7 | 79% | 0.79 | 83% | 0.826 | S | S | * | * | trans | -73.9 | 76.9 | -164 | -52.7 | 0 | 0 | 0 | 0 | 114.3 | A11 | S9-A11 PolarHBondContact O-N 2.55Š| ||
| 10 | R | 36 | Very low | 33.1 | Very low | 227 Ų | 227 | 151.4 Ų | 151.4 | 86% | 0.857 | 83% | 0.829 | S | S | * | * | trans | -69.5 | 82.1 | 163.4 | -79.9 | -173.5 | -79 | -99.9 | 1.3 | 110.3 | G8 W12 | G8-R10 PolarHBondContact O-N 2.72Å; R10-W12 PolarHBondContact O-N 3.16Å | ||
| 11 | A | 32.2 | Very low | 33 | Very low | 88 Ų | 88 | 149.2 Ų | 149.2 | 73% | 0.727 | 83% | 0.83 | S | S | * | * | trans | -66.4 | 122.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | S9 R13 | S9-A11 PolarHBondContact O-N 2.55Å; A11-R13 PolarHBondContact O-N 3.35Å | ||
| 12 | W | 30.5 | Very low | 32.6 | Very low | 233 Ų | 233 | 143.3 Ų | 143.3 | 88% | 0.883 | 82% | 0.818 | S | S | * | * | trans | -75.7 | 65.3 | 175.7 | -70.3 | 86.4 | 0 | 0 | 0 | 111.5 | R10 V14 | R10-W12 PolarHBondContact O-N 3.16Å; W12-V14 VanDerWaalsContact C-N 3.29Å; W12-V14 PolarHBondContact O-N 3.44Å | ||
| 13 | R | 30.3 | Very low | 32.6 | Very low | 231 Ų | 231 | 138.6 Ų | 138.6 | 87% | 0.872 | 82% | 0.817 | S | S | * | * | trans | -76.7 | 81.5 | 169.7 | -174.2 | -168.6 | -71.1 | -95.1 | 3.1 | 109.4 | A11 S15 | A11-R13 PolarHBondContact O-N 3.35Å; R13-S15 PolarHBondContact O-N 2.92Å | ||
| 14 | V | 35.1 | Very low | 32.6 | Very low | 89 Ų | 89 | 135 Ų | 135 | 54% | 0.539 | 82% | 0.822 | S | S | . | * | trans | -85.4 | 103.9 | 168.8 | -159.1 | 0 | 0 | 0 | 0 | 108 | W12 | W12-V14 VanDerWaalsContact C-N 3.29Å; W12-V14 PolarHBondContact O-N 3.44Å | ||
| 15 | S | 27.4 | Very low | 32.4 | Very low | 99 Ų | 99 | 131.9 Ų | 131.9 | 69% | 0.692 | 82% | 0.817 | S | S | * | * | trans | -72.4 | 130.4 | 175.7 | -161.6 | 0 | 0 | 0 | 0 | 110.1 | R13 | R13-S15 PolarHBondContact O-N 2.92Š| ||
| 16 | W | 37 | Very low | 32.6 | Very low | 228 Ų | 228 | 130.6 Ų | 130.6 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | -132.8 | 68.3 | 176.2 | -72.9 | 95.6 | 0 | 0 | 0 | 110.3 | ||||
| 17 | E | 32.7 | Very low | 32.5 | Very low | 189 Ų | 189 | 131.2 Ų | 131.2 | 88% | 0.883 | 83% | 0.825 | S | S | * | * | trans | -127.5 | 142.1 | 164.2 | -79.7 | -172.5 | 76.3 | 0 | 0 | 109.1 | ||||
| 18 | G | 28.9 | Very low | 32.2 | Very low | 82 Ų | 82 | 127.7 Ų | 127.7 | 85% | 0.845 | 82% | 0.822 | S | S | * | * | trans | 144 | 56.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 19 | A | 29.8 | Very low | 32.3 | Very low | 104 Ų | 104 | 128.4 Ų | 128.4 | 86% | 0.86 | 83% | 0.83 | S | S | * | * | trans | -155.2 | 42.2 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 20 | A | 29.7 | Very low | 32 | Very low | 107 Ų | 107 | 126.5 Ų | 126.5 | 88% | 0.884 | 83% | 0.828 | S | S | * | * | trans | -149.8 | 98.6 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 21 | A | 30.4 | Very low | 31.7 | Very low | 105 Ų | 105 | 121.9 Ų | 121.9 | 87% | 0.868 | 83% | 0.83 | S | S | * | * | trans | -143.2 | 143.5 | 168.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 22 | A | 30.4 | Very low | 31.9 | Very low | 101 Ų | 101 | 122.2 Ų | 122.2 | 84% | 0.835 | 83% | 0.833 | S | S | * | * | cis | -150.9 | 152.3 | -3.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 23 | A | 31 | Very low | 31.9 | Very low | 107 Ų | 107 | 119.5 Ų | 119.5 | 88% | 0.884 | 84% | 0.835 | S | S | * | * | trans | -168.4 | 118.1 | 152 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 24 | A | 32.3 | Very low | 32 | Very low | 112 Ų | 112 | 119.6 Ų | 119.6 | 93% | 0.926 | 84% | 0.835 | S | S | * | * | trans | -142.5 | 128.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 25 | G | 30.3 | Very low | 31.7 | Very low | 71 Ų | 71 | 122 Ų | 122 | 73% | 0.732 | 86% | 0.855 | S | S | * | * | trans | -158.2 | 128.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 26 | P | 48 | Very low | 31.9 | Very low | 141 Ų | 141 | 128 Ų | 128 | 92% | 0.916 | 86% | 0.862 | S | S | * | * | trans | -94 | 154 | -163.1 | 35.6 | -36 | 0 | 0 | 0 | 114.2 | ||||
| 27 | G | 30 | Very low | 31.5 | Very low | 81 Ų | 81 | 121.6 Ų | 121.6 | 84% | 0.835 | 86% | 0.858 | S | S | * | * | trans | -159.6 | 131.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 28 | A | 32 | Very low | 31.3 | Very low | 107 Ų | 107 | 119.7 Ų | 119.7 | 88% | 0.884 | 85% | 0.849 | S | S | * | * | trans | -90.8 | 145.9 | -164.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 29 | G | 29.7 | Very low | 31.3 | Very low | 82 Ų | 82 | 126.6 Ų | 126.6 | 85% | 0.845 | 85% | 0.849 | S | S | * | * | 83.4 | 144.1 | 128.7 | 0 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 30 | G | 28.1 | Very low | 31.3 | Very low | 73 Ų | 73 | 128 Ų | 128 | 75% | 0.753 | 85% | 0.847 | S | S | * | * | trans | 118.5 | 115.9 | 145.6 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 31 | S | 30 | Very low | 31.2 | Very low | 129 Ų | 129 | 128 Ų | 128 | 90% | 0.902 | 84% | 0.841 | S | S | * | * | trans | 63.7 | 136.4 | 146.1 | -59.8 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 32 | A | 35.3 | Very low | 31.4 | Very low | 96 Ų | 96 | 128.7 Ų | 128.7 | 79% | 0.793 | 84% | 0.839 | S | S | * | * | trans | -90.5 | 153.9 | 167.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 33 | L | 31.9 | Very low | 32 | Very low | 176 Ų | 176 | 129.7 Ų | 129.7 | 92% | 0.921 | 84% | 0.837 | S | S | * | * | trans | -160.9 | 155.9 | 153.3 | -112.5 | 165.1 | 0 | 0 | 0 | 111.6 | ||||
| 34 | R | 32 | Very low | 32 | Very low | 233 Ų | 233 | 136.3 Ų | 136.3 | 88% | 0.879 | 84% | 0.839 | S | S | * | * | trans | -68.2 | 148.5 | 169.5 | -68.1 | 170.8 | 164.1 | -178 | -4.5 | 110.2 | ||||
| 35 | C | 27.8 | Very low | 32.1 | Very low | 140 Ų | 140 | 139.6 Ų | 139.6 | 95% | 0.946 | 84% | 0.84 | S | S | * | * | -162.3 | 175.1 | 124.6 | -129.3 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 36 | R | 32.1 | Very low | 32 | Very low | 224 Ų | 224 | 139.3 Ų | 139.3 | 85% | 0.845 | 84% | 0.837 | S | S | * | * | trans | -136.3 | 109.6 | -166.5 | 166.1 | -165 | 171 | -124.3 | 7.8 | 111.1 | ||||
| 37 | A | 29.2 | Very low | 31.3 | Very low | 94 Ų | 94 | 144.5 Ų | 144.5 | 78% | 0.777 | 84% | 0.838 | S | S | * | * | trans | -167.7 | 142.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 38 | Q | 28.9 | Very low | 31.4 | Very low | 148 Ų | 148 | 152.6 Ų | 152.6 | 69% | 0.692 | 84% | 0.844 | S | S | * | * | cis | 116 | 141.7 | 20.9 | -98.2 | -161.9 | 61.4 | 0 | 0 | 110.7 | ||||
| 39 | R | 28.8 | Very low | 31.3 | Very low | 227 Ų | 227 | 151.1 Ų | 151.1 | 86% | 0.857 | 84% | 0.839 | S | S | * | * | trans | 69.3 | 162.5 | 174 | -47.8 | -177.7 | -171.7 | -159.5 | 1.1 | 114.6 | ||||
| 40 | V | 29.1 | Very low | 31.5 | Very low | 134 Ų | 134 | 153.2 Ų | 153.2 | 81% | 0.812 | 84% | 0.84 | S | S | * | * | cis | -127.9 | 151.1 | 5.4 | 178.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 41 | S | 28.7 | Very low | 31.9 | Very low | 108 Ų | 108 | 161.1 Ų | 161.1 | 76% | 0.755 | 85% | 0.847 | S | S | * | * | trans | -103.5 | 136.1 | 173.2 | -48.9 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 42 | S | 34.8 | Very low | 32.1 | Very low | 119 Ų | 119 | 163 Ų | 163 | 83% | 0.832 | 85% | 0.846 | S | S | * | * | trans | 174.7 | 164.5 | 154.5 | -87.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 43 | P | 42.1 | Very low | 31.9 | Very low | 121 Ų | 121 | 163.7 Ų | 163.7 | 79% | 0.786 | 85% | 0.846 | S | S | * | * | cis | -129.4 | -175.7 | -41.8 | 38 | -23 | 0 | 0 | 0 | 111.3 | ||||
| 44 | R | 31.9 | Very low | 31.8 | Very low | 246 Ų | 246 | 159.2 Ų | 159.2 | 93% | 0.928 | 84% | 0.841 | S | S | * | * | trans | -93.6 | 144.3 | 171.7 | -55 | 179.9 | -167.4 | -158.2 | 2.5 | 110.3 | ||||
| 45 | L | 33.7 | Very low | 31.7 | Very low | 182 Ų | 182 | 152.8 Ų | 152.8 | 95% | 0.953 | 84% | 0.839 | S | S | * | * | trans | -117.1 | 146.6 | 158.5 | -106.5 | 165.1 | 0 | 0 | 0 | 108.8 | ||||
| 46 | G | 28.9 | Very low | 32.1 | Very low | 64 Ų | 64 | 153.7 Ų | 153.7 | 66% | 0.66 | 83% | 0.833 | S | S | * | * | trans | -162.4 | 172.5 | -175 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 47 | R | 32.8 | Very low | 32.5 | Very low | 250 Ų | 250 | 148.3 Ų | 148.3 | 94% | 0.943 | 83% | 0.827 | S | S | * | * | trans | 55.8 | 107.6 | -179.9 | -78.4 | -178.2 | 164.7 | -122.8 | 2.6 | 116.3 | ||||
| 48 | R | 32.1 | Very low | 32.7 | Very low | 252 Ų | 252 | 151.3 Ų | 151.3 | 95% | 0.951 | 83% | 0.829 | S | S | * | * | -121.8 | 154 | 110.3 | -86 | -168.2 | 172.8 | -135.5 | -0.6 | 109.4 | |||||
| 49 | G | 29.1 | Very low | 32.7 | Very low | 76 Ų | 76 | 150.2 Ų | 150.2 | 78% | 0.784 | 84% | 0.837 | S | S | * | * | trans | -159.6 | 140.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 50 | S | 34.2 | Very low | 32.8 | Very low | 125 Ų | 125 | 147.3 Ų | 147.3 | 87% | 0.874 | 84% | 0.837 | S | S | * | * | trans | -126.6 | 137 | -178.2 | -59.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 51 | R | 36.2 | Very low | 33 | Very low | 240 Ų | 240 | 146.6 Ų | 146.6 | 91% | 0.906 | 84% | 0.838 | S | S | * | * | trans | -108.7 | 146.2 | 168.5 | -54.6 | 175.3 | -173.9 | -114.1 | 9.9 | 108.2 | ||||
| 52 | L | 33.7 | Very low | 33.2 | Very low | 168 Ų | 168 | 153.3 Ų | 153.3 | 88% | 0.88 | 85% | 0.847 | S | S | * | * | trans | -171 | 120.4 | 150.5 | -90.7 | 171.9 | 0 | 0 | 0 | 103.1 | ||||
| 53 | S | 32.4 | Very low | 32.9 | Very low | 111 Ų | 111 | 151.4 Ų | 151.4 | 78% | 0.776 | 85% | 0.846 | S | S | * | * | cis | 88.5 | 119.1 | 43.5 | -65.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 54 | G | 29.7 | Very low | 32.3 | Very low | 81 Ų | 81 | 149.6 Ų | 149.6 | 84% | 0.835 | 85% | 0.849 | S | S | * | * | trans | 83.2 | 153.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 55 | A | 30.7 | Very low | 32.2 | Very low | 99 Ų | 99 | 142.1 Ų | 142.1 | 82% | 0.818 | 85% | 0.849 | S | S | * | * | cis | -159.2 | 156.7 | -19 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 56 | L | 34.3 | Very low | 32 | Very low | 158 Ų | 158 | 137.4 Ų | 137.4 | 83% | 0.827 | 84% | 0.844 | S | S | * | * | trans | -78 | 154.9 | 163.6 | -82.4 | 159.2 | 0 | 0 | 0 | 109.7 | ||||
| 57 | P | 42.2 | Very low | 32.1 | Very low | 112 Ų | 112 | 138.3 Ų | 138.3 | 73% | 0.727 | 85% | 0.846 | S | S | * | * | -133.9 | 152.4 | 111.1 | 37.2 | -29.9 | 0 | 0 | 0 | 114.3 | |||||
| 58 | L | 31.7 | Very low | 31.9 | Very low | 156 Ų | 156 | 135.5 Ų | 135.5 | 82% | 0.817 | 84% | 0.843 | S | S | * | * | trans | -81 | 143.6 | 159.5 | -75 | 148.3 | 0 | 0 | 0 | 109.2 | ||||
| 59 | C | 29.9 | Very low | 31.9 | Very low | 126 Ų | 126 | 128.3 Ų | 128.3 | 85% | 0.851 | 84% | 0.837 | S | S | * | * | trans | -130.4 | 135.1 | 159.9 | -72.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 60 | L | 31.4 | Very low | 32.1 | Very low | 165 Ų | 165 | 131.7 Ų | 131.7 | 86% | 0.864 | 84% | 0.837 | S | S | * | * | trans | -138.7 | 107.5 | -170.7 | -161.3 | 85.1 | 0 | 0 | 0 | 110.3 | ||||
| 61 | S | 32.6 | Very low | 32.9 | Very low | 120 Ų | 120 | 131.4 Ų | 131.4 | 84% | 0.839 | 83% | 0.832 | S | S | * | * | trans | -167.7 | 133.1 | 161.2 | -79.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 62 | R | 32.9 | Very low | 32.8 | Very low | 249 Ų | 249 | 126.2 Ų | 126.2 | 94% | 0.94 | 82% | 0.822 | S | S | * | * | cis | 94.1 | 106.1 | 31.4 | -173.1 | 140 | 78.7 | 171.5 | 3.5 | 113 | ||||
| 63 | G | 29 | Very low | 32.7 | Very low | 79 Ų | 79 | 124.1 Ų | 124.1 | 81% | 0.814 | 82% | 0.82 | S | S | * | * | trans | 135.9 | 135.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 64 | G | 29.3 | Very low | 32.7 | Very low | 82 Ų | 82 | 123.4 Ų | 123.4 | 85% | 0.845 | 82% | 0.821 | S | S | * | * | cis | 164.1 | 87.1 | -10.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 65 | G | 29.8 | Very low | 32.9 | Very low | 89 Ų | 89 | 123 Ų | 123 | 92% | 0.918 | 82% | 0.816 | S | S | * | * | trans | 79.2 | 168.8 | 167.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 66 | G | 28.9 | Very low | 33.9 | Very low | 83 Ų | 83 | 124.6 Ų | 124.6 | 86% | 0.856 | 82% | 0.819 | S | S | * | * | trans | 138.9 | 108.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 67 | A | 30.8 | Very low | 34.1 | Very low | 84 Ų | 84 | 122.5 Ų | 122.5 | 69% | 0.694 | 82% | 0.817 | S | S | * | * | trans | -76.8 | 149.6 | -169.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 68 | Q | 29.7 | Very low | 34.6 | Very low | 190 Ų | 190 | 123.4 Ų | 123.4 | 89% | 0.888 | 82% | 0.823 | S | S | * | * | 52.7 | 149.6 | 129.8 | -64.5 | -171.2 | 80.5 | 0 | 0 | 124.7 | |||||
| 69 | A | 30.6 | Very low | 34.8 | Very low | 101 Ų | 101 | 119 Ų | 119 | 84% | 0.835 | 82% | 0.815 | S | S | * | * | trans | 103 | 137 | 138.9 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 70 | L | 34.3 | Very low | 35.5 | Very low | 148 Ų | 148 | 122 Ų | 122 | 78% | 0.775 | 82% | 0.817 | S | S | * | * | trans | -86.3 | 164.4 | 162.6 | -140.6 | 79.4 | 0 | 0 | 0 | 108.9 | D72 | L70-D72 HydrophobicContact CD2-CB 4.25Š| ||
| 71 | P | 51.8 | Low | 36.6 | Very low | 118 Ų | 118 | 120 Ų | 120 | 77% | 0.766 | 81% | 0.814 | S | S | * | * | -129.1 | 162.4 | 67.4 | 14.5 | 10 | 0 | 0 | 0 | 112.3 | |||||
| 72 | D | 34.3 | Very low | 36.5 | Very low | 132 Ų | 132 | 118 Ų | 118 | 71% | 0.706 | 81% | 0.811 | S | S | * | * | 70.8 | 119.6 | 50.5 | -153.2 | -64.3 | 0 | 0 | 0 | 115.7 | L70 | L70-D72 HydrophobicContact CD2-CB 4.25Š| |||
| 73 | C | 30.8 | Very low | 36.8 | Very low | 124 Ų | 124 | 115.1 Ų | 115.1 | 84% | 0.838 | 81% | 0.808 | S | S | * | * | trans | -172.9 | 114.6 | 150.5 | -119.8 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 74 | A | 32.4 | Very low | 37.9 | Very low | 95 Ų | 95 | 116.8 Ų | 116.8 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | 37 | 145.2 | 146.1 | 0 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 75 | G | 33.7 | Very low | 38 | Very low | 72 Ų | 72 | 116.7 Ų | 116.7 | 74% | 0.742 | 80% | 0.804 | S | S | * | * | trans | -87.6 | -155.3 | 170.3 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 76 | P | 52 | Low | 38.3 | Very low | 134 Ų | 134 | 117 Ų | 117 | 87% | 0.87 | 80% | 0.797 | S | S | * | * | -147.4 | -179.2 | 68 | 40.8 | -22.6 | 0 | 0 | 0 | 117 | |||||
| 77 | S | 38.5 | Very low | 38.8 | Very low | 113 Ų | 113 | 125 Ų | 125 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -97.4 | 175.9 | 173.8 | -48 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 78 | P | 51.8 | Low | 39.2 | Very low | 132 Ų | 132 | 129.6 Ų | 129.6 | 86% | 0.857 | 81% | 0.809 | S | S | * | * | -146.2 | 148.7 | 110.7 | 36.7 | -22 | 0 | 0 | 0 | 117.5 | |||||
| 79 | G | 36.9 | Very low | 40 | Very low | 63 Ų | 63 | 128.9 Ų | 128.9 | 65% | 0.649 | 81% | 0.81 | S | S | * | * | trans | 80.9 | 173.3 | 160 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 80 | H | 43.4 | Very low | 40.4 | Very low | 190 Ų | 190 | 128.6 Ų | 128.6 | 88% | 0.88 | 81% | 0.808 | S | S | * | * | cis | -160.3 | -175.5 | -21.4 | -113.2 | -32.6 | 0 | 0 | 0 | 110.8 | ||||
| 81 | P | 54.1 | Low | 40.6 | Very low | 123 Ų | 123 | 124.2 Ų | 124.2 | 80% | 0.799 | 80% | 0.799 | S | S | * | * | trans | -102.5 | 155.2 | -141.6 | 40.2 | -36.2 | 0 | 0 | 0 | 117.5 | ||||
| 82 | G | 31 | Very low | 40.2 | Very low | 77 Ų | 77 | 125.1 Ų | 125.1 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | trans | 178.8 | 125.7 | 164.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 83 | H | 39.7 | Very low | 40.4 | Very low | 188 Ų | 188 | 126.8 Ų | 126.8 | 87% | 0.87 | 81% | 0.812 | S | S | * | * | trans | -138.2 | 165.3 | 175.9 | -120 | -96.3 | 0 | 0 | 0 | 107.6 | ||||
| 84 | P | 51.1 | Low | 40.8 | Very low | 114 Ų | 114 | 125.3 Ų | 125.3 | 74% | 0.74 | 81% | 0.81 | S | S | * | * | cis | -131.8 | 169 | -4 | 41.9 | -27.7 | 0 | 0 | 0 | 115.3 | ||||
| 85 | G | 31.9 | Very low | 41.3 | Very low | 80 Ų | 80 | 128.9 Ų | 128.9 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | trans | 92.9 | 98.6 | 131.8 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 86 | A | 37.2 | Very low | 41.9 | Very low | 95 Ų | 95 | 133.8 Ų | 133.8 | 79% | 0.785 | 82% | 0.815 | S | S | * | * | trans | -160.3 | 90.3 | 147.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q88 | A86-Q88 VanDerWaalsContact C-N 3.34Å; A86-Q88 PolarHBondContact O-N 3.41Å; A86-Q88 VanDerWaalsContact O-N 3.12Å | ||
| 87 | R | 39.6 | Very low | 41.7 | Very low | 252 Ų | 252 | 134.8 Ų | 134.8 | 95% | 0.951 | 81% | 0.809 | S | S | * | * | trans | -83.2 | 76.9 | 170.5 | -73.2 | -175.7 | 77.6 | 177.4 | 5.3 | 110.3 | ||||
| 88 | Q | 38.5 | Very low | 42.4 | Very low | 181 Ų | 181 | 135.6 Ų | 135.6 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | -76.5 | 129.7 | 173.6 | -166 | 162.1 | 8.7 | 0 | 0 | 110.5 | A86 A90 | A86-Q88 VanDerWaalsContact C-N 3.34Å; A86-Q88 PolarHBondContact O-N 3.41Å; A86-Q88 VanDerWaalsContact O-N 3.12Å; Q88-A90 PolarHBondContact O-N 3.34Å | ||
| 89 | L | 46.8 | Very low | 42.8 | Very low | 174 Ų | 174 | 139.2 Ų | 139.2 | 91% | 0.911 | 81% | 0.807 | S | S | * | * | trans | -70.3 | 98.5 | 173.7 | -92.9 | 70.4 | 0 | 0 | 0 | 109.9 | ||||
| 90 | A | 39.5 | Very low | 44.6 | Very low | 96 Ų | 96 | 137.2 Ų | 137.2 | 79% | 0.793 | 79% | 0.786 | S | S | * | * | trans | -92.4 | 100 | 160.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | Q88 | Q88-A90 PolarHBondContact O-N 3.34Š| ||
| 91 | G | 38.1 | Very low | 46.6 | Very low | 56 Ų | 56 | 133.1 Ų | 133.1 | 58% | 0.577 | 77% | 0.767 | S | S | * | * | trans | -66.8 | 153.7 | 165.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | L93 | G91-L93 PolarHBondContact O-N 2.75Š| ||
| 92 | P | 41.9 | Very low | 48.4 | Very low | 137 Ų | 137 | 132 Ų | 132 | 89% | 0.89 | 76% | 0.758 | S | S | * | * | trans | -74.3 | 73.2 | 179.3 | 32.3 | -36 | 0 | 0 | 0 | 111.1 | A94 | P92-A94 PolarHBondContact O-N 2.7Å; P92-A94 VanDerWaalsContact O-N 3.16Å | ||
| 93 | L | 38.9 | Very low | 51.2 | Low | 166 Ų | 166 | 130.1 Ų | 130.1 | 87% | 0.869 | 73% | 0.73 | S | S | * | * | trans | -58.8 | 114.5 | 149 | -72.5 | 179 | 0 | 0 | 0 | 105.9 | G91 M95 | G91-L93 PolarHBondContact O-N 2.75Å; L93-M95 PolarHBondContact O-N 3.07Å; L93-M95 VanDerWaalsContact O-N 3.08Å | ||
| 94 | A | 38.9 | Very low | 53.6 | Low | 94 Ų | 94 | 131 Ų | 131 | 78% | 0.777 | 73% | 0.734 | S | S | * | * | trans | -55.6 | 120.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | P92 E96 | P92-A94 PolarHBondContact O-N 2.7Å; P92-A94 VanDerWaalsContact O-N 3.16Å; A94-E96 PolarHBondContact O-N 2.98Å | ||
