| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 36.2 | Very low | 38.7 | Very low | 203 Ų | 203 | 141.6 Ų | 141.6 | 100% | 1 | 74% | 0.739 | S | S | * | * | 0 | 109 | 0 | -73.5 | -170.2 | 177.3 | 0 | 0 | 111.1 | Y3 | M1-Y3 PolarHBondContact N-OH 3.04Å; M1-Y3 VanDerWaalsContact N-OH 3.12Å | |||
| 2 | D | 45.8 | Very low | 38.4 | Very low | 129 Ų | 129 | 139.8 Ų | 139.8 | 69% | 0.69 | 73% | 0.729 | S | S | * | * | cis | -166.2 | 131.7 | -39.7 | -114.9 | -102.7 | 0 | 0 | 0 | 109.3 | ||||
| 3 | Y | 51.7 | Low | 37.8 | Very low | 177 Ų | 177 | 141.2 Ų | 141.2 | 69% | 0.694 | 73% | 0.73 | S | S | * | * | cis | -140.9 | 125 | -46.9 | -90.1 | 141.5 | 0 | 0 | 0 | 109.3 | M1 | M1-Y3 PolarHBondContact N-OH 3.04Å; M1-Y3 VanDerWaalsContact N-OH 3.12Å | ||
| 4 | M | 43.2 | Very low | 37.5 | Very low | 182 Ų | 182 | 139.1 Ų | 139.1 | 90% | 0.897 | 73% | 0.734 | S | S | * | * | trans | 44.3 | 123.9 | 133.6 | -53.2 | -70.6 | -81 | 0 | 0 | 120.4 | ||||
| 5 | G | 38.4 | Very low | 36.8 | Very low | 68 Ų | 68 | 137.1 Ų | 137.1 | 70% | 0.701 | 74% | 0.735 | S | S | * | * | cis | 140 | 142.3 | -12.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 6 | V | 38 | Very low | 37.3 | Very low | 136 Ų | 136 | 134.8 Ų | 134.8 | 82% | 0.824 | 73% | 0.73 | S | S | * | * | trans | 67.3 | 144.4 | 162.7 | -165.1 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 7 | G | 35 | Very low | 36.7 | Very low | 60 Ų | 60 | 135.4 Ų | 135.4 | 62% | 0.619 | 73% | 0.733 | S | S | * | * | cis | 136.7 | 155.2 | -7.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 8 | R | 36.8 | Very low | 36.3 | Very low | 223 Ų | 223 | 133.1 Ų | 133.1 | 84% | 0.842 | 73% | 0.729 | S | S | * | * | trans | 70.7 | 171 | 170.8 | -62.3 | -167.9 | -80.4 | -147.4 | -1.4 | 115.2 | ||||
| 9 | K | 34.6 | Very low | 35.8 | Very low | 166 Ų | 166 | 132 Ų | 132 | 72% | 0.722 | 73% | 0.727 | S | S | * | * | cis | -167.9 | 162.9 | -23.4 | -112.8 | -169.6 | 174.6 | -167.5 | 0 | 110.8 | ||||
| 10 | T | 34 | Very low | 35.5 | Very low | 95 Ų | 95 | 134.1 Ų | 134.1 | 58% | 0.583 | 73% | 0.733 | S | S | * | * | trans | 38.5 | 131.2 | 143.2 | 61.7 | 0 | 0 | 0 | 0 | 124.7 | ||||
| 11 | E | 32.3 | Very low | 35.2 | Very low | 119 Ų | 119 | 132.1 Ų | 132.1 | 56% | 0.556 | 74% | 0.735 | S | S | * | * | 59.7 | 141.7 | 124.9 | -60.2 | 179.5 | 98.9 | 0 | 0 | 124.6 | K465 | E11-K465 WeakPolarHBondContact OE1-CD 3.49Å; E11-K465 WeakPolarHBondContact OE1-CE 3.47Å; E11-K465 IonicContact OE1-NZ 2.73Å; E11-K465 PolarHBondContact OE1-NZ 3.33Å; E11-K465 IonicContact OE2-NZ 2.67Å; E11-K465 PolarHBondContact OE2-NZ 3.22Å | |||
| 12 | L | 34.8 | Very low | 35 | Very low | 119 Ų | 119 | 131.8 Ų | 131.8 | 62% | 0.623 | 73% | 0.728 | S | S | * | * | trans | 81.7 | 145.8 | 145.2 | -81.3 | -176.8 | 0 | 0 | 0 | 122.7 | ||||
| 13 | E | 30.7 | Very low | 34.8 | Very low | 159 Ų | 159 | 130 Ų | 130 | 74% | 0.743 | 72% | 0.722 | S | S | * | * | trans | 66.7 | 145.4 | 145.9 | -86.8 | 171.9 | 136.2 | 0 | 0 | 124 | ||||
| 14 | S | 32.9 | Very low | 33.8 | Very low | 112 Ų | 112 | 131.1 Ų | 131.1 | 78% | 0.783 | 73% | 0.73 | S | S | * | * | trans | 64.5 | 137.3 | 145 | 62.6 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 15 | S | 27.5 | Very low | 33.4 | Very low | 108 Ų | 108 | 128 Ų | 128 | 76% | 0.755 | 72% | 0.717 | S | S | * | * | trans | -48.3 | 164.1 | 145.3 | -41.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 16 | P | 45.3 | Very low | 33.4 | Very low | 101 Ų | 101 | 131.3 Ų | 131.3 | 66% | 0.656 | 72% | 0.718 | S | S | * | * | cis | -143.3 | -156 | 24.6 | 39.1 | -16 | 0 | 0 | 0 | 114.2 | ||||
| 17 | D | 27.4 | Very low | 33.8 | Very low | 144 Ų | 144 | 130.5 Ų | 130.5 | 77% | 0.77 | 72% | 0.716 | S | S | * | * | trans | 69.5 | 127.1 | 144 | -73.9 | -9.5 | 0 | 0 | 0 | 122.3 | ||||
| 18 | S | 27.9 | Very low | 33.7 | Very low | 95 Ų | 95 | 132.8 Ų | 132.8 | 66% | 0.664 | 72% | 0.722 | S | S | * | * | 79.1 | 133.5 | 126.7 | -163.3 | 0 | 0 | 0 | 0 | 121 | |||||
| 19 | T | 28.4 | Very low | 33.4 | Very low | 112 Ų | 112 | 128.2 Ų | 128.2 | 69% | 0.687 | 72% | 0.715 | S | S | * | * | trans | 61.9 | 113.8 | 146.3 | 43.2 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 20 | M | 28.5 | Very low | 33.9 | Very low | 174 Ų | 174 | 125 Ų | 125 | 86% | 0.857 | 71% | 0.711 | S | S | * | * | trans | 70.7 | 94.3 | 132.5 | -63.2 | -170.2 | 177.2 | 0 | 0 | 120.2 | ||||
| 21 | A | 28.8 | Very low | 34 | Very low | 92 Ų | 92 | 128.7 Ų | 128.7 | 76% | 0.76 | 72% | 0.719 | S | S | * | * | 72.1 | 161.1 | 120.2 | 0 | 0 | 0 | 0 | 0 | 120.2 | |||||
| 22 | K | 32.6 | Very low | 34 | Very low | 197 Ų | 197 | 129.7 Ų | 129.7 | 86% | 0.857 | 72% | 0.724 | S | S | * | * | trans | 67.5 | 136.3 | 173.4 | -77.4 | 178 | 178.6 | 176 | 0 | 115.3 | ||||
| 23 | T | 41.1 | Very low | 34 | Very low | 92 Ų | 92 | 128 Ų | 128 | 56% | 0.564 | 72% | 0.722 | S | S | * | * | cis | -153.5 | 133 | -5 | -19.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 24 | F | 31 | Very low | 34 | Very low | 200 Ų | 200 | 125.2 Ų | 125.2 | 88% | 0.877 | 72% | 0.72 | S | S | * | * | trans | -154.1 | 107.2 | 138.4 | -91.4 | -80.8 | 0 | 0 | 0 | 103.7 | ||||
| 25 | N | 35.2 | Very low | 33.9 | Very low | 116 Ų | 116 | 123.9 Ų | 123.9 | 62% | 0.62 | 72% | 0.716 | S | S | * | * | 51.5 | 98.8 | 74.9 | -58 | -13.4 | 0 | 0 | 0 | 109.3 | |||||
| 26 | L | 38.6 | Very low | 33.9 | Very low | 138 Ų | 138 | 125.7 Ų | 125.7 | 72% | 0.723 | 72% | 0.717 | S | S | * | * | cis | 54.1 | 133.7 | 30.1 | -84 | 169.6 | 0 | 0 | 0 | 112.1 | ||||
| 27 | P | 45.5 | Very low | 33.1 | Very low | 119 Ų | 119 | 126.6 Ų | 126.6 | 77% | 0.773 | 72% | 0.721 | S | S | * | * | cis | -112.6 | 174.8 | 43.3 | 7.7 | 16 | 0 | 0 | 0 | 114.1 | ||||
| 28 | S | 33.2 | Very low | 34.8 | Very low | 108 Ų | 108 | 125 Ų | 125 | 76% | 0.755 | 72% | 0.719 | S | S | * | * | cis | -153.7 | 152 | -8.4 | -119.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 29 | D | 30.5 | Very low | 35.5 | Very low | 127 Ų | 127 | 126.9 Ų | 126.9 | 68% | 0.679 | 73% | 0.728 | S | S | * | * | trans | -89.1 | -176.8 | 166.3 | -158 | 31.1 | 0 | 0 | 0 | 109.6 | F31 | D29-F31 PolarHBondContact OD2-N 3.46Š| ||
| 30 | P | 45.8 | Very low | 35.7 | Very low | 99 Ų | 99 | 131.9 Ų | 131.9 | 64% | 0.643 | 73% | 0.734 | S | S | * | * | -158.6 | 149.8 | 78.2 | 42.3 | -21.6 | 0 | 0 | 0 | 119.8 | |||||
| 31 | F | 35.2 | Very low | 35.7 | Very low | 171 Ų | 171 | 129.8 Ų | 129.8 | 75% | 0.75 | 73% | 0.727 | S | S | * | * | trans | 67.6 | 140 | 155.4 | -65.3 | -68.8 | 0 | 0 | 0 | 120.2 | D29 | D29-F31 PolarHBondContact OD2-N 3.46Š| ||
| 32 | E | 34.1 | Very low | 35.7 | Very low | 141 Ų | 141 | 128.2 Ų | 128.2 | 66% | 0.659 | 72% | 0.72 | S | S | * | * | cis | -164 | 148.5 | -38.1 | -109.4 | -155.3 | 102.2 | 0 | 0 | 106.1 | ||||
| 33 | S | 33.2 | Very low | 35.5 | Very low | 83 Ų | 83 | 127.4 Ų | 127.4 | 58% | 0.58 | 72% | 0.719 | S | S | * | * | 62.6 | 146.7 | 78.1 | 130.3 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 34 | S | 31.9 | Very low | 34.8 | Very low | 100 Ų | 100 | 129.5 Ų | 129.5 | 70% | 0.699 | 73% | 0.726 | S | S | * | * | cis | -149 | 153 | 8 | -99.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 35 | A | 30.1 | Very low | 34.6 | Very low | 85 Ų | 85 | 123.1 Ų | 123.1 | 70% | 0.702 | 71% | 0.706 | S | S | * | * | 65.8 | 157.8 | 88.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 36 | D | 27.1 | Very low | 34.2 | Very low | 146 Ų | 146 | 122.9 Ų | 122.9 | 78% | 0.781 | 71% | 0.709 | S | S | * | * | cis | -153.2 | -151.6 | 22.1 | -149.9 | -18.5 | 0 | 0 | 0 | 115 | ||||
| 37 | T | 29 | Very low | 33.7 | Very low | 119 Ų | 119 | 120.7 Ų | 120.7 | 73% | 0.73 | 71% | 0.705 | S | S | * | * | trans | -109.1 | 177.1 | -151.2 | 39.6 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 38 | P | 62.9 | Low | 33.7 | Very low | 112 Ų | 112 | 120.5 Ų | 120.5 | 73% | 0.727 | 70% | 0.704 | S | S | * | * | trans | -93 | -164.8 | -172.1 | 39.5 | -36 | 0 | 0 | 0 | 112.7 | ||||
| 39 | P | 43.9 | Very low | 33.3 | Very low | 133 Ų | 133 | 122.3 Ų | 122.3 | 86% | 0.864 | 71% | 0.705 | S | S | * | * | -136.4 | -170.7 | 125.9 | 39.9 | -30 | 0 | 0 | 0 | 114.9 | |||||
| 40 | R | 32.6 | Very low | 33.4 | Very low | 217 Ų | 217 | 120.9 Ų | 120.9 | 82% | 0.819 | 71% | 0.705 | S | S | * | * | trans | -136.7 | 179.1 | -165.3 | -171.6 | -170.4 | 176.9 | -102.9 | 14 | 109.4 | ||||
| 41 | D | 27.3 | Very low | 32.6 | Very low | 130 Ų | 130 | 123.3 Ų | 123.3 | 70% | 0.695 | 71% | 0.713 | S | S | * | * | trans | 105.8 | 146.7 | 158.4 | -58.4 | -23.9 | 0 | 0 | 0 | 115.7 | ||||
| 42 | G | 29.8 | Very low | 32.1 | Very low | 60 Ų | 60 | 118.5 Ų | 118.5 | 62% | 0.619 | 71% | 0.712 | S | S | * | * | cis | 163.2 | -177.6 | -6.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 43 | Q | 28 | Very low | 31.9 | Very low | 180 Ų | 180 | 119.6 Ų | 119.6 | 84% | 0.841 | 72% | 0.72 | S | S | * | * | trans | 71 | 150.2 | 169.1 | -58.7 | -161 | 35.4 | 0 | 0 | 115.9 | ||||
