| 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 | 37.6 | Very low | 38 | Very low | 204 Ų | 204 | 131.6 Ų | 131.6 | 100% | 1.005 | 76% | 0.759 | S | S | * | * | 0 | 87.6 | 0 | -68.6 | 149.2 | -178.3 | 0 | 0 | 105.3 | |||||
| 2 | E | 38.3 | Very low | 37.4 | Very low | 161 Ų | 161 | 130.9 Ų | 130.9 | 75% | 0.752 | 77% | 0.767 | S | S | * | * | 65.6 | 130.3 | 53.7 | -52.7 | 118.3 | -131 | 0 | 0 | 110 | |||||
| 3 | D | 41 | Very low | 37.1 | Very low | 146 Ų | 146 | 131.5 Ų | 131.5 | 78% | 0.781 | 77% | 0.773 | S | S | * | * | cis | -123.2 | 165.1 | 7.5 | -73.4 | -83.1 | 0 | 0 | 0 | 110.9 | ||||
| 4 | E | 42 | Very low | 36.8 | Very low | 160 Ų | 160 | 129.4 Ų | 129.4 | 75% | 0.748 | 77% | 0.769 | S | S | * | * | cis | 70.4 | 138.9 | 44.3 | -115.1 | -77.8 | 70.1 | 0 | 0 | 114.3 | S6 | E4-S6 PolarHBondContact OE1-OG 2.64Š| ||
| 5 | G | 35.9 | Very low | 36.6 | Very low | 73 Ų | 73 | 130.5 Ų | 130.5 | 75% | 0.753 | 78% | 0.777 | S | S | * | * | trans | 148 | 93.4 | -170.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 6 | S | 39.2 | Very low | 36.3 | Very low | 97 Ų | 97 | 128.8 Ų | 128.8 | 68% | 0.678 | 77% | 0.773 | S | S | * | * | trans | -112.1 | -177.4 | -165.5 | -70.5 | 0 | 0 | 0 | 0 | 115.3 | E4 | E4-S6 PolarHBondContact OE1-OG 2.64Š| ||
| 7 | H | 35.2 | Very low | 36.1 | Very low | 189 Ų | 189 | 129.8 Ų | 129.8 | 88% | 0.875 | 78% | 0.779 | S | S | * | * | trans | 81.1 | 146.5 | 171.3 | -97.4 | -99.6 | 0 | 0 | 0 | 118.3 | ||||
| 8 | A | 36.4 | Very low | 35.8 | Very low | 83 Ų | 83 | 129.1 Ų | 129.1 | 69% | 0.686 | 78% | 0.782 | S | S | * | * | cis | -149.4 | 152.3 | 7 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 9 | E | 33.2 | Very low | 35.5 | Very low | 164 Ų | 164 | 126.3 Ų | 126.3 | 77% | 0.766 | 78% | 0.781 | S | S | * | * | trans | -77.3 | 168.9 | 154.8 | -94.3 | -77.4 | 116.5 | 0 | 0 | 110.2 | G11 | E9-G11 PolarHBondContact OE2-N 2.9Š| ||
| 10 | P | 47.7 | Very low | 35.1 | Very low | 120 Ų | 120 | 125.9 Ų | 125.9 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | cis | -147.2 | 160.6 | 31.2 | 41.5 | -20.9 | 0 | 0 | 0 | 121.1 | ||||
| 11 | G | 31.5 | Very low | 35.2 | Very low | 51 Ų | 51 | 125.8 Ų | 125.8 | 53% | 0.526 | 78% | 0.783 | S | S | . | * | 96.5 | 119.2 | 118.7 | 0 | 0 | 0 | 0 | 0 | 122.9 | E9 | E9-G11 PolarHBondContact OE2-N 2.9Š| |||
| 12 | S | 30.6 | Very low | 35.1 | Very low | 123 Ų | 123 | 124.2 Ų | 124.2 | 86% | 0.86 | 77% | 0.772 | S | S | * | * | trans | 70.7 | 151 | 157 | -47.5 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 13 | V | 34 | Very low | 34.8 | Very low | 139 Ų | 139 | 122.1 Ų | 122.1 | 84% | 0.842 | 77% | 0.771 | S | S | * | * | cis | -135.4 | 156.4 | 22.1 | 173.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 14 | S | 32.8 | Very low | 34.7 | Very low | 102 Ų | 102 | 123.1 Ų | 123.1 | 71% | 0.713 | 78% | 0.776 | S | S | * | * | trans | -77 | 144.2 | 179.6 | 55.7 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 15 | V | 34.2 | Very low | 34.4 | Very low | 146 Ų | 146 | 120.7 Ų | 120.7 | 89% | 0.885 | 77% | 0.773 | S | S | * | * | trans | -136.5 | 136.1 | 145.1 | -178.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 16 | S | 30.8 | Very low | 34 | Very low | 103 Ų | 103 | 125.7 Ų | 125.7 | 72% | 0.72 | 78% | 0.777 | S | S | * | * | trans | -83.3 | 141.9 | -170.3 | -49.7 | 0 | 0 | 0 | 0 | 114 | ||||
| 17 | V | 32.8 | Very low | 33.7 | Very low | 145 Ų | 145 | 129.6 Ų | 129.6 | 88% | 0.879 | 79% | 0.789 | S | S | * | * | trans | -99.8 | 107.7 | 162.9 | 176.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 18 | S | 31.5 | Very low | 33.5 | Very low | 118 Ų | 118 | 127.4 Ų | 127.4 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | -92.7 | 109.1 | 169.4 | -67.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 19 | G | 29.7 | Very low | 33.5 | Very low | 75 Ų | 75 | 129.4 Ų | 129.4 | 77% | 0.773 | 79% | 0.785 | S | S | * | * | trans | -78.2 | 147 | 164.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 20 | S | 27.3 | Very low | 33.4 | Very low | 119 Ų | 119 | 127.1 Ų | 127.1 | 83% | 0.832 | 78% | 0.778 | S | S | * | * | trans | -147.1 | 140.9 | 164.7 | -169.5 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 21 | T | 38.1 | Very low | 33 | Very low | 123 Ų | 123 | 129.1 Ų | 129.1 | 76% | 0.755 | 78% | 0.783 | S | S | * | * | trans | -108.1 | 130 | -167.1 | 49.3 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 22 | H | 34.1 | Very low | 33.2 | Very low | 171 Ų | 171 | 132.5 Ų | 132.5 | 79% | 0.792 | 79% | 0.793 | S | S | * | * | trans | -147.3 | 107.3 | 158.1 | -89.2 | -68.5 | 0 | 0 | 0 | 108.5 | ||||
| 23 | T | 33.9 | Very low | 33.3 | Very low | 118 Ų | 118 | 134.3 Ų | 134.3 | 72% | 0.724 | 79% | 0.788 | S | S | * | * | 60.8 | 95.9 | 84.6 | 66.7 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 24 | L | 38.3 | Very low | 33.4 | Very low | 167 Ų | 167 | 135.5 Ų | 135.5 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | trans | -74.7 | 153.4 | 151.8 | -81.2 | 163.3 | 0 | 0 | 0 | 109.2 | ||||
| 25 | P | 36.1 | Very low | 33.4 | Very low | 108 Ų | 108 | 138 Ų | 138 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | -146 | 176.6 | 98 | 41.7 | -28.1 | 0 | 0 | 0 | 115.4 | |||||
| 26 | Q | 27.4 | Very low | 33.5 | Very low | 179 Ų | 179 | 138.8 Ų | 138.8 | 84% | 0.836 | 79% | 0.787 | S | S | * | * | trans | 75.7 | 99.2 | 146.6 | -152.4 | 159.6 | 7.9 | 0 | 0 | 118.8 | ||||
| 27 | L | 33.2 | Very low | 33.6 | Very low | 178 Ų | 178 | 138 Ų | 138 | 93% | 0.932 | 78% | 0.781 | S | S | * | * | trans | -80.5 | 134 | 156.2 | -86 | 159.2 | 0 | 0 | 0 | 109.6 | ||||
| 28 | Q | 29.1 | Very low | 33.9 | Very low | 144 Ų | 144 | 136.5 Ų | 136.5 | 67% | 0.673 | 78% | 0.775 | S | S | * | * | trans | -110.6 | 131.8 | 174.4 | 176.3 | 173 | -54.3 | 0 | 0 | 109.4 | D30 | Q28-D30 PolarHBondContact NE2-OD2 3.19Å; Q28-D30 PolarHBondContact O-N 3.41Å | ||
| 29 | P | 38.1 | Very low | 33.8 | Very low | 124 Ų | 124 | 136.7 Ų | 136.7 | 81% | 0.805 | 78% | 0.776 | S | S | * | * | trans | -84.2 | 90.4 | 175.7 | 33.2 | -31.9 | 0 | 0 | 0 | 110.3 | ||||
| 30 | D | 30 | Very low | 34 | Very low | 116 Ų | 116 | 138.2 Ų | 138.2 | 62% | 0.62 | 78% | 0.775 | S | S | * | * | trans | -80.7 | 120.1 | 176.2 | -126.8 | -83.9 | 0 | 0 | 0 | 111.4 | Q28 T32 | Q28-D30 PolarHBondContact NE2-OD2 3.19Å; Q28-D30 PolarHBondContact O-N 3.41Å; D30-T32 PolarHBondContact O-N 3.29Å | ||
| 31 | N | 39.8 | Very low | 34.5 | Very low | 162 Ų | 162 | 136.4 Ų | 136.4 | 87% | 0.866 | 77% | 0.767 | S | S | * | * | trans | -79.1 | 84.3 | 178.4 | -98.1 | -52.9 | 0 | 0 | 0 | 110.1 | E33 | N31-E33 PolarHBondContact O-N 3.37Š| ||
| 32 | T | 35.6 | Very low | 34.5 | Very low | 122 Ų | 122 | 136.8 Ų | 136.8 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | trans | -83.1 | 96.3 | 168.2 | -40.7 | 0 | 0 | 0 | 0 | 110.4 | D30 L34 | D30-T32 PolarHBondContact O-N 3.29Å; T32-L34 PolarHBondContact O-N 3.44Å | ||
| 33 | E | 32.8 | Very low | 34.5 | Very low | 162 Ų | 162 | 134.5 Ų | 134.5 | 76% | 0.757 | 77% | 0.773 | S | S | * | * | trans | -44.7 | 130.8 | 164 | -169.5 | -178.3 | 116.9 | 0 | 0 | 110.3 | N31 Q35 | N31-E33 PolarHBondContact O-N 3.37Å; E33-Q35 PolarHBondContact O-N 2.95Å | ||
| 34 | L | 35.7 | Very low | 34.5 | Very low | 164 Ų | 164 | 133.4 Ų | 133.4 | 86% | 0.859 | 77% | 0.771 | S | S | * | * | trans | -76 | 71.9 | -178.9 | -90.7 | 172.9 | 0 | 0 | 0 | 111.1 | T32 I36 | T32-L34 PolarHBondContact O-N 3.44Å; L34-I36 WeakPolarHBondContact O-CG1 3.39Å; L34-I36 PolarHBondContact O-N 3.02Å | ||
| 35 | Q | 32.9 | Very low | 35 | Very low | 153 Ų | 153 | 131 Ų | 131 | 72% | 0.715 | 77% | 0.765 | S | S | * | * | trans | -66.9 | 93.6 | 176.9 | -159.6 | -179.5 | 25.6 | 0 | 0 | 109.4 | E33 S37 | E33-Q35 PolarHBondContact O-N 2.95Å; Q35-S37 PolarHBondContact O-N 3.19Å | ||
| 36 | I | 36.4 | Very low | 35.1 | Very low | 164 Ų | 164 | 131.3 Ų | 131.3 | 84% | 0.841 | 77% | 0.765 | S | S | * | * | trans | -69.1 | 80.8 | -178.9 | -50.2 | -178.1 | 0 | 0 | 0 | 109.7 | L34 | L34-I36 WeakPolarHBondContact O-CG1 3.39Å; L34-I36 PolarHBondContact O-N 3.02Å | ||
| 37 | S | 32 | Very low | 35.9 | Very low | 85 Ų | 85 | 128.8 Ų | 128.8 | 59% | 0.594 | 76% | 0.764 | S | S | * | * | trans | -64.8 | 129 | 173.6 | -68 | 0 | 0 | 0 | 0 | 109.6 | Q35 S39 | Q35-S37 PolarHBondContact O-N 3.19Å; S37-S39 PolarHBondContact O-N 3.14Å | ||
| 38 | P | 39.4 | Very low | 36.4 | Very low | 115 Ų | 115 | 126.7 Ų | 126.7 | 75% | 0.747 | 76% | 0.759 | S | S | * | * | trans | -66.4 | 107.1 | 174.9 | 26.8 | -32.7 | 0 | 0 | 0 | 109.1 | S40 | P38-S40 VanDerWaalsContact C-N 3.26Å; P38-S40 PolarHBondContact O-N 2.88Å | ||
| 39 | S | 30.4 | Very low | 36.7 | Very low | 121 Ų | 121 | 122.5 Ų | 122.5 | 85% | 0.846 | 76% | 0.755 | S | S | * | * | trans | -73.1 | 80.4 | -179.8 | -169 | 0 | 0 | 0 | 0 | 110.8 | S37 A41 | S37-S39 PolarHBondContact O-N 3.14Å; S39-A41 VanDerWaalsContact C-N 3.33Å; S39-A41 PolarHBondContact O-N 3.21Å | ||
| 40 | S | 33.7 | Very low | 36.8 | Very low | 107 Ų | 107 | 122.9 Ų | 122.9 | 75% | 0.748 | 76% | 0.755 | S | S | * | * | trans | -66.8 | 89.5 | 170 | -68.5 | 0 | 0 | 0 | 0 | 109.7 | P38 | P38-S40 VanDerWaalsContact C-N 3.26Å; P38-S40 PolarHBondContact O-N 2.88Å | ||
| 41 | A | 37.7 | Very low | 37.1 | Very low | 82 Ų | 82 | 125.3 Ų | 125.3 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | trans | -55.5 | 129.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | S39 C43 | S39-A41 VanDerWaalsContact C-N 3.33Å; S39-A41 PolarHBondContact O-N 3.21Å; A41-C43 PolarHBondContact O-N 2.85Å | ||
| 42 | P | 38.5 | Very low | 37.3 | Very low | 131 Ų | 131 | 126.4 Ų | 126.4 | 85% | 0.851 | 76% | 0.764 | S | S | * | * | trans | -70.2 | 97.3 | -177.5 | 27.6 | -34 | 0 | 0 | 0 | 110.2 | S44 | P42-S44 PolarHBondContact O-N 3.23Š| ||
| 43 | C | 32.8 | Very low | 37.7 | Very low | 122 Ų | 122 | 131.9 Ų | 131.9 | 82% | 0.824 | 77% | 0.771 | S | S | * | * | trans | -65.6 | 116.1 | 174.8 | -168 | 0 | 0 | 0 | 0 | 109.3 | A41 P45 | A41-C43 PolarHBondContact O-N 2.85Å; C43-P45 WeakPolarHBondContact O-CD 3.28Å | ||
| 44 | S | 34.5 | Very low | 38 | Very low | 96 Ų | 96 | 131.6 Ų | 131.6 | 67% | 0.671 | 77% | 0.774 | S | S | * | * | trans | -61.1 | 121.3 | -175.7 | -178 | 0 | 0 | 0 | 0 | 111.9 | P42 T46 | P42-S44 PolarHBondContact O-N 3.23Å; S44-T46 PolarHBondContact O-N 3.37Å | ||
| 45 | P | 48.3 | Very low | 38.4 | Very low | 117 Ų | 117 | 128.7 Ų | 128.7 | 76% | 0.76 | 77% | 0.768 | S | S | * | * | trans | -77 | 107.1 | 168.3 | 30.8 | -30.8 | 0 | 0 | 0 | 109.1 | C43 P47 | C43-P45 WeakPolarHBondContact O-CD 3.28Å; P45-P47 VanDerWaalsContact O-CD 3.31Å; P45-P47 WeakPolarHBondContact O-CD 3.49Å | ||
| 46 | T | 39.5 | Very low | 39.1 | Very low | 114 Ų | 114 | 129.2 Ų | 129.2 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | trans | -62.3 | 119.3 | 172.4 | 28.3 | 0 | 0 | 0 | 0 | 110.6 | S44 T48 | S44-T46 PolarHBondContact O-N 3.37Å; T46-T48 PolarHBondContact O-N 2.61Å | ||
| 47 | P | 42.8 | Very low | 39.5 | Very low | 125 Ų | 125 | 133 Ų | 133 | 81% | 0.812 | 78% | 0.778 | S | S | * | * | trans | -81.3 | 49.7 | -176.7 | 34.4 | -36.2 | 0 | 0 | 0 | 112.1 | P45 G49 | P45-P47 VanDerWaalsContact O-CD 3.31Å; P45-P47 WeakPolarHBondContact O-CD 3.49Å; P47-G49 VanDerWaalsContact C-N 3.27Å; P47-G49 PolarHBondContact O-N 3.06Å | ||
| 48 | T | 44.4 | Very low | 40 | Very low | 134 Ų | 134 | 131.4 Ų | 131.4 | 82% | 0.822 | 78% | 0.775 | S | S | * | * | trans | -85.1 | 70 | 179.4 | -48.9 | 0 | 0 | 0 | 0 | 110.2 | T46 | T46-T48 PolarHBondContact O-N 2.61Š| ||
| 49 | G | 35.7 | Very low | 40.4 | Very low | 57 Ų | 57 | 132.4 Ų | 132.4 | 59% | 0.588 | 78% | 0.782 | S | S | * | * | trans | -175.3 | 53 | -172.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | P47 L51 | P47-G49 VanDerWaalsContact C-N 3.27Å; P47-G49 PolarHBondContact O-N 3.06Å; G49-L51 PolarHBondContact O-N 3.45Å | ||
| 50 | T | 39.2 | Very low | 41.2 | Very low | 132 Ų | 132 | 134.6 Ų | 134.6 | 81% | 0.81 | 78% | 0.783 | S | S | * | * | trans | -60.1 | 95.9 | 179.2 | -45.5 | 0 | 0 | 0 | 0 | 110.3 | K52 | T50-K52 VanDerWaalsContact C-N 3.25Å; T50-K52 PolarHBondContact O-N 3.2Å | ||
| 51 | L | 37.1 | Very low | 41.8 | Very low | 167 Ų | 167 | 134.8 Ų | 134.8 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | -62.9 | 88.1 | 173.6 | -70.6 | 176.1 | 0 | 0 | 0 | 108.9 | G49 R53 | G49-L51 PolarHBondContact O-N 3.45Å; L51-R53 PolarHBondContact O-N 2.9Å | ||
| 52 | K | 43.6 | Very low | 42.8 | Very low | 185 Ų | 185 | 136.2 Ų | 136.2 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | trans | -55.3 | 113.5 | 164.5 | -74.9 | -172.1 | 177.2 | -179.1 | 0 | 106.3 | T50 L54 | T50-K52 VanDerWaalsContact C-N 3.25Å; T50-K52 PolarHBondContact O-N 3.2Å; K52-L54 VanDerWaalsContact C-N 3.3Å; K52-L54 PolarHBondContact O-N 2.91Å | ||
| 53 | R | 43.9 | Very low | 43.3 | Very low | 237 Ų | 237 | 136.7 Ų | 136.7 | 89% | 0.894 | 79% | 0.787 | S | S | * | * | trans | -52.8 | 101.8 | 163.9 | -81.8 | -176 | 170.9 | -170.7 | -1.9 | 106.9 | L51 S55 | L51-R53 PolarHBondContact O-N 2.9Å; R53-S55 PolarHBondContact O-N 3.14Å | ||
| 54 | L | 40.1 | Very low | 43.9 | Very low | 155 Ų | 155 | 135.5 Ų | 135.5 | 81% | 0.812 | 79% | 0.786 | S | S | * | * | trans | -65.3 | 93.4 | 159.2 | -81.6 | 165.8 | 0 | 0 | 0 | 105.3 | K52 L56 | K52-L54 VanDerWaalsContact C-N 3.3Å; K52-L54 PolarHBondContact O-N 2.91Å; L54-L56 VanDerWaalsContact O-CD1 3.31Å; L54-L56 WeakPolarHBondContact O-CD1 3.32Å; L54-L56 PolarHBondContact O-N 3.47Å | ||
| 55 | S | 44.2 | Very low | 44.8 | Very low | 104 Ų | 104 | 136.3 Ų | 136.3 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | trans | -58.4 | 106.8 | 164.3 | -64.6 | 0 | 0 | 0 | 0 | 106.7 | R53 R57 | R53-S55 PolarHBondContact O-N 3.14Å; S55-R57 PolarHBondContact O-N 3.45Å | ||
| 56 | L | 46.4 | Very low | 45.1 | Very low | 164 Ų | 164 | 134.9 Ų | 134.9 | 86% | 0.859 | 79% | 0.791 | S | S | * | * | trans | -67.6 | 74.3 | 170.7 | -87.4 | 73.6 | 0 | 0 | 0 | 109.2 | L54 G58 | L54-L56 VanDerWaalsContact O-CD1 3.31Å; L54-L56 WeakPolarHBondContact O-CD1 3.32Å; L54-L56 PolarHBondContact O-N 3.47Å; L56-G58 PolarHBondContact O-N 3.19Å | ||
| 57 | R | 44.4 | Very low | 45.6 | Very low | 242 Ų | 242 | 133.5 Ų | 133.5 | 91% | 0.913 | 78% | 0.784 | S | S | * | * | trans | -67.5 | 88.1 | 151 | -95.1 | -167.7 | 169.1 | -161.1 | -1.9 | 106.4 | S55 | S55-R57 PolarHBondContact O-N 3.45Š| ||
| 58 | G | 43.8 | Very low | 46 | Very low | 52 Ų | 52 | 134.3 Ų | 134.3 | 54% | 0.536 | 79% | 0.79 | S | S | . | * | trans | -57.7 | 141.7 | 165.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | L56 L60 | L56-G58 PolarHBondContact O-N 3.19Å; G58-L60 PolarHBondContact O-N 3.1Å; G58-L60 VanDerWaalsContact O-N 3.16Å | ||
| 59 | P | 47.7 | Very low | 46.7 | Very low | 136 Ų | 136 | 131.2 Ų | 131.2 | 88% | 0.883 | 78% | 0.784 | S | S | * | * | trans | -65.8 | 114.6 | 172.8 | 27.4 | -32.6 | 0 | 0 | 0 | 109.2 | ||||
| 60 | L | 47.5 | Very low | 48.1 | Very low | 168 Ų | 168 | 135.7 Ų | 135.7 | 88% | 0.88 | 79% | 0.79 | S | S | * | * | trans | -76.4 | 125.7 | 172.1 | -72.4 | 170.3 | 0 | 0 | 0 | 110 | G58 | G58-L60 PolarHBondContact O-N 3.1Å; G58-L60 VanDerWaalsContact O-N 3.16Å | ||
| 61 | S | 45.3 | Very low | 50 | Low | 111 Ų | 111 | 134.8 Ų | 134.8 | 78% | 0.776 | 78% | 0.784 | S | S | * | * | trans | 157.4 | 154.8 | 139.6 | -72.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 62 | P | 59.5 | Low | 52.5 | Low | 111 Ų | 111 | 129.8 Ų | 129.8 | 72% | 0.721 | 76% | 0.763 | S | S | * | * | -132.5 | 173.2 | -55.9 | 37 | -21 | 0 | 0 | 0 | 112.1 | |||||
| 63 | T | 49.2 | Very low | 54.8 | Low | 141 Ų | 141 | 124.4 Ų | 124.4 | 87% | 0.865 | 75% | 0.753 | S | S | * | * | trans | 52.2 | 95.7 | 156.9 | -52.7 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 64 | A | 44.4 | Very low | 57.1 | Low | 98 Ų | 98 | 119.6 Ų | 119.6 | 81% | 0.81 | 74% | 0.744 | S | S | * | * | -161.8 | 145.4 | 127.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 65 | A | 53.6 | Low | 59.7 | Low | 112 Ų | 112 | 116 Ų | 116 | 93% | 0.926 | 73% | 0.728 | S | S | * | * | trans | -80.8 | 128.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 66 | S | 54.6 | Low | 62.1 | Low | 87 Ų | 87 | 114.1 Ų | 114.1 | 61% | 0.608 | 71% | 0.712 | S | S | * | * | trans | -133.1 | 138.1 | 166.1 | -174.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 67 | P | 50.5 | Low | 64.5 | Low | 85 Ų | 85 | 110.8 Ų | 110.8 | 55% | 0.552 | 70% | 0.698 | S | S | * | * | trans | -70 | 149 | -169.7 | 27.5 | -35.4 | 0 | 0 | 0 | 112.8 | G69 | P67-G69 PolarHBondContact O-N 2.94Š| ||
| 68 | P | 50.7 | Low | 66.9 | Low | 143 Ų | 143 | 102.1 Ų | 102.1 | 93% | 0.929 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | 93 | 176.7 | 29.5 | -34.6 | 0 | 0 | 0 | 110.5 | ||
| 69 | G | 59.9 | Low | 69.5 | Low | 68 Ų | 68 | 104.6 Ų | 104.6 | 70% | 0.701 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 166.8 | -21.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | P67 V71 | P67-G69 PolarHBondContact O-N 2.94Å; G69-V71 PolarHBondContact O-N 3.17Å |
| 70 | Q | 63.8 | Low | 71.9 | Confident | 152 Ų | 152 | 102.9 Ų | 102.9 | 71% | 0.71 | 66% | 0.661 | S | S | * | * | trans | -85.8 | 92.3 | 179.4 | -70.6 | -172.3 | -15.1 | 0 | 0 | 112.1 | S72 | Q70-S72 PolarHBondContact O-N 3.4Š| ||
| 71 | V | 78.9 | Confident | 74.3 | Confident | 112 Ų | 112 | 99.6 Ų | 99.6 | 68% | 0.679 | 65% | 0.645 | S | S | * | * | trans | -70.7 | 119.3 | 168.2 | -172.7 | 0 | 0 | 0 | 0 | 108.8 | G69 A73 V76 | G69-V71 PolarHBondContact O-N 3.17Å; V71-A73 PolarHBondContact O-N 3.34Å; V71-V76 HydrophobicContact CG1-CG2 3.66Å | ||
| 72 | S | 91.3 | Very high | 76.7 | Confident | 63 Ų | 63 | 100.2 Ų | 100.2 | 44% | 0.441 | 63% | 0.634 | S | S | . | * | trans | -66.8 | 126.7 | 179.5 | -179.1 | 0 | 0 | 0 | 0 | 111.2 | Q70 I74 T75 V76 | Q70-S72 PolarHBondContact O-N 3.4Å; S72-I74 PolarHBondContact O-N 3.36Å; S72-I74 VanDerWaalsContact O-N 3.17Å; S72-T75 WeakPolarHBondContact O-CB 3.33Å; S72-T75 PolarHBondContact O-N 2.84Å; S72-V76 PolarHBondContact O-N 3.26Å | ||
| 73 | A | 91.8 | Very high | 78.6 | Confident | 71 Ų | 71 | 99.2 Ų | 99.2 | 59% | 0.587 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -56.5 | -33.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | V71 T75 V76 V77 | V71-A73 PolarHBondContact O-N 3.34Å; A73-T75 VanDerWaalsContact C-N 3.3Å; A73-T75 PolarHBondContact O-N 2.98Å; A73-V76 PolarHBondContact O-N 3.45Å; A73-V77 WeakPolarHBondContact O-CG2 3.48Å; A73-V77 PolarHBondContact O-N 3.34Å |
| 74 | I | 91.9 | Very high | 80.9 | Confident | 137 Ų | 137 | 96 Ų | 96 | 70% | 0.703 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -61.6 | -39.7 | 176.1 | -58.1 | 172.8 | 0 | 0 | 0 | 110.7 | S72 V77 A78 | S72-I74 PolarHBondContact O-N 3.36Å; S72-I74 VanDerWaalsContact O-N 3.17Å; I74-V77 PolarHBondContact O-N 3.14Å; I74-A78 WeakPolarHBondContact O-CB 3.4Å; I74-A78 PolarHBondContact O-N 3.29Å |
| 75 | T | 93.6 | Very high | 83.4 | Confident | 80 Ų | 80 | 95.3 Ų | 95.3 | 49% | 0.491 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -70.2 | -35.9 | 176.8 | -49.4 | 0 | 0 | 0 | 0 | 111.7 | S72 A73 L79 | S72-T75 WeakPolarHBondContact O-CB 3.33Å; S72-T75 PolarHBondContact O-N 2.84Å; A73-T75 VanDerWaalsContact C-N 3.3Å; A73-T75 PolarHBondContact O-N 2.98Å; T75-L79 WeakPolarHBondContact O-CG 3.5Å; T75-L79 PolarHBondContact O-N 3.48Å; T75-L79 VanDerWaalsContact O-N 3.1Å |
| 76 | V | 96 | Very high | 85.6 | Confident | 63 Ų | 63 | 94.3 Ų | 94.3 | 38% | 0.382 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.9 | -46.5 | 173.6 | -176.3 | 0 | 0 | 0 | 0 | 110.6 | V71 S72 A73 A78 L79 L80 | V71-V76 HydrophobicContact CG1-CG2 3.66Å; S72-V76 PolarHBondContact O-N 3.26Å; A73-V76 PolarHBondContact O-N 3.45Å; V76-A78 PolarHBondContact O-N 2.9Å; V76-L79 PolarHBondContact O-N 3.49Å; V76-L79 VanDerWaalsContact O-N 3.14Å; V76-L80 HydrophobicContact CG1-CD1 4.08Å; V76-L80 HydrophobicContact CG1-CG 4.42Å; V76-L80 WeakPolarHBondContact O-CG 3.34Å; V76-L80 PolarHBondContact O-N 3.26Å |