| 95 | M | 44.1 | Very low | 55.4 | Low | 170 Ų | 170 | 128.8 Ų | 128.8 | 84% | 0.837 | 72% | 0.716 | S | S | * | * | trans | -64.5 | 92.2 | 159.1 | -74.1 | -174 | 173.3 | 0 | 0 | 106.4 | L93 Q97 | L93-M95 PolarHBondContact O-N 3.07Å; L93-M95 VanDerWaalsContact O-N 3.08Å; M95-Q97 VanDerWaalsContact C-N 3.26Å; M95-Q97 PolarHBondContact O-N 3.1Å | ||
| 96 | E | 46.3 | Very low | 58 | Low | 174 Ų | 174 | 126.4 Ų | 126.4 | 81% | 0.813 | 69% | 0.691 | S | S | * | * | trans | -58.3 | 100.8 | 161.6 | -176.6 | 167.1 | 114.8 | 0 | 0 | 105.6 | A94 T98 | A94-E96 PolarHBondContact O-N 2.98Å; E96-T98 PolarHBondContact O-N 2.69Å | ||
| 97 | Q | 46.5 | Very low | 60.5 | Low | 156 Ų | 156 | 122.4 Ų | 122.4 | 73% | 0.729 | 66% | 0.659 | S | S | * | * | trans | -50.4 | 134.5 | -172.4 | -139.9 | 98.3 | 60.6 | 0 | 0 | 108.6 | M95 Y99 | M95-Q97 VanDerWaalsContact C-N 3.26Å; M95-Q97 PolarHBondContact O-N 3.1Å; Q97-Y99 PolarHBondContact O-N 3.41Å | ||
| 98 | T | 53.2 | Low | 63 | Low | 130 Ų | 130 | 115 Ų | 115 | 80% | 0.798 | 64% | 0.641 | S | S | * | * | trans | -64.8 | 74.8 | -175.6 | -49.6 | 0 | 0 | 0 | 0 | 111.8 | E96 G100 | E96-T98 PolarHBondContact O-N 2.69Å; T98-G100 PolarHBondContact O-N 3.25Å | ||
| 99 | Y | 60.9 | Low | 65.5 | Low | 208 Ų | 208 | 109.4 Ų | 109.4 | 82% | 0.816 | 61% | 0.614 | S | S | * | * | trans | -104.3 | 55 | -176.4 | -145.1 | -79.5 | 0 | 0 | 0 | 109.4 | Q97 | Q97-Y99 PolarHBondContact O-N 3.41Š| ||
| 100 | G | 75.6 | Confident | 67.6 | Low | 20 Ų | 20 | 104 Ų | 104 | 21% | 0.206 | 59% | 0.589 | C | S | . | * | trans | -133 | 134 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | T98 F109 | T98-G100 PolarHBondContact O-N 3.25Å; G100-F109 CarbonylContact C-O 3.59Å; G100-F109 WeakPolarHBondContact CA-O 3.34Å | ||
| 101 | E | 85.8 | Confident | 69.9 | Low | 105 Ų | 105 | 104.3 Ų | 104.3 | 49% | 0.491 | 58% | 0.577 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -69.7 | 150.8 | 171.7 | -73 | 162.3 | -129.9 | 0 | 0 | 109.9 | V108 F109 N111 | E101-V108 CarbonylContact O-C 3.59Å; E101-V108 WeakPolarHBondContact O-CA 3.22Å; E101-F109 HydrophobicContact CB-CD1 4.19Å; E101-F109 HydrophobicContact CB-CE1 3.52Å; E101-F109 HydrophobicContact CB-CE2 4.34Å; E101-F109 HydrophobicContact CB-CZ 3.6Å; E101-F109 PolarHBondContact N-O 2.92Å; E101-F109 WeakPolarHBondContact O-CD1 3.1Å; E101-F109 WeakPolarHBondContact O-CE1 3.47Å; E101-F109 PolarHBondContact O-N 3.36Å; E101-F109 WeakPolarHBondContact OE2-CZ 3.49Å; E101-N111 PolarHBondContact OE1-ND2 2.95Å; E101-N111 PolarHBondContact OE2-ND2 3.3Å |
| 102 | V | 90.8 | Very high | 72.1 | Confident | 100 Ų | 100 | 105.1 Ų | 105.1 | 61% | 0.606 | 59% | 0.586 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -97.9 | 123 | 173.9 | -177.7 | 0 | 0 | 0 | 0 | 108.4 | V108 | V102-V108 HydrophobicContact CG2-CG2 4.48Å |
| 103 | N | 89.8 | Confident | 74.4 | Confident | 36 Ų | 36 | 107.2 Ų | 107.2 | 19% | 0.193 | 58% | 0.576 | C | S | . | * | P | Polyproline II helix | trans | -77.8 | 170.1 | 177.2 | 69.4 | 42 | 0 | 0 | 0 | 112 | L105 G106 G107 F109 R141 | N103-L105 PolarHBondContact O-N 3.14Å; N103-L105 WeakPolarHBondContact OD1-CA 3.19Å; N103-L105 WeakPolarHBondContact OD1-CB 3.22Å; N103-L105 PolarHBondContact OD1-N 3.18Å; N103-G106 PolarHBondContact O-N 3.23Å; N103-G106 PolarHBondContact OD1-N 2.81Å; N103-G107 PolarHBondContact N-O 2.98Å; N103-G107 PolarHBondContact ND2-O 3.17Å; N103-G107 VanDerWaalsContact ND2-O 3.14Å; N103-G107 PolarHBondContact OD1-N 2.9Å; N103-G107 VanDerWaalsContact OD1-N 3.14Å; N103-F109 HydrophobicContact CB-CD1 3.86Å; N103-F109 HydrophobicContact CB-CE1 3.79Å; N103-R141 PolarHBondContact ND2-O 3.35Å; N103-R141 PolarHBondContact OD1-O 2.86Å |
| 104 | Q | 90.9 | Very high | 76.9 | Confident | 206 Ų | 206 | 102.4 Ų | 102.4 | 96% | 0.963 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.1 | -14.6 | 179.8 | -66.3 | 174 | -12.3 | 0 | 0 | 115.1 | ||
| 105 | L | 87.6 | Confident | 79.4 | Confident | 69 Ų | 69 | 99.3 Ų | 99.3 | 36% | 0.361 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -97 | 5.1 | 176 | -57 | 172.2 | 0 | 0 | 0 | 112.4 | N103 R141 V142 | N103-L105 PolarHBondContact O-N 3.14Å; N103-L105 WeakPolarHBondContact OD1-CA 3.19Å; N103-L105 WeakPolarHBondContact OD1-CB 3.22Å; N103-L105 PolarHBondContact OD1-N 3.18Å; L105-R141 HydrophobicContact CB-CB 4.17Å; L105-R141 WeakPolarHBondContact O-CB 3.3Å; L105-R141 VanDerWaalsContact O-CD 3.26Å; L105-R141 WeakPolarHBondContact O-CD 3.28Å; L105-R141 VanDerWaalsContact O-CG 3.29Å; L105-R141 WeakPolarHBondContact O-CG 3.42Å; L105-V142 WeakPolarHBondContact CD1-O 3.24Å |
| 106 | G | 87.2 | Confident | 81.7 | Confident | 30 Ų | 30 | 95.1 Ų | 95.1 | 31% | 0.309 | 51% | 0.51 | S | S | . | . | S | Bend | trans | 75.9 | 23.7 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | N103 R141 | N103-G106 PolarHBondContact O-N 3.23Å; N103-G106 PolarHBondContact OD1-N 2.81Å; G106-R141 WeakPolarHBondContact O-CD 3.36Å; G106-R141 PolarHBondContact O-NH1 3.35Å |
| 107 | G | 90.1 | Very high | 83.9 | Confident | 10 Ų | 10 | 90.1 Ų | 90.1 | 10% | 0.103 | 49% | 0.489 | C | S | . | . | trans | -106.1 | 137.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | N103 | N103-G107 PolarHBondContact N-O 2.98Å; N103-G107 PolarHBondContact ND2-O 3.17Å; N103-G107 VanDerWaalsContact ND2-O 3.14Å; N103-G107 PolarHBondContact OD1-N 2.9Å; N103-G107 VanDerWaalsContact OD1-N 3.14Å | ||
| 108 | V | 92.1 | Very high | 86.2 | Confident | 96 Ų | 96 | 86 Ų | 86 | 58% | 0.582 | 48% | 0.482 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.6 | 134.5 | -179.7 | -174.4 | 0 | 0 | 0 | 0 | 110.6 | E101 V102 | E101-V108 CarbonylContact O-C 3.59Å; E101-V108 WeakPolarHBondContact O-CA 3.22Å; V102-V108 HydrophobicContact CG2-CG2 4.48Å |
| 109 | F | 90.9 | Very high | 88.1 | Confident | 64 Ų | 64 | 82.6 Ų | 82.6 | 28% | 0.281 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145 | 160 | 175 | 74.3 | -75.6 | 0 | 0 | 0 | 111.2 | G100 E101 N103 | G100-F109 CarbonylContact C-O 3.59Å; G100-F109 WeakPolarHBondContact CA-O 3.34Å; E101-F109 HydrophobicContact CB-CD1 4.19Å; E101-F109 HydrophobicContact CB-CE1 3.52Å; E101-F109 HydrophobicContact CB-CE2 4.34Å; E101-F109 HydrophobicContact CB-CZ 3.6Å; E101-F109 PolarHBondContact N-O 2.92Å; E101-F109 WeakPolarHBondContact O-CD1 3.1Å; E101-F109 WeakPolarHBondContact O-CE1 3.47Å; E101-F109 PolarHBondContact O-N 3.36Å; E101-F109 WeakPolarHBondContact OE2-CZ 3.49Å; N103-F109 HydrophobicContact CB-CD1 3.86Å; N103-F109 HydrophobicContact CB-CE1 3.79Å |
| 110 | V | 90.4 | Very high | 89.8 | Confident | 62 Ų | 62 | 73.9 Ų | 73.9 | 38% | 0.376 | 42% | 0.424 | S | S | . | . | trans | -117.4 | 121.9 | 178.6 | -173.1 | 0 | 0 | 0 | 0 | 109.2 | R113 | V110-R113 HydrophobicContact CB-CB 4.2Å; V110-R113 HydrophobicContact CB-CG 4.33Å; V110-R113 HydrophobicContact CG1-CB 4.38Å; V110-R113 HydrophobicContact CG1-CG 3.98Å; V110-R113 PolarHBondContact O-N 2.96Å | ||
| 111 | N | 87.9 | Confident | 90.8 | Very high | 102 Ų | 102 | 76.2 Ų | 76.2 | 55% | 0.545 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60 | 140.2 | -178.9 | -101.8 | -40.9 | 0 | 0 | 0 | 112.1 | E101 R113 | E101-N111 PolarHBondContact OE1-ND2 2.95Å; E101-N111 PolarHBondContact OE2-ND2 3.3Å; N111-R113 PolarHBondContact O-N 2.94Å; N111-R113 VanDerWaalsContact O-N 3.12Å |
| 112 | G | 84.8 | Confident | 91.3 | Very high | 73 Ų | 73 | 76.4 Ų | 76.4 | 75% | 0.753 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.7 | -10.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||
| 113 | R | 89.1 | Confident | 91.6 | Very high | 180 Ų | 180 | 71.6 Ų | 71.6 | 68% | 0.679 | 40% | 0.398 | S | S | * | . | S | Bend | trans | -96.8 | 149.9 | 177.5 | -63.6 | -165.7 | 179.1 | -156.5 | -1.3 | 112.1 | V110 N111 | V110-R113 HydrophobicContact CB-CB 4.2Å; V110-R113 HydrophobicContact CB-CG 4.33Å; V110-R113 HydrophobicContact CG1-CB 4.38Å; V110-R113 HydrophobicContact CG1-CG 3.98Å; V110-R113 PolarHBondContact O-N 2.96Å; N111-R113 PolarHBondContact O-N 2.94Å; N111-R113 VanDerWaalsContact O-N 3.12Å |
| 114 | P | 91.3 | Very high | 91.9 | Very high | 65 Ų | 65 | 70.2 Ų | 70.2 | 42% | 0.422 | 39% | 0.391 | S | S | . | . | P | Polyproline II helix | trans | -67.5 | 145.8 | 171.4 | 29.1 | -34.2 | 0 | 0 | 0 | 111.2 | P162 I165 | P114-P162 HydrophobicContact CB-CB 3.6Å; P114-P162 HydrophobicContact CB-CG 3.88Å; P114-P162 HydrophobicContact CG-CB 4.27Å; P114-P162 HydrophobicContact CG-CG 4.11Å; P114-I165 HydrophobicContact CB-CD1 4.19Å; P114-I165 HydrophobicContact CG-CD1 4.45Å |
| 115 | L | 91.6 | Very high | 92.1 | Very high | 30 Ų | 30 | 64 Ų | 64 | 16% | 0.157 | 36% | 0.362 | C | S | . | . | P | Polyproline II helix | trans | -54 | 139.1 | 174.6 | -170.9 | 73.4 | 0 | 0 | 0 | 111 | I119 R120 I123 V142 I150 | L115-I119 HydrophobicContact CD2-CB 4.13Å; L115-I119 HydrophobicContact CD2-CG2 3.8Å; L115-I119 HydrophobicContact CG-CB 4.21Å; L115-I119 HydrophobicContact CG-CG2 4.28Å; L115-R120 HydrophobicContact CB-CG 4.08Å; L115-R120 HydrophobicContact CD2-CG 4.13Å; L115-R120 HydrophobicContact CG-CG 4.35Å; L115-R120 WeakPolarHBondContact O-CD 3.36Å; L115-I123 HydrophobicContact CD2-CD1 3.85Å; L115-V142 HydrophobicContact CD1-CG2 4.24Å; L115-V142 HydrophobicContact CD2-CG1 4.06Å; L115-V142 HydrophobicContact CD2-CG2 4.14Å; L115-I150 HydrophobicContact CD2-CD1 3.7Å |
| 116 | P | 92.9 | Very high | 92.6 | Very high | 81 Ų | 81 | 61 Ų | 61 | 53% | 0.526 | 35% | 0.346 | S | S | . | . | P | Polyproline II helix | trans | -54.3 | 139.7 | -178.2 | -29.1 | 36.3 | 0 | 0 | 0 | 113.8 | A118 I119 R120 | P116-A118 VanDerWaalsContact C-N 3.29Å; P116-A118 PolarHBondContact O-N 3.25Å; P116-I119 HydrophobicContact CB-CG1 4.38Å; P116-I119 PolarHBondContact O-N 3.01Å; P116-R120 PolarHBondContact O-N 3.23Å; P116-R120 VanDerWaalsContact O-N 3.15Å |
| 117 | N | 92.7 | Very high | 93 | Very high | 70 Ų | 70 | 61.1 Ų | 61.1 | 37% | 0.374 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61.2 | -34.8 | -168.3 | -161.5 | 59.8 | 0 | 0 | 0 | 113.6 | I119 R120 L121 I160 | N117-I119 VanDerWaalsContact C-N 3.33Å; N117-I119 PolarHBondContact O-N 3.08Å; N117-R120 WeakPolarHBondContact O-CB 3.46Å; N117-R120 PolarHBondContact O-N 2.88Å; N117-L121 WeakPolarHBondContact O-CG 3.45Å; N117-L121 PolarHBondContact O-N 3.04Å; N117-I160 VanDerWaalsContact OD1-CD1 3.23Å; N117-I160 WeakPolarHBondContact OD1-CD1 3.42Å |
| 118 | A | 93.8 | Very high | 93.3 | Very high | 70 Ų | 70 | 66.7 Ų | 66.7 | 58% | 0.579 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -60 | -39.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | P116 R122 | P116-A118 VanDerWaalsContact C-N 3.29Å; P116-A118 PolarHBondContact O-N 3.25Å; A118-R122 WeakPolarHBondContact O-CB 2.99Å; A118-R122 PolarHBondContact O-N 3.02Å |
| 119 | I | 94.9 | Very high | 93.5 | Very high | 57 Ų | 57 | 68 Ų | 68 | 29% | 0.292 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -72.5 | -35.5 | 177 | -49.6 | -59 | 0 | 0 | 0 | 110.6 | L115 P116 N117 R122 I123 L140 V142 | L115-I119 HydrophobicContact CD2-CB 4.13Å; L115-I119 HydrophobicContact CD2-CG2 3.8Å; L115-I119 HydrophobicContact CG-CB 4.21Å; L115-I119 HydrophobicContact CG-CG2 4.28Å; P116-I119 HydrophobicContact CB-CG1 4.38Å; P116-I119 PolarHBondContact O-N 3.01Å; N117-I119 VanDerWaalsContact C-N 3.33Å; N117-I119 PolarHBondContact O-N 3.08Å; I119-R122 PolarHBondContact O-N 3.39Å; I119-I123 HydrophobicContact CG2-CD1 4.32Å; I119-I123 VanDerWaalsContact O-CG1 3.3Å; I119-I123 WeakPolarHBondContact O-CG1 3.46Å; I119-I123 PolarHBondContact O-N 3.45Å; I119-L140 HydrophobicContact CG2-CB 4.43Å; I119-L140 HydrophobicContact CG2-CD1 4.28Å; I119-V142 HydrophobicContact CG2-CG2 3.69Å |
| 120 | R | 96.1 | Very high | 93.7 | Very high | 26 Ų | 26 | 68 Ų | 68 | 10% | 0.098 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -64 | -40.5 | 175.2 | -63.8 | 176.9 | 58.6 | 84.8 | 6.3 | 112.2 | L115 P116 N117 I150 I160 L161 | L115-R120 HydrophobicContact CB-CG 4.08Å; L115-R120 HydrophobicContact CD2-CG 4.13Å; L115-R120 HydrophobicContact CG-CG 4.35Å; L115-R120 WeakPolarHBondContact O-CD 3.36Å; P116-R120 PolarHBondContact O-N 3.23Å; P116-R120 VanDerWaalsContact O-N 3.15Å; N117-R120 WeakPolarHBondContact O-CB 3.46Å; N117-R120 PolarHBondContact O-N 2.88Å; R120-I150 HydrophobicContact CG-CD1 4Å; R120-I160 PolarHBondContact NE-O 2.84Å; R120-I160 PolarHBondContact NH2-O 3.25Å; R120-L161 PolarHBondContact NH2-O 2.84Å; R120-L161 VanDerWaalsContact NH2-O 3.13Å |
| 121 | L | 95.8 | Very high | 94 | Very high | 68 Ų | 68 | 67.5 Ų | 67.5 | 36% | 0.356 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.8 | -51.8 | 170.2 | -74 | 164.4 | 0 | 0 | 0 | 110.9 | N117 I123 V124 E125 I160 | N117-L121 WeakPolarHBondContact O-CG 3.45Å; N117-L121 PolarHBondContact O-N 3.04Å; L121-I123 VanDerWaalsContact C-N 3.27Å; L121-I123 PolarHBondContact O-N 3.5Å; L121-V124 WeakPolarHBondContact O-CA 3.32Å; L121-V124 WeakPolarHBondContact O-CB 3.27Å; L121-V124 PolarHBondContact O-N 3.22Å; L121-E125 PolarHBondContact O-N 2.86Å; L121-I160 HydrophobicContact CD2-CB 4.36Å; L121-I160 HydrophobicContact CD2-CD1 3.92Å; L121-I160 HydrophobicContact CD2-CG1 3.74Å; L121-I160 HydrophobicContact CD2-CG2 4.35Å; L121-I160 HydrophobicContact CG-CD1 4.17Å; L121-I160 HydrophobicContact CG-CG1 4.42Å |
| 122 | R | 96.3 | Very high | 94.5 | Very high | 109 Ų | 109 | 70.8 Ų | 70.8 | 41% | 0.411 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61.6 | -32.2 | -177 | -167.2 | 56.8 | 173.4 | 176.8 | 1.4 | 113.7 | A118 I119 V124 E125 L126 L140 | A118-R122 WeakPolarHBondContact O-CB 2.99Å; A118-R122 PolarHBondContact O-N 3.02Å; I119-R122 PolarHBondContact O-N 3.39Å; R122-V124 VanDerWaalsContact C-N 3.32Å; R122-V124 PolarHBondContact O-N 3.19Å; R122-E125 WeakPolarHBondContact CD-OE2 3.46Å; R122-E125 IonicContact CZ-OE2 2.71Å; R122-E125 IonicContact NE-OE2 2.7Å; R122-E125 IonicContact NH1-OE2 3.75Å; R122-E125 PolarHBondContact NH1-OE2 2.73Å; R122-L126 HydrophobicContact CG-CD1 4.07Å; R122-L126 HydrophobicContact CG-CG 4.34Å; R122-L126 WeakPolarHBondContact O-CB 3.49Å; R122-L126 VanDerWaalsContact O-CG 3.24Å; R122-L126 WeakPolarHBondContact O-CG 3.49Å; R122-L126 PolarHBondContact O-N 3.14Å; R122-L126 VanDerWaalsContact O-N 3.08Å; R122-L140 HydrophobicContact CB-CD1 4.18Å; R122-L140 HydrophobicContact CB-CD2 4.44Å; R122-L140 HydrophobicContact CG-CD1 4.08Å; R122-L140 HydrophobicContact CG-CD2 3.74Å |
| 123 | I | 96.6 | Very high | 95 | Very high | 0 Ų | 0 | 69.6 Ų | 69.6 | 0% | 0 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -59.3 | -42.7 | 171.3 | -76.3 | 165.4 | 0 | 0 | 0 | 111.5 | L115 I119 L121 A127 I136 L140 V142 V147 I150 L151 | L115-I123 HydrophobicContact CD2-CD1 3.85Å; I119-I123 HydrophobicContact CG2-CD1 4.32Å; I119-I123 VanDerWaalsContact O-CG1 3.3Å; I119-I123 WeakPolarHBondContact O-CG1 3.46Å; I119-I123 PolarHBondContact O-N 3.45Å; L121-I123 VanDerWaalsContact C-N 3.27Å; L121-I123 PolarHBondContact O-N 3.5Å; I123-A127 WeakPolarHBondContact O-CB 3.46Å; I123-A127 PolarHBondContact O-N 3.44Å; I123-I136 HydrophobicContact CB-CG2 4.38Å; I123-I136 HydrophobicContact CG1-CG2 4Å; I123-I136 HydrophobicContact CG2-CG2 4.46Å; I123-L140 HydrophobicContact CB-CD1 4.45Å; I123-L140 HydrophobicContact CG1-CD1 3.52Å; I123-V142 HydrophobicContact CD1-CG1 4.28Å; I123-V147 HydrophobicContact CD1-CG2 4.18Å; I123-V147 HydrophobicContact CG1-CG2 4.44Å; I123-V147 HydrophobicContact CG2-CG1 4.02Å; I123-I150 HydrophobicContact CB-CG2 4.34Å; I123-I150 HydrophobicContact CD1-CD1 3.55Å; I123-I150 HydrophobicContact CG2-CB 4.22Å; I123-I150 HydrophobicContact CG2-CG2 3.81Å; I123-L151 HydrophobicContact CG2-CD2 3.84Å; I123-L151 HydrophobicContact CG2-CG 3.95Å |
| 124 | V | 96.2 | Very high | 95.3 | Very high | 7 Ų | 7 | 62.6 Ų | 62.6 | 4% | 0.042 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -73.5 | -44 | -180 | 172.2 | 0 | 0 | 0 | 0 | 111.2 | L121 R122 L126 A127 Q128 I150 L151 Y154 I160 | L121-V124 WeakPolarHBondContact O-CA 3.32Å; L121-V124 WeakPolarHBondContact O-CB 3.27Å; L121-V124 PolarHBondContact O-N 3.22Å; R122-V124 VanDerWaalsContact C-N 3.32Å; R122-V124 PolarHBondContact O-N 3.19Å; V124-L126 PolarHBondContact O-N 2.93Å; V124-A127 PolarHBondContact O-N 2.75Å; V124-Q128 HydrophobicContact CG1-CG 4.3Å; V124-Q128 WeakPolarHBondContact O-CG 3.27Å; V124-Q128 PolarHBondContact O-N 3.04Å; V124-I150 HydrophobicContact CG2-CG2 4.33Å; V124-L151 HydrophobicContact CG2-CD2 4.29Å; V124-Y154 HydrophobicContact CG1-CD1 3.74Å; V124-Y154 HydrophobicContact CG1-CD2 3.99Å; V124-Y154 HydrophobicContact CG1-CE1 3.53Å; V124-Y154 HydrophobicContact CG1-CE2 3.8Å; V124-Y154 HydrophobicContact CG1-CG 3.97Å; V124-Y154 HydrophobicContact CG2-CD1 4.2Å; V124-Y154 HydrophobicContact CG2-CD2 3.97Å; V124-Y154 HydrophobicContact CG2-CG 3.77Å; V124-I160 HydrophobicContact CG2-CG2 3.98Å |
| 125 | E | 96.8 | Very high | 95.6 | Very high | 74 Ų | 74 | 61.7 Ų | 61.7 | 35% | 0.346 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -54.7 | -50.5 | 175.7 | -69 | 166.3 | -156 | 0 | 0 | 112 | L121 R122 A127 Q128 L129 | L121-E125 PolarHBondContact O-N 2.86Å; R122-E125 WeakPolarHBondContact CD-OE2 3.46Å; R122-E125 IonicContact CZ-OE2 2.71Å; R122-E125 IonicContact NE-OE2 2.7Å; R122-E125 IonicContact NH1-OE2 3.75Å; R122-E125 PolarHBondContact NH1-OE2 2.73Å; E125-A127 VanDerWaalsContact C-N 3.29Å; E125-A127 PolarHBondContact O-N 3.24Å; E125-Q128 PolarHBondContact O-N 3.1Å; E125-L129 WeakPolarHBondContact O-CG 3.38Å; E125-L129 PolarHBondContact O-N 3.17Å |
| 126 | L | 96.6 | Very high | 95.8 | Very high | 7 Ų | 7 | 60.2 Ų | 60.2 | 4% | 0.037 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -65.3 | -33.9 | -179.1 | -64.6 | 170 | 0 | 0 | 0 | 111.8 | R122 V124 L129 G130 I131 I136 L140 | R122-L126 HydrophobicContact CG-CD1 4.07Å; R122-L126 HydrophobicContact CG-CG 4.34Å; R122-L126 WeakPolarHBondContact O-CB 3.49Å; R122-L126 VanDerWaalsContact O-CG 3.24Å; R122-L126 WeakPolarHBondContact O-CG 3.49Å; R122-L126 PolarHBondContact O-N 3.14Å; R122-L126 VanDerWaalsContact O-N 3.08Å; V124-L126 PolarHBondContact O-N 2.93Å; L126-L129 PolarHBondContact O-N 3.13Å; L126-G130 PolarHBondContact O-N 3Å; L126-I131 HydrophobicContact CB-CB 4.45Å; L126-I131 HydrophobicContact CB-CD1 4.05Å; L126-I131 HydrophobicContact CD2-CD1 3.57Å; L126-I131 HydrophobicContact CG-CD1 4.38Å; L126-I131 VanDerWaalsContact O-CB 3.26Å; L126-I131 WeakPolarHBondContact O-CB 3.32Å; L126-I131 PolarHBondContact O-N 3.04Å; L126-I136 HydrophobicContact CB-CD1 3.8Å; L126-I136 HydrophobicContact CB-CG1 3.75Å; L126-I136 HydrophobicContact CD1-CG1 4.41Å; L126-I136 HydrophobicContact CD1-CG2 4.22Å; L126-L140 HydrophobicContact CD1-CD1 3.94Å; L126-L140 HydrophobicContact CD1-CD2 4.16Å; L126-L140 HydrophobicContact CD1-CG 4.03Å |