| 44 | L | 27.1 | Very low | 31.6 | Very low | 135 Ų | 135 | 120.3 Ų | 120.3 | 71% | 0.707 | 73% | 0.725 | S | S | * | * | cis | -150.7 | -172.3 | -0.2 | -123.1 | 170 | 0 | 0 | 0 | 111.9 | ||||
| 45 | S | 25 | Very low | 31.3 | Very low | 66 Ų | 66 | 119.4 Ų | 119.4 | 46% | 0.462 | 72% | 0.719 | S | S | . | * | trans | -70.2 | -177.7 | -179.9 | 53 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 46 | T | 27.2 | Very low | 31.4 | Very low | 112 Ų | 112 | 120.4 Ų | 120.4 | 69% | 0.687 | 71% | 0.712 | S | S | * | * | cis | -153.9 | 178.2 | 30.5 | 57.5 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 47 | S | 27.5 | Very low | 31.5 | Very low | 91 Ų | 91 | 116.6 Ų | 116.6 | 64% | 0.636 | 70% | 0.697 | S | S | * | * | trans | -75 | 177.4 | 154.2 | -139.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 48 | P | 46.1 | Very low | 31.6 | Very low | 115 Ų | 115 | 116.6 Ų | 116.6 | 75% | 0.747 | 69% | 0.688 | S | S | * | * | -147.8 | -169.1 | 56 | 42.3 | -20.5 | 0 | 0 | 0 | 116.8 | |||||
| 49 | D | 25.6 | Very low | 30.2 | Very low | 147 Ų | 147 | 120.3 Ų | 120.3 | 79% | 0.786 | 69% | 0.688 | S | S | * | * | trans | -69.7 | 162.2 | -178.2 | -41.6 | -103.5 | 0 | 0 | 0 | 116.1 | ||||
| 50 | S | 31.5 | Very low | 29.5 | Very low | 97 Ų | 97 | 121.2 Ų | 121.2 | 68% | 0.678 | 68% | 0.681 | S | S | * | * | 169 | 161.3 | 91.9 | -153.7 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 51 | D | 29.1 | Very low | 29.3 | Very low | 150 Ų | 150 | 114.8 Ų | 114.8 | 80% | 0.802 | 67% | 0.674 | S | S | * | * | trans | 66.9 | 145.8 | 164.1 | -54.2 | -7.7 | 0 | 0 | 0 | 116.7 | ||||
| 52 | G | 26.3 | Very low | 29.2 | Very low | 70 Ų | 70 | 114.5 Ų | 114.5 | 72% | 0.722 | 68% | 0.682 | S | S | * | * | cis | 110.2 | 132.4 | 18.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 53 | I | 28.3 | Very low | 29.1 | Very low | 163 Ų | 163 | 115.8 Ų | 115.8 | 84% | 0.836 | 70% | 0.695 | S | S | * | * | cis | -158.2 | 155.2 | 22 | -22.8 | 173.2 | 0 | 0 | 0 | 110 | ||||
| 54 | S | 26.7 | Very low | 29.3 | Very low | 99 Ų | 99 | 112.4 Ų | 112.4 | 69% | 0.692 | 69% | 0.691 | S | S | * | * | trans | 64.9 | 131.9 | 162.2 | -56 | 0 | 0 | 0 | 0 | 118 | ||||
| 55 | S | 27.2 | Very low | 30.2 | Very low | 81 Ų | 81 | 111.5 Ų | 111.5 | 57% | 0.566 | 69% | 0.694 | S | S | * | * | cis | 80.6 | 142.6 | 33.2 | -54 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 56 | L | 31.5 | Very low | 30.4 | Very low | 105 Ų | 105 | 118.1 Ų | 118.1 | 55% | 0.55 | 71% | 0.71 | S | S | . | * | trans | 77.8 | 139.2 | 162.4 | -65.6 | 139.5 | 0 | 0 | 0 | 117.6 | T715 S716 | L56-T715 VanDerWaalsContact CD2-C 3.41Å; L56-T715 VanDerWaalsContact CD2-O 3.26Å; L56-T715 WeakPolarHBondContact CD2-O 3.48Å; L56-S716 WeakPolarHBondContact CD2-O 3.3Å | ||
| 57 | S | 29.2 | Very low | 30.6 | Very low | 67 Ų | 67 | 118.9 Ų | 118.9 | 47% | 0.469 | 71% | 0.709 | S | S | . | * | cis | -158.3 | 173.3 | -10.1 | -150.7 | 0 | 0 | 0 | 0 | 113.7 | S716 | S57-S716 PolarHBondContact OG-N 3.16Å; S57-S716 PolarHBondContact OG-O 3.41Å | ||
| 58 | E | 31.8 | Very low | 30.5 | Very low | 118 Ų | 118 | 121.2 Ų | 121.2 | 55% | 0.551 | 71% | 0.714 | S | S | * | * | trans | -11 | 142.6 | 156.9 | -57.7 | 154.8 | 165.8 | 0 | 0 | 117.1 | S716 T717 | E58-S716 WeakPolarHBondContact OE1-CA 3.47Å; E58-S716 VanDerWaalsContact OE2-C 3.24Å; E58-T717 PolarHBondContact OE2-N 3.37Å | ||
| 59 | R | 32.8 | Very low | 29.8 | Very low | 191 Ų | 191 | 121.7 Ų | 121.7 | 72% | 0.721 | 72% | 0.715 | S | S | * | * | -164.5 | 163.7 | 63.9 | -88.2 | -176.6 | 177.4 | -117.6 | 4.3 | 115.6 | |||||
| 60 | E | 28.9 | Very low | 29.9 | Very low | 152 Ų | 152 | 121.2 Ų | 121.2 | 71% | 0.71 | 71% | 0.712 | S | S | * | * | trans | 5.2 | 152.6 | 135.4 | -54 | 163.1 | 126.3 | 0 | 0 | 119.7 | ||||
| 61 | A | 28.1 | Very low | 29.9 | Very low | 81 Ų | 81 | 124.9 Ų | 124.9 | 67% | 0.669 | 72% | 0.718 | S | S | * | * | cis | -174 | 165.6 | -16.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 62 | S | 26.4 | Very low | 29.7 | Very low | 125 Ų | 125 | 123.1 Ų | 123.1 | 87% | 0.874 | 72% | 0.717 | S | S | * | * | trans | 45.1 | 111.1 | 157.1 | 60.1 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 63 | G | 27.9 | Very low | 29.8 | Very low | 87 Ų | 87 | 127.9 Ų | 127.9 | 90% | 0.897 | 73% | 0.725 | S | S | * | * | trans | -174.3 | 105.4 | 166 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 64 | S | 31.3 | Very low | 29.7 | Very low | 108 Ų | 108 | 127.8 Ų | 127.8 | 76% | 0.755 | 73% | 0.726 | S | S | * | * | trans | -136 | 127.4 | 161.4 | 180 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 65 | P | 46.3 | Very low | 29.8 | Very low | 117 Ų | 117 | 130.1 Ų | 130.1 | 76% | 0.76 | 73% | 0.726 | S | S | * | * | -146.9 | 151.7 | 91.6 | 35.9 | -17.8 | 0 | 0 | 0 | 116.8 | |||||
| 66 | Y | 29.9 | Very low | 29.9 | Very low | 205 Ų | 205 | 133.9 Ų | 133.9 | 80% | 0.804 | 73% | 0.734 | S | S | * | * | 22.6 | 142.7 | 112.7 | -93.5 | -58.9 | 0 | 0 | 0 | 119.1 | |||||
| 67 | I | 30.9 | Very low | 29.6 | Very low | 128 Ų | 128 | 134.6 Ų | 134.6 | 66% | 0.656 | 75% | 0.748 | S | S | * | * | cis | -153.2 | 170.8 | 14.5 | -30.1 | 166.3 | 0 | 0 | 0 | 109.9 | ||||
| 68 | N | 26 | Very low | 29.6 | Very low | 140 Ų | 140 | 136 Ų | 136 | 75% | 0.749 | 76% | 0.757 | S | S | * | * | trans | 75.1 | 154.6 | 152.7 | -75.7 | -5.8 | 0 | 0 | 0 | 118.5 | ||||
| 69 | T | 30 | Very low | 29.4 | Very low | 125 Ų | 125 | 137.2 Ų | 137.2 | 77% | 0.767 | 77% | 0.773 | S | S | * | * | cis | -128.7 | 159 | 9.2 | 51 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 70 | D | 28.9 | Very low | 29.2 | Very low | 136 Ų | 136 | 131 Ų | 131 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | -73.2 | -173.7 | 157.6 | -78.8 | -64.9 | 0 | 0 | 0 | 113 | ||||
| 71 | H | 29.8 | Very low | 29.3 | Very low | 174 Ų | 174 | 131.4 Ų | 131.4 | 81% | 0.806 | 78% | 0.775 | S | S | * | * | trans | 84.9 | 142.8 | 172.9 | -56.8 | -78 | 0 | 0 | 0 | 116.8 | ||||
| 72 | C | 26.1 | Very low | 29.5 | Very low | 114 Ų | 114 | 131.3 Ų | 131.3 | 77% | 0.77 | 77% | 0.769 | S | S | * | * | cis | -147.6 | 168.4 | -1.9 | -133.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 73 | L | 27.7 | Very low | 29.8 | Very low | 169 Ų | 169 | 133.1 Ų | 133.1 | 89% | 0.885 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 158.9 | 163 | -79.4 | 170.7 | 0 | 0 | 0 | 111 | ||
| 74 | N | 26.4 | Very low | 29.9 | Very low | 161 Ų | 161 | 133.8 Ų | 133.8 | 86% | 0.861 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -91.1 | 121 | -179.1 | -171 | 49.1 | 0 | 0 | 0 | 110.5 | ||
| 75 | E | 28.5 | Very low | 29.8 | Very low | 148 Ų | 148 | 137.8 Ų | 137.8 | 69% | 0.692 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -98.2 | 135.1 | 169.5 | -68.3 | -153.5 | 143.6 | 0 | 0 | 111.7 | ||
| 76 | H | 29.2 | Very low | 28.9 | Very low | 161 Ų | 161 | 137.8 Ų | 137.8 | 75% | 0.745 | 75% | 0.753 | S | S | * | * | 160.9 | 137.4 | 107.3 | -80.5 | -46.1 | 0 | 0 | 0 | 111.2 | |||||
| 77 | S | 26.5 | Very low | 28.8 | Very low | 120 Ų | 120 | 133.4 Ų | 133.4 | 84% | 0.839 | 75% | 0.752 | S | S | * | * | trans | 63.5 | 143.3 | 140.3 | -167.2 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 78 | S | 27.4 | Very low | 28.7 | Very low | 95 Ų | 95 | 131.2 Ų | 131.2 | 66% | 0.664 | 75% | 0.753 | S | S | * | * | cis | -173.4 | 164.8 | -23.1 | -174.8 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 79 | V | 28.6 | Very low | 28.8 | Very low | 145 Ų | 145 | 132 Ų | 132 | 88% | 0.879 | 75% | 0.752 | S | S | * | * | trans | 67 | 130.6 | 172.7 | -165 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 80 | G | 28.7 | Very low | 28.8 | Very low | 60 Ų | 60 | 133.2 Ų | 133.2 | 62% | 0.619 | 75% | 0.749 | S | S | * | * | cis | 172.4 | 170.9 | -5.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 81 | N | 30.5 | Very low | 28.8 | Very low | 160 Ų | 160 | 132.2 Ų | 132.2 | 86% | 0.856 | 74% | 0.744 | S | S | * | * | trans | 19.8 | 138.9 | 158.8 | -64.4 | 18.6 | 0 | 0 | 0 | 120.7 | ||||
| 82 | S | 33.1 | Very low | 28.9 | Very low | 79 Ų | 79 | 130.9 Ų | 130.9 | 55% | 0.552 | 74% | 0.742 | S | S | * | * | cis | -178.6 | 158.5 | 1 | -105.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 83 | H | 32.3 | Very low | 29.1 | Very low | 163 Ų | 163 | 131.7 Ų | 131.7 | 76% | 0.755 | 74% | 0.738 | S | S | * | * | trans | 63.4 | 158.9 | 148.3 | -68.6 | -49.2 | 0 | 0 | 0 | 120.7 | ||||
| 84 | T | 29.8 | Very low | 29.1 | Very low | 101 Ų | 101 | 129.5 Ų | 129.5 | 62% | 0.62 | 73% | 0.732 | S | S | * | * | -171.4 | 143.5 | -54.1 | 18.1 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 85 | F | 28.9 | Very low | 29.1 | Very low | 193 Ų | 193 | 127.7 Ų | 127.7 | 85% | 0.846 | 73% | 0.726 | S | S | * | * | trans | 59.4 | 173.9 | 162.9 | -81.8 | -77.8 | 0 | 0 | 0 | 115.8 | ||||