| 77 | V | 95.8 | Very high | 87.7 | Confident | 95 Ų | 95 | 96.4 Ų | 96.4 | 58% | 0.576 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -60.3 | -43.5 | 176.7 | 171.7 | 0 | 0 | 0 | 0 | 111.3 | A73 I74 L79 L80 D81 | A73-V77 WeakPolarHBondContact O-CG2 3.48Å; A73-V77 PolarHBondContact O-N 3.34Å; I74-V77 PolarHBondContact O-N 3.14Å; V77-L79 VanDerWaalsContact C-N 3.28Å; V77-L79 PolarHBondContact O-N 2.96Å; V77-L80 PolarHBondContact O-N 2.87Å; V77-D81 WeakPolarHBondContact O-CB 3.38Å; V77-D81 PolarHBondContact O-N 3.18Å |
| 78 | A | 96.2 | Very high | 89.9 | Confident | 59 Ų | 59 | 97.9 Ų | 97.9 | 49% | 0.488 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.5 | -28.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | I74 V76 K82 | I74-A78 WeakPolarHBondContact O-CB 3.4Å; I74-A78 PolarHBondContact O-N 3.29Å; V76-A78 PolarHBondContact O-N 2.9Å; A78-K82 WeakPolarHBondContact O-CB 3.39Å; A78-K82 PolarHBondContact O-N 3.48Å |
| 79 | L | 97.4 | Very high | 92.2 | Very high | 105 Ų | 105 | 93.8 Ų | 93.8 | 55% | 0.55 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -77.3 | -36.4 | 172.9 | -71.8 | 170.2 | 0 | 0 | 0 | 112.2 | T75 V76 V77 L83 | T75-L79 WeakPolarHBondContact O-CG 3.5Å; T75-L79 PolarHBondContact O-N 3.48Å; T75-L79 VanDerWaalsContact O-N 3.1Å; V76-L79 PolarHBondContact O-N 3.49Å; V76-L79 VanDerWaalsContact O-N 3.14Å; V77-L79 VanDerWaalsContact C-N 3.28Å; V77-L79 PolarHBondContact O-N 2.96Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 3.13Å |
| 80 | L | 97.5 | Very high | 94 | Very high | 99 Ų | 99 | 95 Ų | 95 | 52% | 0.518 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -67.3 | -44.7 | 174.4 | -70.8 | 171.3 | 0 | 0 | 0 | 111.7 | V76 V77 K82 L83 V84 | V76-L80 HydrophobicContact CG1-CD1 4.08Å; V76-L80 HydrophobicContact CG1-CG 4.42Å; V76-L80 WeakPolarHBondContact O-CG 3.34Å; V76-L80 PolarHBondContact O-N 3.26Å; V77-L80 PolarHBondContact O-N 2.87Å; L80-K82 VanDerWaalsContact C-N 3.33Å; L80-K82 PolarHBondContact O-N 3.35Å; L80-L83 HydrophobicContact CD2-CD1 4.43Å; L80-L83 WeakPolarHBondContact O-CA 3.39Å; L80-L83 WeakPolarHBondContact O-CB 3.47Å; L80-L83 PolarHBondContact O-N 2.91Å; L80-V84 WeakPolarHBondContact O-CG2 3.29Å; L80-V84 PolarHBondContact O-N 3.46Å |
| 81 | D | 97.6 | Very high | 95.7 | Very high | 100 Ų | 100 | 94.2 Ų | 94.2 | 54% | 0.535 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -57.2 | -46.8 | 173.1 | 179.2 | 79.3 | 0 | 0 | 0 | 111.1 | V77 L83 V84 N85 | V77-D81 WeakPolarHBondContact O-CB 3.38Å; V77-D81 PolarHBondContact O-N 3.18Å; D81-L83 VanDerWaalsContact C-N 3.3Å; D81-L83 PolarHBondContact O-N 3.4Å; D81-V84 PolarHBondContact O-N 3.16Å; D81-N85 PolarHBondContact O-N 3.27Å; D81-N85 PolarHBondContact O-ND2 3.08Å; D81-N85 PolarHBondContact OD2-ND2 3.39Å |
| 82 | K | 97.5 | Very high | 96.6 | Very high | 124 Ų | 124 | 95.2 Ų | 95.2 | 54% | 0.539 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.3 | -36.1 | 173.5 | -170.9 | -179.3 | 177.4 | -174.1 | 0 | 112.8 | A78 L80 M86 | A78-K82 WeakPolarHBondContact O-CB 3.39Å; A78-K82 PolarHBondContact O-N 3.48Å; L80-K82 VanDerWaalsContact C-N 3.33Å; L80-K82 PolarHBondContact O-N 3.35Å; K82-M86 HydrophobicContact CG-CE 4.24Å; K82-M86 HydrophobicContact CG-SD 4.39Å; K82-M86 WeakPolarHBondContact O-CB 3.35Å; K82-M86 VanDerWaalsContact O-CG 3.27Å; K82-M86 WeakPolarHBondContact O-CG 3.46Å; K82-M86 PolarHBondContact O-N 2.88Å |
| 83 | L | 98.1 | Very high | 96.9 | Very high | 89 Ų | 89 | 96 Ų | 96 | 47% | 0.466 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.4 | -41.6 | 175 | -79.5 | 161.9 | 0 | 0 | 0 | 111.8 | L79 L80 D81 M86 M87 | L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 3.13Å; L80-L83 HydrophobicContact CD2-CD1 4.43Å; L80-L83 WeakPolarHBondContact O-CA 3.39Å; L80-L83 WeakPolarHBondContact O-CB 3.47Å; L80-L83 PolarHBondContact O-N 2.91Å; D81-L83 VanDerWaalsContact C-N 3.3Å; D81-L83 PolarHBondContact O-N 3.4Å; L83-M86 HydrophobicContact CD2-CE 3.82Å; L83-M86 HydrophobicContact CG-CE 4.27Å; L83-M86 PolarHBondContact O-N 3.43Å; L83-M87 WeakPolarHBondContact O-CG 3.4Å; L83-M87 PolarHBondContact O-N 3.18Å |
| 84 | V | 97.8 | Very high | 97.2 | Very high | 73 Ų | 73 | 97.3 Ų | 97.3 | 44% | 0.442 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.9 | -52.1 | 173.9 | 173.2 | 0 | 0 | 0 | 0 | 110.5 | L80 D81 M86 M87 E88 | L80-V84 WeakPolarHBondContact O-CG2 3.29Å; L80-V84 PolarHBondContact O-N 3.46Å; D81-V84 PolarHBondContact O-N 3.16Å; V84-M86 PolarHBondContact O-N 2.88Å; V84-M87 WeakPolarHBondContact O-CB 3.45Å; V84-M87 PolarHBondContact O-N 3.47Å; V84-E88 HydrophobicContact CG1-CG 4.41Å; V84-E88 WeakPolarHBondContact O-CG 3.31Å; V84-E88 PolarHBondContact O-N 3.21Å |
| 85 | N | 97.9 | Very high | 97.5 | Very high | 85 Ų | 85 | 97.3 Ų | 97.3 | 46% | 0.455 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -55.9 | -37.2 | 176.3 | -78.1 | -95.7 | 0 | 0 | 0 | 112.6 | D81 A89 | D81-N85 PolarHBondContact O-N 3.27Å; D81-N85 PolarHBondContact O-ND2 3.08Å; D81-N85 PolarHBondContact OD2-ND2 3.39Å; N85-A89 WeakPolarHBondContact O-CB 3.49Å; N85-A89 PolarHBondContact O-N 3.33Å; N85-A89 VanDerWaalsContact O-N 3.17Å |
| 86 | M | 98.3 | Very high | 97.8 | Very high | 91 Ų | 91 | 98.9 Ų | 98.9 | 45% | 0.448 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -74.3 | -32.7 | 175.8 | -71.2 | -176.1 | -49.9 | 0 | 0 | 112.9 | K82 L83 V84 V90 | K82-M86 HydrophobicContact CG-CE 4.24Å; K82-M86 HydrophobicContact CG-SD 4.39Å; K82-M86 WeakPolarHBondContact O-CB 3.35Å; K82-M86 VanDerWaalsContact O-CG 3.27Å; K82-M86 WeakPolarHBondContact O-CG 3.46Å; K82-M86 PolarHBondContact O-N 2.88Å; L83-M86 HydrophobicContact CD2-CE 3.82Å; L83-M86 HydrophobicContact CG-CE 4.27Å; L83-M86 PolarHBondContact O-N 3.43Å; V84-M86 PolarHBondContact O-N 2.88Å; M86-V90 VanDerWaalsContact O-CG2 3.31Å; M86-V90 WeakPolarHBondContact O-CG2 3.39Å; M86-V90 PolarHBondContact O-N 3.19Å |
| 87 | M | 98.2 | Very high | 97.9 | Very high | 131 Ų | 131 | 101.7 Ų | 101.7 | 65% | 0.645 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -68.7 | -43.7 | 173.6 | -75.9 | 179.1 | 61.4 | 0 | 0 | 111.7 | L83 V84 A89 V90 Q91 | L83-M87 WeakPolarHBondContact O-CG 3.4Å; L83-M87 PolarHBondContact O-N 3.18Å; V84-M87 WeakPolarHBondContact O-CB 3.45Å; V84-M87 PolarHBondContact O-N 3.47Å; M87-A89 PolarHBondContact O-N 2.86Å; M87-V90 PolarHBondContact O-N 2.99Å; M87-Q91 WeakPolarHBondContact O-CB 3.49Å; M87-Q91 PolarHBondContact O-N 2.87Å |
| 88 | E | 98.3 | Very high | 98 | Very high | 116 Ų | 116 | 102 Ų | 102 | 54% | 0.542 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58.6 | -46.4 | 174.7 | -70.6 | 176.2 | 174.8 | 0 | 0 | 111.1 | V84 V90 Q91 E92 | V84-E88 HydrophobicContact CG1-CG 4.41Å; V84-E88 WeakPolarHBondContact O-CG 3.31Å; V84-E88 PolarHBondContact O-N 3.21Å; E88-V90 VanDerWaalsContact C-N 3.32Å; E88-V90 PolarHBondContact O-N 3.26Å; E88-Q91 PolarHBondContact O-N 3.34Å; E88-Q91 VanDerWaalsContact O-N 3.17Å; E88-E92 PolarHBondContact O-N 3.42Å |
| 89 | A | 98.1 | Very high | 98.1 | Very high | 56 Ų | 56 | 104.3 Ų | 104.3 | 46% | 0.463 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.5 | -31.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | N85 M87 N93 | N85-A89 WeakPolarHBondContact O-CB 3.49Å; N85-A89 PolarHBondContact O-N 3.33Å; N85-A89 VanDerWaalsContact O-N 3.17Å; M87-A89 PolarHBondContact O-N 2.86Å; A89-N93 WeakPolarHBondContact O-CB 3.34Å; A89-N93 PolarHBondContact O-N 2.8Å |
| 90 | V | 98.5 | Very high | 98.1 | Very high | 95 Ų | 95 | 106.2 Ų | 106.2 | 58% | 0.576 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -70.4 | -43.7 | 171.6 | 166.1 | 0 | 0 | 0 | 0 | 110.6 | M86 M87 E88 N93 Q94 | M86-V90 VanDerWaalsContact O-CG2 3.31Å; M86-V90 WeakPolarHBondContact O-CG2 3.39Å; M86-V90 PolarHBondContact O-N 3.19Å; M87-V90 PolarHBondContact O-N 2.99Å; E88-V90 VanDerWaalsContact C-N 3.32Å; E88-V90 PolarHBondContact O-N 3.26Å; V90-N93 PolarHBondContact O-N 2.94Å; V90-Q94 WeakPolarHBondContact O-CB 3.45Å; V90-Q94 PolarHBondContact O-N 3.17Å |
| 91 | Q | 98.5 | Very high | 98.2 | Very high | 135 Ų | 135 | 106.7 Ų | 106.7 | 63% | 0.631 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -66.9 | -43.3 | -177.8 | -171 | 171.6 | -1.6 | 0 | 0 | 112.3 | M87 E88 Q94 Q95 | M87-Q91 WeakPolarHBondContact O-CB 3.49Å; M87-Q91 PolarHBondContact O-N 2.87Å; E88-Q91 PolarHBondContact O-N 3.34Å; E88-Q91 VanDerWaalsContact O-N 3.17Å; Q91-Q94 PolarHBondContact O-N 3.03Å; Q91-Q95 WeakPolarHBondContact O-CB 3.37Å; Q91-Q95 PolarHBondContact O-N 3.14Å |
| 92 | E | 98.3 | Very high | 98.2 | Very high | 132 Ų | 132 | 105.3 Ų | 105.3 | 62% | 0.617 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.5 | -45.3 | 172.8 | -169 | -153.5 | 152.4 | 0 | 0 | 110.9 | E88 Q94 Q95 R96 | E88-E92 PolarHBondContact O-N 3.42Å; E92-Q94 VanDerWaalsContact C-N 3.35Å; E92-Q94 PolarHBondContact O-N 2.81Å; E92-Q95 PolarHBondContact O-N 3.29Å; E92-R96 VanDerWaalsContact O-CB 3.27Å; E92-R96 WeakPolarHBondContact O-CB 3.48Å; E92-R96 PolarHBondContact O-N 2.91Å |
| 93 | N | 98.2 | Very high | 98.3 | Very high | 81 Ų | 81 | 103.7 Ų | 103.7 | 43% | 0.433 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.8 | -34.2 | -178.2 | -165.7 | 17.7 | 0 | 0 | 0 | 112.1 | A89 V90 R96 M97 | A89-N93 WeakPolarHBondContact O-CB 3.34Å; A89-N93 PolarHBondContact O-N 2.8Å; V90-N93 PolarHBondContact O-N 2.94Å; N93-R96 PolarHBondContact OD1-NE 3.08Å; N93-R96 PolarHBondContact OD1-NH2 2.94Å; N93-M97 WeakPolarHBondContact O-CB 3.21Å; N93-M97 PolarHBondContact O-N 3.16Å |
| 94 | Q | 98.4 | Very high | 98.3 | Very high | 98 Ų | 98 | 104.7 Ų | 104.7 | 46% | 0.458 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.4 | -51.1 | 170.7 | 176.9 | 173.6 | -17 | 0 | 0 | 111.2 | V90 Q91 E92 R96 M97 E98 | V90-Q94 WeakPolarHBondContact O-CB 3.45Å; V90-Q94 PolarHBondContact O-N 3.17Å; Q91-Q94 PolarHBondContact O-N 3.03Å; E92-Q94 VanDerWaalsContact C-N 3.35Å; E92-Q94 PolarHBondContact O-N 2.81Å; Q94-R96 PolarHBondContact O-N 2.85Å; Q94-M97 CarbonylContact O-C 3.59Å; Q94-M97 WeakPolarHBondContact O-CA 3.43Å; Q94-M97 WeakPolarHBondContact O-CB 3.41Å; Q94-M97 PolarHBondContact O-N 2.97Å; Q94-E98 HydrophobicContact CG-CG 4.4Å; Q94-E98 VanDerWaalsContact CG-OE1 3.27Å; Q94-E98 WeakPolarHBondContact CG-OE1 3.21Å; Q94-E98 PolarHBondContact NE2-OE1 3.47Å; Q94-E98 WeakPolarHBondContact O-CG 3.28Å; Q94-E98 PolarHBondContact O-N 3.23Å |
| 95 | Q | 98.4 | Very high | 98.3 | Very high | 136 Ų | 136 | 105.3 Ų | 105.3 | 64% | 0.636 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -56.6 | -40.6 | 177.3 | -173.8 | -177.6 | 11.4 | 0 | 0 | 111.6 | Q91 E92 M97 E98 Q99 | Q91-Q95 WeakPolarHBondContact O-CB 3.37Å; Q91-Q95 PolarHBondContact O-N 3.14Å; E92-Q95 PolarHBondContact O-N 3.29Å; Q95-M97 VanDerWaalsContact C-N 3.32Å; Q95-M97 PolarHBondContact O-N 3.03Å; Q95-E98 PolarHBondContact O-N 2.92Å; Q95-Q99 PolarHBondContact O-N 2.89Å |
| 96 | R | 98.5 | Very high | 98.4 | Very high | 114 Ų | 114 | 102.6 Ų | 102.6 | 43% | 0.43 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.6 | -30.9 | 174.9 | -171.8 | -175.6 | 69.8 | 159 | 0.5 | 113 | E92 N93 Q94 R100 | E92-R96 VanDerWaalsContact O-CB 3.27Å; E92-R96 WeakPolarHBondContact O-CB 3.48Å; E92-R96 PolarHBondContact O-N 2.91Å; N93-R96 PolarHBondContact OD1-NE 3.08Å; N93-R96 PolarHBondContact OD1-NH2 2.94Å; Q94-R96 PolarHBondContact O-N 2.85Å; R96-R100 WeakPolarHBondContact O-CB 3.44Å; R96-R100 WeakPolarHBondContact O-CD 3.41Å; R96-R100 VanDerWaalsContact O-CG 3.23Å; R96-R100 WeakPolarHBondContact O-CG 3.49Å; R96-R100 PolarHBondContact O-N 2.88Å |
| 97 | M | 98.4 | Very high | 98.4 | Very high | 121 Ų | 121 | 100.9 Ų | 100.9 | 60% | 0.596 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -73.7 | -44.6 | 174.8 | -175.3 | 171.1 | 67.5 | 0 | 0 | 111 | N93 Q94 Q95 R100 Q101 | N93-M97 WeakPolarHBondContact O-CB 3.21Å; N93-M97 PolarHBondContact O-N 3.16Å; Q94-M97 CarbonylContact O-C 3.59Å; Q94-M97 WeakPolarHBondContact O-CA 3.43Å; Q94-M97 WeakPolarHBondContact O-CB 3.41Å; Q94-M97 PolarHBondContact O-N 2.97Å; Q95-M97 VanDerWaalsContact C-N 3.32Å; Q95-M97 PolarHBondContact O-N 3.03Å; M97-R100 PolarHBondContact O-N 3.44Å; M97-Q101 PolarHBondContact O-N 3.14Å |
| 98 | E | 98.1 | Very high | 98.4 | Very high | 102 Ų | 102 | 97.8 Ų | 97.8 | 48% | 0.477 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.2 | -44.7 | 175.8 | -70.1 | 168.8 | -175.9 | 0 | 0 | 111.6 | Q94 Q95 R100 Q101 S102 | Q94-E98 HydrophobicContact CG-CG 4.4Å; Q94-E98 VanDerWaalsContact CG-OE1 3.27Å; Q94-E98 WeakPolarHBondContact CG-OE1 3.21Å; Q94-E98 PolarHBondContact NE2-OE1 3.47Å; Q94-E98 WeakPolarHBondContact O-CG 3.28Å; Q94-E98 PolarHBondContact O-N 3.23Å; Q95-E98 PolarHBondContact O-N 2.92Å; E98-R100 PolarHBondContact O-N 2.98Å; E98-Q101 PolarHBondContact O-N 2.78Å; E98-S102 PolarHBondContact O-N 3.45Å |
| 99 | Q | 98.4 | Very high | 98.4 | Very high | 107 Ų | 107 | 100 Ų | 100 | 50% | 0.5 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.3 | -48.4 | 173.7 | -178.2 | 61.4 | 55.2 | 0 | 0 | 111.7 | Q95 Q101 S102 D103 | Q95-Q99 PolarHBondContact O-N 2.89Å; Q99-Q101 VanDerWaalsContact C-N 3.29Å; Q99-Q101 PolarHBondContact O-N 2.98Å; Q99-S102 WeakPolarHBondContact O-CB 3.19Å; Q99-S102 PolarHBondContact O-N 3.48Å; Q99-D103 PolarHBondContact NE2-OD1 3.16Å; Q99-D103 PolarHBondContact NE2-OD2 2.63Å; Q99-D103 PolarHBondContact O-N 2.87Å |
| 100 | R | 98.3 | Very high | 98.5 | Very high | 146 Ų | 146 | 101.7 Ų | 101.7 | 55% | 0.551 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63 | -34.8 | 178.5 | -76.2 | 170.5 | 177 | 174.1 | -1.9 | 112.9 | R96 M97 E98 L104 | R96-R100 WeakPolarHBondContact O-CB 3.44Å; R96-R100 WeakPolarHBondContact O-CD 3.41Å; R96-R100 VanDerWaalsContact O-CG 3.23Å; R96-R100 WeakPolarHBondContact O-CG 3.49Å; R96-R100 PolarHBondContact O-N 2.88Å; M97-R100 PolarHBondContact O-N 3.44Å; E98-R100 PolarHBondContact O-N 2.98Å; R100-L104 VanDerWaalsContact O-CB 3.26Å; R100-L104 WeakPolarHBondContact O-CB 3.36Å; R100-L104 PolarHBondContact O-N 3.41Å |
| 101 | Q | 98.4 | Very high | 98.5 | Very high | 109 Ų | 109 | 101.5 Ų | 101.5 | 51% | 0.509 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.2 | -47.5 | 173.9 | -178.2 | 178.1 | -29 | 0 | 0 | 110.5 | M97 E98 Q99 D103 L104 E105 | M97-Q101 PolarHBondContact O-N 3.14Å; E98-Q101 PolarHBondContact O-N 2.78Å; Q99-Q101 VanDerWaalsContact C-N 3.29Å; Q99-Q101 PolarHBondContact O-N 2.98Å; Q101-D103 VanDerWaalsContact C-N 3.33Å; Q101-D103 PolarHBondContact O-N 2.92Å; Q101-L104 PolarHBondContact O-N 3.26Å; Q101-E105 HydrophobicContact CG-CG 4.4Å; Q101-E105 WeakPolarHBondContact CG-OE1 3.27Å; Q101-E105 PolarHBondContact NE2-OE1 2.85Å; Q101-E105 WeakPolarHBondContact O-CB 3.34Å; Q101-E105 WeakPolarHBondContact O-CG 3.43Å; Q101-E105 PolarHBondContact O-N 2.91Å |
| 102 | S | 98.1 | Very high | 98.5 | Very high | 70 Ų | 70 | 100.7 Ų | 100.7 | 49% | 0.49 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57 | -44.2 | 175 | 176.2 | 0 | 0 | 0 | 0 | 112.4 | E98 Q99 E105 G106 | E98-S102 PolarHBondContact O-N 3.45Å; Q99-S102 WeakPolarHBondContact O-CB 3.19Å; Q99-S102 PolarHBondContact O-N 3.48Å; S102-E105 PolarHBondContact O-N 3.36Å; S102-G106 PolarHBondContact O-N 2.94Å |
| 103 | D | 98.5 | Very high | 98.5 | Very high | 91 Ų | 91 | 95.7 Ų | 95.7 | 49% | 0.487 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.1 | -41.5 | 176.8 | -63.9 | -27.5 | 0 | 0 | 0 | 111.7 | Q99 Q101 G106 A107 | Q99-D103 PolarHBondContact NE2-OD1 3.16Å; Q99-D103 PolarHBondContact NE2-OD2 2.63Å; Q99-D103 PolarHBondContact O-N 2.87Å; Q101-D103 VanDerWaalsContact C-N 3.33Å; Q101-D103 PolarHBondContact O-N 2.92Å; D103-G106 PolarHBondContact O-N 3.47Å; D103-A107 PolarHBondContact O-N 3.17Å |
| 104 | L | 98.7 | Very high | 98.5 | Very high | 110 Ų | 110 | 95.2 Ų | 95.2 | 58% | 0.576 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -69.9 | -41.6 | 178.5 | -176.3 | 144.7 | 0 | 0 | 0 | 112.2 | R100 Q101 G106 A107 V108 | R100-L104 VanDerWaalsContact O-CB 3.26Å; R100-L104 WeakPolarHBondContact O-CB 3.36Å; R100-L104 PolarHBondContact O-N 3.41Å; Q101-L104 PolarHBondContact O-N 3.26Å; L104-G106 VanDerWaalsContact C-N 3.29Å; L104-G106 PolarHBondContact O-N 2.88Å; L104-A107 PolarHBondContact O-N 3.33Å; L104-V108 HydrophobicContact CD2-CG2 4.1Å; L104-V108 WeakPolarHBondContact O-CB 3.46Å; L104-V108 VanDerWaalsContact O-CG2 3.32Å; L104-V108 WeakPolarHBondContact O-CG2 3.47Å; L104-V108 PolarHBondContact O-N 3.07Å |
| 105 | E | 98.5 | Very high | 98.6 | Very high | 85 Ų | 85 | 94.8 Ų | 94.8 | 40% | 0.397 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.5 | -38.6 | 172.2 | -74.4 | 179.4 | -155.4 | 0 | 0 | 111.5 | Q101 S102 R109 | Q101-E105 HydrophobicContact CG-CG 4.4Å; Q101-E105 WeakPolarHBondContact CG-OE1 3.27Å; Q101-E105 PolarHBondContact NE2-OE1 2.85Å; Q101-E105 WeakPolarHBondContact O-CB 3.34Å; Q101-E105 WeakPolarHBondContact O-CG 3.43Å; Q101-E105 PolarHBondContact O-N 2.91Å; S102-E105 PolarHBondContact O-N 3.36Å; E105-R109 VanDerWaalsContact O-CB 3.31Å; E105-R109 WeakPolarHBondContact O-CB 3.34Å; E105-R109 PolarHBondContact O-N 2.83Å |
| 106 | G | 98.6 | Very high | 98.6 | Very high | 28 Ų | 28 | 93.2 Ų | 93.2 | 29% | 0.289 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60 | -49.2 | 171 | 0 | 0 | 0 | 0 | 0 | 112.4 | S102 D103 L104 R109 V110 | S102-G106 PolarHBondContact O-N 2.94Å; D103-G106 PolarHBondContact O-N 3.47Å; L104-G106 VanDerWaalsContact C-N 3.29Å; L104-G106 PolarHBondContact O-N 2.88Å; G106-R109 PolarHBondContact O-N 3.29Å; G106-V110 WeakPolarHBondContact O-CG2 3.41Å; G106-V110 PolarHBondContact O-N 2.93Å |
| 107 | A | 98.8 | Very high | 98.6 | Very high | 56 Ų | 56 | 94.6 Ų | 94.6 | 46% | 0.463 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.5 | -43.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | D103 L104 R109 V110 V111 | D103-A107 PolarHBondContact O-N 3.17Å; L104-A107 PolarHBondContact O-N 3.33Å; A107-R109 VanDerWaalsContact C-N 3.34Å; A107-R109 PolarHBondContact O-N 3.16Å; A107-V110 PolarHBondContact O-N 3.13Å; A107-V111 WeakPolarHBondContact O-CG2 3.39Å; A107-V111 PolarHBondContact O-N 3.35Å |
| 108 | V | 98.8 | Very high | 98.6 | Very high | 65 Ų | 65 | 94.4 Ų | 94.4 | 39% | 0.394 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.5 | -43.4 | 175.5 | 168.1 | 0 | 0 | 0 | 0 | 111 | L104 V110 V111 Q112 | L104-V108 HydrophobicContact CD2-CG2 4.1Å; L104-V108 WeakPolarHBondContact O-CB 3.46Å; L104-V108 VanDerWaalsContact O-CG2 3.32Å; L104-V108 WeakPolarHBondContact O-CG2 3.47Å; L104-V108 PolarHBondContact O-N 3.07Å; V108-V110 VanDerWaalsContact C-N 3.33Å; V108-V110 PolarHBondContact O-N 3.39Å; V108-V111 PolarHBondContact O-N 3.46Å; V108-Q112 HydrophobicContact CG1-CG 4.32Å; V108-Q112 WeakPolarHBondContact O-CB 3.31Å; V108-Q112 VanDerWaalsContact O-CG 3.29Å; V108-Q112 WeakPolarHBondContact O-CG 3.27Å; V108-Q112 PolarHBondContact O-N 2.82Å |
| 109 | R | 98.8 | Very high | 98.6 | Very high | 164 Ų | 164 | 93.3 Ų | 93.3 | 62% | 0.619 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.2 | -36.8 | 177.4 | -167 | 179.3 | -60 | 136 | 8.4 | 112.5 | E105 G106 A107 G113 | E105-R109 VanDerWaalsContact O-CB 3.31Å; E105-R109 WeakPolarHBondContact O-CB 3.34Å; E105-R109 PolarHBondContact O-N 2.83Å; G106-R109 PolarHBondContact O-N 3.29Å; A107-R109 VanDerWaalsContact C-N 3.34Å; A107-R109 PolarHBondContact O-N 3.16Å; R109-G113 PolarHBondContact O-N 3.39Å; R109-G113 VanDerWaalsContact O-N 3.12Å |