| 127 | A | 96.5 | Very high | 96 | Very high | 33 Ų | 33 | 56.8 Ų | 56.8 | 27% | 0.273 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -71.3 | -36.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | I123 V124 E125 L129 G130 I136 L151 | I123-A127 WeakPolarHBondContact O-CB 3.46Å; I123-A127 PolarHBondContact O-N 3.44Å; V124-A127 PolarHBondContact O-N 2.75Å; E125-A127 VanDerWaalsContact C-N 3.29Å; E125-A127 PolarHBondContact O-N 3.24Å; A127-L129 VanDerWaalsContact C-N 3.3Å; A127-L129 PolarHBondContact O-N 2.97Å; A127-G130 WeakPolarHBondContact O-CA 3.25Å; A127-G130 PolarHBondContact O-N 3.4Å; A127-I136 HydrophobicContact CB-CD1 3.85Å; A127-L151 HydrophobicContact CB-CD1 4.08Å; A127-L151 HydrophobicContact CB-CD2 3.52Å; A127-L151 HydrophobicContact CB-CG 4.48Å |
| 128 | Q | 96.1 | Very high | 96.2 | Very high | 126 Ų | 126 | 60.4 Ų | 60.4 | 59% | 0.589 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -65 | -33.7 | 172.2 | -72.6 | 172.3 | -11.6 | 0 | 0 | 111.9 | V124 E125 G130 Y154 | V124-Q128 HydrophobicContact CG1-CG 4.3Å; V124-Q128 WeakPolarHBondContact O-CG 3.27Å; V124-Q128 PolarHBondContact O-N 3.04Å; E125-Q128 PolarHBondContact O-N 3.1Å; Q128-G130 PolarHBondContact O-N 3.42Å; Q128-Y154 PolarHBondContact NE2-OH 3.39Å |
| 129 | L | 96.8 | Very high | 96.2 | Very high | 125 Ų | 125 | 62.4 Ų | 62.4 | 65% | 0.654 | 31% | 0.313 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72 | 2.9 | 169.6 | -65.8 | 170.6 | 0 | 0 | 0 | 113.6 | E125 L126 A127 I131 | E125-L129 WeakPolarHBondContact O-CG 3.38Å; E125-L129 PolarHBondContact O-N 3.17Å; L126-L129 PolarHBondContact O-N 3.13Å; A127-L129 VanDerWaalsContact C-N 3.3Å; A127-L129 PolarHBondContact O-N 2.97Å; L129-I131 VanDerWaalsContact C-N 3.35Å; L129-I131 HydrophobicContact CB-CD1 4.37Å; L129-I131 HydrophobicContact CB-CG1 4.44Å; L129-I131 PolarHBondContact O-N 3.32Å |
| 130 | G | 94.8 | Very high | 96.2 | Very high | 63 Ų | 63 | 61.6 Ų | 61.6 | 65% | 0.649 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.7 | 9.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | L126 A127 Q128 | L126-G130 PolarHBondContact O-N 3Å; A127-G130 WeakPolarHBondContact O-CA 3.25Å; A127-G130 PolarHBondContact O-N 3.4Å; Q128-G130 PolarHBondContact O-N 3.42Å |
| 131 | I | 96.9 | Very high | 96.2 | Very high | 51 Ų | 51 | 67 Ų | 67 | 26% | 0.262 | 33% | 0.329 | S | S | . | . | trans | -72.7 | 137.1 | 180 | -57.3 | 167.9 | 0 | 0 | 0 | 109.3 | L126 L129 D135 I136 | L126-I131 HydrophobicContact CB-CB 4.45Å; L126-I131 HydrophobicContact CB-CD1 4.05Å; L126-I131 HydrophobicContact CD2-CD1 3.57Å; L126-I131 HydrophobicContact CG-CD1 4.38Å; L126-I131 VanDerWaalsContact O-CB 3.26Å; L126-I131 WeakPolarHBondContact O-CB 3.32Å; L126-I131 PolarHBondContact O-N 3.04Å; L129-I131 VanDerWaalsContact C-N 3.35Å; L129-I131 HydrophobicContact CB-CD1 4.37Å; L129-I131 HydrophobicContact CB-CG1 4.44Å; L129-I131 PolarHBondContact O-N 3.32Å; I131-D135 HydrophobicContact CG2-CB 4.05Å; I131-I136 HydrophobicContact CB-CD1 4.49Å; I131-I136 HydrophobicContact CB-CG1 4.18Å; I131-I136 HydrophobicContact CG2-CG1 3.89Å; I131-I136 WeakPolarHBondContact O-CD1 3.43Å | ||
| 132 | R | 97.3 | Very high | 96.2 | Very high | 171 Ų | 171 | 64.2 Ų | 64.2 | 65% | 0.645 | 32% | 0.315 | S | S | * | . | trans | -67.7 | 140.9 | -174.9 | -54.6 | 172 | 70.4 | -170.4 | 3.5 | 110.6 | C134 D135 I136 | R132-C134 PolarHBondContact O-N 3.35Å; R132-D135 WeakPolarHBondContact CB-OD2 3.48Å; R132-D135 PolarHBondContact O-N 3.36Å; R132-I136 PolarHBondContact O-N 3.35Å; R132-I136 VanDerWaalsContact O-N 3.09Å | ||
| 133 | P | 95.9 | Very high | 96.1 | Very high | 49 Ų | 49 | 62.1 Ų | 62.1 | 32% | 0.318 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -55.6 | -29.4 | -179.6 | -29.3 | 36.2 | 0 | 0 | 0 | 115.3 | D135 S137 V147 L151 | P133-D135 VanDerWaalsContact C-N 3.31Å; P133-D135 PolarHBondContact O-N 2.94Å; P133-S137 VanDerWaalsContact O-CB 3.29Å; P133-S137 WeakPolarHBondContact O-CB 3.17Å; P133-S137 PolarHBondContact O-N 3Å; P133-V147 HydrophobicContact CB-CG1 4.19Å; P133-L151 HydrophobicContact CB-CD1 4.33Å; P133-L151 HydrophobicContact CG-CD1 4.03Å |
| 134 | C | 96.8 | Very high | 96.2 | Very high | 33 Ų | 33 | 67 Ų | 67 | 22% | 0.223 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -66.4 | -30.8 | 174.1 | 55.5 | 0 | 0 | 0 | 0 | 113.4 | R132 R138 | R132-C134 PolarHBondContact O-N 3.35Å; C134-R138 PolarHBondContact O-N 3.39Å; C134-R138 PolarHBondContact O-NE 3.02Å |
| 135 | D | 96.7 | Very high | 96.1 | Very high | 45 Ų | 45 | 69 Ų | 69 | 24% | 0.241 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -89 | -34.9 | -178.2 | -56.1 | -39.5 | 0 | 0 | 0 | 110.7 | I131 R132 P133 S137 R138 Q139 | I131-D135 HydrophobicContact CG2-CB 4.05Å; R132-D135 WeakPolarHBondContact CB-OD2 3.48Å; R132-D135 PolarHBondContact O-N 3.36Å; P133-D135 VanDerWaalsContact C-N 3.31Å; P133-D135 PolarHBondContact O-N 2.94Å; D135-S137 VanDerWaalsContact C-N 3.29Å; D135-S137 PolarHBondContact O-N 3.34Å; D135-R138 PolarHBondContact O-N 3.31Å; D135-R138 IonicContact OD1-CZ 3.42Å; D135-R138 IonicContact OD1-NE 3.31Å; D135-R138 PolarHBondContact OD1-NE 3.02Å; D135-R138 IonicContact OD1-NH2 2.69Å; D135-R138 PolarHBondContact OD1-NH2 3.16Å; D135-Q139 WeakPolarHBondContact O-CB 3.41Å; D135-Q139 VanDerWaalsContact O-CG 3.27Å; D135-Q139 WeakPolarHBondContact O-CG 3.48Å; D135-Q139 PolarHBondContact O-N 3.46Å |
| 136 | I | 96.4 | Very high | 96 | Very high | 0 Ų | 0 | 67.2 Ų | 67.2 | 0% | 0 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -56.1 | -45.4 | 165.7 | -60 | 177 | 0 | 0 | 0 | 110.6 | I123 L126 A127 I131 R132 R138 Q139 L140 V147 | I123-I136 HydrophobicContact CB-CG2 4.38Å; I123-I136 HydrophobicContact CG1-CG2 4Å; I123-I136 HydrophobicContact CG2-CG2 4.46Å; L126-I136 HydrophobicContact CB-CD1 3.8Å; L126-I136 HydrophobicContact CB-CG1 3.75Å; L126-I136 HydrophobicContact CD1-CG1 4.41Å; L126-I136 HydrophobicContact CD1-CG2 4.22Å; A127-I136 HydrophobicContact CB-CD1 3.85Å; I131-I136 HydrophobicContact CB-CD1 4.49Å; I131-I136 HydrophobicContact CB-CG1 4.18Å; I131-I136 HydrophobicContact CG2-CG1 3.89Å; I131-I136 WeakPolarHBondContact O-CD1 3.43Å; R132-I136 PolarHBondContact O-N 3.35Å; R132-I136 VanDerWaalsContact O-N 3.09Å; I136-R138 VanDerWaalsContact C-N 3.34Å; I136-R138 PolarHBondContact O-N 2.92Å; I136-Q139 PolarHBondContact O-N 2.86Å; I136-L140 HydrophobicContact CG2-CD1 3.89Å; I136-L140 HydrophobicContact CG2-CG 4.48Å; I136-L140 WeakPolarHBondContact O-CB 3.22Å; I136-L140 PolarHBondContact O-N 3.43Å; I136-V147 HydrophobicContact CB-CG1 4.31Å; I136-V147 HydrophobicContact CG2-CG1 4.01Å; I136-V147 HydrophobicContact CG2-CG2 4.46Å |
| 137 | S | 96.9 | Very high | 96 | Very high | 8 Ų | 8 | 66.9 Ų | 66.9 | 6% | 0.056 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -57.9 | -43.7 | 177 | 177.8 | 0 | 0 | 0 | 0 | 112.4 | P133 D135 R141 V142 H144 | P133-S137 VanDerWaalsContact O-CB 3.29Å; P133-S137 WeakPolarHBondContact O-CB 3.17Å; P133-S137 PolarHBondContact O-N 3Å; D135-S137 VanDerWaalsContact C-N 3.29Å; D135-S137 PolarHBondContact O-N 3.34Å; S137-R141 CarbonylContact O-C 3.58Å; S137-R141 WeakPolarHBondContact O-CA 3.3Å; S137-R141 PolarHBondContact O-N 2.84Å; S137-R141 VanDerWaalsContact O-N 3.11Å; S137-V142 VanDerWaalsContact CA-O 3.32Å; S137-V142 WeakPolarHBondContact CA-O 3.45Å; S137-V142 WeakPolarHBondContact CB-O 3.34Å; S137-V142 PolarHBondContact O-N 2.86Å; S137-V142 PolarHBondContact OG-O 2.89Å; S137-H144 PolarHBondContact OG-N 3.35Å |
| 138 | R | 95.4 | Very high | 96 | Very high | 147 Ų | 147 | 68.3 Ų | 68.3 | 56% | 0.555 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -69.5 | -50.1 | 176 | -75.8 | 179.9 | -87 | -100.8 | 6.6 | 112.7 | C134 D135 I136 L140 R141 | C134-R138 PolarHBondContact O-N 3.39Å; C134-R138 PolarHBondContact O-NE 3.02Å; D135-R138 PolarHBondContact O-N 3.31Å; D135-R138 IonicContact OD1-CZ 3.42Å; D135-R138 IonicContact OD1-NE 3.31Å; D135-R138 PolarHBondContact OD1-NE 3.02Å; D135-R138 IonicContact OD1-NH2 2.69Å; D135-R138 PolarHBondContact OD1-NH2 3.16Å; I136-R138 VanDerWaalsContact C-N 3.34Å; I136-R138 PolarHBondContact O-N 2.92Å; R138-L140 PolarHBondContact O-N 2.9Å; R138-R141 PolarHBondContact O-N 3.17Å |
| 139 | Q | 95.3 | Very high | 96 | Very high | 112 Ų | 112 | 69.6 Ų | 69.6 | 52% | 0.523 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -59.9 | -45.6 | -177.2 | -73.7 | 173.8 | 14.8 | 0 | 0 | 112.5 | D135 I136 R141 | D135-Q139 WeakPolarHBondContact O-CB 3.41Å; D135-Q139 VanDerWaalsContact O-CG 3.27Å; D135-Q139 WeakPolarHBondContact O-CG 3.48Å; D135-Q139 PolarHBondContact O-N 3.46Å; I136-Q139 PolarHBondContact O-N 2.86Å; Q139-R141 VanDerWaalsContact C-N 3.35Å |
| 140 | L | 94.9 | Very high | 95.9 | Very high | 40 Ų | 40 | 63.9 Ų | 63.9 | 21% | 0.209 | 34% | 0.337 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | -2.5 | -179.2 | -57.6 | -179.1 | 0 | 0 | 0 | 113.3 | I119 R122 I123 L126 I136 R138 V142 | I119-L140 HydrophobicContact CG2-CB 4.43Å; I119-L140 HydrophobicContact CG2-CD1 4.28Å; R122-L140 HydrophobicContact CB-CD1 4.18Å; R122-L140 HydrophobicContact CB-CD2 4.44Å; R122-L140 HydrophobicContact CG-CD1 4.08Å; R122-L140 HydrophobicContact CG-CD2 3.74Å; I123-L140 HydrophobicContact CB-CD1 4.45Å; I123-L140 HydrophobicContact CG1-CD1 3.52Å; L126-L140 HydrophobicContact CD1-CD1 3.94Å; L126-L140 HydrophobicContact CD1-CD2 4.16Å; L126-L140 HydrophobicContact CD1-CG 4.03Å; I136-L140 HydrophobicContact CG2-CD1 3.89Å; I136-L140 HydrophobicContact CG2-CG 4.48Å; I136-L140 WeakPolarHBondContact O-CB 3.22Å; I136-L140 PolarHBondContact O-N 3.43Å; R138-L140 PolarHBondContact O-N 2.9Å; L140-V142 HydrophobicContact CB-CG2 4.09Å; L140-V142 PolarHBondContact O-N 3.12Å |
| 141 | R | 95.7 | Very high | 95.9 | Very high | 140 Ų | 140 | 61.8 Ų | 61.8 | 53% | 0.528 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 52.7 | 38.7 | -175.1 | -51.6 | -176.7 | 179.7 | -170.3 | -1.6 | 113.1 | N103 L105 G106 S137 R138 Q139 | N103-R141 PolarHBondContact ND2-O 3.35Å; N103-R141 PolarHBondContact OD1-O 2.86Å; L105-R141 HydrophobicContact CB-CB 4.17Å; L105-R141 WeakPolarHBondContact O-CB 3.3Å; L105-R141 VanDerWaalsContact O-CD 3.26Å; L105-R141 WeakPolarHBondContact O-CD 3.28Å; L105-R141 VanDerWaalsContact O-CG 3.29Å; L105-R141 WeakPolarHBondContact O-CG 3.42Å; G106-R141 WeakPolarHBondContact O-CD 3.36Å; G106-R141 PolarHBondContact O-NH1 3.35Å; S137-R141 CarbonylContact O-C 3.58Å; S137-R141 WeakPolarHBondContact O-CA 3.3Å; S137-R141 PolarHBondContact O-N 2.84Å; S137-R141 VanDerWaalsContact O-N 3.11Å; R138-R141 PolarHBondContact O-N 3.17Å; Q139-R141 VanDerWaalsContact C-N 3.35Å |
| 142 | V | 95 | Very high | 95.8 | Very high | 9 Ų | 9 | 61.4 Ų | 61.4 | 6% | 0.055 | 32% | 0.315 | C | S | . | . | trans | -109.6 | 136.7 | 179.2 | 175.6 | 0 | 0 | 0 | 0 | 109.1 | L105 L115 I119 I123 S137 L140 H144 C146 V147 | L105-V142 WeakPolarHBondContact CD1-O 3.24Å; L115-V142 HydrophobicContact CD1-CG2 4.24Å; L115-V142 HydrophobicContact CD2-CG1 4.06Å; L115-V142 HydrophobicContact CD2-CG2 4.14Å; I119-V142 HydrophobicContact CG2-CG2 3.69Å; I123-V142 HydrophobicContact CD1-CG1 4.28Å; S137-V142 VanDerWaalsContact CA-O 3.32Å; S137-V142 WeakPolarHBondContact CA-O 3.45Å; S137-V142 WeakPolarHBondContact CB-O 3.34Å; S137-V142 PolarHBondContact O-N 2.86Å; S137-V142 PolarHBondContact OG-O 2.89Å; L140-V142 HydrophobicContact CB-CG2 4.09Å; L140-V142 PolarHBondContact O-N 3.12Å; V142-H144 PolarHBondContact O-N 2.96Å; V142-C146 HydrophobicContact CG1-CB 3.72Å; V142-V147 HydrophobicContact CB-CG2 4.11Å; V142-V147 HydrophobicContact CG1-CG2 3.91Å | ||
| 143 | S | 95.6 | Very high | 95.5 | Very high | 64 Ų | 64 | 58.4 Ų | 58.4 | 45% | 0.448 | 30% | 0.304 | S | S | . | . | trans | -58.6 | 139 | -179.2 | 64.3 | 0 | 0 | 0 | 0 | 112.6 | G145 C146 V147 | S143-G145 VanDerWaalsContact C-N 3.25Å; S143-G145 PolarHBondContact O-N 3.28Å; S143-C146 WeakPolarHBondContact O-CA 3.45Å; S143-C146 VanDerWaalsContact O-CB 3.32Å; S143-C146 WeakPolarHBondContact O-CB 3.46Å; S143-C146 PolarHBondContact O-N 2.91Å; S143-C146 WeakPolarHBondContact OG-CB 3.36Å; S143-V147 PolarHBondContact O-N 3.41Å; S143-V147 VanDerWaalsContact O-N 3.11Å | ||
| 144 | H | 96.8 | Very high | 95.4 | Very high | 102 Ų | 102 | 59.3 Ų | 59.3 | 47% | 0.472 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -55.8 | -37.7 | -174.4 | -177 | -111.7 | 0 | 0 | 0 | 113.2 | S137 V142 C146 V147 S148 | S137-H144 PolarHBondContact OG-N 3.35Å; V142-H144 PolarHBondContact O-N 2.96Å; H144-C146 VanDerWaalsContact C-N 3.3Å; H144-C146 PolarHBondContact O-N 2.77Å; H144-V147 PolarHBondContact O-N 3.09Å; H144-S148 WeakPolarHBondContact O-CB 3.49Å; H144-S148 PolarHBondContact O-N 2.92Å |
| 145 | G | 95.6 | Very high | 95.2 | Very high | 49 Ų | 49 | 64.3 Ų | 64.3 | 51% | 0.505 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -66.3 | -26.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | S143 K149 | S143-G145 VanDerWaalsContact C-N 3.25Å; S143-G145 PolarHBondContact O-N 3.28Å; G145-K149 WeakPolarHBondContact O-CB 3.44Å; G145-K149 PolarHBondContact O-N 3Å |
| 146 | C | 94.5 | Very high | 94.8 | Very high | 37 Ų | 37 | 68.1 Ų | 68.1 | 25% | 0.25 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -76.4 | -45.4 | 172.1 | -174.1 | 0 | 0 | 0 | 0 | 111 | V142 S143 H144 S148 K149 I150 | V142-C146 HydrophobicContact CG1-CB 3.72Å; S143-C146 WeakPolarHBondContact O-CA 3.45Å; S143-C146 VanDerWaalsContact O-CB 3.32Å; S143-C146 WeakPolarHBondContact O-CB 3.46Å; S143-C146 PolarHBondContact O-N 2.91Å; S143-C146 WeakPolarHBondContact OG-CB 3.36Å; H144-C146 VanDerWaalsContact C-N 3.3Å; H144-C146 PolarHBondContact O-N 2.77Å; C146-S148 PolarHBondContact O-N 2.89Å; C146-K149 PolarHBondContact O-N 3.29Å; C146-I150 WeakPolarHBondContact O-CG1 3.23Å; C146-I150 PolarHBondContact O-N 3.02Å |
| 147 | V | 96.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 71.9 Ų | 71.9 | 0% | 0 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -55.6 | -52.4 | 174 | 177.5 | 0 | 0 | 0 | 0 | 110.7 | I123 P133 I136 V142 S143 H144 K149 I150 L151 | I123-V147 HydrophobicContact CD1-CG2 4.18Å; I123-V147 HydrophobicContact CG1-CG2 4.44Å; I123-V147 HydrophobicContact CG2-CG1 4.02Å; P133-V147 HydrophobicContact CB-CG1 4.19Å; I136-V147 HydrophobicContact CB-CG1 4.31Å; I136-V147 HydrophobicContact CG2-CG1 4.01Å; I136-V147 HydrophobicContact CG2-CG2 4.46Å; V142-V147 HydrophobicContact CB-CG2 4.11Å; V142-V147 HydrophobicContact CG1-CG2 3.91Å; S143-V147 PolarHBondContact O-N 3.41Å; S143-V147 VanDerWaalsContact O-N 3.11Å; H144-V147 PolarHBondContact O-N 3.09Å; V147-K149 PolarHBondContact O-N 3.21Å; V147-I150 PolarHBondContact O-N 3.41Å; V147-L151 HydrophobicContact CG1-CD1 3.99Å; V147-L151 WeakPolarHBondContact O-CG 3.31Å; V147-L151 PolarHBondContact O-N 2.86Å |
| 148 | S | 96.3 | Very high | 94.1 | Very high | 64 Ų | 64 | 73.9 Ų | 73.9 | 45% | 0.448 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -57.7 | -45 | 177.7 | 179.7 | 0 | 0 | 0 | 0 | 112.4 | H144 C146 I150 L151 A152 | H144-S148 WeakPolarHBondContact O-CB 3.49Å; H144-S148 PolarHBondContact O-N 2.92Å; C146-S148 PolarHBondContact O-N 2.89Å; S148-I150 VanDerWaalsContact C-N 3.33Å; S148-I150 PolarHBondContact O-N 2.84Å; S148-L151 PolarHBondContact O-N 3.01Å; S148-A152 WeakPolarHBondContact O-CB 3.17Å; S148-A152 PolarHBondContact O-N 3.4Å |
| 149 | K | 95.1 | Very high | 93.7 | Very high | 153 Ų | 153 | 69 Ų | 69 | 67% | 0.665 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -65.5 | -32.1 | 178.2 | -172 | 176.2 | -62.9 | -177.9 | 0 | 113.3 | G145 C146 V147 R153 | G145-K149 WeakPolarHBondContact O-CB 3.44Å; G145-K149 PolarHBondContact O-N 3Å; C146-K149 PolarHBondContact O-N 3.29Å; V147-K149 PolarHBondContact O-N 3.21Å; K149-R153 WeakPolarHBondContact O-CG 3.4Å; K149-R153 PolarHBondContact O-N 2.86Å |
| 150 | I | 94.8 | Very high | 93.3 | Very high | 5 Ų | 5 | 65.1 Ų | 65.1 | 3% | 0.026 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -72 | -46.3 | 174.3 | -71.2 | 163.8 | 0 | 0 | 0 | 110.3 | L115 R120 I123 V124 C146 V147 S148 R153 Y154 | L115-I150 HydrophobicContact CD2-CD1 3.7Å; R120-I150 HydrophobicContact CG-CD1 4Å; I123-I150 HydrophobicContact CB-CG2 4.34Å; I123-I150 HydrophobicContact CD1-CD1 3.55Å; I123-I150 HydrophobicContact CG2-CB 4.22Å; I123-I150 HydrophobicContact CG2-CG2 3.81Å; V124-I150 HydrophobicContact CG2-CG2 4.33Å; C146-I150 WeakPolarHBondContact O-CG1 3.23Å; C146-I150 PolarHBondContact O-N 3.02Å; V147-I150 PolarHBondContact O-N 3.41Å; S148-I150 VanDerWaalsContact C-N 3.33Å; S148-I150 PolarHBondContact O-N 2.84Å; I150-R153 PolarHBondContact O-N 2.78Å; I150-Y154 WeakPolarHBondContact O-CB 3.35Å; I150-Y154 PolarHBondContact O-N 2.9Å |
| 151 | L | 95.3 | Very high | 93 | Very high | 18 Ų | 18 | 68.4 Ų | 68.4 | 9% | 0.094 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.2 | -40.6 | 179.5 | -66.1 | 177 | 0 | 0 | 0 | 112.4 | I123 V124 A127 P133 V147 S148 Y154 N155 | I123-L151 HydrophobicContact CG2-CD2 3.84Å; I123-L151 HydrophobicContact CG2-CG 3.95Å; V124-L151 HydrophobicContact CG2-CD2 4.29Å; A127-L151 HydrophobicContact CB-CD1 4.08Å; A127-L151 HydrophobicContact CB-CD2 3.52Å; A127-L151 HydrophobicContact CB-CG 4.48Å; P133-L151 HydrophobicContact CB-CD1 4.33Å; P133-L151 HydrophobicContact CG-CD1 4.03Å; V147-L151 HydrophobicContact CG1-CD1 3.99Å; V147-L151 WeakPolarHBondContact O-CG 3.31Å; V147-L151 PolarHBondContact O-N 2.86Å; S148-L151 PolarHBondContact O-N 3.01Å; L151-Y154 PolarHBondContact O-N 3.11Å; L151-N155 PolarHBondContact O-N 3.27Å; L151-N155 PolarHBondContact O-ND2 2.96Å |