| 86 | T | 28 | Very low | 29 | Very low | 116 Ų | 116 | 126.1 Ų | 126.1 | 71% | 0.712 | 73% | 0.726 | S | S | * | * | cis | -150.1 | 144.6 | 1.3 | -9.7 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 87 | S | 28.1 | Very low | 29 | Very low | 113 Ų | 113 | 125 Ų | 125 | 79% | 0.79 | 73% | 0.731 | S | S | * | * | 63.3 | 156.8 | 126.1 | -152.6 | 0 | 0 | 0 | 0 | 124.3 | |||||
| 88 | A | 28.8 | Very low | 29.2 | Very low | 83 Ų | 83 | 124.4 Ų | 124.4 | 69% | 0.686 | 73% | 0.727 | S | S | * | * | trans | 72 | 152.6 | 165.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 89 | Q | 28.6 | Very low | 29.2 | Very low | 156 Ų | 156 | 127.4 Ų | 127.4 | 73% | 0.729 | 74% | 0.736 | S | S | * | * | cis | -151.9 | 145.2 | 11.5 | -155 | 169.1 | -45.1 | 0 | 0 | 111.8 | ||||
| 90 | Q | 28.5 | Very low | 29.3 | Very low | 150 Ų | 150 | 127.5 Ų | 127.5 | 70% | 0.701 | 73% | 0.728 | S | S | * | * | trans | 31.4 | 143.6 | 144.3 | -61.2 | 178.4 | -47.1 | 0 | 0 | 121 | ||||
| 91 | D | 29.1 | Very low | 29.3 | Very low | 115 Ų | 115 | 130.8 Ų | 130.8 | 62% | 0.615 | 73% | 0.732 | S | S | * | * | cis | -158.6 | -153.3 | -3.8 | -127.4 | -66.1 | 0 | 0 | 0 | 106.6 | ||||
| 92 | L | 32.8 | Very low | 29.2 | Very low | 147 Ų | 147 | 131.8 Ų | 131.8 | 77% | 0.77 | 73% | 0.731 | S | S | * | * | cis | -135.3 | 141.2 | 9.3 | -82.3 | 81.1 | 0 | 0 | 0 | 110.9 | ||||
| 93 | L | 29 | Very low | 29.1 | Very low | 130 Ų | 130 | 133.4 Ų | 133.4 | 68% | 0.681 | 74% | 0.738 | S | S | * | * | trans | 49.2 | 126.3 | 143.5 | -55.2 | 176.1 | 0 | 0 | 0 | 120.2 | ||||
| 94 | T | 28.1 | Very low | 28.9 | Very low | 123 Ų | 123 | 134.3 Ų | 134.3 | 76% | 0.755 | 74% | 0.74 | S | S | * | * | cis | 76.8 | 129 | 48 | -61.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 95 | V | 26.5 | Very low | 28.8 | Very low | 124 Ų | 124 | 135.4 Ų | 135.4 | 75% | 0.752 | 74% | 0.741 | S | S | * | * | cis | -166 | 159.6 | -22.5 | 100.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 96 | V | 27.6 | Very low | 29 | Very low | 114 Ų | 114 | 134.3 Ų | 134.3 | 69% | 0.691 | 74% | 0.744 | S | S | * | * | trans | -6.8 | 129.5 | 160.5 | -177.9 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 97 | T | 28.6 | Very low | 29.2 | Very low | 138 Ų | 138 | 133 Ų | 133 | 85% | 0.847 | 74% | 0.744 | S | S | * | * | -167.1 | 148 | 121.2 | 13.8 | 0 | 0 | 0 | 0 | 116 | |||||
| 98 | S | 30 | Very low | 29.7 | Very low | 108 Ų | 108 | 133.2 Ų | 133.2 | 76% | 0.755 | 74% | 0.743 | S | S | * | * | trans | -55.4 | 155.3 | 179.4 | -32.6 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 99 | N | 27.9 | Very low | 29.8 | Very low | 157 Ų | 157 | 135.6 Ų | 135.6 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | -165.4 | 179.6 | 106.7 | -152 | 1.1 | 0 | 0 | 0 | 112.2 | |||||
| 100 | M | 29.5 | Very low | 29.8 | Very low | 147 Ų | 147 | 135.2 Ų | 135.2 | 72% | 0.724 | 75% | 0.751 | S | S | * | * | trans | -106.9 | 167.7 | -168.4 | -55.1 | 172.5 | 60.5 | 0 | 0 | 114.9 | ||||
| 101 | N | 29.4 | Very low | 29.7 | Very low | 129 Ų | 129 | 139.8 Ų | 139.8 | 69% | 0.69 | 76% | 0.761 | S | S | * | * | trans | 67.6 | 124.8 | 161.2 | -59.1 | -0.4 | 0 | 0 | 0 | 116.4 | ||||
| 102 | E | 28.2 | Very low | 29.6 | Very low | 181 Ų | 181 | 138.8 Ų | 138.8 | 85% | 0.846 | 76% | 0.763 | S | S | * | * | 70 | 96 | 61.6 | -71 | -156.3 | 159.1 | 0 | 0 | 114.8 | |||||
| 103 | T | 31.4 | Very low | 30.5 | Very low | 113 Ų | 113 | 136.7 Ų | 136.7 | 69% | 0.693 | 76% | 0.758 | S | S | * | * | trans | -165.3 | 147.9 | 152.3 | -8 | 0 | 0 | 0 | 0 | 104.3 | ||||
| 104 | F | 27.5 | Very low | 30.4 | Very low | 183 Ų | 183 | 137.4 Ų | 137.4 | 80% | 0.803 | 76% | 0.763 | S | S | * | * | cis | -141.9 | -170.9 | 31 | -70.2 | -86.8 | 0 | 0 | 0 | 108.8 | ||||
| 105 | I | 28.9 | Very low | 30.3 | Very low | 124 Ų | 124 | 136.3 Ų | 136.3 | 64% | 0.636 | 76% | 0.76 | S | S | * | * | cis | -148 | 139.3 | 25.2 | -64.4 | 161.8 | 0 | 0 | 0 | 110.8 | A107 | I105-A107 HydrophobicContact CG2-CB 4.43Š| ||
| 106 | N | 32.8 | Very low | 30.4 | Very low | 170 Ų | 170 | 139 Ų | 139 | 91% | 0.909 | 76% | 0.764 | S | S | * | * | trans | -104 | 142.4 | 150 | -86.8 | -20.7 | 0 | 0 | 0 | 109.1 | ||||
| 107 | A | 31.6 | Very low | 30.4 | Very low | 87 Ų | 87 | 138.8 Ų | 138.8 | 72% | 0.719 | 76% | 0.76 | S | S | * | * | trans | -126.6 | 156.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | I105 | I105-A107 HydrophobicContact CG2-CB 4.43Š| ||
| 108 | P | 39.5 | Very low | 30.4 | Very low | 118 Ų | 118 | 140.2 Ų | 140.2 | 77% | 0.766 | 75% | 0.754 | S | S | * | * | -147.3 | 155.9 | 56.1 | 37.5 | -16.4 | 0 | 0 | 0 | 119.3 | |||||
| 109 | V | 30.5 | Very low | 30.2 | Very low | 133 Ų | 133 | 140.1 Ų | 140.1 | 81% | 0.806 | 75% | 0.753 | S | S | * | * | trans | 41.7 | 90.8 | 138.8 | -167.4 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 110 | I | 29.3 | Very low | 30.2 | Very low | 149 Ų | 149 | 139.7 Ų | 139.7 | 76% | 0.764 | 75% | 0.75 | S | S | * | * | 14 | 125.8 | 127.4 | -53.4 | 171 | 0 | 0 | 0 | 119.5 | |||||
| 111 | R | 25.9 | Very low | 30 | Very low | 246 Ų | 246 | 137.1 Ų | 137.1 | 93% | 0.928 | 75% | 0.747 | S | S | * | * | trans | -148.6 | 130.2 | 131 | -172 | 172.8 | -69.8 | 173.3 | -0.3 | 110.8 | ||||
| 112 | S | 26.7 | Very low | 29.9 | Very low | 94 Ų | 94 | 139 Ų | 139 | 66% | 0.657 | 76% | 0.756 | S | S | * | * | trans | -103.3 | -176.4 | -178.6 | -26.5 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 113 | P | 51.1 | Low | 29.9 | Very low | 102 Ų | 102 | 134 Ų | 134 | 66% | 0.662 | 75% | 0.745 | S | S | * | * | cis | -129.2 | 169.9 | -19.1 | 37.5 | -21.6 | 0 | 0 | 0 | 113.6 | ||||
| 114 | D | 26.8 | Very low | 29.8 | Very low | 146 Ų | 146 | 136.5 Ų | 136.5 | 78% | 0.781 | 75% | 0.749 | S | S | * | * | 163.2 | 152.5 | 112.2 | -94.9 | -29.9 | 0 | 0 | 0 | 116.1 | |||||
| 115 | S | 27.4 | Very low | 29.9 | Very low | 99 Ų | 99 | 135.8 Ų | 135.8 | 69% | 0.692 | 75% | 0.748 | S | S | * | * | trans | 39 | 121.5 | 156.1 | 66.3 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 116 | Q | 27.8 | Very low | 29.8 | Very low | 180 Ų | 180 | 133.1 Ų | 133.1 | 84% | 0.841 | 75% | 0.751 | S | S | * | * | 71.9 | 109.6 | 129.3 | -72.3 | -174.2 | -26.5 | 0 | 0 | 123.2 | |||||
| 117 | D | 27.6 | Very low | 29.6 | Very low | 111 Ų | 111 | 133.5 Ų | 133.5 | 59% | 0.594 | 75% | 0.747 | S | S | * | * | 82.2 | 140.9 | 107.8 | -150.6 | 12.1 | 0 | 0 | 0 | 121.6 | |||||
| 118 | K | 29.3 | Very low | 29.5 | Very low | 167 Ų | 167 | 136.6 Ų | 136.6 | 73% | 0.726 | 76% | 0.757 | S | S | * | * | trans | 48 | 111.6 | 163.5 | -74.9 | 144 | -162.9 | 154.3 | 0 | 123 | ||||
| 119 | S | 25.3 | Very low | 29.1 | Very low | 106 Ų | 106 | 134.4 Ų | 134.4 | 74% | 0.741 | 76% | 0.756 | S | S | * | * | 72.4 | 151.9 | 109 | -136.3 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 120 | L | 27.7 | Very low | 30.4 | Very low | 148 Ų | 148 | 134 Ų | 134 | 78% | 0.775 | 76% | 0.756 | S | S | * | * | trans | 70.1 | 101.1 | 156.2 | -70.5 | 169.2 | 0 | 0 | 0 | 122 | ||||
| 121 | S | 24.8 | Very low | 30.4 | Very low | 94 Ų | 94 | 134.8 Ų | 134.8 | 66% | 0.657 | 76% | 0.757 | S | S | * | * | 69.9 | 134.1 | 115.4 | 76.6 | 0 | 0 | 0 | 0 | 124.5 | |||||
| 122 | L | 27.6 | Very low | 30.7 | Very low | 168 Ų | 168 | 128.6 Ų | 128.6 | 88% | 0.88 | 75% | 0.746 | S | S | * | * | trans | 86.4 | 131 | 133.9 | -127.7 | 74.9 | 0 | 0 | 0 | 122.6 | ||||
| 123 | A | 28.1 | Very low | 30.8 | Very low | 75 Ų | 75 | 130.8 Ų | 130.8 | 62% | 0.62 | 75% | 0.751 | S | S | * | * | trans | 80.9 | 115.5 | 135.7 | 0 | 0 | 0 | 0 | 0 | 124.3 | ||||
| 124 | H | 30.3 | Very low | 29.8 | Very low | 166 Ų | 166 | 134.3 Ų | 134.3 | 77% | 0.769 | 76% | 0.758 | S | S | * | * | 84 | 119.8 | 120.9 | -90.5 | -89.1 | 0 | 0 | 0 | 125.9 | |||||
| 125 | H | 27.8 | Very low | 29.8 | Very low | 169 Ų | 169 | 131.3 Ų | 131.3 | 78% | 0.782 | 75% | 0.749 | S | S | * | * | 90.3 | 159.2 | 125.3 | -114.2 | 14.4 | 0 | 0 | 0 | 124.1 | |||||
| 126 | G | 27.1 | Very low | 29.8 | Very low | 68 Ų | 68 | 131.5 Ų | 131.5 | 70% | 0.701 | 75% | 0.75 | S | S | * | * | trans | 84.9 | 112.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 127 | Q | 29 | Very low | 29.8 | Very low | 178 Ų | 178 | 128.2 Ų | 128.2 | 83% | 0.832 | 75% | 0.747 | S | S | * | * | cis | 75.4 | 102.6 | 15 | -159.3 | -168.2 | 97.3 | 0 | 0 | 117.1 | ||||
| 128 | T | 30.5 | Very low | 29.8 | Very low | 152 Ų | 152 | 131.9 Ų | 131.9 | 93% | 0.933 | 76% | 0.758 | S | S | * | * | trans | -155.2 | 161.5 | 155.2 | 17.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 129 | G | 29.8 | Very low | 29.8 | Very low | 72 Ų | 72 | 133.4 Ų | 133.4 | 74% | 0.742 | 77% | 0.767 | S | S | * | * | trans | -106 | -159.4 | -165.7 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 130 | P | 58.9 | Low | 29.9 | Very low | 123 Ų | 123 | 131.5 Ų | 131.5 | 80% | 0.799 | 76% | 0.764 | S | S | * | * | trans | -104.8 | -177.4 | -164.9 | 42.1 | -36.9 | 0 | 0 | 0 | 114.3 | ||||