| 110 | V | 98.7 | Very high | 98.7 | Very high | 90 Ų | 90 | 96 Ų | 96 | 55% | 0.545 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -51.5 | 171.3 | 172.8 | 0 | 0 | 0 | 0 | 110.4 | G106 A107 V108 Q112 G113 D114 | G106-V110 WeakPolarHBondContact O-CG2 3.41Å; G106-V110 PolarHBondContact O-N 2.93Å; A107-V110 PolarHBondContact O-N 3.13Å; V108-V110 VanDerWaalsContact C-N 3.33Å; V108-V110 PolarHBondContact O-N 3.39Å; V110-Q112 VanDerWaalsContact C-N 3.33Å; V110-Q112 PolarHBondContact O-N 3.4Å; V110-G113 CarbonylContact O-C 3.57Å; V110-G113 WeakPolarHBondContact O-CA 3.48Å; V110-G113 PolarHBondContact O-N 3.19Å; V110-D114 WeakPolarHBondContact O-CB 3.29Å; V110-D114 PolarHBondContact O-N 3.17Å; V110-D114 VanDerWaalsContact O-OD1 3.04Å |
| 111 | V | 98.8 | Very high | 98.7 | Very high | 91 Ų | 91 | 92.8 Ų | 92.8 | 55% | 0.552 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -58.5 | -42.1 | 179.8 | 172 | 0 | 0 | 0 | 0 | 112.1 | A107 V108 D114 V115 | A107-V111 WeakPolarHBondContact O-CG2 3.39Å; A107-V111 PolarHBondContact O-N 3.35Å; V108-V111 PolarHBondContact O-N 3.46Å; V111-D114 PolarHBondContact O-N 3.37Å; V111-V115 HydrophobicContact CG1-CG2 4.5Å; V111-V115 WeakPolarHBondContact O-CG2 3.37Å; V111-V115 PolarHBondContact O-N 3.29Å |
| 112 | Q | 98.8 | Very high | 98.7 | Very high | 118 Ų | 118 | 93.7 Ų | 93.7 | 55% | 0.551 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -59 | -47.4 | 173.3 | -73.8 | 170.5 | -13.7 | 0 | 0 | 111.7 | V108 V110 D114 V115 V116 | V108-Q112 HydrophobicContact CG1-CG 4.32Å; V108-Q112 WeakPolarHBondContact O-CB 3.31Å; V108-Q112 VanDerWaalsContact O-CG 3.29Å; V108-Q112 WeakPolarHBondContact O-CG 3.27Å; V108-Q112 PolarHBondContact O-N 2.82Å; V110-Q112 VanDerWaalsContact C-N 3.33Å; V110-Q112 PolarHBondContact O-N 3.4Å; Q112-D114 VanDerWaalsContact C-N 3.31Å; Q112-D114 PolarHBondContact O-N 2.89Å; Q112-V115 PolarHBondContact O-N 3.49Å; Q112-V116 WeakPolarHBondContact O-CG2 3.49Å; Q112-V116 PolarHBondContact O-N 2.96Å |
| 113 | G | 98.8 | Very high | 98.7 | Very high | 28 Ų | 28 | 95.5 Ų | 95.5 | 29% | 0.289 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.3 | -37.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113 | R109 V110 V116 R117 | R109-G113 PolarHBondContact O-N 3.39Å; R109-G113 VanDerWaalsContact O-N 3.12Å; V110-G113 CarbonylContact O-C 3.57Å; V110-G113 WeakPolarHBondContact O-CA 3.48Å; V110-G113 PolarHBondContact O-N 3.19Å; G113-V116 PolarHBondContact O-N 2.94Å; G113-R117 WeakPolarHBondContact O-CG 3.27Å; G113-R117 PolarHBondContact O-N 3.25Å; G113-R117 PolarHBondContact O-NH1 2.82Å |
| 114 | D | 98.8 | Very high | 98.7 | Very high | 70 Ų | 70 | 94.6 Ų | 94.6 | 37% | 0.374 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.6 | -43.1 | 178.2 | -81.7 | 45.7 | 0 | 0 | 0 | 112 | V110 V111 Q112 V116 R117 L118 | V110-D114 WeakPolarHBondContact O-CB 3.29Å; V110-D114 PolarHBondContact O-N 3.17Å; V110-D114 VanDerWaalsContact O-OD1 3.04Å; V111-D114 PolarHBondContact O-N 3.37Å; Q112-D114 VanDerWaalsContact C-N 3.31Å; Q112-D114 PolarHBondContact O-N 2.89Å; D114-V116 PolarHBondContact O-N 3.49Å; D114-R117 PolarHBondContact O-N 3.26Å; D114-R117 IonicContact OD1-CZ 3.85Å; D114-R117 IonicContact OD1-NH1 2.75Å; D114-R117 PolarHBondContact OD1-NH1 3Å; D114-R117 IonicContact OD1-NH2 2.89Å; D114-R117 PolarHBondContact OD1-NH2 3.46Å; D114-R117 IonicContact OD2-CZ 3.57Å; D114-R117 IonicContact OD2-NH2 3.14Å; D114-R117 PolarHBondContact OD2-NH2 2.72Å; D114-L118 WeakPolarHBondContact O-CB 3.45Å; D114-L118 PolarHBondContact O-N 2.99Å |
| 115 | V | 98.8 | Very high | 98.8 | Very high | 90 Ų | 90 | 93.3 Ų | 93.3 | 55% | 0.545 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.8 | -42.8 | 173.1 | 170 | 0 | 0 | 0 | 0 | 111.3 | V111 Q112 L118 S119 | V111-V115 HydrophobicContact CG1-CG2 4.5Å; V111-V115 WeakPolarHBondContact O-CG2 3.37Å; V111-V115 PolarHBondContact O-N 3.29Å; Q112-V115 PolarHBondContact O-N 3.49Å; V115-L118 PolarHBondContact O-N 2.88Å; V115-S119 WeakPolarHBondContact O-CB 3.4Å; V115-S119 PolarHBondContact O-N 3.15Å |
| 116 | V | 98.8 | Very high | 98.8 | Very high | 102 Ų | 102 | 91.5 Ų | 91.5 | 62% | 0.618 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.2 | -41.1 | 176.1 | 172.2 | 0 | 0 | 0 | 0 | 111.6 | Q112 G113 D114 K120 | Q112-V116 WeakPolarHBondContact O-CG2 3.49Å; Q112-V116 PolarHBondContact O-N 2.96Å; G113-V116 PolarHBondContact O-N 2.94Å; D114-V116 PolarHBondContact O-N 3.49Å; V116-K120 PolarHBondContact O-N 3.24Å; V116-K120 VanDerWaalsContact O-N 3.13Å |
| 117 | R | 98.8 | Very high | 98.8 | Very high | 143 Ų | 143 | 93.9 Ų | 93.9 | 54% | 0.54 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.4 | -42.5 | 174 | -70.5 | -165.4 | -42.2 | -79.4 | 7.8 | 111.7 | G113 D114 K120 T121 | G113-R117 WeakPolarHBondContact O-CG 3.27Å; G113-R117 PolarHBondContact O-N 3.25Å; G113-R117 PolarHBondContact O-NH1 2.82Å; D114-R117 PolarHBondContact O-N 3.26Å; D114-R117 IonicContact OD1-CZ 3.85Å; D114-R117 IonicContact OD1-NH1 2.75Å; D114-R117 PolarHBondContact OD1-NH1 3Å; D114-R117 IonicContact OD1-NH2 2.89Å; D114-R117 PolarHBondContact OD1-NH2 3.46Å; D114-R117 IonicContact OD2-CZ 3.57Å; D114-R117 IonicContact OD2-NH2 3.14Å; D114-R117 PolarHBondContact OD2-NH2 2.72Å; R117-K120 PolarHBondContact O-N 3.15Å; R117-T121 PolarHBondContact O-N 2.87Å; R117-T121 PolarHBondContact O-OG1 2.8Å |
| 118 | L | 98.8 | Very high | 98.8 | Very high | 118 Ų | 118 | 94.5 Ų | 94.5 | 62% | 0.618 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.1 | -41.5 | 179 | -179.1 | 59.7 | 0 | 0 | 0 | 112.3 | D114 V115 K120 T121 H122 | D114-L118 WeakPolarHBondContact O-CB 3.45Å; D114-L118 PolarHBondContact O-N 2.99Å; V115-L118 PolarHBondContact O-N 2.88Å; L118-K120 VanDerWaalsContact C-N 3.31Å; L118-K120 PolarHBondContact O-N 3.45Å; L118-T121 WeakPolarHBondContact CA-OG1 3.4Å; L118-T121 PolarHBondContact O-N 3.39Å; L118-T121 PolarHBondContact O-OG1 2.73Å; L118-H122 VanDerWaalsContact O-CB 3.27Å; L118-H122 WeakPolarHBondContact O-CB 3.49Å; L118-H122 PolarHBondContact O-N 3.23Å |
| 119 | S | 98.8 | Very high | 98.8 | Very high | 78 Ų | 78 | 94.9 Ų | 94.9 | 55% | 0.545 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59 | -43.7 | 173.3 | -179.6 | 0 | 0 | 0 | 0 | 111.3 | V115 H122 L123 | V115-S119 WeakPolarHBondContact O-CB 3.4Å; V115-S119 PolarHBondContact O-N 3.15Å; S119-H122 PolarHBondContact O-N 3.35Å; S119-L123 WeakPolarHBondContact O-CB 3.31Å; S119-L123 PolarHBondContact O-N 3.37Å |
| 120 | K | 98.8 | Very high | 98.8 | Very high | 163 Ų | 163 | 91.5 Ų | 91.5 | 71% | 0.709 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.1 | -39.6 | 177.1 | -173 | 173.1 | -178.2 | 173.4 | 0 | 113.4 | V116 R117 L118 S124 | V116-K120 PolarHBondContact O-N 3.24Å; V116-K120 VanDerWaalsContact O-N 3.13Å; R117-K120 PolarHBondContact O-N 3.15Å; L118-K120 VanDerWaalsContact C-N 3.31Å; L118-K120 PolarHBondContact O-N 3.45Å; K120-S124 PolarHBondContact O-N 3.15Å; K120-S124 VanDerWaalsContact O-N 3.16Å |
| 121 | T | 98.8 | Very high | 98.8 | Very high | 80 Ų | 80 | 93.8 Ų | 93.8 | 49% | 0.491 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -71 | -40.6 | 175.3 | 55.1 | 0 | 0 | 0 | 0 | 111.5 | R117 L118 L123 S124 T125 | R117-T121 PolarHBondContact O-N 2.87Å; R117-T121 PolarHBondContact O-OG1 2.8Å; L118-T121 WeakPolarHBondContact CA-OG1 3.4Å; L118-T121 PolarHBondContact O-N 3.39Å; L118-T121 PolarHBondContact O-OG1 2.73Å; T121-L123 PolarHBondContact O-N 2.86Å; T121-S124 WeakPolarHBondContact O-CB 3.26Å; T121-S124 PolarHBondContact O-N 3.12Å; T121-S124 VanDerWaalsContact O-N 3.16Å; T121-T125 PolarHBondContact O-N 3.25Å; T121-T125 PolarHBondContact O-OG1 2.84Å |
| 122 | H | 98.8 | Very high | 98.8 | Very high | 128 Ų | 128 | 95 Ų | 95 | 59% | 0.593 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -57.5 | -46.5 | 173.5 | -180 | -108.5 | 0 | 0 | 0 | 111.8 | L118 S119 S124 T125 A126 | L118-H122 VanDerWaalsContact O-CB 3.27Å; L118-H122 WeakPolarHBondContact O-CB 3.49Å; L118-H122 PolarHBondContact O-N 3.23Å; S119-H122 PolarHBondContact O-N 3.35Å; H122-S124 VanDerWaalsContact C-N 3.32Å; H122-S124 PolarHBondContact O-N 2.97Å; H122-T125 WeakPolarHBondContact O-CB 3.23Å; H122-T125 PolarHBondContact O-N 3.05Å; H122-A126 WeakPolarHBondContact O-CB 3.21Å; H122-A126 PolarHBondContact O-N 3.47Å |
| 123 | L | 98.8 | Very high | 98.8 | Very high | 107 Ų | 107 | 93.8 Ų | 93.8 | 56% | 0.56 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.2 | -38.1 | 175.6 | -177.9 | 60.5 | 0 | 0 | 0 | 112.5 | S119 T121 N127 | S119-L123 WeakPolarHBondContact O-CB 3.31Å; S119-L123 PolarHBondContact O-N 3.37Å; T121-L123 PolarHBondContact O-N 2.86Å; L123-N127 WeakPolarHBondContact O-CB 3.46Å; L123-N127 PolarHBondContact O-N 2.86Å; L123-N127 PolarHBondContact O-ND2 2.93Å |
| 124 | S | 98.8 | Very high | 98.8 | Very high | 73 Ų | 73 | 97.2 Ų | 97.2 | 51% | 0.51 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.7 | -42 | 174.3 | -168.8 | 0 | 0 | 0 | 0 | 112.1 | K120 T121 H122 S128 | K120-S124 PolarHBondContact O-N 3.15Å; K120-S124 VanDerWaalsContact O-N 3.16Å; T121-S124 WeakPolarHBondContact O-CB 3.26Å; T121-S124 PolarHBondContact O-N 3.12Å; T121-S124 VanDerWaalsContact O-N 3.16Å; H122-S124 VanDerWaalsContact C-N 3.32Å; H122-S124 PolarHBondContact O-N 2.97Å; S124-S128 WeakPolarHBondContact O-CB 3.25Å; S124-S128 PolarHBondContact O-N 3.46Å; S124-S128 PolarHBondContact O-OG 3.31Å |
| 125 | T | 98.9 | Very high | 98.8 | Very high | 83 Ų | 83 | 102.7 Ų | 102.7 | 51% | 0.509 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.7 | -47.3 | 175.2 | -60.6 | 0 | 0 | 0 | 0 | 111.3 | T121 H122 N127 S128 V129 | T121-T125 PolarHBondContact O-N 3.25Å; T121-T125 PolarHBondContact O-OG1 2.84Å; H122-T125 WeakPolarHBondContact O-CB 3.23Å; H122-T125 PolarHBondContact O-N 3.05Å; T125-N127 VanDerWaalsContact C-N 3.34Å; T125-N127 PolarHBondContact O-N 3.23Å; T125-S128 CarbonylContact O-C 3.56Å; T125-S128 WeakPolarHBondContact O-CA 3.31Å; T125-S128 WeakPolarHBondContact O-CB 3.34Å; T125-S128 PolarHBondContact O-N 3.45Å; T125-V129 HydrophobicContact CG2-CG2 4.4Å; T125-V129 WeakPolarHBondContact O-CG2 3.41Å; T125-V129 PolarHBondContact O-N 3Å |
| 126 | A | 98.8 | Very high | 98.8 | Very high | 46 Ų | 46 | 102 Ų | 102 | 38% | 0.38 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -58.7 | -43.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | H122 S128 V129 N130 | H122-A126 WeakPolarHBondContact O-CB 3.21Å; H122-A126 PolarHBondContact O-N 3.47Å; A126-S128 VanDerWaalsContact C-N 3.27Å; A126-S128 PolarHBondContact O-N 3.39Å; A126-V129 PolarHBondContact O-N 3Å; A126-N130 WeakPolarHBondContact O-CB 3.47Å; A126-N130 PolarHBondContact O-N 2.81Å |
| 127 | N | 98.8 | Very high | 98.8 | Very high | 79 Ų | 79 | 103.7 Ų | 103.7 | 42% | 0.422 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62 | -33.1 | 173 | -84.9 | -71.1 | 0 | 0 | 0 | 113.1 | L123 T125 K131 | L123-N127 WeakPolarHBondContact O-CB 3.46Å; L123-N127 PolarHBondContact O-N 2.86Å; L123-N127 PolarHBondContact O-ND2 2.93Å; T125-N127 VanDerWaalsContact C-N 3.34Å; T125-N127 PolarHBondContact O-N 3.23Å; N127-K131 WeakPolarHBondContact O-CD 3.22Å; N127-K131 VanDerWaalsContact O-CG 3.29Å; N127-K131 WeakPolarHBondContact O-CG 3.26Å; N127-K131 PolarHBondContact O-N 2.89Å |
| 128 | S | 98.9 | Very high | 98.8 | Very high | 68 Ų | 68 | 103.7 Ų | 103.7 | 48% | 0.476 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -75.5 | -39.1 | 177.1 | -57.4 | 0 | 0 | 0 | 0 | 112 | S124 T125 A126 K131 L132 | S124-S128 WeakPolarHBondContact O-CB 3.25Å; S124-S128 PolarHBondContact O-N 3.46Å; S124-S128 PolarHBondContact O-OG 3.31Å; T125-S128 CarbonylContact O-C 3.56Å; T125-S128 WeakPolarHBondContact O-CA 3.31Å; T125-S128 WeakPolarHBondContact O-CB 3.34Å; T125-S128 PolarHBondContact O-N 3.45Å; A126-S128 VanDerWaalsContact C-N 3.27Å; A126-S128 PolarHBondContact O-N 3.39Å; S128-K131 PolarHBondContact O-N 3.13Å; S128-L132 PolarHBondContact O-N 2.94Å |
| 129 | V | 98.9 | Very high | 98.8 | Very high | 74 Ų | 74 | 102.3 Ų | 102.3 | 45% | 0.448 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.9 | -43.9 | 172.5 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | T125 A126 K131 L132 L133 | T125-V129 HydrophobicContact CG2-CG2 4.4Å; T125-V129 WeakPolarHBondContact O-CG2 3.41Å; T125-V129 PolarHBondContact O-N 3Å; A126-V129 PolarHBondContact O-N 3Å; V129-K131 VanDerWaalsContact C-N 3.34Å; V129-K131 PolarHBondContact O-N 2.98Å; V129-L132 CarbonylContact O-C 3.57Å; V129-L132 WeakPolarHBondContact O-CA 3.4Å; V129-L132 WeakPolarHBondContact O-CB 3.31Å; V129-L132 PolarHBondContact O-N 2.97Å; V129-L133 HydrophobicContact CG1-CD1 4.16Å; V129-L133 HydrophobicContact CG1-CG 4.31Å; V129-L133 WeakPolarHBondContact O-CG 3.43Å; V129-L133 PolarHBondContact O-N 3.18Å |
| 130 | N | 98.8 | Very high | 98.8 | Very high | 93 Ų | 93 | 102.8 Ų | 102.8 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.5 | -42.7 | 177 | -166.5 | 13.6 | 0 | 0 | 0 | 111.8 | A126 L132 L133 E134 | A126-N130 WeakPolarHBondContact O-CB 3.47Å; A126-N130 PolarHBondContact O-N 2.81Å; N130-L132 VanDerWaalsContact C-N 3.28Å; N130-L132 PolarHBondContact O-N 3.35Å; N130-L133 PolarHBondContact O-N 2.9Å; N130-E134 PolarHBondContact O-N 3.35Å |
| 131 | K | 98.8 | Very high | 98.8 | Very high | 138 Ų | 138 | 96.9 Ų | 96.9 | 60% | 0.6 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62 | -32.4 | 172.3 | -71.9 | 167.9 | -175.1 | 173.6 | 0 | 113 | N127 S128 V129 R135 | N127-K131 WeakPolarHBondContact O-CD 3.22Å; N127-K131 VanDerWaalsContact O-CG 3.29Å; N127-K131 WeakPolarHBondContact O-CG 3.26Å; N127-K131 PolarHBondContact O-N 2.89Å; S128-K131 PolarHBondContact O-N 3.13Å; V129-K131 VanDerWaalsContact C-N 3.34Å; V129-K131 PolarHBondContact O-N 2.98Å; K131-R135 VanDerWaalsContact O-CG 3.26Å; K131-R135 WeakPolarHBondContact O-CG 3.34Å; K131-R135 PolarHBondContact O-N 3.31Å |
| 132 | L | 98.9 | Very high | 98.8 | Very high | 117 Ų | 117 | 97.2 Ų | 97.2 | 61% | 0.613 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -73.9 | -41.5 | 175 | -178.5 | 61.5 | 0 | 0 | 0 | 111.9 | S128 V129 N130 E134 R135 S136 | S128-L132 PolarHBondContact O-N 2.94Å; V129-L132 CarbonylContact O-C 3.57Å; V129-L132 WeakPolarHBondContact O-CA 3.4Å; V129-L132 WeakPolarHBondContact O-CB 3.31Å; V129-L132 PolarHBondContact O-N 2.97Å; N130-L132 VanDerWaalsContact C-N 3.28Å; N130-L132 PolarHBondContact O-N 3.35Å; L132-E134 VanDerWaalsContact C-N 3.33Å; L132-E134 PolarHBondContact O-N 2.9Å; L132-R135 PolarHBondContact O-N 3.06Å; L132-S136 WeakPolarHBondContact O-CB 3.46Å; L132-S136 PolarHBondContact O-N 3.06Å |
| 133 | L | 98.8 | Very high | 98.8 | Very high | 91 Ų | 91 | 95.3 Ų | 95.3 | 48% | 0.476 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.5 | -40.7 | 175 | -69.4 | 174.1 | 0 | 0 | 0 | 111.5 | V129 N130 S136 R137 | V129-L133 HydrophobicContact CG1-CD1 4.16Å; V129-L133 HydrophobicContact CG1-CG 4.31Å; V129-L133 WeakPolarHBondContact O-CG 3.43Å; V129-L133 PolarHBondContact O-N 3.18Å; N130-L133 PolarHBondContact O-N 2.9Å; L133-S136 WeakPolarHBondContact O-CB 3.23Å; L133-S136 PolarHBondContact O-N 3.42Å; L133-R137 PolarHBondContact O-N 3.34Å |
| 134 | E | 98.8 | Very high | 98.8 | Very high | 101 Ų | 101 | 96.7 Ų | 96.7 | 47% | 0.472 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.1 | -40.1 | 176 | -169.6 | 50.7 | -135.6 | 0 | 0 | 112.4 | N130 L132 S136 R137 K138 | N130-E134 PolarHBondContact O-N 3.35Å; L132-E134 VanDerWaalsContact C-N 3.33Å; L132-E134 PolarHBondContact O-N 2.9Å; E134-S136 VanDerWaalsContact C-N 3.29Å; E134-S136 PolarHBondContact O-N 3.36Å; E134-R137 PolarHBondContact O-N 2.98Å; E134-R137 IonicContact OE2-CZ 2.66Å; E134-R137 IonicContact OE2-NE 3.66Å; E134-R137 PolarHBondContact OE2-NE 3.48Å; E134-R137 IonicContact OE2-NH2 2.83Å; E134-R137 PolarHBondContact OE2-NH2 3.43Å; E134-K138 PolarHBondContact O-N 3.27Å |
| 135 | R | 98.7 | Very high | 98.8 | Very high | 185 Ų | 185 | 98 Ų | 98 | 70% | 0.698 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -61.1 | -38.7 | 170.2 | -74.3 | 171.8 | 178.3 | -155.4 | -1.3 | 111.9 | K131 L132 K138 V139 | K131-R135 VanDerWaalsContact O-CG 3.26Å; K131-R135 WeakPolarHBondContact O-CG 3.34Å; K131-R135 PolarHBondContact O-N 3.31Å; L132-R135 PolarHBondContact O-N 3.06Å; R135-K138 PolarHBondContact O-N 2.89Å; R135-V139 WeakPolarHBondContact O-CG2 3.41Å; R135-V139 PolarHBondContact O-N 2.83Å |
| 136 | S | 98.8 | Very high | 98.8 | Very high | 75 Ų | 75 | 98.6 Ų | 98.6 | 52% | 0.524 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.6 | -46.5 | 176.3 | -173.4 | 0 | 0 | 0 | 0 | 111.7 | L132 L133 E134 K138 V139 N140 | L132-S136 WeakPolarHBondContact O-CB 3.46Å; L132-S136 PolarHBondContact O-N 3.06Å; L133-S136 WeakPolarHBondContact O-CB 3.23Å; L133-S136 PolarHBondContact O-N 3.42Å; E134-S136 VanDerWaalsContact C-N 3.29Å; E134-S136 PolarHBondContact O-N 3.36Å; S136-K138 VanDerWaalsContact C-N 3.32Å; S136-K138 PolarHBondContact O-N 2.75Å; S136-V139 PolarHBondContact O-N 2.93Å; S136-N140 WeakPolarHBondContact O-CB 3.47Å; S136-N140 PolarHBondContact O-N 3.43Å |
| 137 | R | 98.8 | Very high | 98.8 | Very high | 137 Ų | 137 | 102 Ų | 102 | 52% | 0.517 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -55.5 | -46.1 | 172.1 | -78 | -170.1 | -75.6 | -102.9 | 2.1 | 111.7 | L133 E134 N140 G141 | L133-R137 PolarHBondContact O-N 3.34Å; E134-R137 PolarHBondContact O-N 2.98Å; E134-R137 IonicContact OE2-CZ 2.66Å; E134-R137 IonicContact OE2-NE 3.66Å; E134-R137 PolarHBondContact OE2-NE 3.48Å; E134-R137 IonicContact OE2-NH2 2.83Å; E134-R137 PolarHBondContact OE2-NH2 3.43Å; R137-N140 PolarHBondContact O-N 2.85Å; R137-G141 PolarHBondContact O-N 3.23Å |
| 138 | K | 98.8 | Very high | 98.8 | Very high | 144 Ų | 144 | 102.5 Ų | 102.5 | 63% | 0.626 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.4 | -43.3 | 177.6 | -173.1 | 164.4 | -175.6 | 165.6 | 0 | 113.2 | E134 R135 S136 G141 N142 | E134-K138 PolarHBondContact O-N 3.27Å; R135-K138 PolarHBondContact O-N 2.89Å; S136-K138 VanDerWaalsContact C-N 3.32Å; S136-K138 PolarHBondContact O-N 2.75Å; K138-G141 PolarHBondContact O-N 2.69Å; K138-N142 PolarHBondContact O-N 3.24Å; K138-N142 PolarHBondContact O-OD1 2.75Å |
| 139 | V | 98.8 | Very high | 98.8 | Very high | 89 Ų | 89 | 106 Ų | 106 | 54% | 0.539 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 175.9 | 169.6 | 0 | 0 | 0 | 0 | 111.2 | R135 S136 G141 N142 V143 | R135-V139 WeakPolarHBondContact O-CG2 3.41Å; R135-V139 PolarHBondContact O-N 2.83Å; S136-V139 PolarHBondContact O-N 2.93Å; V139-G141 VanDerWaalsContact C-N 3.33Å; V139-G141 PolarHBondContact O-N 2.8Å; V139-N142 PolarHBondContact O-N 2.76Å; V139-V143 HydrophobicContact CG1-CG2 4.4Å; V139-V143 WeakPolarHBondContact O-CG2 3.47Å; V139-V143 PolarHBondContact O-N 2.98Å |
| 140 | N | 98.7 | Very high | 98.8 | Very high | 88 Ų | 88 | 107.4 Ų | 107.4 | 47% | 0.471 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.7 | -41.9 | 173.8 | -174.3 | 15.4 | 0 | 0 | 0 | 111.7 | S136 R137 V143 K144 | S136-N140 WeakPolarHBondContact O-CB 3.47Å; S136-N140 PolarHBondContact O-N 3.43Å; R137-N140 PolarHBondContact O-N 2.85Å; N140-V143 PolarHBondContact O-N 2.86Å; N140-K144 WeakPolarHBondContact O-CG 3.29Å; N140-K144 PolarHBondContact O-N 3.25Å |
| 141 | G | 98.8 | Very high | 98.7 | Very high | 38 Ų | 38 | 106.3 Ų | 106.3 | 39% | 0.392 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -57.6 | -50.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | R137 K138 V139 V143 K144 E145 | R137-G141 PolarHBondContact O-N 3.23Å; K138-G141 PolarHBondContact O-N 2.69Å; V139-G141 VanDerWaalsContact C-N 3.33Å; V139-G141 PolarHBondContact O-N 2.8Å; G141-V143 VanDerWaalsContact C-N 3.33Å; G141-V143 PolarHBondContact O-N 2.98Å; G141-K144 WeakPolarHBondContact O-CB 3.46Å; G141-K144 PolarHBondContact O-N 3.11Å; G141-E145 PolarHBondContact O-N 3.03Å |
| 142 | N | 98.7 | Very high | 98.7 | Very high | 87 Ų | 87 | 106.2 Ų | 106.2 | 47% | 0.465 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.8 | -41.2 | 176.9 | -66 | 9.2 | 0 | 0 | 0 | 112.3 | K138 V139 K144 E145 V146 | K138-N142 PolarHBondContact O-N 3.24Å; K138-N142 PolarHBondContact O-OD1 2.75Å; V139-N142 PolarHBondContact O-N 2.76Å; N142-K144 VanDerWaalsContact C-N 3.33Å; N142-K144 PolarHBondContact O-N 2.94Å; N142-E145 PolarHBondContact O-N 3.4Å; N142-V146 WeakPolarHBondContact O-CG2 3.41Å; N142-V146 PolarHBondContact O-N 2.94Å |