| 152 | A | 93.8 | Very high | 92.4 | Very high | 43 Ų | 43 | 64.1 Ų | 64.1 | 36% | 0.355 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -57.6 | -53.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | S148 Y154 N155 E156 | S148-A152 WeakPolarHBondContact O-CB 3.17Å; S148-A152 PolarHBondContact O-N 3.4Å; A152-Y154 VanDerWaalsContact C-N 3.26Å; A152-Y154 PolarHBondContact O-N 2.94Å; A152-N155 PolarHBondContact O-N 3.28Å; A152-N155 VanDerWaalsContact O-N 3.11Å; A152-E156 VanDerWaalsContact O-CG 3.31Å; A152-E156 WeakPolarHBondContact O-CG 3.23Å; A152-E156 PolarHBondContact O-N 2.75Å |
| 153 | R | 92.4 | Very high | 91.8 | Very high | 108 Ų | 108 | 66.1 Ų | 66.1 | 41% | 0.408 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.8 | -34.3 | 177.4 | -67.5 | -67 | -61.2 | 140.8 | 3.4 | 113.2 | K149 I150 E156 T157 | K149-R153 WeakPolarHBondContact O-CG 3.4Å; K149-R153 PolarHBondContact O-N 2.86Å; I150-R153 PolarHBondContact O-N 2.78Å; R153-E156 WeakPolarHBondContact CD-OE2 3.42Å; R153-E156 IonicContact CZ-OE2 2.75Å; R153-E156 IonicContact NE-OE2 3.63Å; R153-E156 IonicContact NH1-OE2 3.98Å; R153-E156 PolarHBondContact NH1-OE2 3.05Å; R153-T157 PolarHBondContact NH1-OG1 3.13Å; R153-T157 WeakPolarHBondContact O-CB 3.42Å; R153-T157 PolarHBondContact O-N 3.35Å |
| 154 | Y | 93.7 | Very high | 91.1 | Very high | 69 Ų | 69 | 68.2 Ų | 68.2 | 27% | 0.271 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -69.5 | -41.8 | 175 | -176.5 | -101 | 0 | 0 | 0 | 112.2 | V124 Q128 I150 L151 A152 G158 I160 | V124-Y154 HydrophobicContact CG1-CD1 3.74Å; V124-Y154 HydrophobicContact CG1-CD2 3.99Å; V124-Y154 HydrophobicContact CG1-CE1 3.53Å; V124-Y154 HydrophobicContact CG1-CE2 3.8Å; V124-Y154 HydrophobicContact CG1-CG 3.97Å; V124-Y154 HydrophobicContact CG2-CD1 4.2Å; V124-Y154 HydrophobicContact CG2-CD2 3.97Å; V124-Y154 HydrophobicContact CG2-CG 3.77Å; Q128-Y154 PolarHBondContact NE2-OH 3.39Å; I150-Y154 WeakPolarHBondContact O-CB 3.35Å; I150-Y154 PolarHBondContact O-N 2.9Å; L151-Y154 PolarHBondContact O-N 3.11Å; A152-Y154 VanDerWaalsContact C-N 3.26Å; A152-Y154 PolarHBondContact O-N 2.94Å; Y154-G158 WeakPolarHBondContact CD2-O 3.49Å; Y154-G158 VanDerWaalsContact CE2-O 3.23Å; Y154-G158 WeakPolarHBondContact CE2-O 3.41Å; Y154-G158 WeakPolarHBondContact O-CA 3.45Å; Y154-G158 PolarHBondContact O-N 2.82Å; Y154-I160 HydrophobicContact CD2-CG2 3.74Å; Y154-I160 HydrophobicContact CE2-CG2 4.05Å |
| 155 | N | 92.1 | Very high | 89.7 | Confident | 137 Ų | 137 | 69.1 Ų | 69.1 | 73% | 0.733 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -69.5 | -32.4 | 175.3 | -75.5 | -88 | 0 | 0 | 0 | 112.5 | L151 A152 | L151-N155 PolarHBondContact O-N 3.27Å; L151-N155 PolarHBondContact O-ND2 2.96Å; A152-N155 PolarHBondContact O-N 3.28Å; A152-N155 VanDerWaalsContact O-N 3.11Å |
| 156 | E | 88.2 | Confident | 88.2 | Confident | 125 Ų | 125 | 70.2 Ų | 70.2 | 58% | 0.584 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -73.1 | -41 | 176.5 | -72.7 | 165 | -161.5 | 0 | 0 | 113.9 | A152 R153 | A152-E156 VanDerWaalsContact O-CG 3.31Å; A152-E156 WeakPolarHBondContact O-CG 3.23Å; A152-E156 PolarHBondContact O-N 2.75Å; R153-E156 WeakPolarHBondContact CD-OE2 3.42Å; R153-E156 IonicContact CZ-OE2 2.75Å; R153-E156 IonicContact NE-OE2 3.63Å; R153-E156 IonicContact NH1-OE2 3.98Å; R153-E156 PolarHBondContact NH1-OE2 3.05Å |
| 157 | T | 89.9 | Confident | 87 | Confident | 80 Ų | 80 | 72.1 Ų | 72.1 | 49% | 0.491 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -129 | -9.2 | -162.9 | -46.5 | 0 | 0 | 0 | 0 | 113.4 | R153 S159 | R153-T157 PolarHBondContact NH1-OG1 3.13Å; R153-T157 WeakPolarHBondContact O-CB 3.42Å; R153-T157 PolarHBondContact O-N 3.35Å; T157-S159 PolarHBondContact O-N 3.38Å |
| 158 | G | 89.5 | Confident | 85.6 | Confident | 49 Ų | 49 | 77.2 Ų | 77.2 | 51% | 0.505 | 49% | 0.489 | S | S | . | . | S | Bend | trans | 65.4 | -3 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | Y154 | Y154-G158 WeakPolarHBondContact CD2-O 3.49Å; Y154-G158 VanDerWaalsContact CE2-O 3.23Å; Y154-G158 WeakPolarHBondContact CE2-O 3.41Å; Y154-G158 WeakPolarHBondContact O-CA 3.45Å; Y154-G158 PolarHBondContact O-N 2.82Å |
| 159 | S | 86.3 | Confident | 84.1 | Confident | 44 Ų | 44 | 83.1 Ų | 83.1 | 31% | 0.308 | 51% | 0.506 | S | S | . | . | trans | -96 | 122.4 | -170.6 | -174.3 | 0 | 0 | 0 | 0 | 112.3 | T157 L161 | T157-S159 PolarHBondContact O-N 3.38Å; S159-L161 VanDerWaalsContact C-N 3.33Å; S159-L161 PolarHBondContact OG-N 3.42Å | ||
| 160 | I | 86.9 | Confident | 82.4 | Confident | 32 Ų | 32 | 80.9 Ų | 80.9 | 16% | 0.164 | 51% | 0.507 | C | S | . | . | trans | -80.5 | -11.4 | 172.2 | 58.1 | 85.5 | 0 | 0 | 0 | 113 | N117 R120 L121 V124 Y154 | N117-I160 VanDerWaalsContact OD1-CD1 3.23Å; N117-I160 WeakPolarHBondContact OD1-CD1 3.42Å; R120-I160 PolarHBondContact NE-O 2.84Å; R120-I160 PolarHBondContact NH2-O 3.25Å; L121-I160 HydrophobicContact CD2-CB 4.36Å; L121-I160 HydrophobicContact CD2-CD1 3.92Å; L121-I160 HydrophobicContact CD2-CG1 3.74Å; L121-I160 HydrophobicContact CD2-CG2 4.35Å; L121-I160 HydrophobicContact CG-CD1 4.17Å; L121-I160 HydrophobicContact CG-CG1 4.42Å; V124-I160 HydrophobicContact CG2-CG2 3.98Å; Y154-I160 HydrophobicContact CD2-CG2 3.74Å; Y154-I160 HydrophobicContact CE2-CG2 4.05Å | ||
| 161 | L | 87.9 | Confident | 80.9 | Confident | 108 Ų | 108 | 91.2 Ų | 91.2 | 57% | 0.565 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -69.6 | 146.9 | -178.7 | -64.7 | 175.3 | 0 | 0 | 0 | 111.3 | R120 S159 | R120-L161 PolarHBondContact NH2-O 2.84Å; R120-L161 VanDerWaalsContact NH2-O 3.13Å; S159-L161 VanDerWaalsContact C-N 3.33Å; S159-L161 PolarHBondContact OG-N 3.42Å |
| 162 | P | 85.1 | Confident | 79.3 | Confident | 51 Ų | 51 | 96.2 Ų | 96.2 | 33% | 0.331 | 58% | 0.577 | S | S | . | * | P | Polyproline II helix | trans | -62.7 | 146.2 | 166.1 | 29.2 | -34 | 0 | 0 | 0 | 109.7 | P114 | P114-P162 HydrophobicContact CB-CB 3.6Å; P114-P162 HydrophobicContact CB-CG 3.88Å; P114-P162 HydrophobicContact CG-CB 4.27Å; P114-P162 HydrophobicContact CG-CG 4.11Å |
| 163 | G | 81.9 | Confident | 78 | Confident | 50 Ų | 50 | 97.3 Ų | 97.3 | 52% | 0.515 | 58% | 0.58 | S | S | . | * | P | Polyproline II helix | trans | -62 | 160 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | I165 | G163-I165 PolarHBondContact O-N 3Š|
| 164 | A | 79.3 | Confident | 77.4 | Confident | 108 Ų | 108 | 95 Ų | 95 | 89% | 0.893 | 58% | 0.577 | S | S | * | * | trans | -61.8 | 101.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 165 | I | 69.4 | Low | 76.9 | Confident | 121 Ų | 121 | 96.7 Ų | 96.7 | 62% | 0.621 | 60% | 0.597 | S | S | * | * | trans | -87.9 | 119.2 | 174.5 | -64.7 | 164.3 | 0 | 0 | 0 | 107.5 | P114 G163 | P114-I165 HydrophobicContact CB-CD1 4.19Å; P114-I165 HydrophobicContact CG-CD1 4.45Å; G163-I165 PolarHBondContact O-N 3Å | ||
| 166 | G | 63 | Low | 76.6 | Confident | 72 Ų | 72 | 94.2 Ų | 94.2 | 74% | 0.742 | 58% | 0.583 | S | S | * | * | trans | 98.3 | 133.5 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 167 | G | 68.6 | Low | 76.7 | Confident | 77 Ų | 77 | 88.7 Ų | 88.7 | 79% | 0.794 | 56% | 0.558 | S | S | * | * | trans | 143.9 | 120.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 168 | S | 69.3 | Low | 76.7 | Confident | 107 Ų | 107 | 85.2 Ų | 85.2 | 75% | 0.748 | 54% | 0.537 | S | S | * | . | trans | -69.7 | 133.5 | 164.5 | 46.4 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 169 | K | 64.6 | Low | 76.8 | Confident | 189 Ų | 189 | 88.2 Ų | 88.2 | 82% | 0.822 | 54% | 0.536 | S | S | * | . | trans | -52 | 130.7 | 157.5 | -82.9 | -177.5 | 174.3 | 177.9 | 0 | 106.6 | R171 | K169-R171 PolarHBondContact O-N 3.5Š| ||
| 170 | P | 58 | Low | 77.1 | Confident | 106 Ų | 106 | 88.2 Ų | 88.2 | 69% | 0.688 | 53% | 0.531 | S | S | * | . | trans | -59.8 | 103 | -174.1 | 22.3 | -33 | 0 | 0 | 0 | 109.8 | V172 | P170-V172 PolarHBondContact O-N 3.42Š| ||
| 171 | R | 63.5 | Low | 77.4 | Confident | 222 Ų | 222 | 86.7 Ų | 86.7 | 84% | 0.838 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.8 | 115.7 | -173.2 | -67.6 | -171.1 | 70.4 | -174.5 | 1.1 | 109 | K169 T173 | K169-R171 PolarHBondContact O-N 3.5Å; R171-T173 PolarHBondContact O-N 3.38Å |
| 172 | V | 62.5 | Low | 77.5 | Confident | 122 Ų | 122 | 85.7 Ų | 85.7 | 74% | 0.739 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53 | 51.2 | 173.4 | -160.4 | 0 | 0 | 0 | 0 | 112.5 | P170 | P170-V172 PolarHBondContact O-N 3.42Š|
| 173 | T | 65.6 | Low | 77.9 | Confident | 67 Ų | 67 | 86.3 Ų | 86.3 | 41% | 0.411 | 51% | 0.513 | S | S | . | . | trans | -113.4 | 75.6 | 162.2 | -56.7 | 0 | 0 | 0 | 0 | 107.9 | R171 V178 | R171-T173 PolarHBondContact O-N 3.38Å; T173-V178 HydrophobicContact CG2-CG2 3.44Å; T173-V178 VanDerWaalsContact CG2-CG2 3.44Å | ||
| 174 | T | 80.6 | Confident | 78.5 | Confident | 59 Ų | 59 | 85.1 Ų | 85.1 | 36% | 0.362 | 49% | 0.493 | S | S | . | . | trans | -55.9 | 120.3 | -177.3 | -53.9 | 0 | 0 | 0 | 0 | 109.7 | N176 V177 V178 | T174-N176 HydrophobicContact CG2-CB 4.3Å; T174-N176 PolarHBondContact O-N 2.87Å; T174-N176 VanDerWaalsContact O-N 3.13Å; T174-V177 HydrophobicContact CG2-CG2 4.26Å; T174-V177 PolarHBondContact O-N 3.19Å; T174-V178 PolarHBondContact O-N 2.96Å | ||
| 175 | P | 82.8 | Confident | 79.1 | Confident | 104 Ų | 104 | 82.5 Ų | 82.5 | 68% | 0.675 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -62.2 | -29.7 | -169.8 | 22.4 | -32.9 | 0 | 0 | 0 | 112.6 | V178 K179 | P175-V178 PolarHBondContact O-N 3.22Å; P175-K179 PolarHBondContact O-N 3.41Å |
| 176 | N | 86.8 | Confident | 80.1 | Confident | 85 Ų | 85 | 82.8 Ų | 82.8 | 46% | 0.455 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60 | -46.3 | 174 | -166.1 | 44.4 | 0 | 0 | 0 | 112.7 | T174 V178 K179 H180 | T174-N176 HydrophobicContact CG2-CB 4.3Å; T174-N176 PolarHBondContact O-N 2.87Å; T174-N176 VanDerWaalsContact O-N 3.13Å; N176-V178 VanDerWaalsContact C-N 3.29Å; N176-V178 PolarHBondContact O-N 3.3Å; N176-K179 VanDerWaalsContact O-CB 3.32Å; N176-K179 WeakPolarHBondContact O-CB 3.2Å; N176-K179 PolarHBondContact O-N 2.97Å; N176-K179 VanDerWaalsContact O-N 3.1Å; N176-H180 PolarHBondContact O-N 3.39Å; N176-H180 VanDerWaalsContact O-N 3.17Å; N176-H180 PolarHBondContact O-ND1 2.92Å; N176-H180 PolarHBondContact OD1-CE1 2.82Å; N176-H180 VanDerWaalsContact OD1-CE1 3.25Å |
| 177 | V | 89.8 | Confident | 81.4 | Confident | 10 Ų | 10 | 82.1 Ų | 82.1 | 6% | 0.061 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -62.2 | -40.4 | 178.9 | -179.8 | 0 | 0 | 0 | 0 | 110.4 | T174 K179 H180 I181 L200 V205 C206 P212 | T174-V177 HydrophobicContact CG2-CG2 4.26Å; T174-V177 PolarHBondContact O-N 3.19Å; V177-K179 VanDerWaalsContact C-N 3.3Å; V177-K179 PolarHBondContact O-N 2.99Å; V177-H180 PolarHBondContact O-N 3.2Å; V177-I181 HydrophobicContact CG1-CD1 3.95Å; V177-I181 HydrophobicContact CG1-CG1 4.49Å; V177-I181 VanDerWaalsContact O-CG1 3.27Å; V177-I181 WeakPolarHBondContact O-CG1 3.47Å; V177-I181 PolarHBondContact O-N 3.13Å; V177-L200 HydrophobicContact CG1-CD1 4.03Å; V177-L200 HydrophobicContact CG1-CD2 4.12Å; V177-V205 HydrophobicContact CG2-CG1 4.31Å; V177-C206 WeakPolarHBondContact CG2-SG 3.35Å; V177-P212 HydrophobicContact CG1-CG 4.02Å |
| 178 | V | 90.3 | Very high | 82.4 | Confident | 7 Ų | 7 | 81.8 Ų | 81.8 | 4% | 0.042 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -69.4 | -26.6 | 177.4 | -176.2 | 0 | 0 | 0 | 0 | 112.9 | T173 T174 P175 N176 R182 I220 K224 | T173-V178 HydrophobicContact CG2-CG2 3.44Å; T173-V178 VanDerWaalsContact CG2-CG2 3.44Å; T174-V178 PolarHBondContact O-N 2.96Å; P175-V178 PolarHBondContact O-N 3.22Å; N176-V178 VanDerWaalsContact C-N 3.29Å; N176-V178 PolarHBondContact O-N 3.3Å; V178-R182 PolarHBondContact O-N 3.47Å; V178-I220 HydrophobicContact CG1-CG2 3.69Å; V178-I220 HydrophobicContact CG2-CD1 4.22Å; V178-I220 HydrophobicContact CG2-CG2 4.37Å; V178-K224 HydrophobicContact CG1-CD 3.42Å; V178-K224 VanDerWaalsContact CG1-CD 3.42Å |
| 179 | K | 91.2 | Very high | 83.4 | Confident | 112 Ų | 112 | 81.6 Ų | 81.6 | 49% | 0.487 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -64.7 | -56 | 170.8 | -167 | -146 | 172 | -120.9 | 0 | 109.6 | P175 N176 V177 I181 R182 D183 | P175-K179 PolarHBondContact O-N 3.41Å; N176-K179 VanDerWaalsContact O-CB 3.32Å; N176-K179 WeakPolarHBondContact O-CB 3.2Å; N176-K179 PolarHBondContact O-N 2.97Å; N176-K179 VanDerWaalsContact O-N 3.1Å; V177-K179 VanDerWaalsContact C-N 3.3Å; V177-K179 PolarHBondContact O-N 2.99Å; K179-I181 VanDerWaalsContact C-N 3.34Å; K179-I181 PolarHBondContact O-N 3.22Å; K179-R182 WeakPolarHBondContact O-CA 3.26Å; K179-R182 WeakPolarHBondContact O-CB 3.37Å; K179-R182 PolarHBondContact O-N 2.88Å; K179-D183 WeakPolarHBondContact CE-OD2 3.48Å; K179-D183 IonicContact NZ-OD2 3.72Å; K179-D183 PolarHBondContact NZ-OD2 3.32Å; K179-D183 PolarHBondContact O-N 3.37Å |
| 180 | H | 92.1 | Very high | 84.6 | Confident | 43 Ų | 43 | 75.5 Ų | 75.5 | 20% | 0.199 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -58.2 | -41.5 | 179.5 | -65.4 | 80.3 | 0 | 0 | 0 | 112.6 | N176 V177 R182 D183 Y184 L200 V205 | N176-H180 PolarHBondContact O-N 3.39Å; N176-H180 VanDerWaalsContact O-N 3.17Å; N176-H180 PolarHBondContact O-ND1 2.92Å; N176-H180 PolarHBondContact OD1-CE1 2.82Å; N176-H180 VanDerWaalsContact OD1-CE1 3.25Å; V177-H180 PolarHBondContact O-N 3.2Å; H180-R182 VanDerWaalsContact C-N 3.26Å; H180-R182 PolarHBondContact O-N 3.29Å; H180-D183 PolarHBondContact O-N 3.44Å; H180-D183 VanDerWaalsContact O-N 3.08Å; H180-Y184 HydrophobicContact CB-CE2 3.82Å; H180-Y184 WeakPolarHBondContact O-CD2 3.48Å; H180-Y184 PolarHBondContact O-N 3.49Å; H180-L200 HydrophobicContact CB-CD2 3.91Å; H180-V205 HydrophobicContact CB-CG1 4.16Å |
| 181 | I | 92.5 | Very high | 86.3 | Confident | 1 Ų | 1 | 70.8 Ų | 70.8 | 1% | 0.005 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -55.4 | -38.2 | 172.9 | -70.9 | 168.1 | 0 | 0 | 0 | 112.7 | V177 K179 K185 I196 L200 P212 I217 I220 L221 | V177-I181 HydrophobicContact CG1-CD1 3.95Å; V177-I181 HydrophobicContact CG1-CG1 4.49Å; V177-I181 VanDerWaalsContact O-CG1 3.27Å; V177-I181 WeakPolarHBondContact O-CG1 3.47Å; V177-I181 PolarHBondContact O-N 3.13Å; K179-I181 VanDerWaalsContact C-N 3.34Å; K179-I181 PolarHBondContact O-N 3.22Å; I181-K185 PolarHBondContact O-N 2.9Å; I181-I196 HydrophobicContact CB-CG2 4.38Å; I181-I196 HydrophobicContact CG1-CG2 3.84Å; I181-I196 HydrophobicContact CG2-CG2 4.37Å; I181-L200 HydrophobicContact CD1-CD1 4.15Å; I181-L200 HydrophobicContact CG1-CD1 3.81Å; I181-P212 HydrophobicContact CD1-CG 4.25Å; I181-I217 HydrophobicContact CD1-CG1 4.18Å; I181-I217 HydrophobicContact CG2-CG2 4.29Å; I181-I220 HydrophobicContact CD1-CD1 3.99Å; I181-I220 HydrophobicContact CD1-CG2 4.36Å; I181-I220 HydrophobicContact CG2-CG2 3.89Å; I181-L221 HydrophobicContact CG2-CD2 3.67Å; I181-L221 HydrophobicContact CG2-CG 4.27Å |
| 182 | R | 91.2 | Very high | 87.8 | Confident | 87 Ų | 87 | 66.3 Ų | 66.3 | 33% | 0.328 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -70.9 | -49.9 | 173.2 | 174.6 | -170.3 | -73.4 | 171 | -11.2 | 110.3 | V178 K179 H180 Y184 K185 Q186 | V178-R182 PolarHBondContact O-N 3.47Å; K179-R182 WeakPolarHBondContact O-CA 3.26Å; K179-R182 WeakPolarHBondContact O-CB 3.37Å; K179-R182 PolarHBondContact O-N 2.88Å; H180-R182 VanDerWaalsContact C-N 3.26Å; H180-R182 PolarHBondContact O-N 3.29Å; R182-Y184 VanDerWaalsContact C-N 3.32Å; R182-Y184 PolarHBondContact O-N 3.23Å; R182-K185 CarbonylContact O-C 3.57Å; R182-K185 PolarHBondContact O-N 3.08Å; R182-Q186 WeakPolarHBondContact O-CB 3.04Å; R182-Q186 PolarHBondContact O-N 2.97Å |
| 183 | D | 93.2 | Very high | 89.3 | Confident | 64 Ų | 64 | 61.1 Ų | 61.1 | 34% | 0.342 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -58.8 | -42.8 | -172.3 | -59.9 | -9.7 | 0 | 0 | 0 | 110.7 | K179 H180 Q186 G187 | K179-D183 WeakPolarHBondContact CE-OD2 3.48Å; K179-D183 IonicContact NZ-OD2 3.72Å; K179-D183 PolarHBondContact NZ-OD2 3.32Å; K179-D183 PolarHBondContact O-N 3.37Å; H180-D183 PolarHBondContact O-N 3.44Å; H180-D183 VanDerWaalsContact O-N 3.08Å; D183-Q186 PolarHBondContact O-N 2.98Å; D183-G187 PolarHBondContact O-N 2.71Å; D183-G187 VanDerWaalsContact O-N 3.16Å |
| 184 | Y | 94.1 | Very high | 90.7 | Very high | 25 Ų | 25 | 64.2 Ų | 64.2 | 10% | 0.098 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63.7 | -42.8 | 172.8 | -54.3 | -52.6 | 0 | 0 | 0 | 113.3 | H180 R182 Q186 G187 D188 I196 R199 L200 D203 | H180-Y184 HydrophobicContact CB-CE2 3.82Å; H180-Y184 WeakPolarHBondContact O-CD2 3.48Å; H180-Y184 PolarHBondContact O-N 3.49Å; R182-Y184 VanDerWaalsContact C-N 3.32Å; R182-Y184 PolarHBondContact O-N 3.23Å; Y184-Q186 PolarHBondContact O-N 2.92Å; Y184-G187 PolarHBondContact O-N 3.21Å; Y184-D188 PolarHBondContact O-N 2.74Å; Y184-I196 HydrophobicContact CD2-CG2 4.29Å; Y184-R199 HydrophobicContact CE1-CB 4.32Å; Y184-R199 HydrophobicContact CE2-CB 4.29Å; Y184-L200 HydrophobicContact CE2-CD2 3.86Å; Y184-L200 HydrophobicContact CE2-CG 4.01Å; Y184-D203 VanDerWaalsContact CE1-OD2 3.22Å; Y184-D203 WeakPolarHBondContact CE1-OD2 3.37Å; Y184-D203 VanDerWaalsContact CZ-OD2 3.26Å; Y184-D203 VanDerWaalsContact OH-CG 3.32Å; Y184-D203 PolarHBondContact OH-OD2 3.49Å |
| 185 | K | 91.9 | Very high | 91.4 | Very high | 52 Ų | 52 | 64.2 Ų | 64.2 | 23% | 0.226 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -72.1 | -20.8 | -179.9 | -169 | 58.9 | 166.5 | 177 | 0 | 112.7 | I181 R182 D188 P189 I191 L221 | I181-K185 PolarHBondContact O-N 2.9Å; R182-K185 CarbonylContact O-C 3.57Å; R182-K185 PolarHBondContact O-N 3.08Å; K185-D188 CarbonylContact O-C 3.54Å; K185-P189 VanDerWaalsContact CE-O 3.32Å; K185-P189 WeakPolarHBondContact CE-O 3.49Å; K185-P189 PolarHBondContact NZ-O 2.78Å; K185-I191 HydrophobicContact CB-CG2 4.42Å; K185-I191 HydrophobicContact CD-CG2 3.62Å; K185-I191 PolarHBondContact NZ-O 3.46Å; K185-L221 HydrophobicContact CB-CD2 4Å; K185-L221 HydrophobicContact CG-CD2 3.95Å |
| 186 | Q | 91.1 | Very high | 92 | Very high | 128 Ų | 128 | 59.3 Ų | 59.3 | 60% | 0.598 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -81.9 | -32.2 | 177.3 | -172.7 | 58.4 | 78.5 | 0 | 0 | 112.2 | R182 D183 Y184 | R182-Q186 WeakPolarHBondContact O-CB 3.04Å; R182-Q186 PolarHBondContact O-N 2.97Å; D183-Q186 PolarHBondContact O-N 2.98Å; Y184-Q186 PolarHBondContact O-N 2.92Å |