| 131 | E | 28.7 | Very low | 30.1 | Very low | 166 Ų | 166 | 132.8 Ų | 132.8 | 78% | 0.776 | 77% | 0.766 | S | S | * | * | -178.7 | 141.2 | 121 | -102.5 | 177.1 | -164.7 | 0 | 0 | 114.4 | |||||
| 132 | T | 31.6 | Very low | 30.3 | Very low | 116 Ų | 116 | 135.8 Ų | 135.8 | 71% | 0.712 | 77% | 0.77 | S | S | * | * | trans | 56.1 | 153.9 | 147.2 | 59.2 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 133 | D | 30.6 | Very low | 30.5 | Very low | 141 Ų | 141 | 134 Ų | 134 | 75% | 0.754 | 76% | 0.761 | S | S | * | * | cis | -172.9 | 172.2 | -36.1 | -119.8 | -49.1 | 0 | 0 | 0 | 110.3 | ||||
| 134 | E | 28.6 | Very low | 30.6 | Very low | 175 Ų | 175 | 136.6 Ų | 136.6 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | trans | 61.2 | 179.7 | 160.3 | -70.6 | -103.4 | 96.5 | 0 | 0 | 118.8 | ||||
| 135 | S | 28 | Very low | 30.7 | Very low | 84 Ų | 84 | 136.7 Ų | 136.7 | 59% | 0.587 | 76% | 0.763 | S | S | * | * | -175.5 | 147.9 | -53.2 | -171 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 136 | S | 26.6 | Very low | 30.7 | Very low | 103 Ų | 103 | 136.3 Ų | 136.3 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | cis | -169.9 | 165.4 | -34.7 | 55.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 137 | S | 27.1 | Very low | 30.8 | Very low | 110 Ų | 110 | 142 Ų | 142 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | trans | 86.3 | 161.5 | 151.2 | -152.1 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 138 | K | 28.6 | Very low | 30.7 | Very low | 189 Ų | 189 | 142.3 Ų | 142.3 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | trans | 83 | 97.8 | 162.5 | -66.6 | -176.2 | 177.8 | 177.1 | 0 | 124.1 | ||||
| 139 | H | 29.3 | Very low | 30.6 | Very low | 199 Ų | 199 | 141.8 Ų | 141.8 | 92% | 0.921 | 77% | 0.766 | S | S | * | * | 36.7 | 132.1 | 108.8 | -128.7 | -48 | 0 | 0 | 0 | 123.8 | |||||
| 140 | G | 28 | Very low | 30.5 | Very low | 66 Ų | 66 | 142.5 Ų | 142.5 | 68% | 0.68 | 77% | 0.765 | S | S | * | * | trans | 105.2 | 164.5 | 150.7 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 141 | E | 31.9 | Very low | 29.2 | Very low | 175 Ų | 175 | 141.9 Ų | 141.9 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | cis | -172 | 153.8 | -29.2 | -174.7 | 160.2 | -152.9 | 0 | 0 | 108.3 | ||||
| 142 | Q | 28.6 | Very low | 29.1 | Very low | 157 Ų | 157 | 141.7 Ų | 141.7 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | trans | 63 | 131.9 | 164.9 | -86.2 | -174.6 | -77.7 | 0 | 0 | 124 | ||||
| 143 | D | 30.7 | Very low | 28.9 | Very low | 129 Ų | 129 | 141.1 Ų | 141.1 | 69% | 0.69 | 78% | 0.775 | S | S | * | * | 66.1 | 111.6 | 126.8 | -60.2 | -0.3 | 0 | 0 | 0 | 125.6 | |||||
| 144 | D | 31.9 | Very low | 28.9 | Very low | 130 Ų | 130 | 139.3 Ų | 139.3 | 70% | 0.695 | 78% | 0.78 | S | S | * | * | 88.2 | 145 | 116.6 | -149.3 | 30.7 | 0 | 0 | 0 | 122.9 | |||||
| 145 | K | 31.6 | Very low | 29 | Very low | 169 Ų | 169 | 135 Ų | 135 | 74% | 0.735 | 78% | 0.782 | S | S | * | * | trans | 96.3 | 155.2 | 162.1 | -60.6 | 172.1 | -175.6 | 62.8 | 0 | 121.9 | ||||
| 146 | N | 28.4 | Very low | 29.1 | Very low | 160 Ų | 160 | 134.7 Ų | 134.7 | 86% | 0.856 | 79% | 0.792 | S | S | * | * | trans | -111.6 | -166.2 | -172.1 | -64.7 | -47.9 | 0 | 0 | 0 | 112 | ||||
| 147 | E | 28.1 | Very low | 29.1 | Very low | 189 Ų | 189 | 139.1 Ų | 139.1 | 88% | 0.883 | 80% | 0.802 | S | S | * | * | trans | 77.1 | 104.7 | -177.7 | -55.1 | -173.9 | 158.9 | 0 | 0 | 112.3 | ||||
| 148 | E | 27.5 | Very low | 29.2 | Very low | 183 Ų | 183 | 137.4 Ų | 137.4 | 86% | 0.855 | 80% | 0.801 | S | S | * | * | cis | 94.4 | 149.5 | 40.1 | -151.7 | -161.9 | 148.1 | 0 | 0 | 113.6 | ||||
| 149 | I | 28.9 | Very low | 29.2 | Very low | 142 Ų | 142 | 137.2 Ų | 137.2 | 73% | 0.728 | 80% | 0.8 | S | S | * | * | trans | 85.9 | 76 | 170.4 | -45.4 | -174.8 | 0 | 0 | 0 | 117.3 | ||||
| 150 | A | 27.3 | Very low | 29.1 | Very low | 86 Ų | 86 | 134.7 Ų | 134.7 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | 49.3 | 129 | 125.1 | 0 | 0 | 0 | 0 | 0 | 122.6 | |||||
| 151 | S | 30.6 | Very low | 28.9 | Very low | 111 Ų | 111 | 136.5 Ų | 136.5 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | -174 | 121.3 | 102 | -79.3 | 0 | 0 | 0 | 0 | 115.7 | |||||
| 152 | N | 28 | Very low | 28.6 | Very low | 161 Ų | 161 | 133.1 Ų | 133.1 | 86% | 0.861 | 79% | 0.79 | S | S | * | * | trans | 52.7 | 124.4 | 147.6 | -66.2 | -23.4 | 0 | 0 | 0 | 124.3 | ||||
| 153 | A | 27.5 | Very low | 28.5 | Very low | 104 Ų | 104 | 131.2 Ų | 131.2 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | trans | 85.2 | 94.5 | 133.5 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 154 | A | 29.9 | Very low | 28.2 | Very low | 103 Ų | 103 | 132 Ų | 132 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | -174.2 | 131.2 | 122.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 155 | G | 31.2 | Very low | 28 | Very low | 84 Ų | 84 | 132.3 Ų | 132.3 | 87% | 0.866 | 81% | 0.806 | S | S | * | * | trans | 73.6 | 142.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 156 | G | 29.6 | Very low | 27.6 | Very low | 78 Ų | 78 | 128.9 Ų | 128.9 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | cis | 107.2 | 114.2 | 7.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 157 | E | 27.1 | Very low | 27.5 | Very low | 197 Ų | 197 | 127.3 Ų | 127.3 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | cis | -136.8 | 166.7 | 3.4 | -61.7 | -172 | 118.4 | 0 | 0 | 108.6 | ||||
| 158 | G | 29.2 | Very low | 27.5 | Very low | 73 Ų | 73 | 124.5 Ų | 124.5 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | 93.2 | 62.6 | 50.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 159 | K | 27.7 | Very low | 27.5 | Very low | 186 Ų | 186 | 119.2 Ų | 119.2 | 81% | 0.809 | 80% | 0.797 | S | S | * | * | 82.1 | 101.7 | 84.3 | -172 | -175.1 | 178.3 | -179.3 | 0 | 115.2 | |||||
| 160 | L | 27.1 | Very low | 27.5 | Very low | 145 Ų | 145 | 123 Ų | 123 | 76% | 0.759 | 80% | 0.804 | S | S | * | * | trans | 65.7 | 132.9 | 147.2 | -61.3 | 174.5 | 0 | 0 | 0 | 122.3 | ||||
| 161 | S | 25 | Very low | 27.7 | Very low | 104 Ų | 104 | 124.4 Ų | 124.4 | 73% | 0.727 | 81% | 0.808 | S | S | * | * | trans | 67.4 | 121.2 | 131.3 | 68.4 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 162 | S | 25.6 | Very low | 27.7 | Very low | 104 Ų | 104 | 120.8 Ų | 120.8 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | 60.8 | 122.3 | 123.7 | -171.1 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 163 | S | 26.5 | Very low | 28.1 | Very low | 118 Ų | 118 | 119.4 Ų | 119.4 | 83% | 0.825 | 78% | 0.781 | S | S | * | * | -166.2 | 144.8 | 123.5 | -77.7 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 164 | D | 23.9 | Very low | 28.5 | Very low | 144 Ų | 144 | 117.6 Ų | 117.6 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | -79.2 | 152.1 | 174.1 | -57.7 | -86 | 0 | 0 | 0 | 112.6 | ||||
| 165 | T | 27.1 | Very low | 28.7 | Very low | 137 Ų | 137 | 119.1 Ų | 119.1 | 84% | 0.84 | 76% | 0.762 | S | S | * | * | -174.6 | 110.9 | 126.5 | 18 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 166 | S | 23.8 | Very low | 28.7 | Very low | 98 Ų | 98 | 121.5 Ų | 121.5 | 69% | 0.685 | 75% | 0.754 | S | S | * | * | trans | 16.7 | 117.2 | 143.4 | 58.7 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 167 | C | 25.8 | Very low | 28.7 | Very low | 127 Ų | 127 | 125 Ų | 125 | 86% | 0.858 | 75% | 0.753 | S | S | * | * | 51.2 | 126.8 | 121 | -54.1 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 168 | C | 27.7 | Very low | 28.9 | Very low | 130 Ų | 130 | 123.3 Ų | 123.3 | 88% | 0.878 | 75% | 0.75 | S | S | * | * | -171 | 160.9 | 101.7 | -128.9 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 169 | G | 27.1 | Very low | 28.8 | Very low | 71 Ų | 71 | 125.6 Ų | 125.6 | 73% | 0.732 | 75% | 0.754 | S | S | * | * | trans | 88.8 | 93.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 170 | Y | 29.8 | Very low | 29.2 | Very low | 223 Ų | 223 | 122.5 Ų | 122.5 | 88% | 0.875 | 76% | 0.756 | S | S | * | * | cis | 97.7 | 136.3 | 15.6 | -123.6 | -75.1 | 0 | 0 | 0 | 117.1 | ||||
| 171 | S | 31.8 | Very low | 29.5 | Very low | 114 Ų | 114 | 119.4 Ų | 119.4 | 80% | 0.797 | 76% | 0.759 | S | S | * | * | trans | 77.5 | 134.7 | 176.4 | -153 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 172 | G | 31.4 | Very low | 29.7 | Very low | 35 Ų | 35 | 123.7 Ų | 123.7 | 36% | 0.361 | 77% | 0.767 | S | S | . | * | cis | -160.9 | 145.4 | -4.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 173 | N | 35.7 | Very low | 30.1 | Very low | 132 Ų | 132 | 126.4 Ų | 126.4 | 71% | 0.706 | 77% | 0.771 | S | S | * | * | 72.9 | 138.8 | 76.7 | -66.2 | 2.5 | 0 | 0 | 0 | 112.3 | H175 | N173-H175 WeakPolarHBondContact CB-NE2 3.15Å; N173-H175 VanDerWaalsContact CG-NE2 3.28Å; N173-H175 PolarHBondContact ND2-NE2 3.16Å; N173-H175 VanDerWaalsContact ND2-NE2 3.14Å | |||