| 143 | V | 98.8 | Very high | 98.7 | Very high | 88 Ų | 88 | 106 Ų | 106 | 53% | 0.533 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.8 | -37.4 | 177.7 | 169.6 | 0 | 0 | 0 | 0 | 111.3 | V139 N140 G141 V146 K147 | V139-V143 HydrophobicContact CG1-CG2 4.4Å; V139-V143 WeakPolarHBondContact O-CG2 3.47Å; V139-V143 PolarHBondContact O-N 2.98Å; N140-V143 PolarHBondContact O-N 2.86Å; G141-V143 VanDerWaalsContact C-N 3.33Å; G141-V143 PolarHBondContact O-N 2.98Å; V143-V146 PolarHBondContact O-N 2.83Å; V143-K147 WeakPolarHBondContact O-CB 3.43Å; V143-K147 PolarHBondContact O-N 2.94Å |
| 144 | K | 98.8 | Very high | 98.7 | Very high | 137 Ų | 137 | 103.7 Ų | 103.7 | 60% | 0.596 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.1 | -43.2 | 172.8 | -72.1 | 178.5 | 179.3 | -171.5 | 0 | 112.3 | N140 G141 N142 K147 E148 | N140-K144 WeakPolarHBondContact O-CG 3.29Å; N140-K144 PolarHBondContact O-N 3.25Å; G141-K144 WeakPolarHBondContact O-CB 3.46Å; G141-K144 PolarHBondContact O-N 3.11Å; N142-K144 VanDerWaalsContact C-N 3.33Å; N142-K144 PolarHBondContact O-N 2.94Å; K144-K147 PolarHBondContact O-N 3.45Å; K144-E148 PolarHBondContact O-N 3.16Å |
| 145 | E | 98.7 | Very high | 98.7 | Very high | 99 Ų | 99 | 102.9 Ų | 102.9 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.8 | -46.8 | 174.7 | -165.5 | -155 | 144.1 | 0 | 0 | 111.1 | G141 N142 K147 E148 R149 | G141-E145 PolarHBondContact O-N 3.03Å; N142-E145 PolarHBondContact O-N 3.4Å; E145-K147 VanDerWaalsContact C-N 3.32Å; E145-K147 PolarHBondContact O-N 2.85Å; E145-E148 PolarHBondContact O-N 3Å; E145-R149 VanDerWaalsContact O-CG 3.26Å; E145-R149 WeakPolarHBondContact O-CG 3.44Å; E145-R149 PolarHBondContact O-N 3.32Å; E145-R149 WeakPolarHBondContact OE1-CD 3.32Å; E145-R149 IonicContact OE1-CZ 2.91Å; E145-R149 IonicContact OE1-NH1 2.69Å; E145-R149 PolarHBondContact OE1-NH1 3.02Å |
| 146 | V | 98.9 | Very high | 98.7 | Very high | 96 Ų | 96 | 100.1 Ų | 100.1 | 58% | 0.582 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.4 | -41.8 | 178 | 170.8 | 0 | 0 | 0 | 0 | 111.3 | N142 V143 R149 L150 | N142-V146 WeakPolarHBondContact O-CG2 3.41Å; N142-V146 PolarHBondContact O-N 2.94Å; V143-V146 PolarHBondContact O-N 2.83Å; V146-R149 PolarHBondContact O-N 2.87Å; V146-L150 WeakPolarHBondContact O-CB 3.5Å; V146-L150 PolarHBondContact O-N 3.48Å |
| 147 | K | 98.7 | Very high | 98.6 | Very high | 119 Ų | 119 | 100 Ų | 100 | 52% | 0.517 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.7 | -48.2 | 173.8 | -169.3 | -159.2 | 176.8 | -58.8 | 0 | 111.2 | V143 K144 E145 R149 L150 D151 | V143-K147 WeakPolarHBondContact O-CB 3.43Å; V143-K147 PolarHBondContact O-N 2.94Å; K144-K147 PolarHBondContact O-N 3.45Å; E145-K147 VanDerWaalsContact C-N 3.32Å; E145-K147 PolarHBondContact O-N 2.85Å; K147-R149 VanDerWaalsContact C-N 3.3Å; K147-R149 PolarHBondContact O-N 2.85Å; K147-L150 CarbonylContact O-C 3.59Å; K147-L150 WeakPolarHBondContact O-CB 3.46Å; K147-L150 PolarHBondContact O-N 3.33Å; K147-L150 VanDerWaalsContact O-N 3.11Å; K147-D151 IonicContact NZ-OD1 2.81Å; K147-D151 PolarHBondContact NZ-OD1 2.9Å; K147-D151 IonicContact NZ-OD2 2.63Å; K147-D151 PolarHBondContact NZ-OD2 3.38Å; K147-D151 PolarHBondContact O-N 2.9Å |
| 148 | E | 98.7 | Very high | 98.6 | Very high | 89 Ų | 89 | 100.5 Ų | 100.5 | 42% | 0.416 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.9 | -39.3 | -179.1 | -157.6 | -153.5 | 164 | 0 | 0 | 111.8 | K144 E145 L150 D151 R152 | K144-E148 PolarHBondContact O-N 3.16Å; E145-E148 PolarHBondContact O-N 3Å; E148-L150 VanDerWaalsContact C-N 3.35Å; E148-L150 PolarHBondContact O-N 3.33Å; E148-D151 PolarHBondContact O-N 2.97Å; E148-R152 WeakPolarHBondContact O-CB 3.21Å; E148-R152 WeakPolarHBondContact O-CG 3.39Å; E148-R152 PolarHBondContact O-N 3.43Å; E148-R152 IonicContact OE1-CZ 3.91Å; E148-R152 IonicContact OE1-NE 3.06Å; E148-R152 PolarHBondContact OE1-NE 3.13Å; E148-R152 IonicContact OE1-NH2 2.81Å; E148-R152 PolarHBondContact OE1-NH2 2.63Å; E148-R152 IonicContact OE2-CZ 3.98Å; E148-R152 IonicContact OE2-NE 3.22Å; E148-R152 IonicContact OE2-NH2 3.18Å; E148-R152 PolarHBondContact OE2-NH2 2.83Å |
| 149 | R | 98.7 | Very high | 98.6 | Very high | 140 Ų | 140 | 101.5 Ų | 101.5 | 53% | 0.528 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.5 | -40.1 | 174.3 | -66.7 | 171.6 | 79.4 | 108.7 | 9.6 | 111.9 | E145 V146 K147 Q153 | E145-R149 VanDerWaalsContact O-CG 3.26Å; E145-R149 WeakPolarHBondContact O-CG 3.44Å; E145-R149 PolarHBondContact O-N 3.32Å; E145-R149 WeakPolarHBondContact OE1-CD 3.32Å; E145-R149 IonicContact OE1-CZ 2.91Å; E145-R149 IonicContact OE1-NH1 2.69Å; E145-R149 PolarHBondContact OE1-NH1 3.02Å; V146-R149 PolarHBondContact O-N 2.87Å; K147-R149 VanDerWaalsContact C-N 3.3Å; K147-R149 PolarHBondContact O-N 2.85Å; R149-Q153 WeakPolarHBondContact O-CG 3.42Å; R149-Q153 PolarHBondContact O-N 2.77Å |
| 150 | L | 98.7 | Very high | 98.5 | Very high | 104 Ų | 104 | 103.1 Ų | 103.1 | 55% | 0.545 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.8 | -42.4 | 174.6 | -178 | 63.4 | 0 | 0 | 0 | 111.7 | V146 K147 E148 R152 Q153 A154 | V146-L150 WeakPolarHBondContact O-CB 3.5Å; V146-L150 PolarHBondContact O-N 3.48Å; K147-L150 CarbonylContact O-C 3.59Å; K147-L150 WeakPolarHBondContact O-CB 3.46Å; K147-L150 PolarHBondContact O-N 3.33Å; K147-L150 VanDerWaalsContact O-N 3.11Å; E148-L150 VanDerWaalsContact C-N 3.35Å; E148-L150 PolarHBondContact O-N 3.33Å; L150-R152 VanDerWaalsContact C-N 3.35Å; L150-R152 PolarHBondContact O-N 2.85Å; L150-Q153 PolarHBondContact O-N 2.91Å; L150-A154 WeakPolarHBondContact O-CB 3.47Å; L150-A154 PolarHBondContact O-N 2.93Å |
| 151 | D | 98.6 | Very high | 98.3 | Very high | 71 Ų | 71 | 104.1 Ų | 104.1 | 38% | 0.38 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.4 | -44.7 | 175.9 | -63.5 | -36.4 | 0 | 0 | 0 | 110.7 | K147 E148 A154 V155 | K147-D151 IonicContact NZ-OD1 2.81Å; K147-D151 PolarHBondContact NZ-OD1 2.9Å; K147-D151 IonicContact NZ-OD2 2.63Å; K147-D151 PolarHBondContact NZ-OD2 3.38Å; K147-D151 PolarHBondContact O-N 2.9Å; E148-D151 PolarHBondContact O-N 2.97Å; D151-A154 PolarHBondContact O-N 3.49Å; D151-V155 WeakPolarHBondContact O-CG2 3.34Å; D151-V155 PolarHBondContact O-N 3.01Å; D151-V155 VanDerWaalsContact O-N 3.08Å |
| 152 | R | 98.6 | Very high | 98.2 | Very high | 135 Ų | 135 | 105.3 Ų | 105.3 | 51% | 0.509 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.5 | -43.1 | 174 | -69 | 167.7 | -174.4 | -174.7 | 3.6 | 111.7 | E148 L150 V155 Q156 | E148-R152 WeakPolarHBondContact O-CB 3.21Å; E148-R152 WeakPolarHBondContact O-CG 3.39Å; E148-R152 PolarHBondContact O-N 3.43Å; E148-R152 IonicContact OE1-CZ 3.91Å; E148-R152 IonicContact OE1-NE 3.06Å; E148-R152 PolarHBondContact OE1-NE 3.13Å; E148-R152 IonicContact OE1-NH2 2.81Å; E148-R152 PolarHBondContact OE1-NH2 2.63Å; E148-R152 IonicContact OE2-CZ 3.98Å; E148-R152 IonicContact OE2-NE 3.22Å; E148-R152 IonicContact OE2-NH2 3.18Å; E148-R152 PolarHBondContact OE2-NH2 2.83Å; L150-R152 VanDerWaalsContact C-N 3.35Å; L150-R152 PolarHBondContact O-N 2.85Å; R152-V155 PolarHBondContact O-N 3.18Å; R152-Q156 WeakPolarHBondContact O-CG 3.35Å; R152-Q156 PolarHBondContact O-N 3.28Å; R152-Q156 VanDerWaalsContact O-N 3.17Å |
| 153 | Q | 98.6 | Very high | 98 | Very high | 112 Ų | 112 | 105.5 Ų | 105.5 | 52% | 0.523 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.2 | -42.1 | 174.7 | -77.1 | 176.9 | -22.1 | 0 | 0 | 112 | R149 L150 V155 Q156 V157 | R149-Q153 WeakPolarHBondContact O-CG 3.42Å; R149-Q153 PolarHBondContact O-N 2.77Å; L150-Q153 PolarHBondContact O-N 2.91Å; Q153-V155 PolarHBondContact O-N 3.27Å; Q153-Q156 WeakPolarHBondContact O-CB 3.37Å; Q153-Q156 PolarHBondContact O-N 3.06Å; Q153-V157 WeakPolarHBondContact O-CG2 3.27Å; Q153-V157 PolarHBondContact O-N 2.93Å |
| 154 | A | 98.5 | Very high | 97.6 | Very high | 43 Ų | 43 | 106.1 Ų | 106.1 | 36% | 0.355 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.2 | -24 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | L150 D151 R158 | L150-A154 WeakPolarHBondContact O-CB 3.47Å; L150-A154 PolarHBondContact O-N 2.93Å; D151-A154 PolarHBondContact O-N 3.49Å; A154-R158 WeakPolarHBondContact O-CB 3.36Å; A154-R158 WeakPolarHBondContact O-CG 3.49Å; A154-R158 PolarHBondContact O-N 3.45Å; A154-R158 PolarHBondContact O-NE 2.87Å |
| 155 | V | 98.5 | Very high | 97.3 | Very high | 85 Ų | 85 | 103.2 Ų | 103.2 | 52% | 0.515 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -74.2 | -42.5 | 167.8 | 173.1 | 0 | 0 | 0 | 0 | 111.3 | D151 R152 Q153 R158 K159 | D151-V155 WeakPolarHBondContact O-CG2 3.34Å; D151-V155 PolarHBondContact O-N 3.01Å; D151-V155 VanDerWaalsContact O-N 3.08Å; R152-V155 PolarHBondContact O-N 3.18Å; Q153-V155 PolarHBondContact O-N 3.27Å; V155-R158 PolarHBondContact O-N 3.19Å; V155-K159 PolarHBondContact O-N 2.81Å |
| 156 | Q | 98.2 | Very high | 96.9 | Very high | 126 Ų | 126 | 103.5 Ų | 103.5 | 59% | 0.589 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.1 | -43.2 | 178.2 | -67.8 | 174.7 | 15.1 | 0 | 0 | 112.1 | R152 Q153 K159 L160 | R152-Q156 WeakPolarHBondContact O-CG 3.35Å; R152-Q156 PolarHBondContact O-N 3.28Å; R152-Q156 VanDerWaalsContact O-N 3.17Å; Q153-Q156 WeakPolarHBondContact O-CB 3.37Å; Q153-Q156 PolarHBondContact O-N 3.06Å; Q156-K159 WeakPolarHBondContact O-CB 3.31Å; Q156-K159 PolarHBondContact O-N 2.82Å; Q156-L160 WeakPolarHBondContact O-CG 3.14Å; Q156-L160 PolarHBondContact O-N 3.17Å |
| 157 | V | 98.3 | Very high | 96.5 | Very high | 72 Ų | 72 | 101.5 Ų | 101.5 | 44% | 0.436 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -59.8 | -50 | 174.6 | 172.2 | 0 | 0 | 0 | 0 | 110.5 | Q153 K159 L160 E161 | Q153-V157 WeakPolarHBondContact O-CG2 3.27Å; Q153-V157 PolarHBondContact O-N 2.93Å; V157-K159 VanDerWaalsContact C-N 3.25Å; V157-K159 PolarHBondContact O-N 3.39Å; V157-L160 CarbonylContact O-C 3.59Å; V157-L160 WeakPolarHBondContact O-CA 3.46Å; V157-L160 WeakPolarHBondContact O-CB 3.42Å; V157-L160 PolarHBondContact O-N 3.03Å; V157-E161 HydrophobicContact CG1-CG 4.19Å; V157-E161 WeakPolarHBondContact CG1-OE1 3.41Å; V157-E161 WeakPolarHBondContact O-CG 3.5Å; V157-E161 PolarHBondContact O-N 2.92Å |
| 158 | R | 98.1 | Very high | 95.8 | Very high | 149 Ų | 149 | 99.8 Ų | 99.8 | 56% | 0.562 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -59.2 | -32.6 | 175.6 | -77.6 | -179.4 | -68.2 | 153.3 | -6.2 | 113.9 | A154 V155 E161 A162 | A154-R158 WeakPolarHBondContact O-CB 3.36Å; A154-R158 WeakPolarHBondContact O-CG 3.49Å; A154-R158 PolarHBondContact O-N 3.45Å; A154-R158 PolarHBondContact O-NE 2.87Å; V155-R158 PolarHBondContact O-N 3.19Å; R158-E161 WeakPolarHBondContact CA-OE2 3.42Å; R158-A162 VanDerWaalsContact O-CB 3.28Å; R158-A162 WeakPolarHBondContact O-CB 3.45Å; R158-A162 PolarHBondContact O-N 3.45Å |
| 159 | K | 97.9 | Very high | 95.3 | Very high | 165 Ų | 165 | 102.9 Ų | 102.9 | 72% | 0.717 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -68.1 | -38.9 | 173.3 | -172.8 | 178.3 | 178.6 | -179.1 | 0 | 112 | V155 Q156 V157 N163 | V155-K159 PolarHBondContact O-N 2.81Å; Q156-K159 WeakPolarHBondContact O-CB 3.31Å; Q156-K159 PolarHBondContact O-N 2.82Å; V157-K159 VanDerWaalsContact C-N 3.25Å; V157-K159 PolarHBondContact O-N 3.39Å; K159-N163 WeakPolarHBondContact O-CB 3.5Å; K159-N163 PolarHBondContact O-N 3.16Å; K159-N163 VanDerWaalsContact O-N 3.09Å |
| 160 | L | 96.8 | Very high | 94.7 | Very high | 122 Ų | 122 | 103.1 Ų | 103.1 | 64% | 0.639 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -68.7 | -43.8 | 174.7 | -69.6 | 166.5 | 0 | 0 | 0 | 111.6 | Q156 V157 N163 H164 | Q156-L160 WeakPolarHBondContact O-CG 3.14Å; Q156-L160 PolarHBondContact O-N 3.17Å; V157-L160 CarbonylContact O-C 3.59Å; V157-L160 WeakPolarHBondContact O-CA 3.46Å; V157-L160 WeakPolarHBondContact O-CB 3.42Å; V157-L160 PolarHBondContact O-N 3.03Å; L160-N163 PolarHBondContact O-N 2.82Å; L160-H164 WeakPolarHBondContact O-CB 3.37Å; L160-H164 PolarHBondContact O-N 3.17Å |
| 161 | E | 95.6 | Very high | 93.3 | Very high | 110 Ų | 110 | 105.2 Ų | 105.2 | 51% | 0.514 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.5 | -46.4 | 175.2 | -69.4 | 168.8 | 157.7 | 0 | 0 | 111.7 | V157 R158 N163 H164 N165 | V157-E161 HydrophobicContact CG1-CG 4.19Å; V157-E161 WeakPolarHBondContact CG1-OE1 3.41Å; V157-E161 WeakPolarHBondContact O-CG 3.5Å; V157-E161 PolarHBondContact O-N 2.92Å; R158-E161 WeakPolarHBondContact CA-OE2 3.42Å; E161-N163 VanDerWaalsContact C-N 3.34Å; E161-N163 PolarHBondContact O-N 3.42Å; E161-H164 PolarHBondContact O-N 3.28Å; E161-N165 VanDerWaalsContact O-CB 3.27Å; E161-N165 WeakPolarHBondContact O-CB 3.35Å; E161-N165 PolarHBondContact O-N 3.21Å |
| 162 | A | 95.3 | Very high | 91.8 | Very high | 63 Ų | 63 | 107.2 Ų | 107.2 | 52% | 0.521 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.6 | -39.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | R158 H166 | R158-A162 VanDerWaalsContact O-CB 3.28Å; R158-A162 WeakPolarHBondContact O-CB 3.45Å; R158-A162 PolarHBondContact O-N 3.45Å; A162-H166 WeakPolarHBondContact O-CB 3.5Å; A162-H166 PolarHBondContact O-N 3.07Å |
| 163 | N | 94.2 | Very high | 90.1 | Very high | 90 Ų | 90 | 105.4 Ų | 105.4 | 48% | 0.481 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -66.8 | -46.4 | 175.7 | -176.2 | -94.2 | 0 | 0 | 0 | 112 | K159 L160 E161 N165 H166 L167 | K159-N163 WeakPolarHBondContact O-CB 3.5Å; K159-N163 PolarHBondContact O-N 3.16Å; K159-N163 VanDerWaalsContact O-N 3.09Å; L160-N163 PolarHBondContact O-N 2.82Å; E161-N163 VanDerWaalsContact C-N 3.34Å; E161-N163 PolarHBondContact O-N 3.42Å; N163-N165 PolarHBondContact O-N 3.49Å; N163-H166 WeakPolarHBondContact O-CB 3.39Å; N163-H166 PolarHBondContact O-N 3.46Å; N163-H166 VanDerWaalsContact O-N 3.14Å; N163-L167 WeakPolarHBondContact O-CD1 3.29Å; N163-L167 PolarHBondContact O-N 3.19Å |
| 164 | H | 91.6 | Very high | 88.8 | Confident | 101 Ų | 101 | 108.7 Ų | 108.7 | 47% | 0.468 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -57.8 | -47.9 | 175.3 | -179.9 | -159.6 | 0 | 0 | 0 | 111.1 | L160 E161 H166 L167 L168 F173 | L160-H164 WeakPolarHBondContact O-CB 3.37Å; L160-H164 PolarHBondContact O-N 3.17Å; E161-H164 PolarHBondContact O-N 3.28Å; H164-H166 VanDerWaalsContact C-N 3.27Å; H164-H166 PolarHBondContact O-N 3.18Å; H164-L167 PolarHBondContact O-N 2.76Å; H164-L168 WeakPolarHBondContact O-CB 3.48Å; H164-L168 WeakPolarHBondContact O-CG 3.43Å; H164-L168 PolarHBondContact O-N 3.43Å; H164-F173 AromaticContact CD2-CE2 3.66Å; H164-F173 AromaticContact CD2-CZ 3.79Å |
| 165 | N | 91.8 | Very high | 87.5 | Confident | 76 Ų | 76 | 112.1 Ų | 112.1 | 41% | 0.406 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -59.1 | -36.5 | 175.9 | -168 | -98.6 | 0 | 0 | 0 | 112.7 | E161 N163 K169 | E161-N165 VanDerWaalsContact O-CB 3.27Å; E161-N165 WeakPolarHBondContact O-CB 3.35Å; E161-N165 PolarHBondContact O-N 3.21Å; N163-N165 PolarHBondContact O-N 3.49Å; N165-K169 WeakPolarHBondContact O-CB 3.44Å; N165-K169 VanDerWaalsContact O-CG 3.31Å; N165-K169 WeakPolarHBondContact O-CG 3.46Å; N165-K169 PolarHBondContact O-N 3.06Å; N165-K169 WeakPolarHBondContact OD1-CD 3.26Å; N165-K169 WeakPolarHBondContact OD1-CE 3.28Å; N165-K169 PolarHBondContact OD1-NZ 2.74Å |
| 166 | H | 90.6 | Very high | 86.1 | Confident | 106 Ų | 106 | 113.7 Ų | 113.7 | 49% | 0.491 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -71.5 | -40.8 | 177.7 | -175.9 | 77.1 | 0 | 0 | 0 | 113.3 | A162 N163 H164 R170 | A162-H166 WeakPolarHBondContact O-CB 3.5Å; A162-H166 PolarHBondContact O-N 3.07Å; N163-H166 WeakPolarHBondContact O-CB 3.39Å; N163-H166 PolarHBondContact O-N 3.46Å; N163-H166 VanDerWaalsContact O-N 3.14Å; H164-H166 VanDerWaalsContact C-N 3.27Å; H164-H166 PolarHBondContact O-N 3.18Å; H166-R170 PolarHBondContact CE1-NE 3.36Å; H166-R170 PolarHBondContact CE1-NH1 3.01Å; H166-R170 PolarHBondContact CE1-NH2 3.23Å; H166-R170 PolarHBondContact NE2-NH1 3.03Å; H166-R170 PolarHBondContact O-N 2.75Å |
| 167 | L | 89.6 | Confident | 84.9 | Confident | 54 Ų | 54 | 114.2 Ų | 114.2 | 28% | 0.283 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -68.9 | -38.2 | 175.3 | -89.6 | 62.2 | 0 | 0 | 0 | 111.6 | N163 H164 R170 N171 N172 F173 | N163-L167 WeakPolarHBondContact O-CD1 3.29Å; N163-L167 PolarHBondContact O-N 3.19Å; H164-L167 PolarHBondContact O-N 2.76Å; L167-R170 PolarHBondContact O-N 2.79Å; L167-N171 PolarHBondContact O-N 3.25Å; L167-N172 PolarHBondContact O-N 3.42Å; L167-F173 HydrophobicContact CB-CD2 3.88Å; L167-F173 HydrophobicContact CB-CE2 3.25Å; L167-F173 HydrophobicContact CB-CZ 3.75Å; L167-F173 HydrophobicContact CD2-CE1 4.36Å; L167-F173 HydrophobicContact CD2-CE2 4.23Å; L167-F173 HydrophobicContact CD2-CZ 3.84Å; L167-F173 HydrophobicContact CG-CE2 4.37Å; L167-F173 HydrophobicContact CG-CZ 4.47Å |
| 168 | L | 85.4 | Confident | 82.9 | Confident | 83 Ų | 83 | 119 Ų | 119 | 44% | 0.435 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -58.9 | -53 | 171.7 | -75 | 170.8 | 0 | 0 | 0 | 111.1 | H164 R170 N171 F173 | H164-L168 WeakPolarHBondContact O-CB 3.48Å; H164-L168 WeakPolarHBondContact O-CG 3.43Å; H164-L168 PolarHBondContact O-N 3.43Å; L168-R170 PolarHBondContact O-N 2.86Å; L168-N171 PolarHBondContact O-N 3.4Å; L168-F173 HydrophobicContact CD2-CD2 3.8Å; L168-F173 HydrophobicContact CD2-CE2 4.19Å; L168-F173 HydrophobicContact CG-CD2 4.03Å; L168-F173 HydrophobicContact CG-CE2 3.99Å |
| 169 | K | 88.3 | Confident | 81.2 | Confident | 154 Ų | 154 | 117.2 Ų | 117.2 | 67% | 0.67 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -59.7 | -17.6 | 179.7 | -81.4 | 171.3 | 172.2 | 163.9 | 0 | 114.9 | N165 | N165-K169 WeakPolarHBondContact O-CB 3.44Å; N165-K169 VanDerWaalsContact O-CG 3.31Å; N165-K169 WeakPolarHBondContact O-CG 3.46Å; N165-K169 PolarHBondContact O-N 3.06Å; N165-K169 WeakPolarHBondContact OD1-CD 3.26Å; N165-K169 WeakPolarHBondContact OD1-CE 3.28Å; N165-K169 PolarHBondContact OD1-NZ 2.74Å |
| 170 | R | 86.1 | Confident | 79.6 | Confident | 145 Ų | 145 | 117.4 Ų | 117.4 | 55% | 0.547 | 58% | 0.578 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101.4 | 6.6 | 177.1 | -71.5 | -175.8 | 167.4 | -177.9 | -3.2 | 113.7 | H166 L167 L168 N172 | H166-R170 PolarHBondContact CE1-NE 3.36Å; H166-R170 PolarHBondContact CE1-NH1 3.01Å; H166-R170 PolarHBondContact CE1-NH2 3.23Å; H166-R170 PolarHBondContact NE2-NH1 3.03Å; H166-R170 PolarHBondContact O-N 2.75Å; L167-R170 PolarHBondContact O-N 2.79Å; L168-R170 PolarHBondContact O-N 2.86Å; R170-N172 PolarHBondContact O-N 2.89Å; R170-N172 VanDerWaalsContact O-N 3.11Å; R170-N172 PolarHBondContact O-OD1 3.32Å |
| 171 | N | 69.3 | Low | 77.8 | Confident | 148 Ų | 148 | 119.2 Ų | 119.2 | 79% | 0.791 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 53.5 | 26.1 | -175.9 | -62.5 | -24.9 | 0 | 0 | 0 | 113.6 | L167 L168 F173 | L167-N171 PolarHBondContact O-N 3.25Å; L168-N171 PolarHBondContact O-N 3.4Å; N171-F173 VanDerWaalsContact C-N 3.3Å; N171-F173 PolarHBondContact O-N 2.83Å |
| 172 | N | 66.6 | Low | 75.8 | Confident | 112 Ų | 112 | 119.8 Ų | 119.8 | 60% | 0.599 | 60% | 0.595 | S | S | * | * | trans | -81.4 | -8.4 | -175.2 | -78.7 | -21.6 | 0 | 0 | 0 | 113.4 | L167 R170 K174 | L167-N172 PolarHBondContact O-N 3.42Å; R170-N172 PolarHBondContact O-N 2.89Å; R170-N172 VanDerWaalsContact O-N 3.11Å; R170-N172 PolarHBondContact O-OD1 3.32Å; N172-K174 PolarHBondContact O-N 2.98Å | ||