| 187 | G | 90.1 | Very high | 92.3 | Very high | 58 Ų | 58 | 59.4 Ų | 59.4 | 60% | 0.598 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -74.3 | -52.8 | 168 | 0 | 0 | 0 | 0 | 0 | 112 | D183 Y184 P189 | D183-G187 PolarHBondContact O-N 2.71Å; D183-G187 VanDerWaalsContact O-N 3.16Å; Y184-G187 PolarHBondContact O-N 3.21Å; G187-P189 WeakPolarHBondContact O-CD 3.46Å |
| 188 | D | 89.8 | Confident | 92.5 | Very high | 70 Ų | 70 | 61.5 Ų | 61.5 | 37% | 0.374 | 32% | 0.319 | S | S | . | . | trans | -110.7 | 87.6 | -178 | -67.7 | -49.9 | 0 | 0 | 0 | 111.2 | Y184 K185 G190 I191 R199 | Y184-D188 PolarHBondContact O-N 2.74Å; K185-D188 CarbonylContact O-C 3.54Å; D188-G190 PolarHBondContact O-N 3.42Å; D188-I191 HydrophobicContact CB-CB 3.82Å; D188-I191 HydrophobicContact CB-CG2 4.14Å; D188-I191 WeakPolarHBondContact O-CB 3.48Å; D188-I191 WeakPolarHBondContact O-CG2 3.45Å; D188-I191 PolarHBondContact O-N 3.35Å; D188-R199 IonicContact OD2-CZ 2.72Å; D188-R199 IonicContact OD2-NH1 2.75Å; D188-R199 PolarHBondContact OD2-NH1 3.15Å; D188-R199 IonicContact OD2-NH2 3.18Å; D188-R199 PolarHBondContact OD2-NH2 3.2Å | ||
| 189 | P | 89.3 | Confident | 92.8 | Very high | 103 Ų | 103 | 65.9 Ų | 65.9 | 67% | 0.669 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.7 | -17.7 | 178.4 | 25 | -34.2 | 0 | 0 | 0 | 113.2 | K185 G187 | K185-P189 VanDerWaalsContact CE-O 3.32Å; K185-P189 WeakPolarHBondContact CE-O 3.49Å; K185-P189 PolarHBondContact NZ-O 2.78Å; G187-P189 WeakPolarHBondContact O-CD 3.46Å |
| 190 | G | 91.2 | Very high | 92.8 | Very high | 60 Ų | 60 | 60.5 Ų | 60.5 | 62% | 0.619 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.4 | -28.7 | 170.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | D188 F192 | D188-G190 PolarHBondContact O-N 3.42Å; G190-F192 PolarHBondContact O-N 3.24Å |
| 191 | I | 93.6 | Very high | 92.9 | Very high | 7 Ų | 7 | 61.7 Ų | 61.7 | 4% | 0.036 | 32% | 0.318 | C | S | . | . | trans | -58.2 | 131.5 | -162.2 | -162.2 | 178.3 | 0 | 0 | 0 | 114 | K185 D188 E195 I196 | K185-I191 HydrophobicContact CB-CG2 4.42Å; K185-I191 HydrophobicContact CD-CG2 3.62Å; K185-I191 PolarHBondContact NZ-O 3.46Å; D188-I191 HydrophobicContact CB-CB 3.82Å; D188-I191 HydrophobicContact CB-CG2 4.14Å; D188-I191 WeakPolarHBondContact O-CB 3.48Å; D188-I191 WeakPolarHBondContact O-CG2 3.45Å; D188-I191 PolarHBondContact O-N 3.35Å; I191-E195 WeakPolarHBondContact CA-OE2 3.22Å; I191-E195 HydrophobicContact CD1-CB 3.98Å; I191-E195 HydrophobicContact CG1-CB 3.5Å; I191-E195 VanDerWaalsContact CG1-CB 3.5Å; I191-E195 HydrophobicContact CG1-CG 4.43Å; I191-E195 VanDerWaalsContact CG1-OE2 3.27Å; I191-E195 WeakPolarHBondContact CG1-OE2 3.5Å; I191-I196 HydrophobicContact CD1-CG1 3.92Å; I191-I196 HydrophobicContact CG1-CG1 4.1Å; I191-I196 HydrophobicContact CG2-CD1 3.92Å; I191-I196 HydrophobicContact CG2-CG1 3.8Å | ||
| 192 | F | 94.4 | Very high | 92.9 | Very high | 128 Ų | 128 | 65.6 Ų | 65.6 | 56% | 0.561 | 35% | 0.351 | S | S | * | . | trans | -79.6 | 157.7 | -179.8 | -67.8 | -76.4 | 0 | 0 | 0 | 112.3 | G190 W194 E195 I196 | G190-F192 PolarHBondContact O-N 3.24Å; F192-W194 HydrophobicContact CB-CG 4.37Å; F192-W194 AromaticContact CG-NE1 3.86Å; F192-W194 PolarHBondContact O-N 3.02Å; F192-W194 VanDerWaalsContact O-N 3.14Å; F192-E195 HydrophobicContact CB-CG 4.36Å; F192-E195 WeakPolarHBondContact CD2-OE2 3.3Å; F192-E195 PolarHBondContact N-OE2 3.09Å; F192-E195 PolarHBondContact O-N 3.49Å; F192-I196 WeakPolarHBondContact O-CG1 3.44Å; F192-I196 PolarHBondContact O-N 3.07Å | ||
| 193 | A | 94.6 | Very high | 92.9 | Very high | 13 Ų | 13 | 66 Ų | 66 | 11% | 0.107 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -67.8 | -12.6 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | V214 I217 S218 | A193-V214 HydrophobicContact CB-CG1 3.73Å; A193-I217 HydrophobicContact CB-CB 4.23Å; A193-I217 HydrophobicContact CB-CG2 3.86Å; A193-I217 WeakPolarHBondContact O-CD1 3.41Å; A193-S218 VanDerWaalsContact CB-OG 3.3Å; A193-S218 WeakPolarHBondContact CB-OG 3.38Å |
| 194 | W | 94.9 | Very high | 92.7 | Very high | 132 Ų | 132 | 66 Ų | 66 | 50% | 0.5 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -86.2 | -41.7 | 171 | 67.1 | -93.6 | 0 | 0 | 0 | 111.4 | F192 I196 R197 D198 V214 | F192-W194 HydrophobicContact CB-CG 4.37Å; F192-W194 AromaticContact CG-NE1 3.86Å; F192-W194 PolarHBondContact O-N 3.02Å; F192-W194 VanDerWaalsContact O-N 3.14Å; W194-I196 VanDerWaalsContact C-N 3.31Å; W194-I196 PolarHBondContact O-N 3.4Å; W194-R197 WeakPolarHBondContact O-CA 3.24Å; W194-R197 VanDerWaalsContact O-CB 3.22Å; W194-R197 WeakPolarHBondContact O-CB 3.02Å; W194-R197 PolarHBondContact O-N 3.19Å; W194-D198 PolarHBondContact O-N 2.89Å; W194-V214 HydrophobicContact CB-CG2 4.32Å |
| 195 | E | 95.6 | Very high | 92.4 | Very high | 60 Ų | 60 | 66 Ų | 66 | 28% | 0.28 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -60.4 | -40.6 | 173.1 | -64.3 | 166.1 | 157.4 | 0 | 0 | 111.4 | I191 F192 R197 D198 R199 | I191-E195 WeakPolarHBondContact CA-OE2 3.22Å; I191-E195 HydrophobicContact CD1-CB 3.98Å; I191-E195 HydrophobicContact CG1-CB 3.5Å; I191-E195 VanDerWaalsContact CG1-CB 3.5Å; I191-E195 HydrophobicContact CG1-CG 4.43Å; I191-E195 VanDerWaalsContact CG1-OE2 3.27Å; I191-E195 WeakPolarHBondContact CG1-OE2 3.5Å; F192-E195 HydrophobicContact CB-CG 4.36Å; F192-E195 WeakPolarHBondContact CD2-OE2 3.3Å; F192-E195 PolarHBondContact N-OE2 3.09Å; F192-E195 PolarHBondContact O-N 3.49Å; E195-R197 VanDerWaalsContact C-N 3.33Å; E195-R197 PolarHBondContact O-N 3.02Å; E195-D198 PolarHBondContact O-N 2.86Å; E195-R199 PolarHBondContact O-N 3.11Å |
| 196 | I | 94.2 | Very high | 92.2 | Very high | 0 Ų | 0 | 63.8 Ų | 63.8 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -59.9 | -41.7 | 171.5 | -67.6 | 169.7 | 0 | 0 | 0 | 111.5 | I181 Y184 I191 F192 W194 D198 L200 I217 L221 | I181-I196 HydrophobicContact CB-CG2 4.38Å; I181-I196 HydrophobicContact CG1-CG2 3.84Å; I181-I196 HydrophobicContact CG2-CG2 4.37Å; Y184-I196 HydrophobicContact CD2-CG2 4.29Å; I191-I196 HydrophobicContact CD1-CG1 3.92Å; I191-I196 HydrophobicContact CG1-CG1 4.1Å; I191-I196 HydrophobicContact CG2-CD1 3.92Å; I191-I196 HydrophobicContact CG2-CG1 3.8Å; F192-I196 WeakPolarHBondContact O-CG1 3.44Å; F192-I196 PolarHBondContact O-N 3.07Å; W194-I196 VanDerWaalsContact C-N 3.31Å; W194-I196 PolarHBondContact O-N 3.4Å; I196-D198 PolarHBondContact O-N 3.27Å; I196-L200 HydrophobicContact CG2-CD1 4.15Å; I196-L200 WeakPolarHBondContact O-CB 3.29Å; I196-L200 VanDerWaalsContact O-CG 3.25Å; I196-L200 WeakPolarHBondContact O-CG 3.27Å; I196-L200 PolarHBondContact O-N 3.23Å; I196-I217 HydrophobicContact CB-CG2 4.15Å; I196-I217 HydrophobicContact CD1-CG2 4.15Å; I196-I217 HydrophobicContact CG2-CD1 4.37Å; I196-I217 HydrophobicContact CG2-CG2 3.81Å; I196-L221 HydrophobicContact CD1-CD1 3.86Å; I196-L221 HydrophobicContact CD1-CD2 4.11Å; I196-L221 HydrophobicContact CD1-CG 4.46Å |
| 197 | R | 93.9 | Very high | 92 | Very high | 88 Ų | 88 | 63 Ų | 63 | 33% | 0.332 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -60.9 | -38.7 | 178 | -172.1 | -159.6 | 64.5 | -165.9 | -11.6 | 110.6 | W194 E195 L201 V211 I217 | W194-R197 WeakPolarHBondContact O-CA 3.24Å; W194-R197 VanDerWaalsContact O-CB 3.22Å; W194-R197 WeakPolarHBondContact O-CB 3.02Å; W194-R197 PolarHBondContact O-N 3.19Å; E195-R197 VanDerWaalsContact C-N 3.33Å; E195-R197 PolarHBondContact O-N 3.02Å; R197-L201 WeakPolarHBondContact O-CG 3.43Å; R197-L201 PolarHBondContact O-N 3.12Å; R197-V211 HydrophobicContact CG-CG2 3.54Å; R197-I217 HydrophobicContact CB-CD1 3.63Å; R197-I217 HydrophobicContact CG-CD1 4.17Å |
| 198 | D | 94.6 | Very high | 91.8 | Very high | 54 Ų | 54 | 68.1 Ų | 68.1 | 29% | 0.289 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -85 | -32.6 | -172.7 | -61.6 | -16.5 | 0 | 0 | 0 | 111.5 | W194 E195 I196 L201 A202 | W194-D198 PolarHBondContact O-N 2.89Å; E195-D198 PolarHBondContact O-N 2.86Å; I196-D198 PolarHBondContact O-N 3.27Å; D198-L201 PolarHBondContact O-N 3.49Å; D198-A202 PolarHBondContact O-N 3Å |
| 199 | R | 94.6 | Very high | 91.6 | Very high | 98 Ų | 98 | 75.3 Ų | 75.3 | 37% | 0.37 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.3 | -40.6 | 164.2 | -71 | -168.7 | -173.5 | 175.8 | 7 | 112.6 | Y184 D188 E195 L201 A202 D203 | Y184-R199 HydrophobicContact CE1-CB 4.32Å; Y184-R199 HydrophobicContact CE2-CB 4.29Å; D188-R199 IonicContact OD2-CZ 2.72Å; D188-R199 IonicContact OD2-NH1 2.75Å; D188-R199 PolarHBondContact OD2-NH1 3.15Å; D188-R199 IonicContact OD2-NH2 3.18Å; D188-R199 PolarHBondContact OD2-NH2 3.2Å; E195-R199 PolarHBondContact O-N 3.11Å; R199-L201 PolarHBondContact O-N 2.96Å; R199-A202 PolarHBondContact O-N 2.69Å; R199-A202 VanDerWaalsContact O-N 3.17Å; R199-D203 WeakPolarHBondContact O-CB 3.4Å; R199-D203 PolarHBondContact O-N 3.31Å |
| 200 | L | 93.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 73.3 Ų | 73.3 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61.1 | -26.6 | 174.8 | -78 | 169.9 | 0 | 0 | 0 | 113.8 | V177 H180 I181 Y184 I196 V205 C206 P212 | V177-L200 HydrophobicContact CG1-CD1 4.03Å; V177-L200 HydrophobicContact CG1-CD2 4.12Å; H180-L200 HydrophobicContact CB-CD2 3.91Å; I181-L200 HydrophobicContact CD1-CD1 4.15Å; I181-L200 HydrophobicContact CG1-CD1 3.81Å; Y184-L200 HydrophobicContact CE2-CD2 3.86Å; Y184-L200 HydrophobicContact CE2-CG 4.01Å; I196-L200 HydrophobicContact CG2-CD1 4.15Å; I196-L200 WeakPolarHBondContact O-CB 3.29Å; I196-L200 VanDerWaalsContact O-CG 3.25Å; I196-L200 WeakPolarHBondContact O-CG 3.27Å; I196-L200 PolarHBondContact O-N 3.23Å; L200-V205 HydrophobicContact CD2-CB 3.82Å; L200-V205 HydrophobicContact CD2-CG1 3.64Å; L200-V205 PolarHBondContact O-N 3.39Å; L200-C206 HydrophobicContact CB-CB 4.42Å; L200-C206 PolarHBondContact O-N 3.17Å; L200-P212 HydrophobicContact CD1-CG 4.2Å |
| 201 | L | 92.6 | Very high | 91.2 | Very high | 67 Ų | 67 | 72.1 Ų | 72.1 | 35% | 0.351 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -81.6 | -41.9 | 173.7 | -70.5 | 163.5 | 0 | 0 | 0 | 111.1 | R197 D198 R199 G204 C206 V211 | R197-L201 WeakPolarHBondContact O-CG 3.43Å; R197-L201 PolarHBondContact O-N 3.12Å; D198-L201 PolarHBondContact O-N 3.49Å; R199-L201 PolarHBondContact O-N 2.96Å; L201-G204 PolarHBondContact O-N 3.35Å; L201-C206 WeakPolarHBondContact CD2-O 3.32Å; L201-V211 HydrophobicContact CD2-CB 4.11Å; L201-V211 HydrophobicContact CD2-CG1 4.25Å; L201-V211 HydrophobicContact CD2-CG2 4.34Å; L201-V211 HydrophobicContact CG-CB 4.46Å; L201-V211 HydrophobicContact CG-CG2 4.14Å |
| 202 | A | 93.8 | Very high | 91 | Very high | 84 Ų | 84 | 72.8 Ų | 72.8 | 69% | 0.694 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -64.4 | -44.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.7 | D198 R199 G204 | D198-A202 PolarHBondContact O-N 3Å; R199-A202 PolarHBondContact O-N 2.69Å; R199-A202 VanDerWaalsContact O-N 3.17Å; A202-G204 PolarHBondContact O-N 3.28Å |
| 203 | D | 91 | Very high | 90.9 | Very high | 95 Ų | 95 | 70.2 Ų | 70.2 | 51% | 0.508 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | 3.3 | -179.8 | -66.1 | 5.8 | 0 | 0 | 0 | 112.9 | Y184 R199 V205 | Y184-D203 VanDerWaalsContact CE1-OD2 3.22Å; Y184-D203 WeakPolarHBondContact CE1-OD2 3.37Å; Y184-D203 VanDerWaalsContact CZ-OD2 3.26Å; Y184-D203 VanDerWaalsContact OH-CG 3.32Å; Y184-D203 PolarHBondContact OH-OD2 3.49Å; R199-D203 WeakPolarHBondContact O-CB 3.4Å; R199-D203 PolarHBondContact O-N 3.31Å; D203-V205 HydrophobicContact CB-CG2 3.88Å; D203-V205 PolarHBondContact O-N 2.86Å; D203-V205 VanDerWaalsContact O-N 3.14Å |
| 204 | G | 88.7 | Confident | 90.8 | Very high | 64 Ų | 64 | 72.1 Ų | 72.1 | 66% | 0.66 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 67.4 | 9.3 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | L201 A202 C206 | L201-G204 PolarHBondContact O-N 3.35Å; A202-G204 PolarHBondContact O-N 3.28Å; G204-C206 VanDerWaalsContact C-N 3.27Å; G204-C206 PolarHBondContact O-N 3.01Å |
| 205 | V | 87.2 | Confident | 90.7 | Very high | 25 Ų | 25 | 70 Ų | 70 | 15% | 0.152 | 38% | 0.38 | C | S | . | . | S | Bend | trans | -69.3 | -27 | -177.7 | -178.1 | 0 | 0 | 0 | 0 | 111.8 | V177 H180 L200 D203 | V177-V205 HydrophobicContact CG2-CG1 4.31Å; H180-V205 HydrophobicContact CB-CG1 4.16Å; L200-V205 HydrophobicContact CD2-CB 3.82Å; L200-V205 HydrophobicContact CD2-CG1 3.64Å; L200-V205 PolarHBondContact O-N 3.39Å; D203-V205 HydrophobicContact CB-CG2 3.88Å; D203-V205 PolarHBondContact O-N 2.86Å; D203-V205 VanDerWaalsContact O-N 3.14Å |
| 206 | C | 87.4 | Confident | 90.4 | Very high | 5 Ų | 5 | 69.1 Ų | 69.1 | 3% | 0.034 | 38% | 0.381 | C | S | . | . | S | Bend | trans | -137.1 | 136.2 | 174.3 | -78.7 | 0 | 0 | 0 | 0 | 112 | V177 L200 L201 G204 V211 | V177-C206 WeakPolarHBondContact CG2-SG 3.35Å; L200-C206 HydrophobicContact CB-CB 4.42Å; L200-C206 PolarHBondContact O-N 3.17Å; L201-C206 WeakPolarHBondContact CD2-O 3.32Å; G204-C206 VanDerWaalsContact C-N 3.27Å; G204-C206 PolarHBondContact O-N 3.01Å; C206-V211 HydrophobicContact CB-CB 3.8Å; C206-V211 HydrophobicContact CB-CG2 4.05Å |
| 207 | D | 88.4 | Confident | 90.3 | Very high | 113 Ų | 113 | 69.1 Ų | 69.1 | 60% | 0.604 | 38% | 0.381 | S | S | * | . | trans | -70.4 | 161.8 | 163 | -53.2 | -82.4 | 0 | 0 | 0 | 112.5 | Y209 N210 V211 | D207-Y209 PolarHBondContact O-N 3.33Å; D207-N210 HydrophobicContact CB-CB 4.27Å; D207-N210 PolarHBondContact O-N 3.49Å; D207-V211 WeakPolarHBondContact O-CB 3.32Å; D207-V211 PolarHBondContact O-N 3.29Å | ||
| 208 | K | 86 | Confident | 90.2 | Very high | 165 Ų | 165 | 66.4 Ų | 66.4 | 72% | 0.717 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.7 | -17.7 | 170.7 | -170.6 | 169.6 | -176.5 | -70 | 0 | 115 | ||
| 209 | Y | 84.1 | Confident | 90 | Very high | 220 Ų | 220 | 71.7 Ų | 71.7 | 86% | 0.863 | 39% | 0.391 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.7 | -13.7 | 176.7 | -58.1 | -79.6 | 0 | 0 | 0 | 114.3 | D207 | D207-Y209 PolarHBondContact O-N 3.33Š|
| 210 | N | 84.3 | Confident | 89.8 | Confident | 62 Ų | 62 | 68.2 Ų | 68.2 | 33% | 0.332 | 38% | 0.379 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.8 | -11.6 | -178.7 | -177.4 | 53.4 | 0 | 0 | 0 | 112.4 | D207 | D207-N210 HydrophobicContact CB-CB 4.27Å; D207-N210 PolarHBondContact O-N 3.49Å |
| 211 | V | 88.2 | Confident | 89.6 | Confident | 34 Ų | 34 | 69.4 Ų | 69.4 | 21% | 0.206 | 39% | 0.386 | C | S | . | . | P | Polyproline II helix | trans | -63.7 | 128.2 | 179.3 | 71.3 | 0 | 0 | 0 | 0 | 111.5 | R197 L201 C206 D207 | R197-V211 HydrophobicContact CG-CG2 3.54Å; L201-V211 HydrophobicContact CD2-CB 4.11Å; L201-V211 HydrophobicContact CD2-CG1 4.25Å; L201-V211 HydrophobicContact CD2-CG2 4.34Å; L201-V211 HydrophobicContact CG-CB 4.46Å; L201-V211 HydrophobicContact CG-CG2 4.14Å; C206-V211 HydrophobicContact CB-CB 3.8Å; C206-V211 HydrophobicContact CB-CG2 4.05Å; D207-V211 WeakPolarHBondContact O-CB 3.32Å; D207-V211 PolarHBondContact O-N 3.29Å |
| 212 | P | 89.3 | Confident | 89.3 | Confident | 22 Ų | 22 | 74.1 Ų | 74.1 | 14% | 0.143 | 40% | 0.399 | C | S | . | . | P | Polyproline II helix | trans | -67.8 | 146.2 | 178.9 | 26 | -33.2 | 0 | 0 | 0 | 111.5 | V177 I181 L200 I217 | V177-P212 HydrophobicContact CG1-CG 4.02Å; I181-P212 HydrophobicContact CD1-CG 4.25Å; L200-P212 HydrophobicContact CD1-CG 4.2Å; P212-I217 HydrophobicContact CB-CG1 4.09Å; P212-I217 HydrophobicContact CG-CD1 4.12Å; P212-I217 HydrophobicContact CG-CG1 3.75Å |
| 213 | S | 91.6 | Very high | 88.6 | Confident | 74 Ų | 74 | 75.7 Ų | 75.7 | 52% | 0.517 | 40% | 0.396 | S | S | . | . | P | Polyproline II helix | trans | -64 | 152.7 | 175.3 | 69.6 | 0 | 0 | 0 | 0 | 111.7 | S215 S216 I217 | S213-S215 PolarHBondContact O-N 2.85Å; S213-S215 VanDerWaalsContact O-N 3.12Å; S213-S216 CarbonylContact O-C 3.33Å; S213-S216 WeakPolarHBondContact O-CA 3.47Å; S213-S216 VanDerWaalsContact O-CB 3.28Å; S213-S216 WeakPolarHBondContact O-CB 3.32Å; S213-S216 PolarHBondContact O-N 3.44Å; S213-S216 PolarHBondContact OG-N 3.24Å; S213-I217 PolarHBondContact O-N 3.11Å |
| 214 | V | 92.9 | Very high | 87.6 | Confident | 53 Ų | 53 | 75.7 Ų | 75.7 | 32% | 0.321 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -54.7 | -34.4 | -179.9 | -178.1 | 0 | 0 | 0 | 0 | 112.3 | A193 W194 S218 | A193-V214 HydrophobicContact CB-CG1 3.73Å; W194-V214 HydrophobicContact CB-CG2 4.32Å; V214-S218 WeakPolarHBondContact O-CB 3.49Å; V214-S218 PolarHBondContact O-N 3.03Å; V214-S218 PolarHBondContact O-OG 3.28Å |
| 215 | S | 93.1 | Very high | 86.4 | Confident | 86 Ų | 86 | 74.9 Ų | 74.9 | 60% | 0.601 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -69.7 | -38.5 | 173.8 | -177.3 | 0 | 0 | 0 | 0 | 112.6 | S213 S218 R219 | S213-S215 PolarHBondContact O-N 2.85Å; S213-S215 VanDerWaalsContact O-N 3.12Å; S215-S218 PolarHBondContact O-N 3Å; S215-R219 WeakPolarHBondContact O-CB 3.26Å; S215-R219 PolarHBondContact O-N 2.85Å |
| 216 | S | 89.8 | Confident | 85 | Confident | 43 Ų | 43 | 76.9 Ų | 76.9 | 30% | 0.301 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.5 | -45.9 | 173 | -168.9 | 0 | 0 | 0 | 0 | 111.5 | S213 S218 R219 I220 | S213-S216 CarbonylContact O-C 3.33Å; S213-S216 WeakPolarHBondContact O-CA 3.47Å; S213-S216 VanDerWaalsContact O-CB 3.28Å; S213-S216 WeakPolarHBondContact O-CB 3.32Å; S213-S216 PolarHBondContact O-N 3.44Å; S213-S216 PolarHBondContact OG-N 3.24Å; S216-S218 PolarHBondContact O-N 3.44Å; S216-R219 PolarHBondContact O-N 3.43Å; S216-R219 VanDerWaalsContact O-N 3.17Å; S216-I220 VanDerWaalsContact O-CG1 3.3Å; S216-I220 WeakPolarHBondContact O-CG1 3.29Å; S216-I220 PolarHBondContact O-N 2.61Å |
| 217 | I | 92 | Very high | 83.2 | Confident | 0 Ų | 0 | 82 Ų | 82 | 0% | 0 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -56.9 | -50.2 | 173.4 | -63.4 | 168.3 | 0 | 0 | 0 | 109.7 | I181 A193 I196 R197 P212 S213 R219 I220 L221 | I181-I217 HydrophobicContact CD1-CG1 4.18Å; I181-I217 HydrophobicContact CG2-CG2 4.29Å; A193-I217 HydrophobicContact CB-CB 4.23Å; A193-I217 HydrophobicContact CB-CG2 3.86Å; A193-I217 WeakPolarHBondContact O-CD1 3.41Å; I196-I217 HydrophobicContact CB-CG2 4.15Å; I196-I217 HydrophobicContact CD1-CG2 4.15Å; I196-I217 HydrophobicContact CG2-CD1 4.37Å; I196-I217 HydrophobicContact CG2-CG2 3.81Å; R197-I217 HydrophobicContact CB-CD1 3.63Å; R197-I217 HydrophobicContact CG-CD1 4.17Å; P212-I217 HydrophobicContact CB-CG1 4.09Å; P212-I217 HydrophobicContact CG-CD1 4.12Å; P212-I217 HydrophobicContact CG-CG1 3.75Å; S213-I217 PolarHBondContact O-N 3.11Å; I217-R219 VanDerWaalsContact C-N 3.29Å; I217-R219 PolarHBondContact O-N 3.08Å; I217-I220 WeakPolarHBondContact O-CB 3.16Å; I217-I220 PolarHBondContact O-N 3.16Å; I217-I220 VanDerWaalsContact O-N 3.09Å; I217-L221 HydrophobicContact CG2-CD1 4.24Å; I217-L221 HydrophobicContact CG2-CG 4.34Å; I217-L221 WeakPolarHBondContact O-CG 3.42Å; I217-L221 PolarHBondContact O-N 2.78Å |