| 174 | G | 36.4 | Very low | 30.3 | Very low | 67 Ų | 67 | 126.6 Ų | 126.6 | 69% | 0.691 | 77% | 0.766 | S | S | * | * | cis | 155.1 | -176 | 10.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 175 | H | 32.7 | Very low | 30.6 | Very low | 135 Ų | 135 | 125.3 Ų | 125.3 | 63% | 0.625 | 76% | 0.764 | S | S | * | * | cis | -165.8 | 164.4 | -1.3 | -72.6 | -60.3 | 0 | 0 | 0 | 106.3 | N173 | N173-H175 WeakPolarHBondContact CB-NE2 3.15Å; N173-H175 VanDerWaalsContact CG-NE2 3.28Å; N173-H175 PolarHBondContact ND2-NE2 3.16Å; N173-H175 VanDerWaalsContact ND2-NE2 3.14Å | ||
| 176 | I | 32.5 | Very low | 30.7 | Very low | 134 Ų | 134 | 129.5 Ų | 129.5 | 69% | 0.687 | 76% | 0.764 | S | S | * | * | cis | -166.8 | -175 | -16.7 | -100.1 | 168.6 | 0 | 0 | 0 | 104.4 | ||||
| 177 | L | 29.7 | Very low | 31 | Very low | 150 Ų | 150 | 129.3 Ų | 129.3 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | trans | 106.2 | 127.9 | 163 | -57.8 | 175.6 | 0 | 0 | 0 | 115.3 | ||||
| 178 | L | 30 | Very low | 31.2 | Very low | 163 Ų | 163 | 132.4 Ų | 132.4 | 85% | 0.853 | 76% | 0.764 | S | S | * | * | cis | -129.6 | 159.5 | 0.4 | -90.3 | 127.1 | 0 | 0 | 0 | 111.8 | ||||
| 179 | S | 28.3 | Very low | 31.2 | Very low | 120 Ų | 120 | 132.2 Ų | 132.2 | 84% | 0.839 | 76% | 0.763 | S | S | * | * | trans | -97.3 | 150.9 | -175.7 | -164.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 180 | S | 34.7 | Very low | 31.2 | Very low | 122 Ų | 122 | 135.1 Ų | 135.1 | 85% | 0.853 | 77% | 0.772 | S | S | * | * | trans | -65.2 | 157.6 | 163.3 | -54.3 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 181 | G | 33.3 | Very low | 31.2 | Very low | 80 Ų | 80 | 127.6 Ų | 127.6 | 83% | 0.825 | 76% | 0.762 | S | S | * | * | trans | -140 | 136 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 182 | E | 30.5 | Very low | 31.3 | Very low | 193 Ų | 193 | 129.3 Ų | 129.3 | 90% | 0.902 | 76% | 0.762 | S | S | * | * | trans | -133.1 | 174.3 | 162.9 | -166.1 | 160.8 | -175.8 | 0 | 0 | 109.1 | ||||
| 183 | M | 33 | Very low | 31.2 | Very low | 161 Ų | 161 | 135.9 Ų | 135.9 | 79% | 0.793 | 78% | 0.783 | S | S | * | * | trans | -90.2 | 164.4 | -151.9 | -52.1 | -173.6 | -57.7 | 0 | 0 | 116.2 | ||||
| 184 | V | 30.4 | Very low | 31 | Very low | 122 Ų | 122 | 135.5 Ų | 135.5 | 74% | 0.739 | 78% | 0.781 | S | S | * | * | trans | 139.2 | 99 | 130.5 | 177.6 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 185 | V | 31.5 | Very low | 30.7 | Very low | 117 Ų | 117 | 139.8 Ų | 139.8 | 71% | 0.709 | 78% | 0.783 | S | S | * | * | trans | 35.7 | 112.8 | 134.9 | -162 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 186 | R | 28.5 | Very low | 30.4 | Very low | 226 Ų | 226 | 138.5 Ų | 138.5 | 85% | 0.853 | 79% | 0.788 | S | S | * | * | 176.8 | 122.3 | 118.2 | -94.6 | 178.8 | 177.4 | 118 | -2.5 | 108.5 | |||||
| 187 | S | 31.1 | Very low | 30.3 | Very low | 94 Ų | 94 | 139.8 Ų | 139.8 | 66% | 0.657 | 80% | 0.795 | S | S | * | * | 68.6 | 115.7 | 73 | -57.1 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 188 | H | 28.8 | Very low | 30.2 | Very low | 192 Ų | 192 | 138 Ų | 138 | 89% | 0.889 | 79% | 0.791 | S | S | * | * | -176.8 | 156.9 | 129.5 | -93.6 | -63.9 | 0 | 0 | 0 | 110.6 | |||||
| 189 | C | 29.1 | Very low | 30.1 | Very low | 126 Ų | 126 | 138.6 Ų | 138.6 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -120.1 | 150.5 | -174.7 | -56.1 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 190 | S | 27.1 | Very low | 29.9 | Very low | 132 Ų | 132 | 141.5 Ų | 141.5 | 92% | 0.923 | 79% | 0.79 | S | S | * | * | trans | 177.5 | 145.9 | 149.3 | -78.8 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 191 | G | 29.7 | Very low | 29.5 | Very low | 64 Ų | 64 | 141 Ų | 141 | 66% | 0.66 | 79% | 0.787 | S | S | * | * | cis | 167.9 | 169.1 | -5.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 192 | L | 32.9 | Very low | 29.3 | Very low | 151 Ų | 151 | 142.4 Ų | 142.4 | 79% | 0.791 | 78% | 0.784 | S | S | * | * | trans | 67 | 131.8 | 174.3 | -57.7 | 169.5 | 0 | 0 | 0 | 114.2 | ||||
| 193 | E | 29.8 | Very low | 29.2 | Very low | 172 Ų | 172 | 140.6 Ų | 140.6 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | 59.3 | 127 | 68.8 | -60.2 | 176.1 | 171 | 0 | 0 | 110.6 | |||||
| 194 | D | 30.5 | Very low | 29 | Very low | 125 Ų | 125 | 142.2 Ų | 142.2 | 67% | 0.668 | 78% | 0.783 | S | S | * | * | cis | -164.4 | 175.7 | 37.3 | -166.8 | 10.3 | 0 | 0 | 0 | 112.2 | ||||
| 195 | Q | 30.4 | Very low | 28.9 | Very low | 157 Ų | 157 | 145.1 Ų | 145.1 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | trans | 62.8 | 161.2 | 158.4 | -74.7 | 160.2 | 66.7 | 0 | 0 | 119.3 | ||||
| 196 | C | 27.6 | Very low | 28.7 | Very low | 108 Ų | 108 | 145.6 Ų | 145.6 | 73% | 0.73 | 80% | 0.797 | S | S | * | * | cis | -173.7 | 169.1 | -40.6 | -110.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 197 | L | 29.8 | Very low | 28.7 | Very low | 161 Ų | 161 | 139.8 Ų | 139.8 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | 67.9 | 122.7 | 173.3 | -54.7 | 164.4 | 0 | 0 | 0 | 115 | ||||
| 198 | V | 26.8 | Very low | 28.4 | Very low | 113 Ų | 113 | 142.9 Ų | 142.9 | 69% | 0.685 | 81% | 0.806 | S | S | * | * | cis | 74 | 110.6 | 40.4 | -174.5 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 199 | I | 28.6 | Very low | 28.2 | Very low | 174 Ų | 174 | 139.2 Ų | 139.2 | 89% | 0.892 | 80% | 0.802 | S | S | * | * | trans | -157.4 | 160.8 | 142.7 | -104.9 | 156.1 | 0 | 0 | 0 | 109.1 | ||||
| 200 | F | 24.8 | Very low | 28.1 | Very low | 181 Ų | 181 | 137.1 Ų | 137.1 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | trans | -106.9 | 168 | -163.4 | -94.8 | -106.5 | 0 | 0 | 0 | 114.7 | ||||
| 201 | S | 26.2 | Very low | 28 | Very low | 113 Ų | 113 | 137.3 Ų | 137.3 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | 75.1 | 157.2 | 158.2 | -56.5 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 202 | S | 27.6 | Very low | 27.9 | Very low | 109 Ų | 109 | 139.1 Ų | 139.1 | 76% | 0.762 | 80% | 0.798 | S | S | * | * | cis | -141.6 | 158.5 | 3.7 | -156.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 203 | M | 28.7 | Very low | 27.6 | Very low | 155 Ų | 155 | 135.3 Ų | 135.3 | 76% | 0.764 | 80% | 0.796 | S | S | * | * | trans | -79.3 | 154 | 149.9 | -85.9 | 175.6 | 55.7 | 0 | 0 | 109.7 | ||||
| 204 | E | 30.2 | Very low | 27.4 | Very low | 194 Ų | 194 | 133.2 Ų | 133.2 | 91% | 0.907 | 79% | 0.794 | S | S | * | * | -170.4 | 152.9 | 124.3 | -106.2 | 167.9 | -172.7 | 0 | 0 | 111.3 | |||||
| 205 | E | 27.7 | Very low | 27.3 | Very low | 183 Ų | 183 | 135.1 Ų | 135.1 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | trans | -106.5 | 141.7 | 176.9 | -57.4 | 173.8 | 121.4 | 0 | 0 | 109.9 | ||||
| 206 | S | 26.8 | Very low | 27.1 | Very low | 127 Ų | 127 | 133.1 Ų | 133.1 | 89% | 0.888 | 81% | 0.805 | S | S | * | * | trans | -166.3 | 165 | 143.2 | -159.7 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 207 | S | 28.2 | Very low | 27.1 | Very low | 105 Ų | 105 | 135.9 Ų | 135.9 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | -139 | 148.5 | -175.9 | 65.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 208 | V | 25.6 | Very low | 27.6 | Very low | 158 Ų | 158 | 133.2 Ų | 133.2 | 96% | 0.958 | 80% | 0.804 | S | S | * | * | trans | -156.8 | 172.4 | 155.7 | -108.8 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 209 | S | 24.1 | Very low | 27.7 | Very low | 116 Ų | 116 | 134.3 Ų | 134.3 | 81% | 0.811 | 81% | 0.805 | S | S | * | * | trans | -142.4 | -176 | -159 | -174.3 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 210 | A | 27.1 | Very low | 27.6 | Very low | 81 Ų | 81 | 134 Ų | 134 | 67% | 0.669 | 80% | 0.8 | S | S | * | * | trans | 82.9 | 152.2 | 159.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 211 | T | 24.2 | Very low | 27.8 | Very low | 136 Ų | 136 | 129.6 Ų | 129.6 | 83% | 0.834 | 79% | 0.791 | S | S | * | * | cis | -166.1 | 174.1 | -4.2 | 2.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 212 | A | 27.5 | Very low | 27.8 | Very low | 102 Ų | 102 | 131.8 Ų | 131.8 | 84% | 0.843 | 79% | 0.793 | S | S | * | * | trans | 78.7 | 154 | 154.6 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 213 | G | 27 | Very low | 27.7 | Very low | 72 Ų | 72 | 134.3 Ų | 134.3 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | cis | -163.4 | 176.1 | 1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 214 | T | 26.8 | Very low | 28.5 | Very low | 127 Ų | 127 | 131.3 Ų | 131.3 | 78% | 0.779 | 79% | 0.787 | S | S | * | * | trans | -133.6 | 156.4 | -157.5 | -29.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 215 | M | 28.5 | Very low | 28.4 | Very low | 166 Ų | 166 | 129 Ų | 129 | 82% | 0.818 | 78% | 0.78 | S | S | * | * | trans | 73.2 | 143.5 | 171.3 | -47.8 | -58.6 | -171 | 0 | 0 | 115.1 | ||||