| 173 | F | 63.8 | Low | 73.9 | Confident | 97 Ų | 97 | 125.4 Ų | 125.4 | 43% | 0.425 | 61% | 0.611 | S | S | . | * | trans | -82 | 89.8 | 174.1 | -77.3 | -71.3 | 0 | 0 | 0 | 111.7 | H164 L167 L168 N171 V175 | H164-F173 AromaticContact CD2-CE2 3.66Å; H164-F173 AromaticContact CD2-CZ 3.79Å; L167-F173 HydrophobicContact CB-CD2 3.88Å; L167-F173 HydrophobicContact CB-CE2 3.25Å; L167-F173 HydrophobicContact CB-CZ 3.75Å; L167-F173 HydrophobicContact CD2-CE1 4.36Å; L167-F173 HydrophobicContact CD2-CE2 4.23Å; L167-F173 HydrophobicContact CD2-CZ 3.84Å; L167-F173 HydrophobicContact CG-CE2 4.37Å; L167-F173 HydrophobicContact CG-CZ 4.47Å; L168-F173 HydrophobicContact CD2-CD2 3.8Å; L168-F173 HydrophobicContact CD2-CE2 4.19Å; L168-F173 HydrophobicContact CG-CD2 4.03Å; L168-F173 HydrophobicContact CG-CE2 3.99Å; N171-F173 VanDerWaalsContact C-N 3.3Å; N171-F173 PolarHBondContact O-N 2.83Å; F173-V175 PolarHBondContact O-N 3.36Å | ||
| 174 | K | 70.6 | Confident | 71.8 | Confident | 182 Ų | 182 | 127.1 Ų | 127.1 | 79% | 0.791 | 62% | 0.619 | S | S | * | * | trans | -83.2 | 94.6 | 158.7 | -67.3 | -174.8 | 179.6 | -178.3 | 0 | 108.7 | N172 L176 | N172-K174 PolarHBondContact O-N 2.98Å; K174-L176 HydrophobicContact CB-CD1 4.01Å; K174-L176 PolarHBondContact O-N 3.39Å | ||
| 175 | V | 71.8 | Confident | 69.8 | Low | 115 Ų | 115 | 126.1 Ų | 126.1 | 70% | 0.697 | 62% | 0.621 | S | S | * | * | trans | -78.5 | 96.6 | 171.8 | -176.4 | 0 | 0 | 0 | 0 | 108.3 | F173 I177 | F173-V175 PolarHBondContact O-N 3.36Å; V175-I177 HydrophobicContact CG1-CG1 3.98Å; V175-I177 PolarHBondContact O-N 3.18Å | ||
| 176 | L | 68.7 | Low | 68 | Low | 117 Ų | 117 | 127.6 Ų | 127.6 | 61% | 0.613 | 64% | 0.644 | S | S | * | * | trans | -80.3 | 102.3 | 168.7 | -75.1 | 85.1 | 0 | 0 | 0 | 108.4 | K174 F178 | K174-L176 HydrophobicContact CB-CD1 4.01Å; K174-L176 PolarHBondContact O-N 3.39Å; L176-F178 HydrophobicContact CB-CD2 3.99Å; L176-F178 HydrophobicContact CB-CE2 3.56Å; L176-F178 HydrophobicContact CB-CZ 4.25Å; L176-F178 HydrophobicContact CD2-CE2 3.84Å; L176-F178 HydrophobicContact CD2-CZ 3.72Å; L176-F178 HydrophobicContact CG-CE2 4.34Å; L176-F178 PolarHBondContact O-N 2.83Å | ||
| 177 | I | 72.5 | Confident | 66.3 | Low | 137 Ų | 137 | 128.5 Ų | 128.5 | 70% | 0.703 | 65% | 0.652 | S | S | * | * | trans | -78.3 | 96.9 | 169.1 | -55.4 | 179.9 | 0 | 0 | 0 | 107.2 | V175 Q179 | V175-I177 HydrophobicContact CG1-CG1 3.98Å; V175-I177 PolarHBondContact O-N 3.18Å; I177-Q179 VanDerWaalsContact C-N 3.31Å; I177-Q179 PolarHBondContact O-N 3.23Å | ||
| 178 | F | 56.3 | Low | 64.3 | Low | 174 Ų | 174 | 131.6 Ų | 131.6 | 76% | 0.763 | 67% | 0.673 | S | S | * | * | trans | -74.9 | 88 | 169.3 | -74.1 | -84.2 | 0 | 0 | 0 | 109 | L176 E180 | L176-F178 HydrophobicContact CB-CD2 3.99Å; L176-F178 HydrophobicContact CB-CE2 3.56Å; L176-F178 HydrophobicContact CB-CZ 4.25Å; L176-F178 HydrophobicContact CD2-CE2 3.84Å; L176-F178 HydrophobicContact CD2-CZ 3.72Å; L176-F178 HydrophobicContact CG-CE2 4.34Å; L176-F178 PolarHBondContact O-N 2.83Å; F178-E180 VanDerWaalsContact C-N 3.3Å; F178-E180 PolarHBondContact O-N 2.81Å; F178-E180 VanDerWaalsContact O-N 3.11Å | ||
| 179 | Q | 62.7 | Low | 62.6 | Low | 110 Ų | 110 | 133.2 Ų | 133.2 | 51% | 0.514 | 69% | 0.686 | S | S | . | * | trans | -80.9 | 81.6 | 172.2 | -174.7 | 165.7 | -21.7 | 0 | 0 | 108.8 | I177 D181 N182 | I177-Q179 VanDerWaalsContact C-N 3.31Å; I177-Q179 PolarHBondContact O-N 3.23Å; Q179-D181 PolarHBondContact O-N 2.69Å; Q179-N182 HydrophobicContact CG-CB 4.39Å; Q179-N182 PolarHBondContact NE2-O 3.37Å | ||
| 180 | E | 64.2 | Low | 60.7 | Low | 170 Ų | 170 | 132 Ų | 132 | 79% | 0.794 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.3 | 115.8 | -178.8 | -160.6 | 164.1 | -133.7 | 0 | 0 | 110.4 | F178 N182 | F178-E180 VanDerWaalsContact C-N 3.3Å; F178-E180 PolarHBondContact O-N 2.81Å; F178-E180 VanDerWaalsContact O-N 3.11Å; E180-N182 PolarHBondContact O-N 2.98Å; E180-N182 PolarHBondContact O-ND2 3.17Å |
| 181 | D | 59.1 | Low | 58.5 | Low | 160 Ų | 160 | 129.4 Ų | 129.4 | 86% | 0.856 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 44.7 | 30 | 171 | -60.6 | -13.1 | 0 | 0 | 0 | 118.3 | Q179 | Q179-D181 PolarHBondContact O-N 2.69Š|
| 182 | N | 53 | Low | 57.2 | Low | 122 Ų | 122 | 128.4 Ų | 128.4 | 65% | 0.652 | 70% | 0.697 | S | S | * | * | trans | -110.9 | 84.5 | 166.5 | -84.5 | -87.7 | 0 | 0 | 0 | 111.8 | Q179 E180 I184 | Q179-N182 HydrophobicContact CG-CB 4.39Å; Q179-N182 PolarHBondContact NE2-O 3.37Å; E180-N182 PolarHBondContact O-N 2.98Å; E180-N182 PolarHBondContact O-ND2 3.17Å; N182-I184 PolarHBondContact O-N 3.42Å; N182-I184 VanDerWaalsContact O-N 3.16Å | ||
| 183 | E | 55.6 | Low | 55.9 | Low | 181 Ų | 181 | 132.6 Ų | 132.6 | 85% | 0.846 | 71% | 0.71 | S | S | * | * | trans | -43.8 | 110.8 | 155.3 | -177 | 176.4 | -127.3 | 0 | 0 | 109.9 | P185 | E183-P185 VanDerWaalsContact O-CD 3.26Å; E183-P185 WeakPolarHBondContact O-CD 3.43Å | ||
| 184 | I | 50.8 | Low | 55 | Low | 126 Ų | 126 | 133.9 Ų | 133.9 | 65% | 0.646 | 73% | 0.726 | S | S | * | * | trans | -71.8 | 119.1 | 171.6 | -56.9 | 179.4 | 0 | 0 | 0 | 106.7 | N182 A186 | N182-I184 PolarHBondContact O-N 3.42Å; N182-I184 VanDerWaalsContact O-N 3.16Å; I184-A186 PolarHBondContact O-N 3.29Å; I184-A186 VanDerWaalsContact O-N 3.1Å | ||
| 185 | P | 48.5 | Very low | 53.4 | Low | 79 Ų | 79 | 131.1 Ų | 131.1 | 51% | 0.513 | 73% | 0.727 | S | S | . | * | trans | -60.2 | 120 | -178.4 | -25.3 | 36.4 | 0 | 0 | 0 | 110.7 | E183 N187 | E183-P185 VanDerWaalsContact O-CD 3.26Å; E183-P185 WeakPolarHBondContact O-CD 3.43Å; P185-N187 WeakPolarHBondContact CB-OD1 3.4Å; P185-N187 PolarHBondContact O-N 2.98Å | ||
| 186 | A | 54.8 | Low | 51.8 | Low | 108 Ų | 108 | 132 Ų | 132 | 89% | 0.893 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73 | 30.4 | -173.3 | 0 | 0 | 0 | 0 | 0 | 114 | I184 | I184-A186 PolarHBondContact O-N 3.29Å; I184-A186 VanDerWaalsContact O-N 3.1Å |
| 187 | N | 53.6 | Low | 50.8 | Low | 124 Ų | 124 | 132.4 Ų | 132.4 | 66% | 0.663 | 74% | 0.742 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.3 | 14.3 | -173 | 62.9 | -19.4 | 0 | 0 | 0 | 114.2 | P185 V189 | P185-N187 WeakPolarHBondContact CB-OD1 3.4Å; P185-N187 PolarHBondContact O-N 2.98Å; N187-V189 PolarHBondContact O-N 3.47Å; N187-V189 VanDerWaalsContact O-N 3.13Å |
| 188 | V | 47.7 | Very low | 49.1 | Very low | 119 Ų | 119 | 129.9 Ų | 129.9 | 72% | 0.721 | 74% | 0.736 | S | S | * | * | trans | -84.4 | 64.2 | 158.6 | -171.9 | 0 | 0 | 0 | 0 | 109.4 | V190 | V188-V190 HydrophobicContact CG1-CG2 4.33Å; V188-V190 PolarHBondContact O-N 3.28Å | ||
| 189 | V | 50.3 | Low | 48.2 | Very low | 117 Ų | 117 | 129.7 Ų | 129.7 | 71% | 0.709 | 74% | 0.738 | S | S | * | * | trans | -77.4 | 87.5 | 173.8 | -179.4 | 0 | 0 | 0 | 0 | 108.9 | N187 | N187-V189 PolarHBondContact O-N 3.47Å; N187-V189 VanDerWaalsContact O-N 3.13Å | ||
| 190 | V | 48.6 | Very low | 46.8 | Very low | 128 Ų | 128 | 134.4 Ų | 134.4 | 78% | 0.776 | 75% | 0.752 | S | S | * | * | trans | -84.3 | 106.5 | 159.4 | 179.5 | 0 | 0 | 0 | 0 | 107.3 | V188 | V188-V190 HydrophobicContact CG1-CG2 4.33Å; V188-V190 PolarHBondContact O-N 3.28Å | ||
| 191 | S | 39.2 | Very low | 45.3 | Very low | 92 Ų | 92 | 132.4 Ų | 132.4 | 64% | 0.643 | 75% | 0.747 | S | S | * | * | trans | -54.5 | 145 | -175.8 | -56.8 | 0 | 0 | 0 | 0 | 112.9 | K193 | S191-K193 PolarHBondContact O-N 2.83Š| ||
| 192 | P | 43.5 | Very low | 44.1 | Very low | 126 Ų | 126 | 130.1 Ų | 130.1 | 82% | 0.818 | 74% | 0.739 | S | S | * | * | trans | -67.6 | 125.2 | -168.3 | 26.4 | -35.2 | 0 | 0 | 0 | 112.7 | ||||
| 193 | K | 38.9 | Very low | 43.3 | Very low | 200 Ų | 200 | 132.6 Ų | 132.6 | 87% | 0.87 | 75% | 0.747 | S | S | * | * | trans | -113.8 | 112.2 | 153.4 | -106.3 | -175.2 | 172 | 63.9 | 0 | 108.8 | S191 | S191-K193 PolarHBondContact O-N 2.83Š| ||
| 194 | T | 44.8 | Very low | 42.4 | Very low | 124 Ų | 124 | 127.9 Ų | 127.9 | 76% | 0.761 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 138.3 | 174.8 | 44.5 | 0 | 0 | 0 | 0 | 112 | ||
| 195 | P | 37.8 | Very low | 41.5 | Very low | 125 Ų | 125 | 127.1 Ų | 127.1 | 81% | 0.812 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -103.1 | 117.1 | 151.4 | 32.4 | -23.4 | 0 | 0 | 0 | 110.4 | ||
| 196 | V | 37.8 | Very low | 40.7 | Very low | 132 Ų | 132 | 130.4 Ų | 130.4 | 80% | 0.8 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -89.4 | 140.6 | 164.5 | 175.6 | 0 | 0 | 0 | 0 | 107.5 | ||
| 197 | P | 47.3 | Very low | 39.8 | Very low | 127 Ų | 127 | 134 Ų | 134 | 83% | 0.825 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -90.8 | 133.9 | -165.1 | 33.5 | -35.6 | 0 | 0 | 0 | 115.5 | ||
| 198 | S | 37.4 | Very low | 39.5 | Very low | 83 Ų | 83 | 133.1 Ų | 133.1 | 58% | 0.58 | 75% | 0.746 | S | S | * | * | trans | -155.3 | 118.9 | 157.9 | 57.3 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 199 | Q | 36.5 | Very low | 39 | Very low | 171 Ų | 171 | 131.9 Ų | 131.9 | 80% | 0.799 | 75% | 0.748 | S | S | * | * | 67.6 | 147.4 | 88.4 | -70.9 | -173.6 | -32.3 | 0 | 0 | 114.5 | |||||
| 200 | Y | 34 | Very low | 38.8 | Very low | 208 Ų | 208 | 132 Ų | 132 | 82% | 0.816 | 75% | 0.752 | S | S | * | * | trans | 58.8 | 154.7 | 171.2 | 74.1 | -102.2 | 0 | 0 | 0 | 117 | ||||
| 201 | D | 32.4 | Very low | 38 | Very low | 129 Ų | 129 | 131.1 Ų | 131.1 | 69% | 0.69 | 75% | 0.751 | S | S | * | * | cis | -159.4 | 171.8 | -33.4 | -177.9 | 37.9 | 0 | 0 | 0 | 108.3 | ||||
| 202 | T | 33.9 | Very low | 37.7 | Very low | 112 Ų | 112 | 134.1 Ų | 134.1 | 69% | 0.687 | 76% | 0.758 | S | S | * | * | trans | 44.4 | 136 | 154.5 | 34.8 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 203 | E | 35.9 | Very low | 37 | Very low | 174 Ų | 174 | 134.5 Ų | 134.5 | 81% | 0.813 | 76% | 0.758 | S | S | * | * | trans | 93.7 | 148.1 | 140.2 | -123.2 | -155.8 | 76.3 | 0 | 0 | 123.3 | ||||
| 204 | S | 37.1 | Very low | 36.5 | Very low | 82 Ų | 82 | 128.1 Ų | 128.1 | 57% | 0.573 | 75% | 0.749 | S | S | * | * | trans | 74.7 | 104.2 | 146 | -99.8 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 205 | T | 31.7 | Very low | 35.9 | Very low | 110 Ų | 110 | 128 Ų | 128 | 68% | 0.675 | 75% | 0.754 | S | S | * | * | 106.3 | 102.4 | 105.8 | -70.7 | 0 | 0 | 0 | 0 | 121 | |||||
| 206 | I | 31.9 | Very low | 35.6 | Very low | 147 Ų | 147 | 129.2 Ų | 129.2 | 75% | 0.754 | 75% | 0.752 | S | S | * | * | trans | 61.9 | 97.6 | 131.5 | -54.9 | -179.2 | 0 | 0 | 0 | 120.2 | ||||
| 207 | Q | 34.8 | Very low | 35.4 | Very low | 185 Ų | 185 | 131.5 Ų | 131.5 | 86% | 0.864 | 75% | 0.753 | S | S | * | * | 60.5 | 165.7 | 112.9 | -86.3 | -157.2 | 49.8 | 0 | 0 | 122.4 | |||||
| 208 | P | 48.8 | Very low | 34.6 | Very low | 105 Ų | 105 | 128 Ų | 128 | 68% | 0.682 | 74% | 0.741 | S | S | * | * | trans | -135.1 | 178.1 | -134.6 | 46.7 | -32.3 | 0 | 0 | 0 | 118.7 | ||||
| 209 | A | 37.4 | Very low | 34.3 | Very low | 93 Ų | 93 | 129.9 Ų | 129.9 | 77% | 0.769 | 75% | 0.754 | S | S | * | * | trans | 72.3 | 159.3 | 157 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 210 | P | 45.4 | Very low | 34.3 | Very low | 120 Ų | 120 | 132.2 Ų | 132.2 | 78% | 0.779 | 76% | 0.756 | S | S | * | * | -143.3 | 157 | 61.3 | 39.2 | -20.3 | 0 | 0 | 0 | 118.9 | |||||
| 211 | S | 32.5 | Very low | 34.1 | Very low | 108 Ų | 108 | 127.9 Ų | 127.9 | 76% | 0.755 | 75% | 0.751 | S | S | * | * | trans | 12.8 | 138.2 | 136.5 | -167.6 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 212 | I | 31.6 | Very low | 34.3 | Very low | 156 Ų | 156 | 131.3 Ų | 131.3 | 80% | 0.8 | 76% | 0.763 | S | S | * | * | -166.5 | 159.1 | 121.2 | -103.4 | 162.6 | 0 | 0 | 0 | 113.3 | |||||
| 213 | T | 29.9 | Very low | 34.4 | Very low | 133 Ų | 133 | 134.5 Ų | 134.5 | 82% | 0.816 | 77% | 0.77 | S | S | * | * | trans | -38.3 | 164.5 | -179 | 59.2 | 0 | 0 | 0 | 0 | 119 | ||||
| 214 | G | 27.3 | Very low | 34.9 | Very low | 66 Ų | 66 | 135 Ų | 135 | 68% | 0.68 | 77% | 0.772 | S | S | * | * | cis | 142.1 | 157 | 2.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 215 | S | 32.3 | Very low | 34.7 | Very low | 123 Ų | 123 | 138.8 Ų | 138.8 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | trans | 70.4 | 154.3 | -174.3 | -116 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 216 | I | 31.7 | Very low | 35 | Very low | 149 Ų | 149 | 142 Ų | 142 | 76% | 0.764 | 80% | 0.795 | S | S | * | * | cis | -151.2 | 153.6 | 4 | -170.2 | 159.4 | 0 | 0 | 0 | 112 | ||||
| 217 | E | 33.7 | Very low | 35.2 | Very low | 180 Ų | 180 | 142.5 Ų | 142.5 | 84% | 0.841 | 79% | 0.794 | S | S | * | * | trans | 14.6 | 137.9 | 157.9 | -151.9 | 64.9 | -128.4 | 0 | 0 | 122.5 | ||||
| 218 | G | 30.1 | Very low | 35.2 | Very low | 55 Ų | 55 | 142.8 Ų | 142.8 | 57% | 0.567 | 79% | 0.793 | S | S | * | * | trans | 160.5 | 92.8 | 152.6 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 219 | S | 31.3 | Very low | 34.6 | Very low | 122 Ų | 122 | 145.8 Ų | 145.8 | 85% | 0.853 | 80% | 0.801 | S | S | * | * | trans | 57 | 157.8 | 152.1 | 51.3 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 220 | R | 36 | Very low | 34.8 | Very low | 219 Ų | 219 | 146.6 Ų | 146.6 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | cis | 168.6 | 146.9 | -17.1 | -170.6 | 178.1 | -160.8 | -105.2 | 7.1 | 103.6 | ||||
| 221 | T | 30.7 | Very low | 34.5 | Very low | 118 Ų | 118 | 149.4 Ų | 149.4 | 72% | 0.724 | 81% | 0.809 | S | S | * | * | trans | 56.1 | 107.9 | 171.6 | 41.6 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 222 | Q | 36.2 | Very low | 34.5 | Very low | 201 Ų | 201 | 150.3 Ų | 150.3 | 94% | 0.939 | 82% | 0.815 | S | S | * | * | trans | -138.9 | 91.9 | 153 | -175.2 | -174.9 | 57.3 | 0 | 0 | 109.4 | ||||
| 223 | E | 36.8 | Very low | 35.1 | Very low | 179 Ų | 179 | 148.3 Ų | 148.3 | 84% | 0.836 | 82% | 0.815 | S | S | * | * | trans | -149.4 | 165.1 | 164.1 | 60 | -170 | 154.1 | 0 | 0 | 109.2 | ||||
| 224 | E | 45.2 | Very low | 35.7 | Very low | 183 Ų | 183 | 144.7 Ų | 144.7 | 86% | 0.855 | 80% | 0.804 | S | S | * | * | trans | 64.3 | 83.9 | -177.2 | -166.7 | 168.6 | -148.2 | 0 | 0 | 117.4 | ||||
| 225 | M | 34.1 | Very low | 36.2 | Very low | 162 Ų | 162 | 149.4 Ų | 149.4 | 80% | 0.798 | 81% | 0.814 | S | S | * | * | -169 | 72.8 | 127.1 | -165.8 | 171.6 | -175.5 | 0 | 0 | 112 | |||||
| 226 | L | 37.4 | Very low | 36.7 | Very low | 179 Ų | 179 | 151.2 Ų | 151.2 | 94% | 0.937 | 81% | 0.814 | S | S | * | * | trans | -129.2 | 85.6 | 163.7 | -78.7 | 179 | 0 | 0 | 0 | 109.8 | ||||
| 227 | Q | 35.9 | Very low | 37.6 | Very low | 157 Ų | 157 | 149.5 Ų | 149.5 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | -90 | 118.9 | 179.6 | -65.7 | -170.4 | 8.4 | 0 | 0 | 111.8 | ||||
| 228 | K | 34.8 | Very low | 37.5 | Very low | 191 Ų | 191 | 147.5 Ų | 147.5 | 83% | 0.83 | 81% | 0.807 | S | S | * | * | 46.7 | 93.9 | 128.1 | -169.9 | -165.9 | 178.7 | -172.7 | 0 | 117.4 | |||||
| 229 | I | 36.3 | Very low | 37.8 | Very low | 168 Ų | 168 | 151.9 Ų | 151.9 | 86% | 0.862 | 82% | 0.817 | S | S | * | * | trans | -134 | 134.9 | 133.5 | 36.3 | 173.1 | 0 | 0 | 0 | 109.7 | ||||
| 230 | S | 42.1 | Very low | 37.8 | Very low | 110 Ų | 110 | 150.3 Ų | 150.3 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | trans | -133.1 | 118.3 | 173.9 | -57.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 231 | L | 37.9 | Very low | 37.6 | Very low | 179 Ų | 179 | 146.7 Ų | 146.7 | 94% | 0.937 | 82% | 0.818 | S | S | * | * | trans | -138.7 | 106.6 | 170.7 | -71.8 | 177.7 | 0 | 0 | 0 | 108.2 | ||||
| 232 | S | 32.6 | Very low | 37.6 | Very low | 126 Ų | 126 | 144.9 Ų | 144.9 | 88% | 0.881 | 82% | 0.823 | S | S | * | * | trans | -153.1 | 90.7 | 165.6 | -170.7 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 233 | S | 44 | Very low | 37.5 | Very low | 114 Ų | 114 | 140.4 Ų | 140.4 | 80% | 0.797 | 82% | 0.82 | S | S | * | * | trans | -97.6 | 151.1 | 145.3 | -151.9 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 234 | G | 43.6 | Very low | 37.3 | Very low | 58 Ų | 58 | 137.4 Ų | 137.4 | 60% | 0.598 | 82% | 0.819 | S | S | * | * | cis | 115 | 89.1 | 4.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 235 | D | 37.7 | Very low | 36.7 | Very low | 164 Ų | 164 | 136.4 Ų | 136.4 | 88% | 0.877 | 81% | 0.814 | S | S | * | * | trans | -151.9 | 121.4 | 174.5 | -76.7 | -63 | 0 | 0 | 0 | 107.6 | ||||
| 236 | D | 42.2 | Very low | 36.9 | Very low | 162 Ų | 162 | 137.9 Ų | 137.9 | 87% | 0.866 | 81% | 0.811 | S | S | * | * | trans | -89 | 158.7 | 158.4 | -73.1 | -71.2 | 0 | 0 | 0 | 108.3 | ||||
| 237 | P | 50.3 | Low | 37.1 | Very low | 112 Ų | 112 | 136.8 Ų | 136.8 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | -151 | 169.7 | 101.8 | 39.3 | -22.8 | 0 | 0 | 0 | 117.3 | |||||
| 238 | D | 31.8 | Very low | 37.2 | Very low | 138 Ų | 138 | 138.3 Ų | 138.3 | 74% | 0.738 | 81% | 0.808 | S | S | * | * | trans | 83.1 | 114.6 | 146.8 | -76.9 | -10 | 0 | 0 | 0 | 123.8 | ||||
| 239 | L | 36.1 | Very low | 37.1 | Very low | 148 Ų | 148 | 132.5 Ų | 132.5 | 78% | 0.775 | 80% | 0.803 | S | S | * | * | 73.1 | 87 | 126.6 | -64.5 | 168.4 | 0 | 0 | 0 | 120.9 | |||||
| 240 | A | 32.4 | Very low | 37 | Very low | 89 Ų | 89 | 132.2 Ų | 132.2 | 74% | 0.736 | 80% | 0.803 | S | S | * | * | 44.1 | 115.9 | 112 | 0 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 241 | C | 31.7 | Very low | 36.7 | Very low | 142 Ų | 142 | 132.4 Ų | 132.4 | 96% | 0.959 | 80% | 0.804 | S | S | * | * | -166.9 | 159.8 | 129.9 | -102.3 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 242 | G | 30.1 | Very low | 36.8 | Very low | 80 Ų | 80 | 131.8 Ų | 131.8 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | 109 | 44.2 | 160 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 243 | A | 35.3 | Very low | 37 | Very low | 107 Ų | 107 | 135.1 Ų | 135.1 | 88% | 0.884 | 80% | 0.803 | S | S | * | * | trans | -96.1 | 116.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 244 | S | 31.6 | Very low | 36.6 | Very low | 117 Ų | 117 | 139.1 Ų | 139.1 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | trans | -161 | 152.1 | 154.9 | 71.2 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 245 | Q | 33.7 | Very low | 36.4 | Very low | 161 Ų | 161 | 142.5 Ų | 142.5 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | cis | -158 | 135.6 | 17.6 | 178 | 169.7 | 59.7 | 0 | 0 | 111.4 | ||||
| 246 | R | 36.3 | Very low | 36.7 | Very low | 193 Ų | 193 | 139 Ų | 139 | 73% | 0.728 | 79% | 0.79 | S | S | * | * | trans | 65.7 | 120.3 | 164.1 | -67.5 | -174.5 | -175 | -78.8 | 5 | 117.8 | ||||
| 247 | E | 42 | Very low | 36.9 | Very low | 156 Ų | 156 | 134.9 Ų | 134.9 | 73% | 0.729 | 78% | 0.775 | S | S | * | * | 76.9 | 141.4 | 79.1 | -70.3 | 169.5 | 159.4 | 0 | 0 | 112.6 | |||||
| 248 | E | 39.1 | Very low | 36.6 | Very low | 189 Ų | 189 | 134.4 Ų | 134.4 | 88% | 0.883 | 77% | 0.772 | S | S | * | * | cis | -155.2 | 163.1 | 24.2 | -164.8 | 176.8 | -178.8 | 0 | 0 | 112.4 | ||||
| 249 | G | 32.4 | Very low | 37.4 | Very low | 69 Ų | 69 | 135.3 Ų | 135.3 | 71% | 0.711 | 78% | 0.775 | S | S | * | * | trans | 62.4 | 110.1 | 162 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 250 | D | 33.8 | Very low | 38 | Very low | 162 Ų | 162 | 136.9 Ų | 136.9 | 87% | 0.866 | 78% | 0.775 | S | S | * | * | 73.9 | 101.8 | 54.1 | -165.5 | 34.8 | 0 | 0 | 0 | 116.9 | |||||
| 251 | S | 35.3 | Very low | 38.7 | Very low | 115 Ų | 115 | 141.3 Ų | 141.3 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | -176.7 | 145.2 | 135.4 | -174 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 252 | L | 41 | Very low | 39.7 | Very low | 166 Ų | 166 | 137.8 Ų | 137.8 | 87% | 0.869 | 75% | 0.748 | S | S | * | * | trans | -104.9 | 125.9 | -177.9 | -84 | 161.8 | 0 | 0 | 0 | 112.3 | ||||
| 253 | E | 37.5 | Very low | 41.3 | Very low | 196 Ų | 196 | 142.4 Ų | 142.4 | 92% | 0.916 | 74% | 0.74 | S | S | * | * | trans | -136.6 | 143.5 | 152.6 | -168.9 | 163.7 | -151.9 | 0 | 0 | 110.7 | ||||
| 254 | Y | 35.8 | Very low | 42.6 | Very low | 197 Ų | 197 | 147.7 Ų | 147.7 | 77% | 0.773 | 74% | 0.737 | S | S | * | * | trans | -124.3 | 80.8 | -163.2 | 172.9 | -106.4 | 0 | 0 | 0 | 110.7 | V256 | Y254-V256 HydrophobicContact CD1-CG2 3.8Å; Y254-V256 HydrophobicContact CD2-CG2 4.23Å; Y254-V256 HydrophobicContact CE1-CG2 3.24Å; Y254-V256 HydrophobicContact CE2-CG2 3.72Å; Y254-V256 HydrophobicContact CG-CG2 4.28Å; Y254-V256 PolarHBondContact O-N 3.06Å; Y254-V256 WeakPolarHBondContact OH-CG2 3.45Å | ||