| 218 | S | 92.4 | Very high | 81.5 | Confident | 31 Ų | 31 | 80.3 Ų | 80.3 | 22% | 0.217 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -59.1 | -35.9 | 177.7 | -59.4 | 0 | 0 | 0 | 0 | 113.5 | A193 V214 S215 S216 R222 | A193-S218 VanDerWaalsContact CB-OG 3.3Å; A193-S218 WeakPolarHBondContact CB-OG 3.38Å; V214-S218 WeakPolarHBondContact O-CB 3.49Å; V214-S218 PolarHBondContact O-N 3.03Å; V214-S218 PolarHBondContact O-OG 3.28Å; S215-S218 PolarHBondContact O-N 3Å; S216-S218 PolarHBondContact O-N 3.44Å; S218-R222 WeakPolarHBondContact O-CG 3.35Å; S218-R222 PolarHBondContact O-N 3.23Å; S218-R222 VanDerWaalsContact O-N 3.16Å |
| 219 | R | 89.8 | Confident | 79.5 | Confident | 164 Ų | 164 | 75.9 Ų | 75.9 | 62% | 0.619 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -70.3 | -41.3 | 174 | -173.4 | 178.6 | -175.1 | 172.5 | 3.4 | 111.8 | S215 S216 I217 L221 N223 | S215-R219 WeakPolarHBondContact O-CB 3.26Å; S215-R219 PolarHBondContact O-N 2.85Å; S216-R219 PolarHBondContact O-N 3.43Å; S216-R219 VanDerWaalsContact O-N 3.17Å; I217-R219 VanDerWaalsContact C-N 3.29Å; I217-R219 PolarHBondContact O-N 3.08Å; R219-L221 VanDerWaalsContact C-N 3.34Å; R219-N223 VanDerWaalsContact O-CB 3.24Å; R219-N223 WeakPolarHBondContact O-CB 3.49Å; R219-N223 VanDerWaalsContact O-CG 3.3Å; R219-N223 PolarHBondContact O-N 3.45Å; R219-N223 PolarHBondContact O-OD1 3.4Å |
| 220 | I | 89.3 | Confident | 77.2 | Confident | 25 Ų | 25 | 73.2 Ų | 73.2 | 13% | 0.128 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -60.4 | -45 | 174.4 | -71.6 | 160.7 | 0 | 0 | 0 | 110.3 | V178 I181 S216 I217 K224 | V178-I220 HydrophobicContact CG1-CG2 3.69Å; V178-I220 HydrophobicContact CG2-CD1 4.22Å; V178-I220 HydrophobicContact CG2-CG2 4.37Å; I181-I220 HydrophobicContact CD1-CD1 3.99Å; I181-I220 HydrophobicContact CD1-CG2 4.36Å; I181-I220 HydrophobicContact CG2-CG2 3.89Å; S216-I220 VanDerWaalsContact O-CG1 3.3Å; S216-I220 WeakPolarHBondContact O-CG1 3.29Å; S216-I220 PolarHBondContact O-N 2.61Å; I217-I220 WeakPolarHBondContact O-CB 3.16Å; I217-I220 PolarHBondContact O-N 3.16Å; I217-I220 VanDerWaalsContact O-N 3.09Å; I220-K224 WeakPolarHBondContact O-CB 3.12Å; I220-K224 PolarHBondContact O-N 2.82Å |
| 221 | L | 89.1 | Confident | 75 | Confident | 25 Ų | 25 | 75.7 Ų | 75.7 | 13% | 0.131 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -58.9 | -55.6 | 178.2 | -69.2 | 177.5 | 0 | 0 | 0 | 111.4 | I181 K185 I196 I217 R219 N223 K224 I225 | I181-L221 HydrophobicContact CG2-CD2 3.67Å; I181-L221 HydrophobicContact CG2-CG 4.27Å; K185-L221 HydrophobicContact CB-CD2 4Å; K185-L221 HydrophobicContact CG-CD2 3.95Å; I196-L221 HydrophobicContact CD1-CD1 3.86Å; I196-L221 HydrophobicContact CD1-CD2 4.11Å; I196-L221 HydrophobicContact CD1-CG 4.46Å; I217-L221 HydrophobicContact CG2-CD1 4.24Å; I217-L221 HydrophobicContact CG2-CG 4.34Å; I217-L221 WeakPolarHBondContact O-CG 3.42Å; I217-L221 PolarHBondContact O-N 2.78Å; R219-L221 VanDerWaalsContact C-N 3.34Å; L221-N223 PolarHBondContact O-N 3.03Å; L221-K224 PolarHBondContact O-N 3.14Å; L221-I225 HydrophobicContact CB-CD1 4.37Å; L221-I225 HydrophobicContact CD2-CD1 3.66Å; L221-I225 WeakPolarHBondContact O-CD1 3.4Å; L221-I225 PolarHBondContact O-N 3.14Å |
| 222 | R | 86.6 | Confident | 72.6 | Confident | 166 Ų | 166 | 77.2 Ų | 77.2 | 63% | 0.626 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -58.7 | -47.5 | 179.3 | -69.8 | -171.6 | -62.2 | -97 | 5.4 | 112.2 | S218 K224 | S218-R222 WeakPolarHBondContact O-CG 3.35Å; S218-R222 PolarHBondContact O-N 3.23Å; S218-R222 VanDerWaalsContact O-N 3.16Å; R222-K224 VanDerWaalsContact C-N 3.3Å; R222-K224 PolarHBondContact O-N 2.89Å |
| 223 | N | 80.1 | Confident | 70.2 | Confident | 118 Ų | 118 | 82.3 Ų | 82.3 | 63% | 0.631 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -71.6 | -18.3 | -176.6 | -73.9 | 21.6 | 0 | 0 | 0 | 114.3 | R219 L221 | R219-N223 VanDerWaalsContact O-CB 3.24Å; R219-N223 WeakPolarHBondContact O-CB 3.49Å; R219-N223 VanDerWaalsContact O-CG 3.3Å; R219-N223 PolarHBondContact O-N 3.45Å; R219-N223 PolarHBondContact O-OD1 3.4Å; L221-N223 PolarHBondContact O-N 3.03Å |
| 224 | K | 68.6 | Low | 67.5 | Low | 95 Ų | 95 | 88.8 Ų | 88.8 | 41% | 0.413 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -130.6 | -8.6 | -166.5 | -141.3 | -179.4 | -176.3 | -174.2 | 0 | 116.2 | V178 I220 L221 R222 | V178-K224 HydrophobicContact CG1-CD 3.42Å; V178-K224 VanDerWaalsContact CG1-CD 3.42Å; I220-K224 WeakPolarHBondContact O-CB 3.12Å; I220-K224 PolarHBondContact O-N 2.82Å; L221-K224 PolarHBondContact O-N 3.14Å; R222-K224 VanDerWaalsContact C-N 3.3Å; R222-K224 PolarHBondContact O-N 2.89Å |
| 225 | I | 64 | Low | 64.8 | Low | 47 Ų | 47 | 93.9 Ų | 93.9 | 24% | 0.241 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -101.5 | -28 | 164.8 | -70.3 | 88.3 | 0 | 0 | 0 | 111.2 | L221 S227 L228 A229 | L221-I225 HydrophobicContact CB-CD1 4.37Å; L221-I225 HydrophobicContact CD2-CD1 3.66Å; L221-I225 WeakPolarHBondContact O-CD1 3.4Å; L221-I225 PolarHBondContact O-N 3.14Å; I225-S227 PolarHBondContact O-N 2.93Å; I225-L228 PolarHBondContact O-N 3.35Å; I225-A229 PolarHBondContact O-N 2.91Å |
| 226 | G | 57.2 | Low | 62.2 | Low | 67 Ų | 67 | 93 Ų | 93 | 69% | 0.691 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.6 | -10.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 227 | S | 51.1 | Low | 59.6 | Low | 111 Ų | 111 | 96 Ų | 96 | 78% | 0.776 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -107.4 | 2.6 | 173.4 | -175.4 | 0 | 0 | 0 | 0 | 113.7 | I225 | I225-S227 PolarHBondContact O-N 2.93Š|
| 228 | L | 52.1 | Low | 57.1 | Low | 79 Ų | 79 | 105 Ų | 105 | 41% | 0.414 | 58% | 0.58 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -112.4 | -21.9 | -179.8 | -170.6 | 61.4 | 0 | 0 | 0 | 112.4 | I225 Q230 | I225-L228 PolarHBondContact O-N 3.35Å; L228-Q230 PolarHBondContact O-N 2.89Å |
| 229 | A | 44.5 | Very low | 54.4 | Low | 71 Ų | 71 | 111.6 Ų | 111.6 | 59% | 0.587 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -74.9 | 30.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | I225 | I225-A229 PolarHBondContact O-N 2.91Š|
| 230 | Q | 34.9 | Very low | 51.9 | Low | 164 Ų | 164 | 109.9 Ų | 109.9 | 77% | 0.766 | 62% | 0.618 | S | S | * | * | trans | -139.1 | 80.1 | 174 | -76.3 | -63.8 | -11.9 | 0 | 0 | 110.6 | L228 G232 | L228-Q230 PolarHBondContact O-N 2.89Å; Q230-G232 PolarHBondContact O-N 2.73Å; Q230-G232 VanDerWaalsContact O-N 3.1Å | ||
| 231 | P | 39.5 | Very low | 49.5 | Very low | 115 Ų | 115 | 114.7 Ų | 114.7 | 75% | 0.747 | 65% | 0.651 | S | S | * | * | trans | -69.2 | 97.2 | 160 | 30.3 | -31.6 | 0 | 0 | 0 | 108.3 | P233 | P231-P233 WeakPolarHBondContact O-CD 3.47Š| ||
| 232 | G | 37.6 | Very low | 46.8 | Very low | 65 Ų | 65 | 119 Ų | 119 | 67% | 0.67 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 126.6 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q230 | Q230-G232 PolarHBondContact O-N 2.73Å; Q230-G232 VanDerWaalsContact O-N 3.1Å |
| 233 | P | 38.4 | Very low | 44.5 | Very low | 130 Ų | 130 | 119.6 Ų | 119.6 | 84% | 0.844 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 125.1 | 165.2 | 30.9 | -30.7 | 0 | 0 | 0 | 109 | P231 | P231-P233 WeakPolarHBondContact O-CD 3.47Š|
| 234 | Y | 35.3 | Very low | 42.6 | Very low | 209 Ų | 209 | 119.6 Ų | 119.6 | 82% | 0.82 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 127.1 | 156.1 | 88.9 | -87.7 | 0 | 0 | 0 | 107.4 | ||
| 235 | E | 35.3 | Very low | 41.2 | Very low | 161 Ų | 161 | 121.2 Ų | 121.2 | 75% | 0.752 | 72% | 0.718 | S | S | * | * | trans | -159.5 | 164.9 | 146 | -127.4 | -55.9 | 89.4 | 0 | 0 | 108.2 | ||||
| 236 | A | 39.4 | Very low | 39.8 | Very low | 67 Ų | 67 | 127.2 Ų | 127.2 | 55% | 0.554 | 75% | 0.749 | S | S | * | * | trans | -101.7 | 179.5 | -167.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 237 | S | 34.4 | Very low | 39.2 | Very low | 106 Ų | 106 | 129.4 Ų | 129.4 | 74% | 0.741 | 75% | 0.751 | S | S | * | * | trans | 74.5 | 102.4 | 154.1 | -56 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 238 | K | 39.2 | Very low | 38.2 | Very low | 189 Ų | 189 | 134.1 Ų | 134.1 | 82% | 0.822 | 75% | 0.753 | S | S | * | * | trans | 70.2 | 133.7 | 141.3 | -63.1 | -172.9 | 175.9 | -176.3 | 0 | 120.8 | ||||
| 239 | Q | 36.9 | Very low | 37.4 | Very low | 170 Ų | 170 | 135.8 Ų | 135.8 | 79% | 0.794 | 76% | 0.763 | S | S | * | * | trans | 64.9 | 130.8 | 156.8 | -72.8 | 173.3 | -97.2 | 0 | 0 | 119.1 | ||||
| 240 | P | 36.8 | Very low | 37.1 | Very low | 127 Ų | 127 | 140.9 Ų | 140.9 | 83% | 0.825 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 128.2 | 168.6 | 33.4 | -30.7 | 0 | 0 | 0 | 111.6 | ||
| 241 | P | 38 | Very low | 37.8 | Very low | 127 Ų | 127 | 139.5 Ų | 139.5 | 83% | 0.825 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 158.2 | 165.8 | 33 | -32.9 | 0 | 0 | 0 | 112 | ||
| 242 | S | 33.9 | Very low | 37.9 | Very low | 116 Ų | 116 | 144.3 Ų | 144.3 | 81% | 0.811 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 144.4 | -173.9 | 49 | 0 | 0 | 0 | 0 | 114.6 | ||
| 243 | Q | 37.3 | Very low | 37.6 | Very low | 178 Ų | 178 | 148.5 Ų | 148.5 | 83% | 0.832 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 134.8 | 166.2 | -73.2 | -77.1 | -13.1 | 0 | 0 | 111.1 | ||
| 244 | P | 39.8 | Very low | 37.3 | Very low | 117 Ų | 117 | 152.4 Ų | 152.4 | 76% | 0.76 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -80.2 | 145 | 171.4 | 32.9 | -33.6 | 0 | 0 | 0 | 111.8 | ||
| 245 | T | 38.8 | Very low | 37.6 | Very low | 130 Ų | 130 | 147 Ų | 147 | 80% | 0.798 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 140.6 | -179.6 | 51 | 0 | 0 | 0 | 0 | 112.9 | ||
| 246 | L | 34.6 | Very low | 37.4 | Very low | 173 Ų | 173 | 150.2 Ų | 150.2 | 91% | 0.906 | 77% | 0.774 | S | S | * | * | trans | -129.7 | 148.8 | 152.3 | -75.5 | 179.1 | 0 | 0 | 0 | 110.3 | ||||
| 247 | P | 45.5 | Very low | 37.5 | Very low | 113 Ų | 113 | 151.6 Ų | 151.6 | 73% | 0.734 | 78% | 0.778 | S | S | * | * | trans | -108.4 | 147.5 | -158.1 | 38.3 | -30.9 | 0 | 0 | 0 | 114.3 | ||||
| 248 | Y | 30.2 | Very low | 37.7 | Very low | 209 Ų | 209 | 151.6 Ų | 151.6 | 82% | 0.82 | 78% | 0.778 | S | S | * | * | trans | -149.3 | 120.6 | 152.3 | -145.3 | -101.4 | 0 | 0 | 0 | 113.6 | ||||
| 249 | N | 35.2 | Very low | 37.8 | Very low | 114 Ų | 114 | 148.2 Ų | 148.2 | 61% | 0.61 | 78% | 0.775 | S | S | * | * | trans | 21.2 | 108 | 164.8 | -70.9 | -76.3 | 0 | 0 | 0 | 120.1 | I251 | N249-I251 PolarHBondContact O-N 2.84Š| ||
| 250 | H | 38.5 | Very low | 37.8 | Very low | 179 Ų | 179 | 146.3 Ų | 146.3 | 83% | 0.829 | 78% | 0.775 | S | S | * | * | trans | -81.9 | 101.5 | 159.5 | -57 | -77.6 | 0 | 0 | 0 | 110.4 | ||||
| 251 | I | 48.8 | Very low | 37.9 | Very low | 134 Ų | 134 | 145.8 Ų | 145.8 | 69% | 0.687 | 77% | 0.774 | S | S | * | * | trans | -120.1 | 127.7 | 162.2 | -68.9 | 178.7 | 0 | 0 | 0 | 107.5 | N249 | N249-I251 PolarHBondContact O-N 2.84Š| ||
| 252 | Y | 41.5 | Very low | 38 | Very low | 217 Ų | 217 | 145.8 Ų | 145.8 | 85% | 0.851 | 77% | 0.774 | S | S | * | * | trans | 66.8 | 76.3 | -164.6 | -65.3 | -72.3 | 0 | 0 | 0 | 116.5 | ||||
| 253 | Q | 31.8 | Very low | 38 | Very low | 152 Ų | 152 | 147.3 Ų | 147.3 | 71% | 0.71 | 78% | 0.779 | S | S | * | * | trans | -58 | 129.6 | 149.9 | -179.5 | 73.4 | 13.9 | 0 | 0 | 110 | ||||
| 254 | Y | 31.4 | Very low | 37.9 | Very low | 212 Ų | 212 | 142.5 Ų | 142.5 | 83% | 0.831 | 78% | 0.777 | S | S | * | * | trans | -140.1 | 120.8 | 162 | -128 | -85.6 | 0 | 0 | 0 | 109.8 | ||||
| 255 | P | 42.4 | Very low | 37.6 | Very low | 97 Ų | 97 | 141.6 Ų | 141.6 | 63% | 0.63 | 78% | 0.779 | S | S | * | * | trans | -92.2 | 132.5 | -171.3 | 33.6 | -32.8 | 0 | 0 | 0 | 112.8 | ||||
| 256 | Y | 31.1 | Very low | 37.3 | Very low | 227 Ų | 227 | 145.3 Ų | 145.3 | 89% | 0.89 | 78% | 0.784 | S | S | * | * | trans | -146.7 | 140.5 | 147.6 | -142.3 | -111.3 | 0 | 0 | 0 | 110.9 | ||||
| 257 | P | 42.3 | Very low | 37.3 | Very low | 96 Ų | 96 | 145.4 Ų | 145.4 | 62% | 0.623 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -88 | 154.1 | -159.1 | 33.5 | -36.6 | 0 | 0 | 0 | 114.3 | P259 | P257-P259 WeakPolarHBondContact O-CD 3.09Š|
| 258 | S | 37.8 | Very low | 36.5 | Very low | 106 Ų | 106 | 143.4 Ų | 143.4 | 74% | 0.741 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -88 | 125.7 | 157.4 | 179 | 0 | 0 | 0 | 0 | 109.8 | ||
| 259 | P | 42 | Very low | 36.5 | Very low | 119 Ų | 119 | 137.8 Ų | 137.8 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 119 | 158.4 | 32.5 | -27 | 0 | 0 | 0 | 110.1 | P257 | P257-P259 WeakPolarHBondContact O-CD 3.09Š|
| 260 | V | 36.9 | Very low | 36.7 | Very low | 129 Ų | 129 | 140.7 Ų | 140.7 | 78% | 0.782 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -77 | 162.4 | 166.6 | -70.4 | 0 | 0 | 0 | 0 | 111.3 | ||
| 261 | S | 37.1 | Very low | 37 | Very low | 116 Ų | 116 | 138.4 Ų | 138.4 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 148.1 | 178.6 | -43.4 | 0 | 0 | 0 | 0 | 113.9 | ||
| 262 | P | 41.7 | Very low | 36.1 | Very low | 127 Ų | 127 | 135.6 Ų | 135.6 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | -112.9 | 132.5 | 158 | 35.2 | -26.2 | 0 | 0 | 0 | 112.6 | ||||
| 263 | T | 34.2 | Very low | 35.8 | Very low | 148 Ų | 148 | 132.1 Ų | 132.1 | 91% | 0.908 | 79% | 0.789 | S | S | * | * | trans | -116.5 | 126.5 | 159.6 | 27.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 264 | G | 33.8 | Very low | 36.5 | Very low | 78 Ų | 78 | 131 Ų | 131 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | 117.6 | 112.9 | 157.8 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 265 | A | 34.7 | Very low | 36.5 | Very low | 97 Ų | 97 | 124.2 Ų | 124.2 | 80% | 0.802 | 79% | 0.79 | S | S | * | * | trans | 76.9 | 131.9 | 140.9 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 266 | K | 32.3 | Very low | 36 | Very low | 208 Ų | 208 | 126.2 Ų | 126.2 | 90% | 0.904 | 80% | 0.8 | S | S | * | * | trans | 104.7 | 134.6 | 146.8 | 94.4 | -155.2 | 176.2 | -176 | 0 | 120.1 | ||||
| 267 | M | 34.1 | Very low | 36 | Very low | 176 Ų | 176 | 120.5 Ų | 120.5 | 87% | 0.867 | 80% | 0.8 | S | S | * | * | trans | -50.2 | 146.5 | -174.5 | -176 | 71.4 | 169.8 | 0 | 0 | 116.7 | ||||
| 268 | G | 29.4 | Very low | 35.5 | Very low | 71 Ų | 71 | 119.4 Ų | 119.4 | 73% | 0.732 | 81% | 0.806 | S | S | * | * | trans | 179.9 | 134.3 | 168 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 269 | S | 30.2 | Very low | 35.6 | Very low | 90 Ų | 90 | 122.5 Ų | 122.5 | 63% | 0.629 | 81% | 0.809 | S | S | * | * | trans | -95.9 | 137.2 | -160.8 | -68.2 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 270 | H | 39 | Very low | 35.2 | Very low | 175 Ų | 175 | 122.6 Ų | 122.6 | 81% | 0.81 | 81% | 0.807 | S | S | * | * | trans | 62.5 | -178.3 | 146.2 | -47.5 | -48.2 | 0 | 0 | 0 | 118.6 | ||||
| 271 | P | 44.1 | Very low | 35.1 | Very low | 131 Ų | 131 | 120.7 Ų | 120.7 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | -134.4 | 164.9 | -92.4 | 40.5 | -22.8 | 0 | 0 | 0 | 116.9 | |||||
| 272 | G | 29.5 | Very low | 35.5 | Very low | 75 Ų | 75 | 122.2 Ų | 122.2 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | trans | 179.4 | 148.6 | 169.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 273 | V | 36.5 | Very low | 35.5 | Very low | 145 Ų | 145 | 120.8 Ų | 120.8 | 88% | 0.879 | 79% | 0.787 | S | S | * | * | trans | -160.7 | 168.6 | 179.7 | -113.4 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 274 | P | 45.7 | Very low | 36 | Very low | 128 Ų | 128 | 124.9 Ų | 124.9 | 83% | 0.831 | 79% | 0.786 | S | S | * | * | cis | -127.3 | -177.9 | -13.3 | 38.7 | -21.9 | 0 | 0 | 0 | 113.6 | ||||
| 275 | G | 31.2 | Very low | 36 | Very low | 70 Ų | 70 | 126.7 Ų | 126.7 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | trans | -177.6 | 77.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 276 | T | 32.7 | Very low | 35.9 | Very low | 139 Ų | 139 | 133.7 Ų | 133.7 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | trans | 20.4 | 111.9 | 156.5 | 54 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 277 | A | 31.8 | Very low | 36.6 | Very low | 107 Ų | 107 | 129.6 Ų | 129.6 | 88% | 0.884 | 79% | 0.787 | S | S | * | * | 50.7 | 104 | 128.9 | 0 | 0 | 0 | 0 | 0 | 121.5 | |||||
| 278 | G | 31.4 | Very low | 36.9 | Very low | 73 Ų | 73 | 126.6 Ų | 126.6 | 75% | 0.753 | 78% | 0.783 | S | S | * | * | trans | -106.4 | 149.1 | 157.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 279 | H | 38.6 | Very low | 37.3 | Very low | 171 Ų | 171 | 127.8 Ų | 127.8 | 79% | 0.792 | 79% | 0.786 | S | S | * | * | trans | -67.6 | 129.8 | -175.7 | -174.1 | -79.6 | 0 | 0 | 0 | 113.1 | S281 | H279-S281 PolarHBondContact CE1-OG 3.35Å; H279-S281 VanDerWaalsContact CE1-OG 3.24Å; H279-S281 PolarHBondContact ND1-OG 2.64Å; H279-S281 PolarHBondContact O-N 3.45Å | ||
| 280 | V | 34.8 | Very low | 37.9 | Very low | 120 Ų | 120 | 131 Ų | 131 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -88.6 | 107.1 | 178.8 | -179.1 | 0 | 0 | 0 | 0 | 110.8 | I282 | V280-I282 HydrophobicContact CG1-CD1 3.71Š| ||
| 281 | S | 35.2 | Very low | 38.2 | Very low | 89 Ų | 89 | 127.1 Ų | 127.1 | 62% | 0.622 | 78% | 0.784 | S | S | * | * | trans | -118.7 | 112.5 | 170.4 | -64 | 0 | 0 | 0 | 0 | 110.3 | H279 P283 | H279-S281 PolarHBondContact CE1-OG 3.35Å; H279-S281 VanDerWaalsContact CE1-OG 3.24Å; H279-S281 PolarHBondContact ND1-OG 2.64Å; H279-S281 PolarHBondContact O-N 3.45Å; S281-P283 WeakPolarHBondContact O-CD 3.36Å | ||
| 282 | I | 44.2 | Very low | 38.3 | Very low | 149 Ų | 149 | 126.9 Ų | 126.9 | 76% | 0.764 | 78% | 0.779 | S | S | * | * | trans | -91.3 | 121.9 | 173.5 | -61.8 | 99.8 | 0 | 0 | 0 | 110 | V280 | V280-I282 HydrophobicContact CG1-CD1 3.71Š| ||