| 216 | S | 25.1 | Very low | 28.3 | Very low | 115 Ų | 115 | 126.4 Ų | 126.4 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | cis | -158 | 173.5 | 39.2 | -53.6 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 217 | L | 27.1 | Very low | 28.3 | Very low | 166 Ų | 166 | 125.2 Ų | 125.2 | 87% | 0.869 | 77% | 0.767 | S | S | * | * | trans | -73.9 | -178.7 | 168.2 | -69.4 | 171.9 | 0 | 0 | 0 | 111.7 | ||||
| 218 | P | 41.8 | Very low | 28.3 | Very low | 105 Ų | 105 | 128.9 Ų | 128.9 | 68% | 0.682 | 77% | 0.77 | S | S | * | * | cis | -152.5 | -175 | 20.6 | 43.9 | -21.5 | 0 | 0 | 0 | 120.9 | ||||
| 219 | L | 28.4 | Very low | 28.4 | Very low | 136 Ų | 136 | 125.9 Ų | 125.9 | 71% | 0.712 | 76% | 0.762 | S | S | * | * | trans | 88.6 | 128.5 | 140.9 | -114.6 | 67.1 | 0 | 0 | 0 | 122.9 | ||||
| 220 | E | 26 | Very low | 28.7 | Very low | 166 Ų | 166 | 125.4 Ų | 125.4 | 78% | 0.776 | 76% | 0.759 | S | S | * | * | trans | 52.4 | 151.3 | 137.6 | -74.3 | 171 | 174.6 | 0 | 0 | 122.6 | ||||
| 221 | S | 29.3 | Very low | 28.7 | Very low | 89 Ų | 89 | 126.5 Ų | 126.5 | 62% | 0.622 | 76% | 0.757 | S | S | * | * | cis | -172.1 | -179.2 | -16 | 57.4 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 222 | I | 26.8 | Very low | 28.8 | Very low | 160 Ų | 160 | 127.7 Ų | 127.7 | 82% | 0.821 | 75% | 0.753 | S | S | * | * | trans | 88.6 | 156.3 | 158.3 | -65.3 | 161.2 | 0 | 0 | 0 | 118.5 | ||||
| 223 | M | 24.3 | Very low | 28.8 | Very low | 162 Ų | 162 | 129.9 Ų | 129.9 | 80% | 0.798 | 75% | 0.746 | S | S | * | * | trans | -122.9 | -167.5 | -159.1 | -87 | -98.1 | 78.6 | 0 | 0 | 110.5 | ||||
| 224 | P | 45.7 | Very low | 28.6 | Very low | 92 Ų | 92 | 133.6 Ų | 133.6 | 60% | 0.597 | 74% | 0.744 | S | S | * | * | cis | -148.1 | 178.5 | 12.8 | 46.3 | -26.4 | 0 | 0 | 0 | 120.4 | ||||
| 225 | N | 27.9 | Very low | 28.6 | Very low | 144 Ų | 144 | 133.9 Ų | 133.9 | 77% | 0.77 | 75% | 0.745 | S | S | * | * | trans | 71.6 | 153.3 | 154.3 | -62.5 | -32.9 | 0 | 0 | 0 | 118.9 | ||||
| 226 | V | 26.9 | Very low | 28.7 | Very low | 129 Ų | 129 | 133.7 Ų | 133.7 | 78% | 0.782 | 74% | 0.74 | S | S | * | * | cis | -141.1 | 139.6 | 25.9 | 169 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 227 | C | 27.1 | Very low | 28.8 | Very low | 102 Ų | 102 | 135.5 Ų | 135.5 | 69% | 0.689 | 74% | 0.736 | S | S | * | * | trans | 20.2 | 154.3 | 150.7 | -64.6 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 228 | K | 28.3 | Very low | 28.8 | Very low | 183 Ų | 183 | 131.8 Ų | 131.8 | 80% | 0.796 | 72% | 0.724 | S | S | * | * | cis | -157.7 | 139.5 | 1 | -104.3 | 152.3 | -175.2 | -179.7 | 0 | 106.4 | ||||
| 229 | A | 27.6 | Very low | 28.2 | Very low | 95 Ų | 95 | 135.1 Ų | 135.1 | 79% | 0.785 | 73% | 0.732 | S | S | * | * | cis | 81 | 139.8 | 44.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 230 | S | 28.8 | Very low | 28.2 | Very low | 106 Ų | 106 | 131.6 Ų | 131.6 | 74% | 0.741 | 73% | 0.728 | S | S | * | * | cis | -170.5 | 166.8 | -21.2 | -154.2 | 0 | 0 | 0 | 0 | 112 | ||||
| 231 | T | 27.8 | Very low | 28.2 | Very low | 103 Ų | 103 | 132.2 Ų | 132.2 | 63% | 0.632 | 73% | 0.731 | S | S | * | * | trans | 24.8 | 143.7 | 151.9 | 16.7 | 0 | 0 | 0 | 0 | 124.9 | ||||
| 232 | E | 26.5 | Very low | 28.8 | Very low | 161 Ų | 161 | 133.3 Ų | 133.3 | 75% | 0.752 | 74% | 0.736 | S | S | * | * | trans | 60.7 | 120.1 | 136.9 | -77.6 | 161.6 | 158.4 | 0 | 0 | 124 | ||||
| 233 | Q | 26.6 | Very low | 28.9 | Very low | 149 Ų | 149 | 131.1 Ų | 131.1 | 70% | 0.696 | 73% | 0.73 | S | S | * | * | 76.5 | 131.8 | 115.6 | -164.5 | 172.7 | -26.5 | 0 | 0 | 122.5 | |||||
| 234 | E | 23.2 | Very low | 29.4 | Very low | 150 Ų | 150 | 131.7 Ų | 131.7 | 70% | 0.701 | 74% | 0.736 | S | S | * | * | trans | 70.8 | 161.3 | 155.7 | -90.3 | -176.9 | 101.6 | 0 | 0 | 122.6 | ||||
| 235 | T | 27.5 | Very low | 28.7 | Very low | 132 Ų | 132 | 130.2 Ų | 130.2 | 81% | 0.81 | 74% | 0.737 | S | S | * | * | trans | 67.4 | 150.7 | 178.9 | 68.7 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 236 | K | 29.4 | Very low | 28.8 | Very low | 162 Ų | 162 | 130 Ų | 130 | 70% | 0.704 | 74% | 0.741 | S | S | * | * | cis | -178.4 | 152.2 | -38.7 | -136.4 | 179.5 | 169 | -138.9 | 0 | 105.4 | ||||
| 237 | E | 28.8 | Very low | 29.1 | Very low | 154 Ų | 154 | 129.5 Ų | 129.5 | 72% | 0.72 | 74% | 0.738 | S | S | * | * | trans | 63.6 | 161.6 | 155 | -80.1 | 158 | -144.4 | 0 | 0 | 116.7 | ||||
| 238 | S | 25.6 | Very low | 29 | Very low | 87 Ų | 87 | 133.2 Ų | 133.2 | 61% | 0.608 | 74% | 0.743 | S | S | * | * | cis | -158.5 | 160.4 | -19.6 | -178.4 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 239 | M | 29.5 | Very low | 29.1 | Very low | 176 Ų | 176 | 130.3 Ų | 130.3 | 87% | 0.867 | 74% | 0.736 | S | S | * | * | trans | 10.7 | 148.7 | 159.3 | -60.7 | -176.7 | -71.9 | 0 | 0 | 121.5 | ||||
| 240 | G | 28.5 | Very low | 29 | Very low | 61 Ų | 61 | 134.9 Ų | 134.9 | 63% | 0.629 | 74% | 0.741 | S | S | * | * | cis | 156.5 | 174.5 | -0.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 241 | H | 26.6 | Very low | 29 | Very low | 179 Ų | 179 | 133.7 Ų | 133.7 | 83% | 0.829 | 74% | 0.738 | S | S | * | * | trans | 31.2 | 141 | 142.6 | -57 | -56 | 0 | 0 | 0 | 121.4 | ||||
| 242 | P | 40.6 | Very low | 29 | Very low | 113 Ų | 113 | 135.9 Ų | 135.9 | 73% | 0.734 | 75% | 0.746 | S | S | * | * | -131.4 | -171.3 | 52.1 | 38.7 | -19.5 | 0 | 0 | 0 | 113.2 | |||||
| 243 | T | 30.3 | Very low | 29.1 | Very low | 114 Ų | 114 | 132.8 Ų | 132.8 | 70% | 0.699 | 74% | 0.742 | S | S | * | * | cis | -159.4 | 149.9 | 29.1 | -17.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 244 | L | 34.1 | Very low | 29.2 | Very low | 174 Ų | 174 | 132.4 Ų | 132.4 | 91% | 0.911 | 74% | 0.744 | S | S | * | * | trans | 58.4 | 122.9 | 160.1 | -60.7 | 163.6 | 0 | 0 | 0 | 118 | ||||
| 245 | G | 30.7 | Very low | 29.6 | Very low | 61 Ų | 61 | 131 Ų | 131 | 63% | 0.629 | 74% | 0.741 | S | S | * | * | cis | -175.8 | 138.1 | -5.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 246 | V | 30.8 | Very low | 29.4 | Very low | 138 Ų | 138 | 130.8 Ų | 130.8 | 84% | 0.836 | 74% | 0.735 | S | S | * | * | 70.1 | 117.3 | 87.9 | 167.8 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 247 | T | 32.1 | Very low | 29.4 | Very low | 119 Ų | 119 | 128.8 Ų | 128.8 | 73% | 0.73 | 73% | 0.731 | S | S | * | * | cis | -163.4 | 142.5 | 7.9 | 14.2 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 248 | F | 25.5 | Very low | 29.3 | Very low | 181 Ų | 181 | 125.7 Ų | 125.7 | 79% | 0.794 | 72% | 0.723 | S | S | * | * | 79.1 | 152 | 77.6 | -160.9 | -105.3 | 0 | 0 | 0 | 115.4 | |||||
| 249 | N | 30.9 | Very low | 29.6 | Very low | 122 Ų | 122 | 130 Ų | 130 | 65% | 0.652 | 73% | 0.734 | S | S | * | * | trans | 75.5 | 99.7 | -179.4 | -66.6 | -33.1 | 0 | 0 | 0 | 120.2 | ||||
| 250 | Q | 24.3 | Very low | 29.6 | Very low | 190 Ų | 190 | 129 Ų | 129 | 89% | 0.888 | 73% | 0.727 | S | S | * | * | 20.9 | 106 | 117.8 | -176.5 | -175.9 | 45.6 | 0 | 0 | 118.3 | |||||
| 251 | A | 29.1 | Very low | 29.9 | Very low | 81 Ų | 81 | 132.9 Ų | 132.9 | 67% | 0.669 | 73% | 0.732 | S | S | * | * | trans | -169 | 156.9 | 145.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 252 | N | 28.6 | Very low | 30.2 | Very low | 150 Ų | 150 | 130.3 Ų | 130.3 | 80% | 0.802 | 72% | 0.724 | S | S | * | * | trans | 42.9 | 142.1 | 140 | -59.7 | -5.2 | 0 | 0 | 0 | 123.1 | ||||
| 253 | S | 29.1 | Very low | 29.6 | Very low | 96 Ų | 96 | 129.8 Ų | 129.8 | 67% | 0.671 | 72% | 0.719 | S | S | * | * | 85.2 | 145.4 | 127.2 | -94.6 | 0 | 0 | 0 | 0 | 118.9 | |||||
| 254 | L | 28.6 | Very low | 29.5 | Very low | 141 Ų | 141 | 130.1 Ų | 130.1 | 74% | 0.738 | 73% | 0.726 | S | S | * | * | 59.6 | 111.5 | 75.3 | -154.1 | 86.8 | 0 | 0 | 0 | 109 | |||||
| 255 | D | 30.4 | Very low | 29.2 | Very low | 119 Ų | 119 | 126.4 Ų | 126.4 | 64% | 0.636 | 72% | 0.72 | S | S | * | * | cis | -147.9 | -163.1 | 8 | -118.5 | -9 | 0 | 0 | 0 | 108.5 | ||||
| 256 | N | 24 | Very low | 29.1 | Very low | 129 Ų | 129 | 133.3 Ų | 133.3 | 69% | 0.69 | 73% | 0.733 | S | S | * | * | cis | 56 | 163.2 | 39.2 | -105.2 | 6.5 | 0 | 0 | 0 | 110.1 | ||||
| 257 | L | 28.9 | Very low | 28.9 | Very low | 119 Ų | 119 | 133.4 Ų | 133.4 | 62% | 0.623 | 73% | 0.729 | S | S | * | * | cis | -162.4 | 165 | -14 | -167.9 | 77 | 0 | 0 | 0 | 105.6 | ||||
| 258 | T | 27.5 | Very low | 28.7 | Very low | 89 Ų | 89 | 131.8 Ų | 131.8 | 55% | 0.546 | 72% | 0.722 | S | S | . | * | trans | 63 | 169.3 | 153.7 | 37.7 | 0 | 0 | 0 | 0 | 117.5 | E260 | T258-E260 HydrophobicContact CG2-CB 3.6Å; T258-E260 HydrophobicContact CG2-CG 3.79Å; T258-E260 WeakPolarHBondContact CG2-OE2 3.34Å | ||
| 259 | E | 32.4 | Very low | 29 | Very low | 179 Ų | 179 | 131.4 Ų | 131.4 | 84% | 0.836 | 72% | 0.723 | S | S | * | * | cis | -103.4 | 138.9 | 2.9 | -66.1 | 169.2 | 155 | 0 | 0 | 109.7 | ||||