| 255 | D | 38.6 | Very low | 43.8 | Very low | 130 Ų | 130 | 145.7 Ų | 145.7 | 70% | 0.695 | 72% | 0.723 | S | S | * | * | trans | -81.6 | 112 | 166.7 | 177.3 | 43.1 | 0 | 0 | 0 | 111 | S257 | D255-S257 PolarHBondContact O-N 3.15Å; D255-S257 WeakPolarHBondContact OD2-CB 3.34Å; D255-S257 PolarHBondContact OD2-N 2.89Å; D255-S257 PolarHBondContact OD2-OG 3.27Å | ||
| 256 | V | 44.4 | Very low | 45.3 | Very low | 89 Ų | 89 | 142 Ų | 142 | 54% | 0.539 | 71% | 0.708 | S | S | . | * | trans | -85.7 | 66.2 | 171.1 | -172 | 0 | 0 | 0 | 0 | 109.8 | Y254 P258 | Y254-V256 HydrophobicContact CD1-CG2 3.8Å; Y254-V256 HydrophobicContact CD2-CG2 4.23Å; Y254-V256 HydrophobicContact CE1-CG2 3.24Å; Y254-V256 HydrophobicContact CE2-CG2 3.72Å; Y254-V256 HydrophobicContact CG-CG2 4.28Å; Y254-V256 PolarHBondContact O-N 3.06Å; Y254-V256 WeakPolarHBondContact OH-CG2 3.45Å; V256-P258 VanDerWaalsContact O-CD 3.28Å; V256-P258 WeakPolarHBondContact O-CD 3.42Å | ||
| 257 | S | 46.4 | Very low | 46.6 | Very low | 77 Ų | 77 | 139.7 Ų | 139.7 | 54% | 0.538 | 70% | 0.7 | S | S | . | * | trans | -61.3 | 114.1 | 159.3 | -87.9 | 0 | 0 | 0 | 0 | 108.9 | D255 I259 | D255-S257 PolarHBondContact O-N 3.15Å; D255-S257 WeakPolarHBondContact OD2-CB 3.34Å; D255-S257 PolarHBondContact OD2-N 2.89Å; D255-S257 PolarHBondContact OD2-OG 3.27Å; S257-I259 PolarHBondContact O-N 2.99Å | ||
| 258 | P | 42.6 | Very low | 47.5 | Very low | 102 Ų | 102 | 139.6 Ų | 139.6 | 66% | 0.662 | 70% | 0.697 | S | S | * | * | trans | -66.7 | 121.1 | -171.6 | 25.1 | -33.8 | 0 | 0 | 0 | 110.8 | V256 K260 | V256-P258 VanDerWaalsContact O-CD 3.28Å; V256-P258 WeakPolarHBondContact O-CD 3.42Å; P258-K260 VanDerWaalsContact C-N 3.3Å; P258-K260 PolarHBondContact O-N 3.26Å | ||
| 259 | I | 49 | Very low | 49.2 | Very low | 156 Ų | 156 | 137.6 Ų | 137.6 | 80% | 0.8 | 69% | 0.686 | S | S | * | * | trans | -66.4 | 84.9 | -173.3 | -54.7 | 176.9 | 0 | 0 | 0 | 110.7 | S257 F261 | S257-I259 PolarHBondContact O-N 2.99Å; I259-F261 PolarHBondContact O-N 3.39Å | ||
| 260 | K | 49.2 | Very low | 50.8 | Low | 182 Ų | 182 | 141.2 Ų | 141.2 | 79% | 0.791 | 68% | 0.678 | S | S | * | * | trans | -67.9 | 112.8 | 167.9 | -70.6 | -178.3 | -178.1 | 176 | 0 | 107.9 | P258 E262 | P258-K260 VanDerWaalsContact C-N 3.3Å; P258-K260 PolarHBondContact O-N 3.26Å; K260-E262 PolarHBondContact O-N 3.37Å | ||
| 261 | F | 48.1 | Very low | 52.2 | Low | 182 Ų | 182 | 136 Ų | 136 | 80% | 0.798 | 65% | 0.654 | S | S | * | * | trans | -70.5 | 72 | -177.1 | -136.8 | -91.1 | 0 | 0 | 0 | 111 | I259 R263 | I259-F261 PolarHBondContact O-N 3.39Å; F261-R263 PolarHBondContact O-N 2.98Å | ||
| 262 | E | 51.7 | Low | 53.6 | Low | 68 Ų | 68 | 133 Ų | 133 | 32% | 0.318 | 63% | 0.633 | S | S | . | * | trans | -69.5 | 77.8 | -175.6 | -158.9 | -177.7 | -153.7 | 0 | 0 | 110.3 | K260 D266 R267 R270 | K260-E262 PolarHBondContact O-N 3.37Å; E262-D266 HydrophobicContact CG-CB 4.16Å; E262-R267 HydrophobicContact CB-CG 4.41Å; E262-R267 VanDerWaalsContact CD-CG 3.49Å; E262-R267 HydrophobicContact CG-CG 3.67Å; E262-R267 WeakPolarHBondContact OE2-CD 3.39Å; E262-R267 WeakPolarHBondContact OE2-CG 3.38Å; E262-R270 IonicContact OE1-CZ 2.69Å; E262-R270 VanDerWaalsContact OE1-CZ 3.28Å; E262-R270 IonicContact OE1-NE 3.04Å; E262-R270 PolarHBondContact OE1-NE 3.39Å; E262-R270 IonicContact OE1-NH2 3.6Å; E262-R270 PolarHBondContact OE1-NH2 3.49Å; E262-R270 IonicContact OE2-NH2 3.28Å | ||
| 263 | R | 64 | Low | 54.9 | Low | 176 Ų | 176 | 130.9 Ų | 130.9 | 66% | 0.664 | 62% | 0.622 | S | S | * | * | trans | -46.2 | 137.3 | 178.8 | -166.3 | 177.6 | -69.7 | 104.8 | -4.4 | 109.5 | F261 S265 D266 | F261-R263 PolarHBondContact O-N 2.98Å; R263-S265 PolarHBondContact O-N 2.88Å; R263-D266 WeakPolarHBondContact O-CB 3.41Å; R263-D266 PolarHBondContact O-N 2.89Å | ||
| 264 | R | 62.3 | Low | 56.6 | Low | 219 Ų | 219 | 128.6 Ų | 128.6 | 83% | 0.826 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -48.8 | -30.3 | -168.6 | -71.6 | -178.5 | 172.7 | 124.9 | -3.3 | 115.1 | ||
| 265 | S | 56.8 | Low | 58.6 | Low | 75 Ų | 75 | 125.5 Ų | 125.5 | 52% | 0.524 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -70.5 | -26.2 | 176.3 | 46.3 | 0 | 0 | 0 | 0 | 115.2 | R263 K269 | R263-S265 PolarHBondContact O-N 2.88Å; S265-K269 PolarHBondContact O-N 2.83Å |
| 266 | D | 64.2 | Low | 60.4 | Low | 82 Ų | 82 | 123.4 Ų | 123.4 | 44% | 0.439 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -76.8 | -43 | -179.4 | -157.5 | 9.5 | 0 | 0 | 0 | 111 | E262 R263 F268 K269 R270 | E262-D266 HydrophobicContact CG-CB 4.16Å; R263-D266 WeakPolarHBondContact O-CB 3.41Å; R263-D266 PolarHBondContact O-N 2.89Å; D266-F268 PolarHBondContact O-N 3.23Å; D266-K269 PolarHBondContact O-N 3.17Å; D266-R270 PolarHBondContact O-N 3.19Å |
| 267 | R | 64.1 | Low | 61.7 | Low | 146 Ų | 146 | 123.2 Ų | 123.2 | 55% | 0.551 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -54 | -37.7 | 170 | -57.6 | -159.1 | -57.8 | -166 | 5.2 | 112.3 | E262 S271 | E262-R267 HydrophobicContact CB-CG 4.41Å; E262-R267 VanDerWaalsContact CD-CG 3.49Å; E262-R267 HydrophobicContact CG-CG 3.67Å; E262-R267 WeakPolarHBondContact OE2-CD 3.39Å; E262-R267 WeakPolarHBondContact OE2-CG 3.38Å; R267-S271 WeakPolarHBondContact O-CB 3.49Å; R267-S271 PolarHBondContact O-N 3Å |
| 268 | F | 62.1 | Low | 62.9 | Low | 153 Ų | 153 | 123.3 Ų | 123.3 | 67% | 0.671 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -65.1 | -46.9 | 174.8 | -178.6 | -98.4 | 0 | 0 | 0 | 112 | D266 S271 S272 | D266-F268 PolarHBondContact O-N 3.23Å; F268-S271 PolarHBondContact O-N 3.23Å; F268-S272 WeakPolarHBondContact O-CB 3.35Å; F268-S272 PolarHBondContact O-N 3.4Å |
| 269 | K | 74.4 | Confident | 64.1 | Low | 148 Ų | 148 | 123.2 Ų | 123.2 | 64% | 0.643 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61.6 | -48.9 | 176.4 | -69.7 | -178.7 | 178.2 | -174.2 | 0 | 111.8 | S265 D266 S271 S272 L273 | S265-K269 PolarHBondContact O-N 2.83Å; D266-K269 PolarHBondContact O-N 3.17Å; K269-S271 PolarHBondContact O-N 3.05Å; K269-S272 PolarHBondContact O-N 2.91Å; K269-L273 PolarHBondContact O-N 2.95Å |
| 270 | R | 64.8 | Low | 65.3 | Low | 145 Ų | 145 | 122.4 Ų | 122.4 | 55% | 0.547 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.5 | -32.1 | -178.5 | -158.5 | 158.4 | 72.8 | 113.3 | -1.7 | 112.9 | E262 D266 K274 | E262-R270 IonicContact OE1-CZ 2.69Å; E262-R270 VanDerWaalsContact OE1-CZ 3.28Å; E262-R270 IonicContact OE1-NE 3.04Å; E262-R270 PolarHBondContact OE1-NE 3.39Å; E262-R270 IonicContact OE1-NH2 3.6Å; E262-R270 PolarHBondContact OE1-NH2 3.49Å; E262-R270 IonicContact OE2-NH2 3.28Å; D266-R270 PolarHBondContact O-N 3.19Å; R270-K274 WeakPolarHBondContact O-CG 3.42Å |
| 271 | S | 63.3 | Low | 66.5 | Low | 52 Ų | 52 | 121.9 Ų | 121.9 | 36% | 0.364 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -73 | -42.8 | 170.5 | -173.1 | 0 | 0 | 0 | 0 | 112.5 | R267 F268 K269 K274 K275 | R267-S271 WeakPolarHBondContact O-CB 3.49Å; R267-S271 PolarHBondContact O-N 3Å; F268-S271 PolarHBondContact O-N 3.23Å; K269-S271 PolarHBondContact O-N 3.05Å; S271-K274 PolarHBondContact O-N 3.35Å; S271-K275 WeakPolarHBondContact O-CG 3.37Å; S271-K275 PolarHBondContact O-N 3.04Å |
| 272 | S | 64.6 | Low | 67.2 | Low | 53 Ų | 53 | 117 Ų | 117 | 37% | 0.371 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64 | -44.4 | -178.7 | -167.2 | 0 | 0 | 0 | 0 | 111.8 | F268 K269 K274 K275 V276 | F268-S272 WeakPolarHBondContact O-CB 3.35Å; F268-S272 PolarHBondContact O-N 3.4Å; K269-S272 PolarHBondContact O-N 2.91Å; S272-K274 PolarHBondContact O-N 2.91Å; S272-K275 WeakPolarHBondContact O-CB 3.26Å; S272-K275 PolarHBondContact O-N 2.66Å; S272-K275 VanDerWaalsContact O-N 3.11Å; S272-V276 WeakPolarHBondContact O-CG2 3.47Å; S272-V276 PolarHBondContact O-N 2.93Å |
| 273 | L | 68.3 | Low | 67.4 | Low | 120 Ų | 120 | 121.1 Ų | 121.1 | 63% | 0.628 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -60.4 | -46.4 | 177 | -153.2 | 76.8 | 0 | 0 | 0 | 111.6 | K269 K275 V276 D277 | K269-L273 PolarHBondContact O-N 2.95Å; L273-K275 VanDerWaalsContact C-N 3.29Å; L273-K275 PolarHBondContact O-N 3.44Å; L273-V276 PolarHBondContact O-N 3.36Å; L273-D277 PolarHBondContact O-N 3.4Å |
| 274 | K | 74.2 | Confident | 67.2 | Low | 148 Ų | 148 | 116.8 Ų | 116.8 | 64% | 0.643 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -62.4 | -32.4 | 174.7 | -73.9 | -174.1 | 174.2 | -167.2 | 0 | 113.2 | R270 S271 S272 S278 | R270-K274 WeakPolarHBondContact O-CG 3.42Å; S271-K274 PolarHBondContact O-N 3.35Å; S272-K274 PolarHBondContact O-N 2.91Å; K274-S278 VanDerWaalsContact O-CB 3.22Å; K274-S278 WeakPolarHBondContact O-CB 3.45Å; K274-S278 PolarHBondContact O-N 2.95Å |
| 275 | K | 78.4 | Confident | 67 | Low | 132 Ų | 132 | 114.1 Ų | 114.1 | 57% | 0.574 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -70.5 | -41 | 173.4 | -75.7 | 171.1 | 178.8 | 176.7 | 0 | 111.8 | S271 S272 L273 S278 I279 | S271-K275 WeakPolarHBondContact O-CG 3.37Å; S271-K275 PolarHBondContact O-N 3.04Å; S272-K275 WeakPolarHBondContact O-CB 3.26Å; S272-K275 PolarHBondContact O-N 2.66Å; S272-K275 VanDerWaalsContact O-N 3.11Å; L273-K275 VanDerWaalsContact C-N 3.29Å; L273-K275 PolarHBondContact O-N 3.44Å; K275-S278 PolarHBondContact O-N 3.18Å; K275-I279 WeakPolarHBondContact O-CB 3.22Å; K275-I279 WeakPolarHBondContact O-CD1 3.46Å; K275-I279 VanDerWaalsContact O-CG1 3.23Å; K275-I279 WeakPolarHBondContact O-CG1 3.38Å; K275-I279 PolarHBondContact O-N 2.94Å |
| 276 | V | 76.3 | Confident | 67.3 | Low | 86 Ų | 86 | 113.2 Ų | 113.2 | 52% | 0.521 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.2 | -46.4 | 174.8 | 171.7 | 0 | 0 | 0 | 0 | 111 | S272 L273 I279 K280 | S272-V276 WeakPolarHBondContact O-CG2 3.47Å; S272-V276 PolarHBondContact O-N 2.93Å; L273-V276 PolarHBondContact O-N 3.36Å; V276-I279 PolarHBondContact O-N 3.42Å; V276-K280 VanDerWaalsContact O-CB 3.31Å; V276-K280 WeakPolarHBondContact O-CB 3.42Å; V276-K280 PolarHBondContact O-N 3.37Å |
| 277 | D | 71.6 | Confident | 67.1 | Low | 86 Ų | 86 | 117.6 Ų | 117.6 | 46% | 0.46 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.7 | -33.9 | 176.1 | -84.2 | -36.2 | 0 | 0 | 0 | 112.9 | L273 K280 K281 | L273-D277 PolarHBondContact O-N 3.4Å; D277-K280 PolarHBondContact O-N 3Å; D277-K281 VanDerWaalsContact O-CB 3.25Å; D277-K281 WeakPolarHBondContact O-CB 3.47Å; D277-K281 PolarHBondContact O-N 3.46Å |
| 278 | S | 71 | Confident | 67.1 | Low | 79 Ų | 79 | 115.5 Ų | 115.5 | 55% | 0.552 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -63.3 | -43.1 | 172.4 | -174 | 0 | 0 | 0 | 0 | 111.9 | K274 K275 K281 A282 | K274-S278 VanDerWaalsContact O-CB 3.22Å; K274-S278 WeakPolarHBondContact O-CB 3.45Å; K274-S278 PolarHBondContact O-N 2.95Å; K275-S278 PolarHBondContact O-N 3.18Å; S278-K281 PolarHBondContact O-N 2.91Å; S278-A282 WeakPolarHBondContact O-CB 3.49Å; S278-A282 PolarHBondContact O-N 3.28Å |
| 279 | I | 67.9 | Low | 67.3 | Low | 99 Ų | 99 | 109.6 Ų | 109.6 | 51% | 0.508 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -62.8 | -46.9 | 173.7 | -70.7 | 164.5 | 0 | 0 | 0 | 110.3 | K275 V276 K281 A282 F283 | K275-I279 WeakPolarHBondContact O-CB 3.22Å; K275-I279 WeakPolarHBondContact O-CD1 3.46Å; K275-I279 VanDerWaalsContact O-CG1 3.23Å; K275-I279 WeakPolarHBondContact O-CG1 3.38Å; K275-I279 PolarHBondContact O-N 2.94Å; V276-I279 PolarHBondContact O-N 3.42Å; I279-K281 VanDerWaalsContact C-N 3.31Å; I279-K281 PolarHBondContact O-N 3.06Å; I279-A282 CarbonylContact O-C 3.53Å; I279-A282 PolarHBondContact O-N 2.82Å; I279-A282 VanDerWaalsContact O-N 3.15Å; I279-F283 HydrophobicContact CG2-CD2 3.74Å; I279-F283 HydrophobicContact CG2-CE2 3.96Å; I279-F283 WeakPolarHBondContact O-CD2 3.48Å; I279-F283 PolarHBondContact O-N 3.3Å |
| 280 | K | 73.9 | Confident | 67.1 | Low | 140 Ų | 140 | 108.3 Ų | 108.3 | 61% | 0.609 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -61.8 | -36.2 | 177.3 | -172.3 | -179.8 | 172.2 | -167.7 | 0 | 112.4 | V276 D277 F283 T284 | V276-K280 VanDerWaalsContact O-CB 3.31Å; V276-K280 WeakPolarHBondContact O-CB 3.42Å; V276-K280 PolarHBondContact O-N 3.37Å; D277-K280 PolarHBondContact O-N 3Å; K280-F283 CarbonylContact O-C 3.59Å; K280-F283 PolarHBondContact O-N 3.11Å; K280-T284 PolarHBondContact O-N 2.99Å; K280-T284 VanDerWaalsContact O-N 3.13Å; K280-T284 PolarHBondContact O-OG1 3.2Å |
| 281 | K | 73.4 | Confident | 67.2 | Low | 170 Ų | 170 | 107.8 Ų | 107.8 | 74% | 0.739 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.1 | -41.1 | 172.7 | -167.7 | 172.3 | -177.3 | 178.2 | 0 | 111.6 | D277 S278 I279 F283 T284 | D277-K281 VanDerWaalsContact O-CB 3.25Å; D277-K281 WeakPolarHBondContact O-CB 3.47Å; D277-K281 PolarHBondContact O-N 3.46Å; S278-K281 PolarHBondContact O-N 2.91Å; I279-K281 VanDerWaalsContact C-N 3.31Å; I279-K281 PolarHBondContact O-N 3.06Å; K281-F283 VanDerWaalsContact C-N 3.31Å; K281-F283 PolarHBondContact O-N 2.94Å; K281-T284 WeakPolarHBondContact CA-OG1 3.43Å; K281-T284 VanDerWaalsContact O-CB 3.26Å; K281-T284 WeakPolarHBondContact O-CB 3.47Å; K281-T284 PolarHBondContact O-N 3.35Å; K281-T284 VanDerWaalsContact O-N 3.15Å; K281-T284 PolarHBondContact O-OG1 3.5Å |
| 282 | A | 62.9 | Low | 67.4 | Low | 80 Ų | 80 | 109 Ų | 109 | 66% | 0.661 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.7 | -29.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | S278 I279 | S278-A282 WeakPolarHBondContact O-CB 3.49Å; S278-A282 PolarHBondContact O-N 3.28Å; I279-A282 CarbonylContact O-C 3.53Å; I279-A282 PolarHBondContact O-N 2.82Å; I279-A282 VanDerWaalsContact O-N 3.15Å |
| 283 | F | 57.5 | Low | 67.6 | Low | 154 Ų | 154 | 111.2 Ų | 111.2 | 68% | 0.675 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | 6.9 | 172.1 | -81.6 | -73.6 | 0 | 0 | 0 | 114.2 | I279 K280 K281 Q285 | I279-F283 HydrophobicContact CG2-CD2 3.74Å; I279-F283 HydrophobicContact CG2-CE2 3.96Å; I279-F283 WeakPolarHBondContact O-CD2 3.48Å; I279-F283 PolarHBondContact O-N 3.3Å; K280-F283 CarbonylContact O-C 3.59Å; K280-F283 PolarHBondContact O-N 3.11Å; K281-F283 VanDerWaalsContact C-N 3.31Å; K281-F283 PolarHBondContact O-N 2.94Å; F283-Q285 PolarHBondContact O-N 3.17Å |
| 284 | T | 59 | Low | 67.7 | Low | 85 Ų | 85 | 111.2 Ų | 111.2 | 52% | 0.521 | 57% | 0.571 | S | S | . | * | trans | -66.4 | 127.5 | 176.5 | -64.7 | 0 | 0 | 0 | 0 | 110.1 | K280 K281 A286 | K280-T284 PolarHBondContact O-N 2.99Å; K280-T284 VanDerWaalsContact O-N 3.13Å; K280-T284 PolarHBondContact O-OG1 3.2Å; K281-T284 WeakPolarHBondContact CA-OG1 3.43Å; K281-T284 VanDerWaalsContact O-CB 3.26Å; K281-T284 WeakPolarHBondContact O-CB 3.47Å; K281-T284 PolarHBondContact O-N 3.35Å; K281-T284 VanDerWaalsContact O-N 3.15Å; K281-T284 PolarHBondContact O-OG1 3.5Å; T284-A286 VanDerWaalsContact C-N 3.28Å; T284-A286 PolarHBondContact O-N 3.47Å | ||
| 285 | Q | 57.4 | Low | 67.3 | Low | 163 Ų | 163 | 108.3 Ų | 108.3 | 76% | 0.762 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.4 | -16 | -150.3 | -69.5 | 175.7 | -21.5 | 0 | 0 | 116.6 | F283 G289 | F283-Q285 PolarHBondContact O-N 3.17Å; Q285-G289 PolarHBondContact O-N 3.34Å |
| 286 | A | 63 | Low | 66.3 | Low | 56 Ų | 56 | 104.3 Ų | 104.3 | 46% | 0.463 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -57.6 | -67.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | T284 I288 G289 E290 | T284-A286 VanDerWaalsContact C-N 3.28Å; T284-A286 PolarHBondContact O-N 3.47Å; A286-I288 VanDerWaalsContact C-N 3.26Å; A286-I288 PolarHBondContact O-N 2.81Å; A286-I288 VanDerWaalsContact O-N 3.16Å; A286-G289 PolarHBondContact O-N 3.45Å; A286-G289 VanDerWaalsContact O-N 3.08Å; A286-E290 WeakPolarHBondContact O-CB 3.49Å; A286-E290 WeakPolarHBondContact O-CG 3.42Å; A286-E290 PolarHBondContact O-N 2.84Å |
| 287 | K | 61 | Low | 65.7 | Low | 174 Ų | 174 | 103.7 Ų | 103.7 | 76% | 0.757 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.1 | -26.3 | -173.9 | -72 | -165.2 | 173.3 | -171.1 | 0 | 114.1 | K291 | K287-K291 VanDerWaalsContact O-CB 3.29Å; K287-K291 WeakPolarHBondContact O-CB 3.37Å; K287-K291 PolarHBondContact O-N 2.63Å |
| 288 | I | 63.5 | Low | 65.2 | Low | 102 Ų | 102 | 108.3 Ų | 108.3 | 52% | 0.523 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -80.2 | -39.1 | 174.5 | -153.6 | 71.2 | 0 | 0 | 0 | 111.4 | A286 V292 | A286-I288 VanDerWaalsContact C-N 3.26Å; A286-I288 PolarHBondContact O-N 2.81Å; A286-I288 VanDerWaalsContact O-N 3.16Å; I288-V292 VanDerWaalsContact O-CB 3.28Å; I288-V292 WeakPolarHBondContact O-CB 3.48Å; I288-V292 WeakPolarHBondContact O-CG2 3.43Å; I288-V292 PolarHBondContact O-N 2.81Å |
| 289 | G | 65.9 | Low | 64.9 | Low | 29 Ų | 29 | 110.6 Ų | 110.6 | 30% | 0.299 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.8 | -44.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q285 A286 N293 | Q285-G289 PolarHBondContact O-N 3.34Å; A286-G289 PolarHBondContact O-N 3.45Å; A286-G289 VanDerWaalsContact O-N 3.08Å; G289-N293 VanDerWaalsContact O-CB 3.29Å; G289-N293 WeakPolarHBondContact O-CB 3.37Å; G289-N293 PolarHBondContact O-N 2.94Å; G289-N293 PolarHBondContact O-ND2 2.92Å |
| 290 | E | 70.5 | Confident | 64.1 | Low | 121 Ų | 121 | 107.6 Ų | 107.6 | 57% | 0.565 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -59.5 | -52.4 | 174.7 | -72.1 | 156.3 | -169.7 | 0 | 0 | 111.3 | A286 V292 N293 Q294 | A286-E290 WeakPolarHBondContact O-CB 3.49Å; A286-E290 WeakPolarHBondContact O-CG 3.42Å; A286-E290 PolarHBondContact O-N 2.84Å; E290-V292 PolarHBondContact O-N 3.22Å; E290-N293 PolarHBondContact O-N 3.02Å; E290-N293 VanDerWaalsContact O-N 3.16Å; E290-Q294 WeakPolarHBondContact O-CB 3.46Å; E290-Q294 PolarHBondContact O-N 3.18Å |
| 291 | K | 67.8 | Low | 63.6 | Low | 135 Ų | 135 | 105.3 Ų | 105.3 | 59% | 0.587 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -65.9 | -37.7 | -178.3 | -161.9 | 166.5 | -173.4 | 171.8 | 0 | 112 | K287 I295 | K287-K291 VanDerWaalsContact O-CB 3.29Å; K287-K291 WeakPolarHBondContact O-CB 3.37Å; K287-K291 PolarHBondContact O-N 2.63Å; K291-I295 HydrophobicContact CG-CD1 4.09Å; K291-I295 WeakPolarHBondContact O-CB 3.5Å; K291-I295 WeakPolarHBondContact O-CD1 3.13Å; K291-I295 WeakPolarHBondContact O-CG1 3.26Å; K291-I295 PolarHBondContact O-N 3.03Å |
| 292 | V | 67.7 | Low | 63.2 | Low | 77 Ų | 77 | 104.9 Ų | 104.9 | 47% | 0.467 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.8 | -42 | 171.4 | 168.3 | 0 | 0 | 0 | 0 | 111.5 | I288 E290 Q294 T296 | I288-V292 VanDerWaalsContact O-CB 3.28Å; I288-V292 WeakPolarHBondContact O-CB 3.48Å; I288-V292 WeakPolarHBondContact O-CG2 3.43Å; I288-V292 PolarHBondContact O-N 2.81Å; E290-V292 PolarHBondContact O-N 3.22Å; V292-Q294 PolarHBondContact O-N 3.11Å; V292-T296 WeakPolarHBondContact O-CB 3.41Å; V292-T296 PolarHBondContact O-N 3.03Å; V292-T296 PolarHBondContact O-OG1 3.45Å |
| 293 | N | 68.1 | Low | 63.1 | Low | 99 Ų | 99 | 107 Ų | 107 | 53% | 0.529 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.4 | -39.8 | 176.9 | -87.1 | -33.3 | 0 | 0 | 0 | 112.7 | G289 E290 S297 R305 | G289-N293 VanDerWaalsContact O-CB 3.29Å; G289-N293 WeakPolarHBondContact O-CB 3.37Å; G289-N293 PolarHBondContact O-N 2.94Å; G289-N293 PolarHBondContact O-ND2 2.92Å; E290-N293 PolarHBondContact O-N 3.02Å; E290-N293 VanDerWaalsContact O-N 3.16Å; N293-S297 VanDerWaalsContact O-CB 3.31Å; N293-S297 WeakPolarHBondContact O-CB 3.36Å; N293-S297 PolarHBondContact O-N 3.28Å; N293-S297 PolarHBondContact O-OG 3.08Å; N293-R305 PolarHBondContact O-NH2 3.33Å |
| 294 | Q | 70.5 | Confident | 63.2 | Low | 121 Ų | 121 | 105.8 Ų | 105.8 | 57% | 0.565 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -69.3 | -45 | 178.5 | -169 | -174.9 | 51.2 | 0 | 0 | 112.2 | E290 V292 S297 K298 | E290-Q294 WeakPolarHBondContact O-CB 3.46Å; E290-Q294 PolarHBondContact O-N 3.18Å; V292-Q294 PolarHBondContact O-N 3.11Å; Q294-S297 WeakPolarHBondContact CA-OG 3.39Å; Q294-S297 PolarHBondContact O-N 3.02Å; Q294-S297 PolarHBondContact O-OG 2.91Å; Q294-K298 PolarHBondContact O-N 2.98Å; Q294-K298 VanDerWaalsContact O-N 3.14Å |