| 283 | P | 42.8 | Very low | 39.4 | Very low | 97 Ų | 97 | 127.7 Ų | 127.7 | 63% | 0.63 | 77% | 0.774 | S | S | * | * | trans | -107.8 | 95.2 | 170.3 | 35.1 | -24.7 | 0 | 0 | 0 | 111.4 | S281 | S281-P283 WeakPolarHBondContact O-CD 3.36Š| ||
| 284 | R | 43.7 | Very low | 40.2 | Very low | 234 Ų | 234 | 127 Ų | 127 | 88% | 0.883 | 77% | 0.765 | S | S | * | * | trans | -176.2 | 90.4 | 149 | -110.2 | 153.9 | -80.8 | -128.9 | -0.2 | 113.5 | ||||
| 285 | S | 35.1 | Very low | 40.6 | Very low | 116 Ų | 116 | 127.7 Ų | 127.7 | 81% | 0.811 | 76% | 0.76 | S | S | * | * | trans | -124 | 156.7 | 149.2 | 51.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 286 | W | 32.5 | Very low | 41.6 | Very low | 243 Ų | 243 | 130.9 Ų | 130.9 | 92% | 0.92 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 155.3 | -171 | -81.6 | 42 | 0 | 0 | 0 | 112.6 | S288 | W286-S288 PolarHBondContact O-N 2.86Å; W286-S288 VanDerWaalsContact O-N 3.13Å |
| 287 | P | 45.3 | Very low | 42.6 | Very low | 123 Ų | 123 | 127.6 Ų | 127.6 | 80% | 0.799 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 118.6 | 173.6 | -23.8 | 34.3 | 0 | 0 | 0 | 111.3 | ||
| 288 | S | 40.8 | Very low | 43.6 | Very low | 112 Ų | 112 | 128.6 Ų | 128.6 | 78% | 0.783 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 165.5 | 173.1 | -165.5 | 0 | 0 | 0 | 0 | 110.7 | W286 H290 | W286-S288 PolarHBondContact O-N 2.86Å; W286-S288 VanDerWaalsContact O-N 3.13Å; S288-H290 PolarHBondContact O-N 2.98Å |
| 289 | A | 37.1 | Very low | 44.7 | Very low | 96 Ų | 96 | 136.8 Ų | 136.8 | 79% | 0.793 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 131.4 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | S291 | A289-S291 PolarHBondContact O-N 3.12Š|
| 290 | H | 42.8 | Very low | 45 | Very low | 157 Ų | 157 | 134.9 Ų | 134.9 | 73% | 0.727 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 128.5 | 170.3 | -76.7 | -93.6 | 0 | 0 | 0 | 110.1 | S288 | S288-H290 PolarHBondContact O-N 2.98Š|
| 291 | S | 46.7 | Very low | 45.2 | Very low | 94 Ų | 94 | 137.9 Ų | 137.9 | 66% | 0.657 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 161.1 | 166.5 | -169.7 | 0 | 0 | 0 | 0 | 110.8 | A289 S293 | A289-S291 PolarHBondContact O-N 3.12Å; S291-S293 PolarHBondContact O-N 2.89Å |
| 292 | V | 45.3 | Very low | 45.8 | Very low | 126 Ų | 126 | 141.8 Ų | 141.8 | 76% | 0.764 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.4 | 32.6 | -168.5 | -161.5 | 0 | 0 | 0 | 0 | 112.9 | I295 | V292-I295 HydrophobicContact CG1-CD1 4.49Š|
| 293 | S | 54 | Low | 45.9 | Very low | 93 Ų | 93 | 143.7 Ų | 143.7 | 65% | 0.65 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.1 | -11.4 | -176.1 | -52.8 | 0 | 0 | 0 | 0 | 114.1 | S291 | S291-S293 PolarHBondContact O-N 2.89Š|
| 294 | N | 51.7 | Low | 45.9 | Very low | 130 Ų | 130 | 148.4 Ų | 148.4 | 70% | 0.695 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -101.3 | -0.5 | -179.1 | -93.2 | 72.6 | 0 | 0 | 0 | 114.7 | ||
| 295 | I | 54.3 | Low | 45.5 | Very low | 143 Ų | 143 | 144.5 Ų | 144.5 | 73% | 0.733 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -86.8 | -24.1 | -177.2 | -62.4 | 178 | 0 | 0 | 0 | 111.9 | V292 | V292-I295 HydrophobicContact CG1-CD1 4.49Š|
| 296 | L | 52.2 | Low | 45.4 | Very low | 136 Ų | 136 | 142.8 Ų | 142.8 | 71% | 0.712 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -104.6 | 104.7 | 170.1 | -66 | 173.1 | 0 | 0 | 0 | 108.5 | I298 | L296-I298 VanDerWaalsContact C-N 3.27Å; L296-I298 HydrophobicContact CB-CD1 4.15Å; L296-I298 HydrophobicContact CB-CG1 4.26Å; L296-I298 PolarHBondContact O-N 2.87Å |
| 297 | G | 55.1 | Low | 45.4 | Very low | 71 Ų | 71 | 135.3 Ų | 135.3 | 73% | 0.732 | 78% | 0.778 | S | S | * | * | trans | -72.7 | 67.8 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 298 | I | 52.8 | Low | 44.8 | Very low | 127 Ų | 127 | 137.7 Ų | 137.7 | 65% | 0.651 | 78% | 0.783 | S | S | * | * | trans | -112.6 | 62 | -174.4 | -44.4 | 174.7 | 0 | 0 | 0 | 110.5 | L296 | L296-I298 VanDerWaalsContact C-N 3.27Å; L296-I298 HydrophobicContact CB-CD1 4.15Å; L296-I298 HydrophobicContact CB-CG1 4.26Å; L296-I298 PolarHBondContact O-N 2.87Å | ||
| 299 | R | 53 | Low | 44.4 | Very low | 246 Ų | 246 | 137.3 Ų | 137.3 | 93% | 0.928 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -160.8 | 20.8 | 170.2 | -115.8 | 163.4 | -139.6 | -124.4 | 1.7 | 115.9 | ||
| 300 | T | 46 | Very low | 44.1 | Very low | 131 Ų | 131 | 136.3 Ų | 136.3 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | S | Bend | trans | -136.9 | 39.2 | -176.3 | 58.8 | 0 | 0 | 0 | 0 | 113.1 | ||
| 301 | F | 39.8 | Very low | 43.5 | Very low | 183 Ų | 183 | 133.6 Ų | 133.6 | 80% | 0.803 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -132.6 | -2.1 | 174.4 | 100.3 | -93.6 | 0 | 0 | 0 | 115.7 | ||
| 302 | M | 47.6 | Very low | 42.9 | Very low | 171 Ų | 171 | 137.7 Ų | 137.7 | 84% | 0.842 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -130.9 | 34.7 | -174.1 | -155 | 168.3 | 72.9 | 0 | 0 | 113.9 | ||
| 303 | E | 45.9 | Very low | 42.3 | Very low | 189 Ų | 189 | 134.9 Ų | 134.9 | 88% | 0.883 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -149.1 | 39.1 | 172.8 | -153.4 | -179.4 | 171.4 | 0 | 0 | 113 | ||
| 304 | Q | 42.8 | Very low | 41.3 | Very low | 195 Ų | 195 | 137.6 Ų | 137.6 | 91% | 0.911 | 80% | 0.803 | S | S | * | * | trans | -151.8 | 35.6 | 171.9 | -146.2 | 163.6 | 76.5 | 0 | 0 | 116.1 | ||||
| 305 | T | 35.3 | Very low | 40.4 | Very low | 153 Ų | 153 | 135.3 Ų | 135.3 | 94% | 0.939 | 80% | 0.802 | S | S | * | * | trans | -122.9 | 84.4 | 166.3 | -50 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 306 | G | 31.9 | Very low | 39.3 | Very low | 80 Ų | 80 | 139.8 Ų | 139.8 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | trans | -141.1 | 37.8 | -169.9 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 307 | A | 32.5 | Very low | 38.2 | Very low | 86 Ų | 86 | 137.9 Ų | 137.9 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | trans | -151.5 | 115.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 308 | L | 32.7 | Very low | 37.6 | Very low | 172 Ų | 172 | 140.3 Ų | 140.3 | 90% | 0.901 | 81% | 0.813 | S | S | * | * | trans | 73.3 | 145.7 | 154.7 | -54.4 | 173.8 | 0 | 0 | 0 | 120.4 | ||||
| 309 | A | 33.1 | Very low | 36.4 | Very low | 105 Ų | 105 | 143.6 Ų | 143.6 | 87% | 0.868 | 82% | 0.822 | S | S | * | * | trans | 66.8 | 106.3 | 161.2 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 310 | G | 30.2 | Very low | 35.5 | Very low | 75 Ų | 75 | 140.1 Ų | 140.1 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | 99.4 | 93.5 | 108.6 | 0 | 0 | 0 | 0 | 0 | 120.4 | |||||
| 311 | S | 31.4 | Very low | 34.9 | Very low | 100 Ų | 100 | 142.2 Ų | 142.2 | 70% | 0.699 | 82% | 0.819 | S | S | * | * | trans | 70 | 149.7 | 145 | -133.4 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 312 | E | 32.7 | Very low | 34.4 | Very low | 179 Ų | 179 | 140.3 Ų | 140.3 | 84% | 0.836 | 82% | 0.817 | S | S | * | * | trans | 19.2 | 137.7 | 158.8 | 68.6 | -144.7 | 101 | 0 | 0 | 123.7 | ||||
| 313 | G | 33.2 | Very low | 33.7 | Very low | 67 Ų | 67 | 144.1 Ų | 144.1 | 69% | 0.691 | 82% | 0.823 | S | S | * | * | trans | 139.6 | 83.8 | 141.6 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 314 | T | 33.3 | Very low | 33.1 | Very low | 151 Ų | 151 | 139.3 Ų | 139.3 | 93% | 0.926 | 82% | 0.815 | S | S | * | * | trans | 71.1 | 137.4 | 140.4 | -45.7 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 315 | A | 33.4 | Very low | 32.6 | Very low | 82 Ų | 82 | 133.8 Ų | 133.8 | 68% | 0.678 | 81% | 0.811 | S | S | * | * | trans | -86.3 | 168.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 316 | Y | 29.9 | Very low | 32.4 | Very low | 236 Ų | 236 | 133.3 Ų | 133.3 | 93% | 0.925 | 81% | 0.807 | S | S | * | * | -165.2 | 172.8 | 110.3 | -117.3 | -88.9 | 0 | 0 | 0 | 113 | |||||
| 317 | S | 30.2 | Very low | 32.4 | Very low | 97 Ų | 97 | 135.9 Ų | 135.9 | 68% | 0.678 | 80% | 0.802 | S | S | * | * | trans | -99.3 | 147.4 | -167.4 | -172.6 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 318 | P | 42.8 | Very low | 32.3 | Very low | 122 Ų | 122 | 142 Ų | 142 | 79% | 0.792 | 81% | 0.807 | S | S | * | * | trans | -75.4 | 144.2 | 174.9 | 31.9 | -35.8 | 0 | 0 | 0 | 112.5 | ||||
| 319 | K | 26.3 | Very low | 32.2 | Very low | 196 Ų | 196 | 140.6 Ų | 140.6 | 85% | 0.852 | 81% | 0.805 | S | S | * | * | trans | -131 | 136.8 | 169.5 | -149.3 | -178.9 | -176.5 | -168.3 | 0 | 110.4 | ||||
| 320 | M | 35.2 | Very low | 32 | Very low | 173 Ų | 173 | 139.3 Ų | 139.3 | 85% | 0.852 | 80% | 0.795 | S | S | * | * | trans | -73.2 | 150.4 | 174.7 | 68.2 | -158.4 | -175 | 0 | 0 | 111 | ||||
| 321 | E | 32.9 | Very low | 32 | Very low | 175 Ų | 175 | 145.1 Ų | 145.1 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -136.5 | 130.9 | 169.1 | -144.6 | 82.1 | 100.9 | 0 | 0 | 109 | ||||
| 322 | D | 29.7 | Very low | 32.7 | Very low | 142 Ų | 142 | 146.4 Ų | 146.4 | 76% | 0.759 | 81% | 0.805 | S | S | * | * | trans | -99.1 | 156.7 | -173.6 | -177.4 | -106.6 | 0 | 0 | 0 | 112.3 | ||||
| 323 | W | 31.8 | Very low | 32.6 | Very low | 252 Ų | 252 | 141.5 Ų | 141.5 | 96% | 0.955 | 80% | 0.795 | S | S | * | * | trans | -121.8 | 87 | -178.2 | -86.4 | 73.7 | 0 | 0 | 0 | 113 | ||||
| 324 | A | 33.6 | Very low | 32.8 | Very low | 87 Ų | 87 | 144.6 Ų | 144.6 | 72% | 0.719 | 80% | 0.801 | S | S | * | * | trans | -133.2 | 104.2 | 168.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 325 | G | 33.1 | Very low | 33.4 | Very low | 80 Ų | 80 | 143.6 Ų | 143.6 | 83% | 0.825 | 80% | 0.797 | S | S | * | * | trans | -92.1 | -175.4 | -166 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 326 | V | 31.2 | Very low | 33.4 | Very low | 143 Ų | 143 | 144.3 Ų | 144.3 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | trans | -136.1 | 112 | -179.3 | -176.5 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 327 | N | 31.9 | Very low | 33.5 | Very low | 134 Ų | 134 | 139 Ų | 139 | 72% | 0.717 | 79% | 0.794 | S | S | * | * | trans | 25.1 | 139.4 | 134.2 | -136.4 | -21.8 | 0 | 0 | 0 | 123.7 | ||||
| 328 | R | 29.3 | Very low | 33.5 | Very low | 215 Ų | 215 | 142 Ų | 142 | 81% | 0.811 | 80% | 0.803 | S | S | * | * | trans | 69.1 | 158.8 | 159.6 | -79.5 | 159.5 | 179.2 | -160.3 | -3 | 117.8 | ||||
| 329 | T | 31.2 | Very low | 32.9 | Very low | 142 Ų | 142 | 139.3 Ų | 139.3 | 87% | 0.871 | 80% | 0.797 | S | S | * | * | cis | -139.6 | -159.3 | 8.6 | -22.8 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 330 | A | 29.8 | Very low | 33.3 | Very low | 78 Ų | 78 | 137.9 Ų | 137.9 | 65% | 0.645 | 80% | 0.798 | S | S | * | * | trans | -140.3 | 165.9 | -166.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 331 | F | 30.2 | Very low | 33 | Very low | 196 Ų | 196 | 138 Ų | 138 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | trans | 68.6 | 151 | 167.8 | -72.4 | -66.3 | 0 | 0 | 0 | 117.9 | ||||
| 332 | P | 44.8 | Very low | 33 | Very low | 128 Ų | 128 | 138.7 Ų | 138.7 | 83% | 0.831 | 80% | 0.797 | S | S | * | * | -133.3 | -171.6 | 74.9 | 40.4 | -25.7 | 0 | 0 | 0 | 115.3 | |||||
| 333 | A | 30.7 | Very low | 33.8 | Very low | 75 Ų | 75 | 137.7 Ų | 137.7 | 62% | 0.62 | 80% | 0.798 | S | S | * | * | trans | -156.8 | 177.2 | -179 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 334 | T | 37.6 | Very low | 33.7 | Very low | 132 Ų | 132 | 129.1 Ų | 129.1 | 81% | 0.81 | 78% | 0.781 | S | S | * | * | trans | 75.3 | 166.8 | 177.2 | 81.8 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 335 | P | 46.8 | Very low | 33.6 | Very low | 131 Ų | 131 | 132.5 Ų | 132.5 | 85% | 0.851 | 79% | 0.786 | S | S | * | * | cis | -97.1 | -174.7 | 35.7 | 38.1 | -37.8 | 0 | 0 | 0 | 116.3 | ||||
| 336 | A | 32.7 | Very low | 33.4 | Very low | 96 Ų | 96 | 136.5 Ų | 136.5 | 79% | 0.793 | 78% | 0.783 | S | S | * | * | trans | -148 | 168.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 337 | V | 30.9 | Very low | 33.5 | Very low | 124 Ų | 124 | 133.3 Ų | 133.3 | 75% | 0.752 | 77% | 0.772 | S | S | * | * | trans | -162.2 | 139.8 | 167.9 | 55.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 338 | N | 32 | Very low | 33.4 | Very low | 162 Ų | 162 | 133.5 Ų | 133.5 | 87% | 0.866 | 77% | 0.773 | S | S | * | * | trans | 62.3 | 136.3 | 173.6 | -64.1 | -6.5 | 0 | 0 | 0 | 119.6 | ||||
| 339 | G | 29.4 | Very low | 34 | Very low | 65 Ų | 65 | 129.9 Ų | 129.9 | 67% | 0.67 | 77% | 0.768 | S | S | * | * | cis | 160.7 | 147.5 | -12.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 340 | L | 33.8 | Very low | 33.9 | Very low | 165 Ų | 165 | 132.3 Ų | 132.3 | 86% | 0.864 | 77% | 0.766 | S | S | * | * | trans | 62.5 | 137.1 | 169.7 | -82.9 | 29.3 | 0 | 0 | 0 | 117.2 | ||||
| 341 | E | 30 | Very low | 33.9 | Very low | 176 Ų | 176 | 138.7 Ų | 138.7 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | cis | -150.9 | 176.8 | -1.3 | -86.5 | -104.2 | 77.4 | 0 | 0 | 111.5 | ||||
| 342 | K | 32.5 | Very low | 33.9 | Very low | 189 Ų | 189 | 135.9 Ų | 135.9 | 82% | 0.822 | 77% | 0.774 | S | S | * | * | trans | -132.8 | -175.1 | 172.3 | -113 | -171.7 | 177.8 | 179.6 | 0 | 108.7 | ||||
| 343 | P | 47 | Very low | 33.3 | Very low | 121 Ų | 121 | 137.3 Ų | 137.3 | 79% | 0.786 | 77% | 0.77 | S | S | * | * | cis | -113.4 | -130.1 | 2 | 23.2 | 3.6 | 0 | 0 | 0 | 110.4 | ||||
| 344 | A | 28.8 | Very low | 33.4 | Very low | 72 Ų | 72 | 139.5 Ų | 139.5 | 60% | 0.595 | 78% | 0.781 | S | S | * | * | cis | -162.5 | 150.8 | -4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 345 | L | 32.7 | Very low | 33.2 | Very low | 159 Ų | 159 | 136.9 Ų | 136.9 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | trans | 56.4 | 178.8 | 159.6 | -86.4 | 78.7 | 0 | 0 | 0 | 117.2 | ||||
| 346 | E | 28 | Very low | 32.6 | Very low | 164 Ų | 164 | 136 Ų | 136 | 77% | 0.766 | 77% | 0.77 | S | S | * | * | -159.3 | -174.5 | -55.2 | -147.7 | -163.3 | 102.3 | 0 | 0 | 109.2 | |||||
| 347 | A | 34.3 | Very low | 32.6 | Very low | 75 Ų | 75 | 137.5 Ų | 137.5 | 62% | 0.62 | 77% | 0.769 | S | S | * | * | trans | 59.6 | 108.3 | 151 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 348 | D | 29.8 | Very low | 32.8 | Very low | 139 Ų | 139 | 140.2 Ų | 140.2 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | 56.5 | 122.6 | 111.6 | -138 | -113.4 | 0 | 0 | 0 | 123.1 | |||||
| 349 | I | 40.2 | Very low | 32.8 | Very low | 139 Ų | 139 | 138 Ų | 138 | 71% | 0.713 | 78% | 0.776 | S | S | * | * | trans | 20.6 | 118.3 | 142 | -42.7 | 170.7 | 0 | 0 | 0 | 118.4 | ||||
| 350 | K | 30.4 | Very low | 33.2 | Very low | 192 Ų | 192 | 139.1 Ų | 139.1 | 84% | 0.835 | 78% | 0.778 | S | S | * | * | 163.6 | 140.3 | 106 | -159.8 | 162.5 | -175.2 | 175.2 | 0 | 114 | |||||
| 351 | Y | 30.1 | Very low | 33.3 | Very low | 213 Ų | 213 | 138.1 Ų | 138.1 | 84% | 0.835 | 78% | 0.779 | S | S | * | * | trans | -35.9 | 135.5 | 171 | -142.1 | -94.2 | 0 | 0 | 0 | 117.1 | ||||
| 352 | T | 29.4 | Very low | 33.4 | Very low | 136 Ų | 136 | 133.4 Ų | 133.4 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | trans | -119.8 | 126.9 | 161.1 | -63.9 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 353 | Q | 32.6 | Very low | 33.4 | Very low | 158 Ų | 158 | 127.9 Ų | 127.9 | 74% | 0.738 | 77% | 0.774 | S | S | * | * | trans | -91.9 | 148.7 | 174.9 | 170.1 | -171.6 | 66.6 | 0 | 0 | 109.9 | A355 | Q353-A355 HydrophobicContact CG-CB 4.48Š| ||
| 354 | S | 33 | Very low | 32.7 | Very low | 122 Ų | 122 | 132.2 Ų | 132.2 | 85% | 0.853 | 78% | 0.781 | S | S | * | * | trans | -123.9 | 141.6 | 159.1 | 54.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 355 | A | 33.7 | Very low | 33.1 | Very low | 76 Ų | 76 | 136.4 Ų | 136.4 | 63% | 0.628 | 79% | 0.793 | S | S | * | * | trans | -149.3 | 142.8 | -170.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q353 | Q353-A355 HydrophobicContact CG-CB 4.48Š| ||
| 356 | S | 34.3 | Very low | 33.9 | Very low | 114 Ų | 114 | 133.9 Ų | 133.9 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | -140.5 | 94.9 | 164.9 | -61.7 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 357 | T | 32.2 | Very low | 34.6 | Very low | 126 Ų | 126 | 131.1 Ų | 131.1 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | 70.8 | 100.8 | 88.5 | 55.6 | 0 | 0 | 0 | 0 | 114.9 | |||||
| 358 | L | 35.3 | Very low | 34.5 | Very low | 181 Ų | 181 | 133.4 Ų | 133.4 | 95% | 0.948 | 80% | 0.801 | S | S | * | * | -170.5 | 154.2 | 121.1 | -95.4 | 171.3 | 0 | 0 | 0 | 108.4 | |||||
| 359 | S | 31.6 | Very low | 34.5 | Very low | 117 Ų | 117 | 130.7 Ų | 130.7 | 82% | 0.818 | 80% | 0.798 | S | S | * | * | trans | -158.9 | 164.4 | -173.3 | -169 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 360 | A | 37.9 | Very low | 34.3 | Very low | 87 Ų | 87 | 134.5 Ų | 134.5 | 72% | 0.719 | 81% | 0.805 | S | S | * | * | trans | 64.9 | 133.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 361 | V | 34.9 | Very low | 35.2 | Very low | 144 Ų | 144 | 131.2 Ų | 131.2 | 87% | 0.873 | 80% | 0.803 | S | S | * | * | cis | -149.9 | 157.6 | -10.1 | -100.5 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 362 | G | 32.5 | Very low | 35.4 | Very low | 78 Ų | 78 | 125.1 Ų | 125.1 | 80% | 0.804 | 80% | 0.797 | S | S | * | * | cis | 125.6 | 107.6 | -1.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 363 | G | 32.3 | Very low | 35.5 | Very low | 72 Ų | 72 | 123.4 Ų | 123.4 | 74% | 0.742 | 79% | 0.79 | S | S | * | * | trans | -168.1 | 141.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 364 | F | 32.3 | Very low | 35.5 | Very low | 212 Ų | 212 | 122.6 Ų | 122.6 | 93% | 0.93 | 79% | 0.791 | S | S | * | * | trans | 51.8 | 104.5 | 169.3 | -75.4 | -87 | 0 | 0 | 0 | 120.7 | ||||
| 365 | L | 38 | Very low | 35.6 | Very low | 161 Ų | 161 | 123.2 Ų | 123.2 | 84% | 0.843 | 78% | 0.781 | S | S | * | * | trans | -93.4 | 170.3 | 137.3 | -64.6 | 173.3 | 0 | 0 | 0 | 108.4 | ||||
| 366 | P | 48.7 | Very low | 35.6 | Very low | 106 Ų | 106 | 126.7 Ų | 126.7 | 69% | 0.688 | 78% | 0.784 | S | S | * | * | cis | -119.5 | -164.3 | -2.3 | 42 | -28 | 0 | 0 | 0 | 112.4 | C368 | P366-C368 PolarHBondContact O-N 3.42Š| ||
| 367 | A | 43.4 | Very low | 35.6 | Very low | 106 Ų | 106 | 124.9 Ų | 124.9 | 88% | 0.876 | 78% | 0.782 | S | S | * | * | trans | -68.3 | 122.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 368 | C | 31.4 | Very low | 35.6 | Very low | 123 Ų | 123 | 125.6 Ų | 125.6 | 83% | 0.831 | 79% | 0.787 | S | S | * | * | trans | -113.5 | 158.1 | 175.8 | -72.5 | 0 | 0 | 0 | 0 | 111.7 | P366 | P366-C368 PolarHBondContact O-N 3.42Š| ||