| 260 | E | 28.4 | Very low | 28.7 | Very low | 153 Ų | 153 | 131.5 Ų | 131.5 | 72% | 0.715 | 73% | 0.728 | S | S | * | * | cis | 57.5 | 84.9 | 28.8 | -77.8 | -155.1 | 131.9 | 0 | 0 | 116.4 | T258 | T258-E260 HydrophobicContact CG2-CB 3.6Å; T258-E260 HydrophobicContact CG2-CG 3.79Å; T258-E260 WeakPolarHBondContact CG2-OE2 3.34Å | ||
| 261 | I | 35.7 | Very low | 29.8 | Very low | 144 Ų | 144 | 127.3 Ų | 127.3 | 74% | 0.738 | 72% | 0.717 | S | S | * | * | trans | -151 | 130.7 | 147.8 | -59.6 | -173.6 | 0 | 0 | 0 | 105.6 | ||||
| 262 | D | 32.3 | Very low | 29.8 | Very low | 125 Ų | 125 | 131 Ų | 131 | 67% | 0.668 | 73% | 0.725 | S | S | * | * | cis | -149.7 | 128.1 | -17.6 | -113.7 | -36.5 | 0 | 0 | 0 | 105.9 | ||||
| 263 | T | 27.6 | Very low | 30.4 | Very low | 102 Ų | 102 | 129.2 Ų | 129.2 | 63% | 0.626 | 72% | 0.721 | S | S | * | * | 65.2 | 154.5 | 85.6 | 80.2 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 264 | S | 29.2 | Very low | 30.4 | Very low | 121 Ų | 121 | 130.1 Ų | 130.1 | 85% | 0.846 | 73% | 0.728 | S | S | * | * | trans | 73.8 | 142.7 | -178.7 | 84.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 265 | A | 27.5 | Very low | 30.4 | Very low | 95 Ų | 95 | 132.5 Ų | 132.5 | 79% | 0.785 | 74% | 0.735 | S | S | * | * | cis | -146.7 | 167.7 | -2.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 266 | F | 27.3 | Very low | 30.5 | Very low | 206 Ų | 206 | 130.8 Ų | 130.8 | 90% | 0.904 | 75% | 0.745 | S | S | * | * | trans | -79.8 | 160.6 | 170.3 | -80.1 | -107.9 | 0 | 0 | 0 | 111.9 | ||||
| 267 | D | 26.6 | Very low | 30.8 | Very low | 140 Ų | 140 | 127.9 Ų | 127.9 | 75% | 0.749 | 75% | 0.746 | S | S | * | * | 162 | 163.1 | 95.8 | -163.5 | 32.3 | 0 | 0 | 0 | 116.3 | |||||
| 268 | S | 29.4 | Very low | 31.1 | Very low | 85 Ų | 85 | 128.4 Ų | 128.4 | 59% | 0.594 | 75% | 0.748 | S | S | * | * | trans | 64.6 | 115.8 | 147.7 | -83.5 | 0 | 0 | 0 | 0 | 125.3 | ||||
| 269 | H | 30.2 | Very low | 31.5 | Very low | 173 Ų | 173 | 134.1 Ų | 134.1 | 80% | 0.801 | 77% | 0.766 | S | S | * | * | 32 | 115.3 | 121.3 | -82.8 | -94 | 0 | 0 | 0 | 123 | |||||
| 270 | V | 26.5 | Very low | 31.9 | Very low | 124 Ų | 124 | 132 Ų | 132 | 75% | 0.752 | 76% | 0.76 | S | S | * | * | 32.5 | 135.5 | 101.4 | 176.2 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 271 | P | 46.5 | Very low | 32.4 | Very low | 103 Ų | 103 | 129.6 Ų | 129.6 | 67% | 0.669 | 76% | 0.756 | S | S | * | * | cis | -148.7 | 169.7 | 27.7 | 30 | -4.8 | 0 | 0 | 0 | 121 | ||||
| 272 | L | 28.2 | Very low | 32.1 | Very low | 159 Ų | 159 | 130.9 Ų | 130.9 | 83% | 0.832 | 76% | 0.757 | S | S | * | * | trans | 64.8 | 171.2 | 147.5 | -69.3 | 162.7 | 0 | 0 | 0 | 119.2 | ||||
| 273 | P | 42.3 | Very low | 32 | Very low | 112 Ų | 112 | 128.5 Ų | 128.5 | 73% | 0.727 | 74% | 0.743 | S | S | * | * | -137.6 | -169.8 | -55.7 | 41.6 | -25.3 | 0 | 0 | 0 | 114.5 | |||||
| 274 | S | 28.4 | Very low | 32.1 | Very low | 115 Ų | 115 | 130.3 Ų | 130.3 | 80% | 0.804 | 76% | 0.758 | S | S | * | * | trans | 108.2 | 160.3 | 147.7 | -154.2 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 275 | E | 29.7 | Very low | 32.1 | Very low | 190 Ų | 190 | 132.6 Ų | 132.6 | 89% | 0.888 | 76% | 0.755 | S | S | * | * | trans | -63.3 | 146.4 | -170.4 | -54.8 | 173.6 | 161.5 | 0 | 0 | 115.3 | ||||
| 276 | G | 31 | Very low | 32.6 | Very low | 83 Ų | 83 | 134.4 Ų | 134.4 | 86% | 0.856 | 76% | 0.757 | S | S | * | * | trans | -179.9 | 128.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 277 | G | 31 | Very low | 33.5 | Very low | 68 Ų | 68 | 130.1 Ų | 130.1 | 70% | 0.701 | 75% | 0.749 | S | S | * | * | trans | -132.9 | -169.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 278 | L | 35.9 | Very low | 33.8 | Very low | 130 Ų | 130 | 129.8 Ų | 129.8 | 68% | 0.681 | 75% | 0.753 | S | S | * | * | trans | 83 | 126.3 | -176.7 | -51.9 | 165.6 | 0 | 0 | 0 | 114.7 | N634 | L278-N634 HydrophobicContact CD1-CB 4.33Å; L278-N634 VanDerWaalsContact CD1-ND2 3.34Å; L278-N634 WeakPolarHBondContact CD1-ND2 3.39Å | ||
| 279 | F | 34.9 | Very low | 33.8 | Very low | 210 Ų | 210 | 132.6 Ų | 132.6 | 92% | 0.921 | 76% | 0.761 | S | S | * | * | trans | -93.9 | 136.5 | 168 | -73.9 | -103.4 | 0 | 0 | 0 | 109.6 | ||||
| 280 | L | 40.5 | Very low | 34.2 | Very low | 134 Ų | 134 | 131.7 Ų | 131.7 | 70% | 0.702 | 76% | 0.757 | S | S | * | * | -168.4 | 140.6 | 119.9 | -147.1 | 69 | 0 | 0 | 0 | 111.1 | |||||
| 281 | T | 40.2 | Very low | 34.4 | Very low | 103 Ų | 103 | 131.8 Ų | 131.8 | 63% | 0.632 | 76% | 0.758 | S | S | * | * | trans | 40.7 | 135.9 | 156.2 | 43.6 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 282 | F | 28.2 | Very low | 33.9 | Very low | 171 Ų | 171 | 133.4 Ų | 133.4 | 75% | 0.75 | 76% | 0.761 | S | S | * | * | -160.2 | 156.1 | 108.3 | -113.2 | -76.9 | 0 | 0 | 0 | 113.4 | |||||
| 283 | I | 30.7 | Very low | 34.1 | Very low | 75 Ų | 75 | 133.8 Ų | 133.8 | 39% | 0.385 | 76% | 0.759 | S | S | . | * | trans | -40.3 | 154.2 | 179.3 | -65 | 166 | 0 | 0 | 0 | 117.1 | E285 | I283-E285 HydrophobicContact CG2-CB 3.95Å; I283-E285 HydrophobicContact CG2-CG 3.72Å | ||
| 284 | C | 29.5 | Very low | 33.4 | Very low | 139 Ų | 139 | 133.9 Ų | 133.9 | 94% | 0.939 | 76% | 0.757 | S | S | * | * | trans | -125.5 | 126.5 | 141.3 | -80.3 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 285 | E | 29.2 | Very low | 33.5 | Very low | 170 Ų | 170 | 137.2 Ų | 137.2 | 79% | 0.794 | 76% | 0.757 | S | S | * | * | trans | -112.3 | 165.4 | -175.6 | -107 | -173.3 | 127.2 | 0 | 0 | 113 | I283 | I283-E285 HydrophobicContact CG2-CB 3.95Å; I283-E285 HydrophobicContact CG2-CG 3.72Å | ||
| 286 | T | 38.3 | Very low | 33.4 | Very low | 133 Ų | 133 | 133.1 Ų | 133.1 | 82% | 0.816 | 75% | 0.75 | S | S | * | * | trans | -121.9 | 132.6 | 172.6 | 53.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 287 | P | 46.9 | Very low | 33.2 | Very low | 115 Ų | 115 | 135.2 Ų | 135.2 | 75% | 0.747 | 75% | 0.751 | S | S | * | * | trans | -112.4 | 173.1 | 163.4 | 42.5 | -33.6 | 0 | 0 | 0 | 110.8 | ||||
| 288 | T | 31.8 | Very low | 32.8 | Very low | 133 Ų | 133 | 135.3 Ų | 135.3 | 82% | 0.816 | 75% | 0.752 | S | S | * | * | cis | -155.4 | 142.1 | 18.4 | -33.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 289 | D | 30.2 | Very low | 32.6 | Very low | 145 Ų | 145 | 133.7 Ų | 133.7 | 78% | 0.775 | 76% | 0.757 | S | S | * | * | trans | -165.3 | 147.5 | 140.4 | -144.3 | 4.5 | 0 | 0 | 0 | 106.3 | ||||
| 290 | Q | 38.9 | Very low | 32.3 | Very low | 154 Ų | 154 | 131 Ų | 131 | 72% | 0.72 | 75% | 0.753 | S | S | * | * | cis | -148 | 179 | 21.9 | -58.3 | 171.5 | -8.5 | 0 | 0 | 111.2 | ||||
| 291 | T | 30.9 | Very low | 32 | Very low | 126 Ų | 126 | 128.2 Ų | 128.2 | 77% | 0.773 | 75% | 0.749 | S | S | * | * | -169.4 | 124.5 | 128.7 | -72.7 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 292 | N | 36 | Very low | 31.5 | Very low | 136 Ų | 136 | 131.1 Ų | 131.1 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | trans | 13.3 | 139 | 154.5 | -56.7 | -40.2 | 0 | 0 | 0 | 123.2 | ||||
| 293 | Q | 30.8 | Very low | 31.8 | Very low | 167 Ų | 167 | 129.4 Ų | 129.4 | 78% | 0.78 | 75% | 0.753 | S | S | * | * | 175.4 | 111.5 | 110.3 | -88.8 | -78.3 | 34.1 | 0 | 0 | 115.4 | |||||
| 294 | V | 29.3 | Very low | 31.7 | Very low | 114 Ų | 114 | 132.9 Ų | 132.9 | 69% | 0.691 | 77% | 0.772 | S | S | * | * | trans | 41.7 | 119.5 | 133.6 | 177.4 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 295 | K | 30.1 | Very low | 31.6 | Very low | 186 Ų | 186 | 130.6 Ų | 130.6 | 81% | 0.809 | 76% | 0.757 | S | S | * | * | trans | 85 | 122.3 | 145.3 | -84.4 | 171.7 | -176.5 | 177.5 | 0 | 124.5 | ||||
| 296 | S | 26.6 | Very low | 31.6 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 73% | 0.727 | 76% | 0.758 | S | S | * | * | 94.5 | 130.4 | 126.9 | 67.6 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 297 | S | 26.3 | Very low | 31.1 | Very low | 126 Ų | 126 | 130.1 Ų | 130.1 | 88% | 0.881 | 75% | 0.754 | S | S | * | * | trans | 57.1 | 136.7 | 168.8 | 51.6 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 298 | G | 24.6 | Very low | 30.1 | Very low | 70 Ų | 70 | 130.6 Ų | 130.6 | 72% | 0.722 | 76% | 0.755 | S | S | * | * | cis | 154.3 | 139.9 | -8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 299 | A | 30.8 | Very low | 29.9 | Very low | 96 Ų | 96 | 132.8 Ų | 132.8 | 79% | 0.793 | 76% | 0.756 | S | S | * | * | trans | 65.1 | 153.8 | -176.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 300 | D | 28.8 | Very low | 29.8 | Very low | 154 Ų | 154 | 131.4 Ų | 131.4 | 82% | 0.824 | 75% | 0.745 | S | S | * | * | cis | -149.5 | 176.5 | 3.4 | -135.5 | -29 | 0 | 0 | 0 | 112.1 | ||||
| 301 | A | 34.4 | Very low | 29.3 | Very low | 76 Ų | 76 | 132.6 Ų | 132.6 | 63% | 0.628 | 75% | 0.748 | S | S | * | * | trans | 23.2 | 144.4 | 150.9 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 302 | E | 29.8 | Very low | 29.1 | Very low | 163 Ų | 163 | 133 Ų | 133 | 76% | 0.762 | 75% | 0.75 | S | S | * | * | cis | -164.5 | 147 | -0.1 | -111.4 | -175.3 | 135.6 | 0 | 0 | 108.8 | ||||