| 295 | I | 64.9 | Low | 63.5 | Low | 87 Ų | 87 | 105.2 Ų | 105.2 | 45% | 0.446 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -60.7 | -47.5 | 172.8 | -71.2 | 168.8 | 0 | 0 | 0 | 109.8 | K291 S297 K298 I299 | K291-I295 HydrophobicContact CG-CD1 4.09Å; K291-I295 WeakPolarHBondContact O-CB 3.5Å; K291-I295 WeakPolarHBondContact O-CD1 3.13Å; K291-I295 WeakPolarHBondContact O-CG1 3.26Å; K291-I295 PolarHBondContact O-N 3.03Å; I295-S297 PolarHBondContact O-N 3.16Å; I295-K298 PolarHBondContact O-N 3.09Å; I295-I299 HydrophobicContact CG2-CD1 3.89Å; I295-I299 WeakPolarHBondContact O-CB 3.36Å; I295-I299 WeakPolarHBondContact O-CG1 3.28Å; I295-I299 PolarHBondContact O-N 3.24Å; I295-I299 VanDerWaalsContact O-N 3.14Å |
| 296 | T | 57.7 | Low | 63.8 | Low | 47 Ų | 47 | 102.7 Ų | 102.7 | 29% | 0.288 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -71 | -16.4 | -179.7 | -46.4 | 0 | 0 | 0 | 0 | 112.5 | V292 V300 R305 | V292-T296 WeakPolarHBondContact O-CB 3.41Å; V292-T296 PolarHBondContact O-N 3.03Å; V292-T296 PolarHBondContact O-OG1 3.45Å; T296-V300 HydrophobicContact CG2-CB 4.49Å; T296-R305 HydrophobicContact CG2-CG 4.42Å; T296-R305 PolarHBondContact O-NE 2.78Å; T296-R305 PolarHBondContact O-NH2 3.13Å |
| 297 | S | 63.5 | Low | 63.9 | Low | 73 Ų | 73 | 106.3 Ų | 106.3 | 51% | 0.51 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -88.6 | -36.1 | 177.5 | 64.3 | 0 | 0 | 0 | 0 | 112.1 | N293 Q294 I295 | N293-S297 VanDerWaalsContact O-CB 3.31Å; N293-S297 WeakPolarHBondContact O-CB 3.36Å; N293-S297 PolarHBondContact O-N 3.28Å; N293-S297 PolarHBondContact O-OG 3.08Å; Q294-S297 WeakPolarHBondContact CA-OG 3.39Å; Q294-S297 PolarHBondContact O-N 3.02Å; Q294-S297 PolarHBondContact O-OG 2.91Å; I295-S297 PolarHBondContact O-N 3.16Å |
| 298 | K | 62.3 | Low | 64 | Low | 184 Ų | 184 | 102.2 Ų | 102.2 | 80% | 0.8 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -79.3 | -20.7 | 175.3 | -67.5 | -161.1 | 173.7 | -168.9 | 0 | 114.2 | Q294 I295 | Q294-K298 PolarHBondContact O-N 2.98Å; Q294-K298 VanDerWaalsContact O-N 3.14Å; I295-K298 PolarHBondContact O-N 3.09Å |
| 299 | I | 63.5 | Low | 63.9 | Low | 126 Ų | 126 | 105 Ų | 105 | 65% | 0.646 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -108.2 | -22.8 | -172.9 | -62.6 | 174.1 | 0 | 0 | 0 | 114.1 | I295 | I295-I299 HydrophobicContact CG2-CD1 3.89Å; I295-I299 WeakPolarHBondContact O-CB 3.36Å; I295-I299 WeakPolarHBondContact O-CG1 3.28Å; I295-I299 PolarHBondContact O-N 3.24Å; I295-I299 VanDerWaalsContact O-N 3.14Å |
| 300 | V | 51.6 | Low | 63.7 | Low | 37 Ų | 37 | 110.2 Ų | 110.2 | 22% | 0.224 | 54% | 0.535 | C | S | . | . | S | Bend | trans | -134.1 | 109.7 | -172.6 | -172.2 | 0 | 0 | 0 | 0 | 112.7 | T296 K304 R305 | T296-V300 HydrophobicContact CG2-CB 4.49Å; V300-K304 HydrophobicContact CG1-CB 3.71Å; V300-R305 HydrophobicContact CG1-CG 4.21Å |
| 301 | P | 64.3 | Low | 63.1 | Low | 92 Ų | 92 | 108.7 Ų | 108.7 | 60% | 0.597 | 54% | 0.537 | S | S | * | . | trans | -54.8 | 144.8 | 171 | -27.4 | 35.9 | 0 | 0 | 0 | 112.9 | E303 K304 | P301-E303 VanDerWaalsContact C-N 3.29Å; P301-E303 PolarHBondContact O-N 2.84Å; P301-E303 VanDerWaalsContact O-N 3.14Å; P301-K304 PolarHBondContact O-N 2.97Å | ||
| 302 | Q | 64.4 | Low | 62.6 | Low | 160 Ų | 160 | 110 Ų | 110 | 75% | 0.748 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -57.3 | -36.6 | -165.9 | -63.9 | -175.2 | -1.7 | 0 | 0 | 114.1 | K304 R305 E306 | Q302-K304 PolarHBondContact O-N 3.22Å; Q302-R305 WeakPolarHBondContact O-CA 3.43Å; Q302-R305 VanDerWaalsContact O-CB 3.28Å; Q302-R305 WeakPolarHBondContact O-CB 3.34Å; Q302-R305 PolarHBondContact O-N 3.39Å; Q302-E306 PolarHBondContact O-N 3.04Å |
| 303 | E | 61.3 | Low | 62 | Low | 126 Ų | 126 | 110.6 Ų | 110.6 | 59% | 0.589 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -55.7 | -34.8 | 177.8 | -162.9 | -135 | 132.9 | 0 | 0 | 113.2 | P301 K307 | P301-E303 VanDerWaalsContact C-N 3.29Å; P301-E303 PolarHBondContact O-N 2.84Å; P301-E303 VanDerWaalsContact O-N 3.14Å; E303-K307 WeakPolarHBondContact OE1-CE 3.48Å; E303-K307 IonicContact OE1-NZ 2.61Å; E303-K307 PolarHBondContact OE1-NZ 2.88Å |
| 304 | K | 59.1 | Low | 61.5 | Low | 127 Ų | 127 | 112.7 Ų | 112.7 | 55% | 0.552 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -78.8 | -28.6 | 176.3 | -68.5 | -179.2 | -178.9 | 176.8 | 0 | 112.3 | V300 P301 Q302 E306 K307 I308 | V300-K304 HydrophobicContact CG1-CB 3.71Å; P301-K304 PolarHBondContact O-N 2.97Å; Q302-K304 PolarHBondContact O-N 3.22Å; K304-E306 VanDerWaalsContact C-N 3.3Å; K304-E306 PolarHBondContact O-N 2.97Å; K304-K307 PolarHBondContact O-N 2.83Å; K304-I308 WeakPolarHBondContact O-CG1 3.27Å; K304-I308 PolarHBondContact O-N 3.24Å |
| 305 | R | 65.3 | Low | 60.4 | Low | 73 Ų | 73 | 111.7 Ų | 111.7 | 28% | 0.275 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61.2 | -39.4 | 173.5 | -62.3 | -179.9 | 167.2 | -147.3 | -5.6 | 111.5 | N293 T296 V300 Q302 I308 K309 | N293-R305 PolarHBondContact O-NH2 3.33Å; T296-R305 HydrophobicContact CG2-CG 4.42Å; T296-R305 PolarHBondContact O-NE 2.78Å; T296-R305 PolarHBondContact O-NH2 3.13Å; V300-R305 HydrophobicContact CG1-CG 4.21Å; Q302-R305 WeakPolarHBondContact O-CA 3.43Å; Q302-R305 VanDerWaalsContact O-CB 3.28Å; Q302-R305 WeakPolarHBondContact O-CB 3.34Å; Q302-R305 PolarHBondContact O-N 3.39Å; R305-I308 PolarHBondContact O-N 3.31Å; R305-K309 PolarHBondContact O-N 3.1Å |
| 306 | E | 63.8 | Low | 59.5 | Low | 111 Ų | 111 | 115.9 Ų | 115.9 | 52% | 0.519 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.7 | -45.4 | 177.9 | -77.2 | -155.9 | -165.4 | 0 | 0 | 112.8 | Q302 K304 I308 K309 K310 | Q302-E306 PolarHBondContact O-N 3.04Å; K304-E306 VanDerWaalsContact C-N 3.3Å; K304-E306 PolarHBondContact O-N 2.97Å; E306-I308 VanDerWaalsContact C-N 3.27Å; E306-I308 PolarHBondContact O-N 3.29Å; E306-K309 PolarHBondContact O-N 3.14Å; E306-K310 WeakPolarHBondContact O-CB 3.35Å; E306-K310 VanDerWaalsContact O-CG 3.32Å; E306-K310 WeakPolarHBondContact O-CG 3.31Å; E306-K310 PolarHBondContact O-N 3.32Å; E306-K310 IonicContact OE2-NZ 2.64Å; E306-K310 PolarHBondContact OE2-NZ 2.69Å |
| 307 | K | 64.4 | Low | 59.3 | Low | 131 Ų | 131 | 118.7 Ų | 118.7 | 57% | 0.57 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -59.7 | -40 | 178.6 | -72.1 | 168.8 | 175.3 | 169.9 | 0 | 111 | E303 K304 S311 | E303-K307 WeakPolarHBondContact OE1-CE 3.48Å; E303-K307 IonicContact OE1-NZ 2.61Å; E303-K307 PolarHBondContact OE1-NZ 2.88Å; K304-K307 PolarHBondContact O-N 2.83Å; K307-S311 PolarHBondContact O-N 3.03Å; K307-S311 VanDerWaalsContact O-N 3.08Å; K307-S311 PolarHBondContact O-OG 3.46Å |
| 308 | I | 62.9 | Low | 58.7 | Low | 89 Ų | 89 | 125.5 Ų | 125.5 | 46% | 0.456 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -70 | -42.9 | 175.5 | -61.6 | 164.1 | 0 | 0 | 0 | 111.8 | K304 R305 E306 K310 S311 F312 | K304-I308 WeakPolarHBondContact O-CG1 3.27Å; K304-I308 PolarHBondContact O-N 3.24Å; R305-I308 PolarHBondContact O-N 3.31Å; E306-I308 VanDerWaalsContact C-N 3.27Å; E306-I308 PolarHBondContact O-N 3.29Å; I308-K310 PolarHBondContact O-N 3.31Å; I308-S311 WeakPolarHBondContact CA-OG 3.45Å; I308-S311 PolarHBondContact O-N 3.46Å; I308-S311 PolarHBondContact O-OG 3.19Å; I308-F312 HydrophobicContact CG2-CD2 3.96Å; I308-F312 HydrophobicContact CG2-CE2 4.26Å; I308-F312 WeakPolarHBondContact O-CD2 3.16Å; I308-F312 PolarHBondContact O-N 3.19Å; I308-F312 VanDerWaalsContact O-N 3.16Å |
| 309 | K | 62.6 | Low | 57.8 | Low | 159 Ų | 159 | 121.4 Ų | 121.4 | 69% | 0.691 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -61.5 | -44 | 175.4 | -80.3 | -171.2 | 172.6 | -171.5 | 0 | 111.7 | R305 E306 S311 F312 T313 | R305-K309 PolarHBondContact O-N 3.1Å; E306-K309 PolarHBondContact O-N 3.14Å; K309-S311 VanDerWaalsContact C-N 3.3Å; K309-S311 PolarHBondContact O-N 3.37Å; K309-F312 PolarHBondContact O-N 3.44Å; K309-F312 VanDerWaalsContact O-N 3.13Å; K309-T313 PolarHBondContact O-N 2.96Å |
| 310 | K | 61.7 | Low | 57.2 | Low | 140 Ų | 140 | 121.8 Ų | 121.8 | 61% | 0.609 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -65.3 | -28.4 | 177.5 | -72.8 | 163.9 | 175.1 | 166.1 | 0 | 112.6 | E306 I308 T313 | E306-K310 WeakPolarHBondContact O-CB 3.35Å; E306-K310 VanDerWaalsContact O-CG 3.32Å; E306-K310 WeakPolarHBondContact O-CG 3.31Å; E306-K310 PolarHBondContact O-N 3.32Å; E306-K310 IonicContact OE2-NZ 2.64Å; E306-K310 PolarHBondContact OE2-NZ 2.69Å; I308-K310 PolarHBondContact O-N 3.31Å; K310-T313 PolarHBondContact O-OG1 3.37Å |
| 311 | S | 58.3 | Low | 57 | Low | 88 Ų | 88 | 126 Ų | 126 | 62% | 0.615 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -81.5 | -14.8 | 172.4 | 63 | 0 | 0 | 0 | 0 | 114.7 | K307 I308 K309 | K307-S311 PolarHBondContact O-N 3.03Å; K307-S311 VanDerWaalsContact O-N 3.08Å; K307-S311 PolarHBondContact O-OG 3.46Å; I308-S311 WeakPolarHBondContact CA-OG 3.45Å; I308-S311 PolarHBondContact O-N 3.46Å; I308-S311 PolarHBondContact O-OG 3.19Å; K309-S311 VanDerWaalsContact C-N 3.3Å; K309-S311 PolarHBondContact O-N 3.37Å |
| 312 | F | 57.2 | Low | 56 | Low | 164 Ų | 164 | 126.6 Ų | 126.6 | 72% | 0.719 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -101 | 1.5 | -178.6 | -95.3 | -79 | 0 | 0 | 0 | 114.6 | I308 K309 P314 | I308-F312 HydrophobicContact CG2-CD2 3.96Å; I308-F312 HydrophobicContact CG2-CE2 4.26Å; I308-F312 WeakPolarHBondContact O-CD2 3.16Å; I308-F312 PolarHBondContact O-N 3.19Å; I308-F312 VanDerWaalsContact O-N 3.16Å; K309-F312 PolarHBondContact O-N 3.44Å; K309-F312 VanDerWaalsContact O-N 3.13Å; F312-P314 WeakPolarHBondContact O-CD 3.37Å |
| 313 | T | 55.1 | Low | 55.2 | Low | 89 Ų | 89 | 130.3 Ų | 130.3 | 55% | 0.546 | 68% | 0.68 | S | S | . | * | trans | -103.3 | 109.6 | 173.3 | 48.4 | 0 | 0 | 0 | 0 | 111.1 | K309 K310 S315 | K309-T313 PolarHBondContact O-N 2.96Å; K310-T313 PolarHBondContact O-OG1 3.37Å; T313-S315 PolarHBondContact O-N 3.46Å | ||
| 314 | P | 56.6 | Low | 54.5 | Low | 142 Ų | 142 | 128.7 Ų | 128.7 | 92% | 0.922 | 69% | 0.689 | S | S | * | * | trans | -72.8 | 61.6 | 176.7 | -19.3 | 34.7 | 0 | 0 | 0 | 113.3 | F312 | F312-P314 WeakPolarHBondContact O-CD 3.37Š| ||
| 315 | S | 47.1 | Very low | 53.9 | Low | 100 Ų | 100 | 127.8 Ų | 127.8 | 70% | 0.699 | 70% | 0.698 | S | S | * | * | trans | -140.6 | 86.8 | -179.8 | -167.9 | 0 | 0 | 0 | 0 | 111.9 | T313 | T313-S315 PolarHBondContact O-N 3.46Š| ||
| 316 | H | 47.9 | Very low | 53.1 | Low | 176 Ų | 176 | 129.7 Ų | 129.7 | 82% | 0.815 | 72% | 0.723 | S | S | * | * | trans | -151.1 | 137.7 | 152.7 | -139.9 | -89.2 | 0 | 0 | 0 | 109.7 | ||||
| 317 | P | 52.9 | Low | 52.3 | Low | 105 Ų | 105 | 133.1 Ų | 133.1 | 68% | 0.682 | 74% | 0.736 | S | S | * | * | trans | -62.2 | 149.8 | 175.6 | 24 | -34 | 0 | 0 | 0 | 112.3 | S319 | P317-S319 PolarHBondContact O-N 3.01Š| ||
| 318 | K | 51.5 | Low | 51.7 | Low | 216 Ų | 216 | 136.4 Ų | 136.4 | 94% | 0.939 | 75% | 0.75 | S | S | * | * | trans | -54.7 | 126.5 | -170.1 | -58.3 | 168.6 | -176.1 | 173.3 | 0 | 112.6 | ||||
| 319 | S | 42.7 | Very low | 51.5 | Low | 98 Ų | 98 | 139.4 Ų | 139.4 | 69% | 0.685 | 77% | 0.766 | S | S | * | * | trans | -116.8 | 146.1 | 165.9 | 60.6 | 0 | 0 | 0 | 0 | 111.2 | P317 T321 | P317-S319 PolarHBondContact O-N 3.01Å; S319-T321 PolarHBondContact O-N 3.42Å; S319-T321 VanDerWaalsContact O-N 3.14Å | ||
| 320 | P | 50.3 | Low | 51.1 | Low | 134 Ų | 134 | 136.7 Ų | 136.7 | 87% | 0.87 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -93.7 | 52.7 | -158.2 | 38.1 | -38.9 | 0 | 0 | 0 | 115.1 | ||
| 321 | T | 48 | Very low | 51.1 | Low | 126 Ų | 126 | 135.7 Ų | 135.7 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | trans | -120.2 | 35.2 | 179.7 | -38.8 | 0 | 0 | 0 | 0 | 113.5 | S319 R323 | S319-T321 PolarHBondContact O-N 3.42Å; S319-T321 VanDerWaalsContact O-N 3.14Å; T321-R323 VanDerWaalsContact C-N 3.34Å; T321-R323 PolarHBondContact O-N 3.32Å | ||
| 322 | A | 42.9 | Very low | 51 | Low | 104 Ų | 104 | 140.2 Ų | 140.2 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | -90.1 | 60.5 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 323 | R | 47.5 | Very low | 51.3 | Low | 238 Ų | 238 | 137.5 Ų | 137.5 | 90% | 0.898 | 79% | 0.785 | S | S | * | * | trans | -78.9 | 124.8 | 166.9 | -82.7 | -70.6 | -173 | 173 | 1.1 | 108.8 | T321 | T321-R323 VanDerWaalsContact C-N 3.34Å; T321-R323 PolarHBondContact O-N 3.32Å | ||
| 324 | A | 46.8 | Very low | 51.1 | Low | 93 Ų | 93 | 141.8 Ų | 141.8 | 77% | 0.769 | 80% | 0.797 | S | S | * | * | trans | -61.8 | 137.9 | -174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S326 | A324-S326 PolarHBondContact O-N 3.11Š| ||
| 325 | S | 46.8 | Very low | 50.9 | Low | 108 Ų | 108 | 141.7 Ų | 141.7 | 76% | 0.755 | 79% | 0.789 | S | S | * | * | trans | -66.3 | 114.5 | 170.3 | -178.2 | 0 | 0 | 0 | 0 | 109.7 | F327 | S325-F327 VanDerWaalsContact C-N 3.26Å; S325-F327 PolarHBondContact O-N 2.74Å; S325-F327 VanDerWaalsContact O-N 3.15Å | ||
| 326 | S | 49.1 | Very low | 51 | Low | 112 Ų | 112 | 142.2 Ų | 142.2 | 78% | 0.783 | 79% | 0.787 | S | S | * | * | trans | -88.6 | 38.2 | -170.4 | 60.9 | 0 | 0 | 0 | 0 | 114 | A324 K328 | A324-S326 PolarHBondContact O-N 3.11Å; S326-K328 VanDerWaalsContact C-N 3.31Å; S326-K328 PolarHBondContact O-N 3.48Å | ||
| 327 | F | 46.3 | Very low | 51.5 | Low | 184 Ų | 184 | 142.8 Ų | 142.8 | 81% | 0.807 | 79% | 0.787 | S | S | * | * | trans | -77 | 81.1 | 172.3 | -100.1 | -87.1 | 0 | 0 | 0 | 111.1 | S325 I329 | S325-F327 VanDerWaalsContact C-N 3.26Å; S325-F327 PolarHBondContact O-N 2.74Å; S325-F327 VanDerWaalsContact O-N 3.15Å; F327-I329 PolarHBondContact O-N 3.23Å; F327-I329 VanDerWaalsContact O-N 3.13Å | ||
| 328 | K | 52.6 | Low | 51.6 | Low | 199 Ų | 199 | 146.8 Ų | 146.8 | 87% | 0.865 | 79% | 0.794 | S | S | * | * | trans | -71.7 | 97.9 | 166.9 | -75.2 | -172.9 | 175.6 | -176.7 | 0 | 109.7 | S326 | S326-K328 VanDerWaalsContact C-N 3.31Å; S326-K328 PolarHBondContact O-N 3.48Å | ||
| 329 | I | 56.9 | Low | 51.6 | Low | 153 Ų | 153 | 142.6 Ų | 142.6 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -78.7 | 117.6 | 160.8 | -53.6 | 176.3 | 0 | 0 | 0 | 106.8 | F327 | F327-I329 PolarHBondContact O-N 3.23Å; F327-I329 VanDerWaalsContact O-N 3.13Å |
| 330 | S | 55.6 | Low | 51.4 | Low | 101 Ų | 101 | 147.9 Ų | 147.9 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 132.8 | 176.1 | -64.1 | 0 | 0 | 0 | 0 | 110.3 | M332 | S330-M332 PolarHBondContact O-N 2.97Š|
| 331 | P | 61.2 | Low | 50.6 | Low | 120 Ų | 120 | 147.8 Ų | 147.8 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 124.4 | 178.3 | 26.2 | -33.3 | 0 | 0 | 0 | 110.4 | T333 | P331-T333 PolarHBondContact O-N 3.36Š|
| 332 | M | 56 | Low | 50.1 | Low | 182 Ų | 182 | 145.3 Ų | 145.3 | 90% | 0.897 | 78% | 0.783 | S | S | * | * | trans | -70.2 | 108 | -177.8 | 178.3 | 178.8 | 170.8 | 0 | 0 | 110.8 | S330 | S330-M332 PolarHBondContact O-N 2.97Š| ||
| 333 | T | 63 | Low | 49.7 | Very low | 107 Ų | 107 | 148.1 Ų | 148.1 | 66% | 0.656 | 78% | 0.784 | S | S | * | * | trans | -84.8 | 134 | 176.4 | 49.4 | 0 | 0 | 0 | 0 | 111.4 | P331 | P331-T333 PolarHBondContact O-N 3.36Š| ||
| 334 | F | 51.3 | Low | 49.3 | Very low | 179 Ų | 179 | 140.8 Ų | 140.8 | 79% | 0.785 | 77% | 0.774 | S | S | * | * | trans | -98.4 | 103.4 | -176.7 | -169.5 | -109.6 | 0 | 0 | 0 | 110.9 | V336 | F334-V336 HydrophobicContact CD1-CG2 3.56Å; F334-V336 HydrophobicContact CE1-CG2 3.63Å; F334-V336 PolarHBondContact O-N 3.04Å | ||
| 335 | N | 53.2 | Low | 49.1 | Very low | 141 Ų | 141 | 142.3 Ų | 142.3 | 75% | 0.754 | 78% | 0.776 | S | S | * | * | trans | -83.6 | 90 | -174.4 | -63.1 | -58.7 | 0 | 0 | 0 | 111.9 | K337 | N335-K337 PolarHBondContact O-N 3.36Š| ||
| 336 | V | 47.8 | Very low | 48.4 | Very low | 111 Ų | 111 | 143.3 Ų | 143.3 | 67% | 0.673 | 78% | 0.778 | S | S | * | * | trans | -75.4 | 93.5 | 174 | -175.1 | 0 | 0 | 0 | 0 | 110 | F334 K338 | F334-V336 HydrophobicContact CD1-CG2 3.56Å; F334-V336 HydrophobicContact CE1-CG2 3.63Å; F334-V336 PolarHBondContact O-N 3.04Å; V336-K338 VanDerWaalsContact C-N 3.35Å; V336-K338 PolarHBondContact O-N 3.02Å | ||
| 337 | K | 58.3 | Low | 47.8 | Very low | 187 Ų | 187 | 145.5 Ų | 145.5 | 81% | 0.813 | 78% | 0.775 | S | S | * | * | trans | -71.7 | 87.2 | 174.6 | -171.5 | 174.5 | -178.9 | 177.2 | 0 | 110.6 | N335 V339 | N335-K337 PolarHBondContact O-N 3.36Å; K337-V339 PolarHBondContact O-N 3.21Å | ||
| 338 | K | 56.3 | Low | 46.9 | Very low | 190 Ų | 190 | 145 Ų | 145 | 83% | 0.826 | 78% | 0.776 | S | S | * | * | trans | -69.1 | 105.2 | 173.6 | -166.8 | 179.2 | -174.4 | -177.2 | 0 | 109.5 | V336 | V336-K338 VanDerWaalsContact C-N 3.35Å; V336-K338 PolarHBondContact O-N 3.02Å | ||
| 339 | V | 51.3 | Low | 46 | Very low | 127 Ų | 127 | 142.8 Ų | 142.8 | 77% | 0.77 | 77% | 0.77 | S | S | * | * | trans | -79.1 | 122.7 | 175 | -72.4 | 0 | 0 | 0 | 0 | 110.5 | K337 | K337-V339 PolarHBondContact O-N 3.21Š| ||
| 340 | R | 38.3 | Very low | 44.7 | Very low | 209 Ų | 209 | 144.1 Ų | 144.1 | 79% | 0.789 | 77% | 0.771 | S | S | * | * | trans | -155.2 | 106.5 | 171.9 | 179.2 | 64 | 168 | 146.2 | -9.1 | 109 | ||||
| 341 | D | 32.6 | Very low | 43.5 | Very low | 132 Ų | 132 | 144 Ų | 144 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | trans | 55 | 163.3 | 173.4 | -64.7 | -71.6 | 0 | 0 | 0 | 117.5 | ||||
| 342 | G | 39 | Very low | 41.9 | Very low | 75 Ų | 75 | 144.2 Ų | 144.2 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | trans | -115.8 | 158.3 | -171.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 343 | D | 33.7 | Very low | 40.7 | Very low | 163 Ų | 163 | 144 Ų | 144 | 87% | 0.872 | 77% | 0.766 | S | S | * | * | trans | -140.4 | 161.6 | 133.9 | -159.9 | 0.8 | 0 | 0 | 0 | 108.1 | ||||
| 344 | A | 40.3 | Very low | 39.2 | Very low | 84 Ų | 84 | 145.8 Ų | 145.8 | 69% | 0.694 | 77% | 0.767 | S | S | * | * | trans | -101.3 | 138.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 345 | P | 42.2 | Very low | 38.4 | Very low | 125 Ų | 125 | 145.8 Ų | 145.8 | 81% | 0.812 | 77% | 0.766 | S | S | * | * | trans | -108.7 | 129.8 | 161.2 | 33.7 | -25.9 | 0 | 0 | 0 | 112 | ||||
| 346 | T | 31.4 | Very low | 37.3 | Very low | 128 Ų | 128 | 143.2 Ų | 143.2 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | trans | -81.3 | 159.1 | 172.9 | -62.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 347 | Q | 36.1 | Very low | 36.5 | Very low | 158 Ų | 158 | 146 Ų | 146 | 74% | 0.738 | 77% | 0.77 | S | S | * | * | trans | -23.8 | 145.3 | 171.4 | -54 | 170.6 | 9.7 | 0 | 0 | 118.3 | ||||
| 348 | E | 28.5 | Very low | 35.4 | Very low | 175 Ų | 175 | 141.6 Ų | 141.6 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | -165.2 | 129.3 | 106 | -98.9 | -176.8 | -165.9 | 0 | 0 | 109.4 | |||||
| 349 | M | 32.6 | Very low | 34.3 | Very low | 151 Ų | 151 | 140.2 Ų | 140.2 | 74% | 0.744 | 76% | 0.755 | S | S | * | * | 63.4 | 125.4 | 84.1 | -62 | -70.5 | -180 | 0 | 0 | 112.4 | |||||
| 350 | K | 29.2 | Very low | 33.5 | Very low | 182 Ų | 182 | 141.1 Ų | 141.1 | 79% | 0.791 | 75% | 0.754 | S | S | * | * | cis | -151.4 | 143.7 | 26.4 | -103.5 | 164.8 | -178.2 | 169.8 | 0 | 110.2 | ||||
| 351 | S | 32.2 | Very low | 33.9 | Very low | 99 Ų | 99 | 135.9 Ų | 135.9 | 69% | 0.692 | 75% | 0.747 | S | S | * | * | 71.5 | 149.5 | 84.6 | 95.6 | 0 | 0 | 0 | 0 | 115 | |||||
| 352 | T | 27.4 | Very low | 34.3 | Very low | 123 Ų | 123 | 134.4 Ų | 134.4 | 76% | 0.755 | 75% | 0.753 | S | S | * | * | cis | -154.6 | 175 | 20.6 | -38.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 353 | E | 30.5 | Very low | 34.2 | Very low | 178 Ų | 178 | 137.6 Ų | 137.6 | 83% | 0.832 | 75% | 0.751 | S | S | * | * | trans | 95.8 | 132.4 | 163.1 | -60.4 | -171.4 | 141 | 0 | 0 | 117.8 | ||||
| 354 | E | 31.5 | Very low | 34 | Very low | 145 Ų | 145 | 135.9 Ų | 135.9 | 68% | 0.678 | 75% | 0.747 | S | S | * | * | cis | -146.6 | 155.3 | -10.9 | 175.9 | 165.2 | -150 | 0 | 0 | 112.1 | ||||