| 369 | A | 29.3 | Very low | 35.5 | Very low | 81 Ų | 81 | 126.8 Ų | 126.8 | 67% | 0.669 | 78% | 0.78 | S | S | * | * | trans | -122.9 | 160.6 | -162.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 370 | Y | 36.1 | Very low | 35.6 | Very low | 219 Ų | 219 | 125.7 Ų | 125.7 | 86% | 0.859 | 77% | 0.772 | S | S | * | * | trans | 65.5 | 172.5 | 163.9 | -73.2 | -64.4 | 0 | 0 | 0 | 115.7 | ||||
| 371 | P | 49.7 | Very low | 35.5 | Very low | 123 Ų | 123 | 125.9 Ų | 125.9 | 80% | 0.799 | 77% | 0.774 | S | S | * | * | cis | -126.5 | -169.7 | 11.8 | 33.2 | -10.9 | 0 | 0 | 0 | 114.9 | ||||
| 372 | A | 34.4 | Very low | 36.5 | Very low | 86 Ų | 86 | 125.3 Ų | 125.3 | 71% | 0.711 | 77% | 0.773 | S | S | * | * | cis | -172.9 | -160.4 | -39.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 373 | S | 31.3 | Very low | 36.6 | Very low | 100 Ų | 100 | 125.4 Ų | 125.4 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | trans | 77.6 | 122.6 | -178.3 | -166.7 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 374 | N | 32.9 | Very low | 36.6 | Very low | 141 Ų | 141 | 126 Ų | 126 | 75% | 0.754 | 78% | 0.781 | S | S | * | * | cis | -160.8 | 157.6 | -1.7 | -102.3 | -4.7 | 0 | 0 | 0 | 106.9 | ||||
| 375 | Q | 35.6 | Very low | 36.6 | Very low | 135 Ų | 135 | 119.2 Ų | 119.2 | 63% | 0.631 | 77% | 0.77 | S | S | * | * | cis | -167.1 | -174.6 | -9.7 | -116.2 | -76.9 | 35.9 | 0 | 0 | 109.9 | ||||
| 376 | H | 33.3 | Very low | 36.5 | Very low | 149 Ų | 149 | 122 Ų | 122 | 69% | 0.69 | 77% | 0.771 | S | S | * | * | trans | -23.7 | 143.9 | 165.6 | 49.4 | 46.3 | 0 | 0 | 0 | 118.7 | ||||
| 377 | G | 35.3 | Very low | 36 | Very low | 75 Ų | 75 | 124.5 Ų | 124.5 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | cis | 176.1 | -145.3 | 3.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 378 | V | 31.8 | Very low | 35.9 | Very low | 142 Ų | 142 | 124 Ų | 124 | 86% | 0.861 | 77% | 0.773 | S | S | * | * | cis | -167.1 | 152.3 | -8.8 | -178.3 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 379 | Y | 32.8 | Very low | 36.9 | Very low | 206 Ų | 206 | 124 Ų | 124 | 81% | 0.808 | 77% | 0.772 | S | S | * | * | cis | -168.7 | 124.9 | -40.3 | 174.7 | -104 | 0 | 0 | 0 | 110.7 | ||||
| 380 | S | 33 | Very low | 37.3 | Very low | 93 Ų | 93 | 123.6 Ų | 123.6 | 65% | 0.65 | 78% | 0.776 | S | S | * | * | trans | 68.5 | 152.6 | 162.6 | -61.1 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 381 | A | 37 | Very low | 38.5 | Very low | 92 Ų | 92 | 118.2 Ų | 118.2 | 76% | 0.76 | 77% | 0.767 | S | S | * | * | trans | -111.7 | 161.8 | 154.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 382 | P | 54.5 | Low | 38.4 | Very low | 131 Ų | 131 | 118.3 Ų | 118.3 | 85% | 0.851 | 77% | 0.768 | S | S | * | * | -156 | -169.7 | 87.6 | 42.7 | -23.8 | 0 | 0 | 0 | 114.8 | |||||
| 383 | G | 35.1 | Very low | 38.8 | Very low | 81 Ų | 81 | 124.3 Ų | 124.3 | 84% | 0.835 | 77% | 0.772 | S | S | * | * | trans | 109.7 | 142.5 | 160.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 384 | G | 32.4 | Very low | 40.1 | Very low | 85 Ų | 85 | 125.5 Ų | 125.5 | 88% | 0.876 | 78% | 0.778 | S | S | * | * | trans | -141.2 | 179.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 385 | G | 33 | Very low | 41.2 | Very low | 69 Ų | 69 | 123.5 Ų | 123.5 | 71% | 0.711 | 77% | 0.773 | S | S | * | * | trans | 115.5 | 145.2 | 165.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 386 | Y | 34.9 | Very low | 41.3 | Very low | 219 Ų | 219 | 121.7 Ų | 121.7 | 86% | 0.859 | 78% | 0.781 | S | S | * | * | trans | 75.4 | 124 | 159.9 | -68.7 | -84.7 | 0 | 0 | 0 | 121.4 | ||||
| 387 | L | 38.1 | Very low | 41.4 | Very low | 158 Ų | 158 | 123.9 Ų | 123.9 | 83% | 0.827 | 79% | 0.791 | S | S | * | * | trans | 68.2 | 116.1 | 146 | -61.1 | 169.1 | 0 | 0 | 0 | 120.1 | ||||
| 388 | A | 42.4 | Very low | 41.5 | Very low | 95 Ų | 95 | 123.5 Ų | 123.5 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | -90.4 | 147.6 | 148.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 389 | P | 52.7 | Low | 42.8 | Very low | 124 Ų | 124 | 122.7 Ų | 122.7 | 81% | 0.805 | 79% | 0.785 | S | S | * | * | trans | -108.4 | 153.4 | 139.8 | -8.5 | 27.9 | 0 | 0 | 0 | 111.4 | ||||
| 390 | G | 37.3 | Very low | 44.3 | Very low | 72 Ų | 72 | 118 Ų | 118 | 74% | 0.742 | 78% | 0.78 | S | S | * | * | trans | -81.5 | 171.3 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 391 | P | 60.7 | Low | 44.3 | Very low | 106 Ų | 106 | 121.5 Ų | 121.5 | 69% | 0.688 | 79% | 0.791 | S | S | * | * | trans | -94.3 | 169.4 | -174.4 | 38.5 | -36.9 | 0 | 0 | 0 | 113.6 | ||||
| 392 | P | 48.5 | Very low | 44.3 | Very low | 125 Ų | 125 | 121.3 Ų | 121.3 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | trans | -108.4 | 143.1 | 142.6 | 34.5 | -27.3 | 0 | 0 | 0 | 111.6 | ||||
| 393 | W | 42.5 | Very low | 44.3 | Very low | 212 Ų | 212 | 120.8 Ų | 120.8 | 80% | 0.803 | 79% | 0.786 | S | S | * | * | trans | -84.7 | -177.8 | 168.1 | -68.5 | 33.9 | 0 | 0 | 0 | 109.9 | P395 | W393-P395 HydrophobicContact CE3-CB 4.31Š| ||
| 394 | P | 57.9 | Low | 44.9 | Very low | 125 Ų | 125 | 123.3 Ų | 123.3 | 81% | 0.812 | 79% | 0.787 | S | S | * | * | -139.9 | 154.2 | 95.2 | 37.3 | -25.5 | 0 | 0 | 0 | 115.4 | |||||
| 395 | P | 56.6 | Low | 44.9 | Very low | 99 Ų | 99 | 122.8 Ų | 122.8 | 64% | 0.643 | 78% | 0.782 | S | S | * | * | trans | -98.6 | 156.6 | 174.6 | 38.1 | -33.9 | 0 | 0 | 0 | 113.6 | W393 | W393-P395 HydrophobicContact CE3-CB 4.31Š| ||
| 396 | A | 37.4 | Very low | 45.1 | Very low | 97 Ų | 97 | 124.7 Ų | 124.7 | 80% | 0.802 | 79% | 0.791 | S | S | * | * | trans | -161.4 | 147.7 | 166 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 397 | Q | 34.9 | Very low | 44.9 | Very low | 195 Ų | 195 | 117.3 Ų | 117.3 | 91% | 0.911 | 78% | 0.781 | S | S | * | * | cis | -159.3 | 176.8 | -30.6 | -126.1 | 168.7 | 12.9 | 0 | 0 | 108.8 | ||||
| 398 | G | 37.3 | Very low | 44.9 | Very low | 68 Ų | 68 | 117.1 Ų | 117.1 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -101.3 | -172.5 | -165.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 399 | P | 60.7 | Low | 44.5 | Very low | 125 Ų | 125 | 116.9 Ų | 116.9 | 81% | 0.812 | 78% | 0.784 | S | S | * | * | trans | -83.8 | -161.8 | 174.1 | 41.6 | -40 | 0 | 0 | 0 | 110.8 | ||||
| 400 | P | 63.8 | Low | 44.1 | Very low | 108 Ų | 108 | 117.2 Ų | 117.2 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | cis | -143.1 | -137 | 7.2 | 44.9 | -22.3 | 0 | 0 | 0 | 115.3 | ||||
| 401 | L | 33.6 | Very low | 44 | Very low | 165 Ų | 165 | 123 Ų | 123 | 86% | 0.864 | 79% | 0.792 | S | S | * | * | trans | 91.1 | 142.7 | 173.3 | -52 | 178.6 | 0 | 0 | 0 | 115.7 | ||||
| 402 | A | 36.3 | Very low | 42.6 | Very low | 88 Ų | 88 | 121.3 Ų | 121.3 | 73% | 0.727 | 79% | 0.793 | S | S | * | * | cis | -157.1 | 170.5 | -0.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 403 | P | 53.3 | Low | 41.8 | Very low | 121 Ų | 121 | 119 Ų | 119 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | trans | -87.7 | -170.4 | 176.6 | 40.2 | -39.3 | 0 | 0 | 0 | 112.4 | ||||
| 404 | P | 49.2 | Very low | 41.5 | Very low | 133 Ų | 133 | 117.3 Ų | 117.3 | 86% | 0.864 | 79% | 0.793 | S | S | * | * | cis | -139.9 | -176.3 | 11.7 | 44.9 | -25.9 | 0 | 0 | 0 | 117.8 | ||||
| 405 | G | 32.5 | Very low | 40.6 | Very low | 75 Ų | 75 | 120.1 Ų | 120.1 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | -168.9 | 148 | 168.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 406 | A | 36.7 | Very low | 39.7 | Very low | 109 Ų | 109 | 119.5 Ų | 119.5 | 90% | 0.901 | 80% | 0.803 | S | S | * | * | trans | -65.5 | 160.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 407 | G | 31.5 | Very low | 39.5 | Very low | 63 Ų | 63 | 119.5 Ų | 119.5 | 65% | 0.649 | 80% | 0.804 | S | S | * | * | cis | 116.7 | 145.6 | 10.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 408 | V | 36.6 | Very low | 39.5 | Very low | 154 Ų | 154 | 114.5 Ų | 114.5 | 93% | 0.933 | 80% | 0.796 | S | S | * | * | trans | 64.9 | 143.8 | -176.2 | -174.3 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 409 | A | 34.6 | Very low | 39.6 | Very low | 90 Ų | 90 | 119.7 Ų | 119.7 | 74% | 0.744 | 80% | 0.803 | S | S | * | * | cis | -175.4 | -176.3 | -35.9 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 410 | V | 44.3 | Very low | 38.3 | Very low | 131 Ų | 131 | 119.4 Ų | 119.4 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | trans | -56 | 133.8 | 176.1 | 171.6 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 411 | H | 36.2 | Very low | 36.7 | Very low | 195 Ų | 195 | 123.6 Ų | 123.6 | 90% | 0.903 | 81% | 0.807 | S | S | * | * | trans | -168.5 | 159.5 | 137.8 | -82.9 | -60.6 | 0 | 0 | 0 | 108.2 | ||||
| 412 | G | 29.8 | Very low | 36.6 | Very low | 70 Ų | 70 | 124.9 Ų | 124.9 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | cis | 140 | 118 | -3.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 413 | G | 32.1 | Very low | 36.9 | Very low | 76 Ų | 76 | 128.8 Ų | 128.8 | 78% | 0.784 | 81% | 0.809 | S | S | * | * | trans | 91.3 | 131 | -173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 414 | E | 36.7 | Very low | 36.5 | Very low | 176 Ų | 176 | 128.6 Ų | 128.6 | 82% | 0.822 | 81% | 0.807 | S | S | * | * | cis | 78.7 | 114.2 | 29.8 | -159.1 | -167.7 | 147.5 | 0 | 0 | 115.5 | ||||
| 415 | L | 38.2 | Very low | 35.5 | Very low | 184 Ų | 184 | 127.3 Ų | 127.3 | 96% | 0.963 | 80% | 0.802 | S | S | * | * | trans | -143.2 | 147.9 | 147.9 | -84.9 | 179.2 | 0 | 0 | 0 | 108.2 | ||||
| 416 | A | 37.1 | Very low | 35.6 | Very low | 86 Ų | 86 | 134 Ų | 134 | 71% | 0.711 | 80% | 0.804 | S | S | * | * | trans | -134.3 | 149.9 | -163.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 417 | A | 34.4 | Very low | 35.2 | Very low | 98 Ų | 98 | 137 Ų | 137 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | trans | -160.9 | 124.3 | 155.2 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 418 | A | 35.4 | Very low | 35.3 | Very low | 90 Ų | 90 | 138.8 Ų | 138.8 | 74% | 0.744 | 80% | 0.797 | S | S | * | * | cis | 105.2 | 143.2 | 34.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 419 | M | 38.5 | Very low | 35.2 | Very low | 176 Ų | 176 | 136.1 Ų | 136.1 | 87% | 0.867 | 79% | 0.792 | S | S | * | * | trans | 96.2 | 66.2 | 169.3 | -50.4 | -164 | -174 | 0 | 0 | 120.8 | ||||
| 420 | T | 33.5 | Very low | 35.1 | Very low | 120 Ų | 120 | 138.5 Ų | 138.5 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | 45.1 | 118.4 | 103.5 | -48.1 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 421 | F | 29.8 | Very low | 34.7 | Very low | 195 Ų | 195 | 143.5 Ų | 143.5 | 86% | 0.855 | 80% | 0.796 | S | S | * | * | trans | 71.3 | 155.9 | 155.8 | -80.7 | -133.9 | 0 | 0 | 0 | 116.8 | ||||
| 422 | K | 32.6 | Very low | 34.6 | Very low | 193 Ų | 193 | 143.8 Ų | 143.8 | 84% | 0.839 | 80% | 0.795 | S | S | * | * | cis | -155.6 | 144.4 | 34.7 | -174.3 | 172.7 | 179.2 | -179 | 0 | 113.6 | ||||
| 423 | H | 43 | Very low | 35.9 | Very low | 170 Ų | 170 | 144.9 Ų | 144.9 | 79% | 0.787 | 79% | 0.789 | S | S | * | * | trans | -92.7 | 158.2 | 169.8 | -134.4 | -72.2 | 0 | 0 | 0 | 111.1 | ||||
| 424 | P | 42.9 | Very low | 36.4 | Very low | 116 Ų | 116 | 147.6 Ų | 147.6 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | trans | -121.3 | 167.7 | 147.2 | 36 | -28.3 | 0 | 0 | 0 | 112.7 | ||||
| 425 | S | 29.1 | Very low | 36.4 | Very low | 107 Ų | 107 | 144.6 Ų | 144.6 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | trans | -129.4 | 129.7 | -177.7 | -177.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 426 | R | 34.4 | Very low | 36.2 | Very low | 216 Ų | 216 | 141.9 Ų | 141.9 | 82% | 0.815 | 79% | 0.788 | S | S | * | * | 22.2 | 122.9 | 129.3 | -176.9 | -169.9 | -176.9 | 179.9 | 1.8 | 119.2 | |||||
| 427 | E | 29.2 | Very low | 35.9 | Very low | 170 Ų | 170 | 141 Ų | 141 | 79% | 0.794 | 79% | 0.787 | S | S | * | * | trans | -153.3 | 156.9 | 133.5 | -80.9 | -113.3 | 92.9 | 0 | 0 | 106.7 | ||||
| 428 | V | 32.9 | Very low | 35.8 | Very low | 101 Ų | 101 | 142.1 Ų | 142.1 | 61% | 0.612 | 79% | 0.789 | S | S | * | * | cis | 108 | 141.4 | 12.3 | 172.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 429 | A | 33.6 | Very low | 35.8 | Very low | 99 Ų | 99 | 147.3 Ų | 147.3 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | 64.2 | 159.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 430 | D | 33.5 | Very low | 35.7 | Very low | 140 Ų | 140 | 142.7 Ų | 142.7 | 75% | 0.749 | 79% | 0.785 | S | S | * | * | cis | -169.7 | 143 | -33.8 | 172.2 | -105.2 | 0 | 0 | 0 | 107.4 | ||||
| 431 | R | 35.1 | Very low | 36.5 | Very low | 235 Ų | 235 | 142.4 Ų | 142.4 | 89% | 0.887 | 79% | 0.785 | S | S | * | * | trans | 165.4 | 160.5 | 141.9 | -91.1 | 162.9 | -172.3 | -164.2 | 0.3 | 113.9 | ||||
| 432 | K | 35.2 | Very low | 36.7 | Very low | 201 Ų | 201 | 140.3 Ų | 140.3 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -108.6 | -164.4 | -170.4 | -137.5 | -163.3 | 166.7 | -178.1 | 0 | 111.3 | ||||
| 433 | P | 57 | Low | 36.8 | Very low | 93 Ų | 93 | 135.2 Ų | 135.2 | 60% | 0.604 | 78% | 0.777 | S | S | * | * | trans | -116 | -166 | -136.1 | 42.8 | -24 | 0 | 0 | 0 | 113.3 | ||||
| 434 | P | 42.4 | Very low | 36.5 | Very low | 133 Ų | 133 | 134.8 Ų | 134.8 | 86% | 0.864 | 78% | 0.779 | S | S | * | * | trans | -116 | 161.9 | 135 | 35.7 | -31.7 | 0 | 0 | 0 | 112.1 | ||||
| 435 | S | 35.8 | Very low | 36 | Very low | 114 Ų | 114 | 134.3 Ų | 134.3 | 80% | 0.797 | 78% | 0.779 | S | S | * | * | trans | -135.8 | 137.3 | -171.2 | 58.2 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 436 | S | 34 | Very low | 36.3 | Very low | 127 Ų | 127 | 134 Ų | 134 | 89% | 0.888 | 78% | 0.777 | S | S | * | * | trans | -160.5 | 139.8 | 154.8 | 55 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 437 | G | 32.3 | Very low | 36.5 | Very low | 67 Ų | 67 | 131.7 Ų | 131.7 | 69% | 0.691 | 78% | 0.779 | S | S | * | * | cis | 157.1 | 134 | -10.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 438 | S | 32.5 | Very low | 37.1 | Very low | 122 Ų | 122 | 132.6 Ų | 132.6 | 85% | 0.853 | 78% | 0.783 | S | S | * | * | trans | 70 | 151.8 | 176 | -49.1 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 439 | K | 33.7 | Very low | 37.1 | Very low | 199 Ų | 199 | 131.1 Ų | 131.1 | 87% | 0.865 | 79% | 0.789 | S | S | * | * | cis | -155 | 148.6 | -11 | -128.5 | -174.7 | 177.5 | -177.6 | 0 | 110.6 | ||||
| 440 | A | 37.5 | Very low | 37.7 | Very low | 79 Ų | 79 | 134.1 Ų | 134.1 | 65% | 0.653 | 79% | 0.79 | S | S | * | * | trans | -91 | -179.9 | 151.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 441 | P | 50.7 | Low | 38.6 | Very low | 113 Ų | 113 | 133.5 Ų | 133.5 | 73% | 0.734 | 79% | 0.794 | S | S | * | * | cis | -143.6 | -165.2 | 20.1 | 42.8 | -20.4 | 0 | 0 | 0 | 116.6 | ||||
| 442 | D | 33.2 | Very low | 39.3 | Very low | 152 Ų | 152 | 129.6 Ų | 129.6 | 81% | 0.813 | 79% | 0.789 | S | S | * | * | trans | -21.8 | 152.8 | 167.2 | -57.3 | -107.3 | 0 | 0 | 0 | 120.6 | ||||
| 443 | A | 35.1 | Very low | 40.6 | Very low | 86 Ų | 86 | 125.4 Ų | 125.4 | 71% | 0.711 | 78% | 0.782 | S | S | * | * | 174 | 131.8 | 101.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | |||||
| 444 | L | 36.8 | Very low | 40 | Very low | 161 Ų | 161 | 125 Ų | 125 | 84% | 0.843 | 79% | 0.786 | S | S | * | * | trans | 64.9 | 153.5 | 133.9 | -70.5 | 169.8 | 0 | 0 | 0 | 125.4 | ||||
| 445 | S | 31.8 | Very low | 40.1 | Very low | 106 Ų | 106 | 123.8 Ų | 123.8 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | trans | 71.8 | 145.7 | 158.6 | -62.4 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 446 | S | 35.1 | Very low | 40.8 | Very low | 101 Ų | 101 | 124.9 Ų | 124.9 | 71% | 0.706 | 78% | 0.783 | S | S | * | * | cis | -162.3 | 154.8 | -17.6 | -92.9 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 447 | L | 40 | Very low | 41.5 | Very low | 166 Ų | 166 | 127.8 Ų | 127.8 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | -174.2 | 161.1 | 82.2 | -102.3 | 167.7 | 0 | 0 | 0 | 112.7 | |||||
| 448 | H | 41.2 | Very low | 42 | Very low | 190 Ų | 190 | 130.8 Ų | 130.8 | 88% | 0.88 | 81% | 0.809 | S | S | * | * | trans | -77.3 | 166.5 | 168.3 | -76.5 | -135.1 | 0 | 0 | 0 | 111.4 | ||||
| 449 | G | 31.6 | Very low | 42.5 | Very low | 70 Ų | 70 | 131.3 Ų | 131.3 | 72% | 0.722 | 81% | 0.807 | S | S | * | * | cis | 175.4 | -164.9 | 1 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 450 | L | 47.2 | Very low | 42.9 | Very low | 162 Ų | 162 | 127.5 Ų | 127.5 | 85% | 0.848 | 80% | 0.803 | S | S | * | * | trans | -83.2 | 160.2 | 177 | -53.9 | 172.2 | 0 | 0 | 0 | 111.1 | ||||
| 451 | P | 52.4 | Low | 43.3 | Very low | 127 Ų | 127 | 130.4 Ų | 130.4 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | -141.1 | 166.4 | 80.4 | 38.4 | -22.6 | 0 | 0 | 0 | 116.4 | |||||
| 452 | I | 49.8 | Very low | 42.8 | Very low | 152 Ų | 152 | 131.4 Ų | 131.4 | 78% | 0.779 | 82% | 0.817 | S | S | * | * | trans | -101.9 | 176.5 | 163.1 | 9.2 | 174.3 | 0 | 0 | 0 | 107.7 | ||||
| 453 | P | 61.5 | Low | 43.4 | Very low | 113 Ų | 113 | 130.1 Ų | 130.1 | 73% | 0.734 | 82% | 0.817 | S | S | * | * | cis | -147.5 | -175 | 24.3 | 44.8 | -24.5 | 0 | 0 | 0 | 118.5 | ||||
| 454 | A | 45.6 | Very low | 44 | Very low | 84 Ų | 84 | 133.2 Ų | 133.2 | 69% | 0.694 | 83% | 0.825 | S | S | * | * | trans | 88.7 | 139.4 | 136.2 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 455 | S | 45.1 | Very low | 44.6 | Very low | 109 Ų | 109 | 131.1 Ų | 131.1 | 76% | 0.762 | 82% | 0.824 | S | S | * | * | trans | 63.7 | 108.1 | 144.7 | -66.3 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 456 | T | 49.6 | Very low | 45.6 | Very low | 137 Ų | 137 | 133.2 Ų | 133.2 | 84% | 0.84 | 83% | 0.831 | S | S | * | * | 79.5 | 112.6 | 66.5 | -146.3 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 457 | S | 48.5 | Very low | 46.6 | Very low | 187 Ų | 187 | 136.1 Ų | 136.1 | 100% | 1.308 | 84% | 0.842 | S | S | * | * | -164.3 | 0 | 114.2 | -170.2 | 0 | 0 | 0 | 0 | 110.2 |
Retrieved 457 of 457 residues in 997 ms
(Link to these results)