| 355 | K | 33.8 | Very low | 33.5 | Very low | 179 Ų | 179 | 135.1 Ų | 135.1 | 78% | 0.778 | 75% | 0.748 | S | S | * | * | trans | -5.6 | 151.5 | 165.2 | -64.6 | 174.4 | -162.6 | 120.4 | 0 | 120.9 | ||||
| 356 | A | 30.1 | Very low | 33.3 | Very low | 86 Ų | 86 | 137.8 Ų | 137.8 | 71% | 0.711 | 75% | 0.754 | S | S | * | * | cis | -173.6 | 149.4 | -10.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 357 | H | 31.8 | Very low | 33.3 | Very low | 170 Ų | 170 | 135.5 Ų | 135.5 | 79% | 0.787 | 76% | 0.756 | S | S | * | * | trans | 57.9 | 151.6 | 142.6 | -112.5 | -138.8 | 0 | 0 | 0 | 120.7 | ||||
| 358 | V | 34.7 | Very low | 33.1 | Very low | 94 Ų | 94 | 131.8 Ų | 131.8 | 57% | 0.57 | 76% | 0.76 | S | S | * | * | cis | -147 | 163.1 | 18.3 | -157.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 359 | E | 32.3 | Very low | 33.2 | Very low | 162 Ų | 162 | 133.6 Ų | 133.6 | 76% | 0.757 | 77% | 0.765 | S | S | * | * | trans | 61.8 | 118.4 | 154.8 | -88.3 | 143.1 | -140.1 | 0 | 0 | 120.6 | ||||
| 360 | I | 35 | Very low | 33.6 | Very low | 146 Ų | 146 | 133.4 Ų | 133.4 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | cis | 78.2 | 139.1 | 20.4 | -46.4 | 169.1 | 0 | 0 | 0 | 113 | ||||
| 361 | P | 47.3 | Very low | 33.9 | Very low | 99 Ų | 99 | 130.5 Ų | 130.5 | 64% | 0.643 | 77% | 0.765 | S | S | * | * | cis | -122.6 | 168.2 | 3.2 | 22.3 | 0.4 | 0 | 0 | 0 | 116.9 | L363 | P361-L363 HydrophobicContact CB-CD1 4.4Å; P361-L363 HydrophobicContact CB-CG 4.26Å; P361-L363 HydrophobicContact CG-CD1 4.38Å | ||
| 362 | A | 41.2 | Very low | 34 | Very low | 101 Ų | 101 | 130.6 Ų | 130.6 | 84% | 0.835 | 77% | 0.766 | S | S | * | * | trans | -108 | 136.5 | 145 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 363 | L | 36.6 | Very low | 34.2 | Very low | 141 Ų | 141 | 132 Ų | 132 | 74% | 0.738 | 77% | 0.769 | S | S | * | * | trans | -140.5 | 140.5 | -177.7 | -88 | 170.6 | 0 | 0 | 0 | 111.7 | P361 | P361-L363 HydrophobicContact CB-CD1 4.4Å; P361-L363 HydrophobicContact CB-CG 4.26Å; P361-L363 HydrophobicContact CG-CD1 4.38Å | ||
| 364 | T | 29.5 | Very low | 34.2 | Very low | 127 Ų | 127 | 132 Ų | 132 | 78% | 0.779 | 77% | 0.769 | S | S | * | * | trans | 51.1 | 117.7 | 146 | -49.1 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 365 | G | 29.7 | Very low | 34 | Very low | 69 Ų | 69 | 132.1 Ų | 132.1 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | cis | 100.4 | 96.4 | 12.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 366 | L | 37.5 | Very low | 33.6 | Very low | 181 Ų | 181 | 130.5 Ų | 130.5 | 95% | 0.948 | 77% | 0.767 | S | S | * | * | trans | -140.6 | 122.6 | 171.3 | -103.8 | 169.2 | 0 | 0 | 0 | 109 | ||||
| 367 | G | 31.2 | Very low | 33.5 | Very low | 80 Ų | 80 | 132.9 Ų | 132.9 | 83% | 0.825 | 77% | 0.767 | S | S | * | * | trans | -107.7 | 137.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 368 | G | 31.9 | Very low | 33.2 | Very low | 79 Ų | 79 | 131 Ų | 131 | 81% | 0.814 | 76% | 0.758 | S | S | * | * | trans | -117.6 | 145.5 | 169.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 369 | K | 30.8 | Very low | 32.9 | Very low | 214 Ų | 214 | 133.8 Ų | 133.8 | 93% | 0.93 | 77% | 0.765 | S | S | * | * | trans | -79.9 | 150 | -177.2 | -82.9 | -175.4 | 172 | -176.9 | 0 | 113.1 | ||||
| 370 | I | 40.7 | Very low | 32.6 | Very low | 146 Ų | 146 | 133.8 Ų | 133.8 | 75% | 0.749 | 77% | 0.765 | S | S | * | * | trans | -67.4 | 160.2 | 160.3 | -10.3 | 176.1 | 0 | 0 | 0 | 110.1 | ||||
| 371 | P | 35.3 | Very low | 32.3 | Very low | 121 Ų | 121 | 131.4 Ų | 131.4 | 79% | 0.786 | 76% | 0.757 | S | S | * | * | -138 | 175.7 | 83.1 | 39.7 | -26.3 | 0 | 0 | 0 | 115 | |||||
| 372 | S | 34.8 | Very low | 31.3 | Very low | 102 Ų | 102 | 132.3 Ų | 132.3 | 71% | 0.713 | 77% | 0.766 | S | S | * | * | trans | -123.3 | 147.1 | 173.6 | -49.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 373 | D | 32 | Very low | 30.9 | Very low | 151 Ų | 151 | 133.9 Ų | 133.9 | 81% | 0.807 | 77% | 0.765 | S | S | * | * | trans | -134.5 | 139.3 | 156.4 | -62.1 | -66.4 | 0 | 0 | 0 | 104.5 | ||||
| 374 | E | 29.7 | Very low | 30.5 | Very low | 180 Ų | 180 | 134.8 Ų | 134.8 | 84% | 0.841 | 77% | 0.771 | S | S | * | * | cis | 60.6 | 139.8 | 49.3 | -109.7 | 175.4 | 131.2 | 0 | 0 | 112.1 | ||||
| 375 | I | 27.3 | Very low | 30.4 | Very low | 146 Ų | 146 | 131.6 Ų | 131.6 | 75% | 0.749 | 76% | 0.763 | S | S | * | * | cis | -143.6 | 163 | 30.8 | -55.4 | 167.9 | 0 | 0 | 0 | 111.8 | ||||
| 376 | H | 25.5 | Very low | 30.4 | Very low | 145 Ų | 145 | 138.4 Ų | 138.4 | 67% | 0.671 | 77% | 0.773 | S | S | * | * | trans | -56.6 | 172.1 | 167.2 | -158.2 | 33.4 | 0 | 0 | 0 | 113.1 | ||||
| 377 | I | 29.1 | Very low | 30.1 | Very low | 136 Ų | 136 | 134.9 Ų | 134.9 | 70% | 0.697 | 76% | 0.764 | S | S | * | * | -167.5 | 132 | 68.9 | -75.4 | 180 | 0 | 0 | 0 | 110.8 | |||||
| 378 | Q | 25.8 | Very low | 30.3 | Very low | 130 Ų | 130 | 136.8 Ų | 136.8 | 61% | 0.607 | 76% | 0.764 | S | S | * | * | 27.4 | 139 | 129.9 | -122.3 | 177.2 | 6.3 | 0 | 0 | 121.4 | |||||
| 379 | E | 27.7 | Very low | 30.2 | Very low | 154 Ų | 154 | 137.9 Ų | 137.9 | 72% | 0.72 | 76% | 0.759 | S | S | * | * | cis | -136.1 | -115.2 | -3.2 | -153.3 | 75.7 | -73.8 | 0 | 0 | 111.5 | ||||
| 380 | E | 27 | Very low | 30.5 | Very low | 162 Ų | 162 | 133.3 Ų | 133.3 | 76% | 0.757 | 75% | 0.754 | S | S | * | * | cis | -154 | -134.2 | -1.6 | -150.1 | -101.6 | 162.4 | 0 | 0 | 112.3 | ||||
| 381 | V | 28 | Very low | 30.1 | Very low | 95 Ų | 95 | 133 Ų | 133 | 58% | 0.576 | 76% | 0.759 | S | S | * | * | trans | -131.5 | 136.8 | -153.3 | 167 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 382 | S | 26.2 | Very low | 30 | Very low | 119 Ų | 119 | 135.9 Ų | 135.9 | 83% | 0.832 | 76% | 0.762 | S | S | * | * | -173.3 | 108.3 | 128.2 | -85.5 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 383 | V | 32.9 | Very low | 29.8 | Very low | 133 Ų | 133 | 135.9 Ų | 135.9 | 81% | 0.806 | 77% | 0.768 | S | S | * | * | trans | -15.4 | 128.9 | 156.2 | -177.2 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 384 | N | 27.6 | Very low | 29.8 | Very low | 161 Ų | 161 | 138 Ų | 138 | 86% | 0.861 | 77% | 0.773 | S | S | * | * | -170.3 | 161.7 | 104.9 | -155.6 | 2.3 | 0 | 0 | 0 | 111.6 | |||||
| 385 | G | 28 | Very low | 30.5 | Very low | 60 Ų | 60 | 137.7 Ų | 137.7 | 62% | 0.619 | 78% | 0.775 | S | S | * | * | trans | -152.1 | -177.9 | -171.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 386 | K | 30.4 | Very low | 30.8 | Very low | 211 Ų | 211 | 138.7 Ų | 138.7 | 92% | 0.917 | 78% | 0.782 | S | S | * | * | trans | -149.2 | 169.7 | 171.9 | -146.5 | 71.3 | 179.7 | -172.7 | 0 | 111.6 | ||||
| 387 | S | 30.6 | Very low | 31.3 | Very low | 108 Ų | 108 | 135 Ų | 135 | 76% | 0.755 | 78% | 0.783 | S | S | * | * | trans | -95.6 | 164.2 | -159.4 | 49.4 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 388 | S | 35.2 | Very low | 31.6 | Very low | 119 Ų | 119 | 138 Ų | 138 | 83% | 0.832 | 79% | 0.794 | S | S | * | * | trans | -87.7 | 142.4 | 175.3 | 56.4 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 389 | S | 30.7 | Very low | 31.9 | Very low | 103 Ų | 103 | 135.1 Ų | 135.1 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | trans | -152.3 | 120.8 | 153.8 | 50.4 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 390 | S | 35.3 | Very low | 32.5 | Very low | 117 Ų | 117 | 136.5 Ų | 136.5 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | 59.7 | 103.7 | 71.9 | -162.2 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 391 | V | 32.5 | Very low | 32.8 | Very low | 141 Ų | 141 | 134 Ų | 134 | 86% | 0.855 | 82% | 0.819 | S | S | * | * | trans | -141.2 | 132.9 | 168.1 | -178.1 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 392 | E | 32.8 | Very low | 33.2 | Very low | 181 Ų | 181 | 132.8 Ų | 132.8 | 85% | 0.846 | 83% | 0.825 | S | S | * | * | trans | -92.9 | 155.1 | 176.6 | -60.5 | -175.9 | 121.3 | 0 | 0 | 110.1 | ||||
| 393 | A | 32 | Very low | 33.6 | Very low | 101 Ų | 101 | 136 Ų | 136 | 84% | 0.835 | 83% | 0.832 | S | S | * | * | trans | -101.8 | 104.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 394 | E | 31.3 | Very low | 33.6 | Very low | 197 Ų | 197 | 134.3 Ų | 134.3 | 92% | 0.921 | 83% | 0.832 | S | S | * | * | trans | -69.9 | 147.7 | 172 | -68.9 | -177.4 | 101.9 | 0 | 0 | 111.5 | ||||
| 395 | I | 44.5 | Very low | 34.1 | Very low | 172 Ų | 172 | 133.3 Ų | 133.3 | 88% | 0.882 | 83% | 0.831 | S | S | * | * | trans | -106.7 | 123.7 | 170.5 | 46.5 | 169.6 | 0 | 0 | 0 | 109.1 | ||||
| 396 | N | 33.9 | Very low | 34.9 | Very low | 167 Ų | 167 | 135.9 Ų | 135.9 | 89% | 0.893 | 84% | 0.837 | S | S | * | * | trans | -141.3 | 153.2 | 168.9 | -163.3 | 21.3 | 0 | 0 | 0 | 108.8 | ||||
| 397 | G | 35.8 | Very low | 35.3 | Very low | 68 Ų | 68 | 135.5 Ų | 135.5 | 70% | 0.701 | 84% | 0.838 | S | S | * | * | trans | -164.4 | 154.1 | -170.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 398 | E | 34.8 | Very low | 35.5 | Very low | 198 Ų | 198 | 137 Ų | 137 | 93% | 0.925 | 83% | 0.833 | S | S | * | * | trans | -167.4 | 153.9 | -179.6 | 55.4 | -167.9 | 156.2 | 0 | 0 | 107.4 | ||||
| 399 | G | 33.4 | Very low | 35.6 | Very low | 71 Ų | 71 | 138.2 Ų | 138.2 | 73% | 0.732 | 83% | 0.83 | S | S | * | * | cis | -176.3 | 132.8 | -10 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 400 | L | 40.1 | Very low | 36.1 | Very low | 183 Ų | 183 | 139.8 Ų | 139.8 | 96% | 0.958 | 83% | 0.827 | S | S | * | * | trans | 36.4 | 113.7 | 155.3 | -61.5 | 172.2 | 0 | 0 | 0 | 121.9 | ||||
| 401 | A | 33.4 | Very low | 36.3 | Very low | 110 Ų | 110 | 142.1 Ų | 142.1 | 91% | 0.909 | 83% | 0.83 | S | S | * | * | 168.6 | 147.1 | 127.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 402 | G | 35.3 | Very low | 36.8 | Very low | 69 Ų | 69 | 142.1 Ų | 142.1 | 71% | 0.711 | 82% | 0.824 | S | S | * | * | cis | 146.3 | 82.1 | -5.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 403 | L | 35.8 | Very low | 36.8 | Very low | 187 Ų | 187 | 137.3 Ų | 137.3 | 98% | 0.979 | 82% | 0.823 | S | S | * | * | trans | -142.5 | 144.7 | 169.7 | -75.5 | 179.2 | 0 | 0 | 0 | 110.4 | ||||
| 404 | A | 32.8 | Very low | 37.3 | Very low | 97 Ų | 97 | 140.8 Ų | 140.8 | 80% | 0.802 | 82% | 0.822 | S | S | * | * | trans | -142.2 | 146 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 405 | V | 36.9 | Very low | 37.5 | Very low | 140 Ų | 140 | 138.6 Ų | 138.6 | 85% | 0.848 | 82% | 0.817 | S | S | * | * | trans | -140.4 | 134.3 | 158.5 | 178.7 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 406 | P | 46.4 | Very low | 37.1 | Very low | 114 Ų | 114 | 138.2 Ų | 138.2 | 74% | 0.74 | 81% | 0.811 | S | S | * | * | trans | -92.8 | 155.9 | -174.8 | 36.4 | -34.5 | 0 | 0 | 0 | 112.6 | ||||
| 407 | E | 37 | Very low | 37.3 | Very low | 202 Ų | 202 | 140 Ų | 140 | 94% | 0.944 | 81% | 0.814 | S | S | * | * | trans | -122.3 | 127.8 | 152 | -70.6 | -171.6 | 165.8 | 0 | 0 | 108.2 | ||||
| 408 | H | 36 | Very low | 37.3 | Very low | 140 Ų | 140 | 144.5 Ų | 144.5 | 65% | 0.648 | 82% | 0.817 | S | S | * | * | trans | -141 | 130.3 | 171.7 | 175.5 | -73.7 | 0 | 0 | 0 | 105.2 | E410 | H408-E410 IonicContact CE1-OE1 2.95Š| ||
| 409 | D | 37 | Very low | 37.2 | Very low | 144 Ų | 144 | 142.8 Ų | 142.8 | 77% | 0.77 | 81% | 0.809 | S | S | * | * | trans | -177.4 | 99.7 | 146.7 | -86.4 | -11.4 | 0 | 0 | 0 | 105.2 | ||||
| 410 | E | 40.8 | Very low | 37.3 | Very low | 137 Ų | 137 | 149.1 Ų | 149.1 | 64% | 0.64 | 82% | 0.819 | S | S | * | * | 87.7 | 93.5 | 93.8 | -67.1 | -110.8 | 162.1 | 0 | 0 | 111.6 | H408 | H408-E410 IonicContact CE1-OE1 2.95Š| |||
| 411 | D | 40.9 | Very low | 37 | Very low | 166 Ų | 166 | 149.1 Ų | 149.1 | 89% | 0.888 | 82% | 0.815 | S | S | * | * | trans | -137.9 | 114.6 | 151.6 | -166 | 16 | 0 | 0 | 0 | 107 | ||||
| 412 | L | 42.4 | Very low | 37.1 | Very low | 141 Ų | 141 | 153 Ų | 153 | 74% | 0.738 | 81% | 0.814 | S | S | * | * | trans | -102.2 | 127.4 | -170.8 | -74.5 | 169.4 | 0 | 0 | 0 | 110.2 | ||||
| 413 | G | 33.2 | Very low | 37 | Very low | 79 Ų | 79 | 156.4 Ų | 156.4 | 81% | 0.814 | 82% | 0.816 | S | S | * | * | trans | -154.9 | 52.9 | -178 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 414 | E | 42.1 | Very low | 36.9 | Very low | 175 Ų | 175 | 156 Ų | 156 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | -70.4 | 133.5 | 157.7 | -62.1 | -177.2 | 155.5 | 0 | 0 | 108.2 | ||||
| 415 | D | 34.9 | Very low | 36.9 | Very low | 151 Ų | 151 | 157.9 Ų | 157.9 | 81% | 0.807 | 80% | 0.801 | S | S | * | * | trans | -169.7 | 134.5 | 145.3 | -94.7 | -28.5 | 0 | 0 | 0 | 110.2 | ||||
| 416 | E | 37.5 | Very low | 36.7 | Very low | 163 Ų | 163 | 158.8 Ų | 158.8 | 76% | 0.762 | 79% | 0.793 | S | S | * | * | trans | 58.1 | 88.2 | 151.7 | -59.8 | 175 | 175.5 | 0 | 0 | 119.6 | ||||
| 417 | E | 37.5 | Very low | 36 | Very low | 205 Ų | 205 | 160.9 Ų | 160.9 | 96% | 0.958 | 79% | 0.793 | S | S | * | * | trans | -86.3 | 104.7 | 142.3 | -75.2 | -168.7 | 167.1 | 0 | 0 | 108.9 | ||||
| 418 | E | 35.2 | Very low | 35.8 | Very low | 163 Ų | 163 | 160 Ų | 160 | 76% | 0.762 | 79% | 0.786 | S | S | * | * | trans | -125.1 | 131 | 168.5 | -75.1 | -161.3 | 161.6 | 0 | 0 | 113 | ||||
| 419 | E | 31.9 | Very low | 35.6 | Very low | 162 Ų | 162 | 158.5 Ų | 158.5 | 76% | 0.757 | 79% | 0.792 | S | S | * | * | trans | 29.8 | 125.4 | 152.4 | -54.9 | -170.1 | 175.3 | 0 | 0 | 122.9 | ||||
| 420 | E | 35.8 | Very low | 36 | Very low | 203 Ų | 203 | 156.8 Ų | 156.8 | 95% | 0.949 | 79% | 0.789 | S | S | * | * | -131.7 | 121.8 | 123.3 | -75.6 | -166.9 | 150.4 | 0 | 0 | 108.7 | |||||
| 421 | E | 33.5 | Very low | 35.5 | Very low | 184 Ų | 184 | 157.5 Ų | 157.5 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | trans | -84 | 155.6 | 171 | -71.2 | -158.5 | 133.1 | 0 | 0 | 112.2 | ||||
| 422 | E | 36.4 | Very low | 35.1 | Very low | 191 Ų | 191 | 157.2 Ų | 157.2 | 89% | 0.893 | 79% | 0.789 | S | S | * | * | trans | -134.3 | 126.3 | 160.7 | -168 | 173.5 | -153.5 | 0 | 0 | 111.1 | ||||
| 423 | D | 32.4 | Very low | 34.6 | Very low | 141 Ų | 141 | 156.2 Ų | 156.2 | 75% | 0.754 | 79% | 0.788 | S | S | * | * | trans | -58.3 | 142.3 | -176.3 | -92.7 | -66.6 | 0 | 0 | 0 | 115.1 | ||||
| 424 | Q | 33.4 | Very low | 34.5 | Very low | 177 Ų | 177 | 160.1 Ų | 160.1 | 83% | 0.827 | 79% | 0.787 | S | S | * | * | -166.3 | 118.4 | 126.4 | -109.8 | 147.5 | 110.8 | 0 | 0 | 117.8 | |||||
| 425 | E | 33.7 | Very low | 34.1 | Very low | 138 Ų | 138 | 156.8 Ų | 156.8 | 65% | 0.645 | 79% | 0.789 | S | S | * | * | trans | 55.5 | 113 | 141.4 | -63.5 | -148.7 | 146.3 | 0 | 0 | 124.3 | ||||
| 426 | K | 33.4 | Very low | 33.9 | Very low | 158 Ų | 158 | 157.1 Ų | 157.1 | 69% | 0.687 | 79% | 0.786 | S | S | * | * | 63.6 | 124.8 | 127.1 | -58.4 | 168.9 | -177.2 | 156.4 | 0 | 118.6 | |||||
| 427 | Q | 30.8 | Very low | 33.8 | Very low | 158 Ų | 158 | 155.6 Ų | 155.6 | 74% | 0.738 | 79% | 0.787 | S | S | * | * | -168.5 | 156 | 72.5 | -94.1 | -165.2 | 31.3 | 0 | 0 | 114.8 | |||||
| 428 | K | 33.8 | Very low | 33.6 | Very low | 183 Ų | 183 | 153.5 Ų | 153.5 | 80% | 0.796 | 78% | 0.778 | S | S | * | * | trans | 66.7 | 104.2 | 155.1 | -71.3 | 170.2 | -179.6 | 172 | 0 | 120 | ||||
| 429 | S | 31 | Very low | 33.6 | Very low | 110 Ų | 110 | 153.2 Ų | 153.2 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | -83.5 | 174.5 | 133 | 60 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 430 | P | 46.3 | Very low | 33.8 | Very low | 108 Ų | 108 | 151.1 Ų | 151.1 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | -149 | -173.3 | 101.7 | 39.9 | -23.3 | 0 | 0 | 0 | 114.4 | |||||
| 431 | I | 29.4 | Very low | 33.7 | Very low | 151 Ų | 151 | 147 Ų | 147 | 77% | 0.774 | 77% | 0.767 | S | S | * | * | trans | 73.8 | 115 | 169.1 | -55.3 | 163.1 | 0 | 0 | 0 | 113.5 | ||||
| 432 | E | 31.6 | Very low | 34 | Very low | 161 Ų | 161 | 146.3 Ų | 146.3 | 75% | 0.752 | 76% | 0.764 | S | S | * | * | cis | -149.9 | -147.9 | -12.2 | -137.5 | -165.3 | -85.7 | 0 | 0 | 109.2 | ||||
| 433 | V | 32.2 | Very low | 34 | Very low | 119 Ų | 119 | 142.4 Ų | 142.4 | 72% | 0.721 | 75% | 0.753 | S | S | * | * | cis | -151 | 171.2 | 15.7 | 74.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 434 | M | 31.8 | Very low | 34.6 | Very low | 162 Ų | 162 | 143.2 Ų | 143.2 | 80% | 0.798 | 76% | 0.756 | S | S | * | * | trans | -26.6 | 130 | 174.2 | -62.2 | 168.1 | 66.5 | 0 | 0 | 118.4 | ||||
| 435 | A | 33.4 | Very low | 35 | Very low | 104 Ų | 104 | 138.7 Ų | 138.7 | 86% | 0.86 | 75% | 0.749 | S | S | * | * | trans | -135.8 | 128.2 | 152.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 436 | E | 30.3 | Very low | 35.4 | Very low | 159 Ų | 159 | 138.3 Ų | 138.3 | 74% | 0.743 | 76% | 0.755 | S | S | * | * | trans | -107.9 | 107.5 | -177.2 | -178.1 | 178.9 | -173.3 | 0 | 0 | 110.8 | ||||
| 437 | V | 36.4 | Very low | 35.9 | Very low | 130 Ų | 130 | 138.1 Ų | 138.1 | 79% | 0.788 | 76% | 0.757 | S | S | * | * | trans | -139.9 | 115.5 | 163.4 | -179.5 | 0 | 0 | 0 | 0 | 108.8 | I439 | V437-I439 HydrophobicContact CG1-CG1 4.41Š| ||
| 438 | Q | 33.7 | Very low | 36.4 | Very low | 162 Ų | 162 | 137.6 Ų | 137.6 | 76% | 0.757 | 76% | 0.755 | S | S | * | * | trans | -87.3 | 131.8 | 171.1 | -59.7 | 175.2 | 19.4 | 0 | 0 | 109.9 | ||||
| 439 | I | 34.8 | Very low | 36.8 | Very low | 156 Ų | 156 | 134.6 Ų | 134.6 | 80% | 0.8 | 75% | 0.751 | S | S | * | * | trans | -139.9 | 120.5 | 148.6 | -25.2 | 176.3 | 0 | 0 | 0 | 109.1 | V437 | V437-I439 HydrophobicContact CG1-CG1 4.41Š| ||
| 440 | T | 34.7 | Very low | 37.6 | Very low | 119 Ų | 119 | 138 Ų | 138 | 73% | 0.73 | 78% | 0.775 | S | S | * | * | trans | -66.1 | 150.6 | 161.3 | 54.1 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 441 | T | 34.8 | Very low | 37.2 | Very low | 117 Ų | 117 | 139.6 Ų | 139.6 | 72% | 0.718 | 78% | 0.779 | S | S | * | * | cis | -154.1 | 174.6 | 45.1 | 56.1 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 442 | E | 39.3 | Very low | 37.6 | Very low | 169 Ų | 169 | 138.9 Ų | 138.9 | 79% | 0.79 | 78% | 0.779 | S | S | * | * | cis | -148 | -136.5 | 4.1 | -146.7 | 163.7 | -93.6 | 0 | 0 | 111.7 | ||||
| 443 | T | 36 | Very low | 37.9 | Very low | 109 Ų | 109 | 137.7 Ų | 137.7 | 67% | 0.669 | 78% | 0.781 | S | S | * | * | trans | -131.8 | 154 | -171.5 | 49 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 444 | I | 45.4 | Very low | 38.3 | Very low | 157 Ų | 157 | 138.8 Ų | 138.8 | 81% | 0.805 | 78% | 0.784 | S | S | * | * | trans | 161.2 | 114.2 | 132.6 | -82.6 | 153.9 | 0 | 0 | 0 | 106.8 | ||||
| 445 | A | 41.5 | Very low | 38.7 | Very low | 82 Ų | 82 | 137.4 Ų | 137.4 | 68% | 0.678 | 78% | 0.784 | S | S | * | * | cis | 96.2 | 153.7 | 26.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 446 | V | 43.2 | Very low | 39 | Very low | 130 Ų | 130 | 139.6 Ų | 139.6 | 79% | 0.788 | 78% | 0.778 | S | S | * | * | trans | 78.7 | 112.9 | -177.8 | -176.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 447 | E | 42.4 | Very low | 39.6 | Very low | 155 Ų | 155 | 138.2 Ų | 138.2 | 72% | 0.724 | 78% | 0.781 | S | S | * | * | 69.2 | 152.4 | 52.4 | -75.5 | -162.5 | 81.6 | 0 | 0 | 114.6 | |||||
| 448 | Q | 42.1 | Very low | 39.9 | Very low | 147 Ų | 147 | 138.8 Ų | 138.8 | 69% | 0.687 | 78% | 0.78 | S | S | * | * | cis | -156.9 | 174.3 | -31.4 | -135 | -164.1 | 110.8 | 0 | 0 | 106.7 | ||||
| 449 | V | 42.5 | Very low | 40.4 | Very low | 119 Ų | 119 | 136.9 Ų | 136.9 | 72% | 0.721 | 78% | 0.782 | S | S | * | * | trans | 55.7 | 113.7 | 152.2 | 175.3 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 450 | S | 47.9 | Very low | 40.9 | Very low | 183 Ų | 183 | 135.2 Ų | 135.2 | 100% | 1.28 | 78% | 0.781 | S | S | * | * | -154.5 | 0 | 97.3 | -170.3 | 0 | 0 | 0 | 0 | 111.8 |
Retrieved 450 of 450 residues in 309.5 ms
(Link to these results)