| 303 | L | 33.7 | Very low | 28.8 | Very low | 136 Ų | 136 | 132.4 Ų | 132.4 | 71% | 0.712 | 76% | 0.757 | S | S | * | * | 56.3 | 137.5 | 100.2 | -100.4 | 70 | 0 | 0 | 0 | 115.7 | |||||
| 304 | L | 29.2 | Very low | 28.8 | Very low | 148 Ų | 148 | 133.1 Ų | 133.1 | 78% | 0.775 | 76% | 0.76 | S | S | * | * | cis | -147.7 | 175.8 | 8 | -79.1 | 166.8 | 0 | 0 | 0 | 107.6 | ||||
| 305 | S | 26.8 | Very low | 29 | Very low | 90 Ų | 90 | 135.4 Ų | 135.4 | 63% | 0.629 | 77% | 0.767 | S | S | * | * | cis | -160.4 | 169.7 | -9.9 | -104.6 | 0 | 0 | 0 | 0 | 107 | ||||
| 306 | Q | 29.7 | Very low | 28.9 | Very low | 175 Ų | 175 | 129.1 Ų | 129.1 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | cis | 80.6 | 137 | 30.2 | -96 | -172.5 | 15.1 | 0 | 0 | 116.2 | ||||
| 307 | V | 27.8 | Very low | 29.4 | Very low | 119 Ų | 119 | 133.9 Ų | 133.9 | 72% | 0.721 | 76% | 0.763 | S | S | * | * | cis | -133.7 | -169.6 | 5.6 | -85.3 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 308 | T | 26 | Very low | 29.5 | Very low | 125 Ų | 125 | 133 Ų | 133 | 77% | 0.767 | 75% | 0.752 | S | S | * | * | cis | -164.4 | 166.3 | 18.2 | -22.2 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 309 | E | 26.9 | Very low | 29.8 | Very low | 178 Ų | 178 | 139.3 Ų | 139.3 | 83% | 0.832 | 76% | 0.761 | S | S | * | * | trans | -146.6 | 166.6 | 169.1 | -64.7 | -171.9 | 101.8 | 0 | 0 | 110.3 | ||||
| 310 | E | 28.5 | Very low | 29.7 | Very low | 117 Ų | 117 | 138.4 Ų | 138.4 | 55% | 0.547 | 76% | 0.761 | S | S | . | * | cis | -146.6 | -15 | -4 | -144.1 | -160.5 | 151.2 | 0 | 0 | 115.3 | K1125 | E310-K1125 IonicContact OE1-NZ 2.68Å; E310-K1125 PolarHBondContact OE1-NZ 3.24Å; E310-K1125 IonicContact OE2-NZ 3.57Å; E310-K1125 PolarHBondContact OE2-NZ 2.91Å | ||
| 311 | F | 28.3 | Very low | 29.7 | Very low | 179 Ų | 179 | 137 Ų | 137 | 79% | 0.785 | 76% | 0.763 | S | S | * | * | trans | -108.1 | 147.2 | -159.2 | -72.6 | -89.2 | 0 | 0 | 0 | 115.6 | ||||
| 312 | T | 26.6 | Very low | 29.6 | Very low | 135 Ų | 135 | 139.4 Ų | 139.4 | 83% | 0.828 | 77% | 0.77 | S | S | * | * | -171.8 | 169.2 | 71.8 | 33.5 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 313 | S | 30.6 | Very low | 29.6 | Very low | 123 Ų | 123 | 138.3 Ų | 138.3 | 86% | 0.86 | 77% | 0.774 | S | S | * | * | trans | -146.9 | 122 | 171.6 | -64.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 314 | E | 30.8 | Very low | 29.5 | Very low | 181 Ų | 181 | 137.4 Ų | 137.4 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | trans | -162.8 | 126.5 | 156.1 | -105.2 | -178.4 | 163 | 0 | 0 | 107.3 | ||||
| 315 | L | 32.1 | Very low | 29.5 | Very low | 162 Ų | 162 | 133.7 Ų | 133.7 | 85% | 0.848 | 78% | 0.776 | S | S | * | * | 70.2 | 115.3 | 82.8 | -165.3 | 75.9 | 0 | 0 | 0 | 113.4 | |||||
| 316 | G | 29.6 | Very low | 29.5 | Very low | 55 Ų | 55 | 133.7 Ų | 133.7 | 57% | 0.567 | 78% | 0.782 | S | S | * | * | cis | 166.7 | -169.8 | -3.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 317 | K | 35.2 | Very low | 29.6 | Very low | 204 Ų | 204 | 133.1 Ų | 133.1 | 89% | 0.887 | 78% | 0.779 | S | S | * | * | trans | 73.3 | 150.8 | -178.7 | -47.4 | 167.4 | -172.8 | 172.2 | 0 | 113.1 | ||||
| 318 | T | 28.7 | Very low | 29.6 | Very low | 106 Ų | 106 | 133.2 Ų | 133.2 | 65% | 0.65 | 78% | 0.776 | S | S | * | * | cis | -148.3 | 158.4 | 7.8 | -15.1 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 319 | F | 31.4 | Very low | 30 | Very low | 204 Ų | 204 | 132.5 Ų | 132.5 | 90% | 0.895 | 78% | 0.776 | S | S | * | * | cis | -132.1 | -142.6 | 18.8 | -53.8 | -100.3 | 0 | 0 | 0 | 110.8 | ||||
| 320 | G | 29.1 | Very low | 30.1 | Very low | 77 Ų | 77 | 132.2 Ų | 132.2 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | trans | -175.3 | -178.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 321 | S | 29.5 | Very low | 30.5 | Very low | 124 Ų | 124 | 129.8 Ų | 129.8 | 87% | 0.867 | 79% | 0.786 | S | S | * | * | trans | -144.5 | 147.9 | 161.5 | -168.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 322 | T | 31 | Very low | 30.9 | Very low | 127 Ų | 127 | 128.8 Ų | 128.8 | 78% | 0.779 | 79% | 0.789 | S | S | * | * | trans | -106 | 139.7 | -157.1 | 23.8 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 323 | V | 30.7 | Very low | 31.2 | Very low | 139 Ų | 139 | 128.7 Ų | 128.7 | 84% | 0.842 | 78% | 0.782 | S | S | * | * | 38.8 | 132.4 | 128.4 | 170.8 | 0 | 0 | 0 | 0 | 117.7 | |||||
| 324 | S | 32 | Very low | 31.2 | Very low | 118 Ų | 118 | 130.7 Ų | 130.7 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | cis | -174 | 149.7 | -8.7 | 175.7 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 325 | G | 28.3 | Very low | 31.1 | Very low | 69 Ų | 69 | 127.4 Ų | 127.4 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | trans | -167.2 | 117.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 326 | A | 27.6 | Very low | 31.1 | Very low | 90 Ų | 90 | 125.2 Ų | 125.2 | 74% | 0.744 | 77% | 0.768 | S | S | * | * | trans | 32.8 | 139.1 | 133.7 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 327 | Q | 30.3 | Very low | 31.4 | Very low | 163 Ų | 163 | 128.7 Ų | 128.7 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | trans | 74.9 | 130.3 | 135.7 | -76.8 | -170 | -84.6 | 0 | 0 | 123.1 | ||||
| 328 | D | 28.4 | Very low | 32 | Very low | 122 Ų | 122 | 124.7 Ų | 124.7 | 65% | 0.652 | 77% | 0.773 | S | S | * | * | 44.7 | 129.2 | 121.3 | -51.7 | -24.9 | 0 | 0 | 0 | 122.4 | |||||
| 329 | S | 33.8 | Very low | 31.9 | Very low | 110 Ų | 110 | 125.2 Ų | 125.2 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | 82.7 | 115.7 | 132.5 | -68.4 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 330 | D | 30.5 | Very low | 32 | Very low | 172 Ų | 172 | 124 Ų | 124 | 92% | 0.92 | 77% | 0.773 | S | S | * | * | 75.4 | 160 | 129.6 | -125.3 | -22.3 | 0 | 0 | 0 | 121 | |||||
| 331 | G | 35.6 | Very low | 31.7 | Very low | 65 Ų | 65 | 125.3 Ų | 125.3 | 67% | 0.67 | 77% | 0.769 | S | S | * | * | trans | 106 | 102.8 | 154.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 332 | D | 36.3 | Very low | 31.8 | Very low | 159 Ų | 159 | 127.1 Ų | 127.1 | 85% | 0.85 | 77% | 0.767 | S | S | * | * | trans | -50.7 | 164.7 | 154.1 | -75.3 | -57.3 | 0 | 0 | 0 | 111.9 | ||||
| 333 | I | 33.3 | Very low | 31.5 | Very low | 132 Ų | 132 | 125 Ų | 125 | 68% | 0.677 | 76% | 0.762 | S | S | * | * | -162.9 | 150.3 | 55.8 | -70.8 | 162.5 | 0 | 0 | 0 | 109.1 | |||||
| 334 | H | 31.7 | Very low | 31.4 | Very low | 166 Ų | 166 | 125 Ų | 125 | 77% | 0.769 | 76% | 0.758 | S | S | * | * | 175.5 | 115.9 | 125.8 | -90.3 | -61.7 | 0 | 0 | 0 | 116.4 | |||||
| 335 | T | 27.9 | Very low | 31.5 | Very low | 112 Ų | 112 | 128.6 Ų | 128.6 | 69% | 0.687 | 76% | 0.759 | S | S | * | * | trans | 59.3 | 107.8 | 141 | 55 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 336 | S | 32.9 | Very low | 31.9 | Very low | 116 Ų | 116 | 132 Ų | 132 | 81% | 0.811 | 76% | 0.759 | S | S | * | * | 74.1 | 135.9 | 111.8 | -52.2 | 0 | 0 | 0 | 0 | 123.4 | |||||
| 337 | T | 36.3 | Very low | 32.4 | Very low | 127 Ų | 127 | 133.6 Ų | 133.6 | 78% | 0.779 | 76% | 0.762 | S | S | * | * | trans | -68.2 | 163.7 | 177 | -12.8 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 338 | P | 45.9 | Very low | 32.1 | Very low | 121 Ų | 121 | 131.3 Ų | 131.3 | 79% | 0.786 | 76% | 0.755 | S | S | * | * | -152 | 143.2 | 92.1 | 38.4 | -19.7 | 0 | 0 | 0 | 119.6 | |||||
| 339 | V | 28.3 | Very low | 32.1 | Very low | 117 Ų | 117 | 132.5 Ų | 132.5 | 71% | 0.709 | 76% | 0.76 | S | S | * | * | trans | 2.9 | 124.1 | 139.1 | -169.7 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 340 | Q | 31.8 | Very low | 31.7 | Very low | 177 Ų | 177 | 131.5 Ų | 131.5 | 83% | 0.827 | 75% | 0.754 | S | S | * | * | 171.1 | 130.4 | 128.3 | -94.7 | 172.2 | 4.3 | 0 | 0 | 109.5 | |||||
| 341 | C | 24.7 | Very low | 31.5 | Very low | 105 Ų | 105 | 127.9 Ų | 127.9 | 71% | 0.709 | 74% | 0.741 | S | S | * | * | 91.3 | 158.1 | 61 | -69.1 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 342 | I | 30.6 | Very low | 31.3 | Very low | 162 Ų | 162 | 132.3 Ų | 132.3 | 83% | 0.831 | 75% | 0.749 | S | S | * | * | trans | 73 | 105.1 | 176 | -48.1 | 175.1 | 0 | 0 | 0 | 113.5 | ||||
| 343 | A | 25.1 | Very low | 30.8 | Very low | 82 Ų | 82 | 131.6 Ų | 131.6 | 68% | 0.678 | 74% | 0.744 | S | S | * | * | cis | 93.2 | 131.7 | 38 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 344 | N | 29.2 | Very low | 30.4 | Very low | 140 Ų | 140 | 130.2 Ų | 130.2 | 75% | 0.749 | 75% | 0.747 | S | S | * | * | trans | -167 | 109.1 | 143.4 | -94.1 | -44.6 | 0 | 0 | 0 | 108.7 | ||||
| 345 | K | 32.4 | Very low | 30.9 | Very low | 193 Ų | 193 | 127.9 Ų | 127.9 | 84% | 0.839 | 75% | 0.746 | S | S | * | * | 82.9 | 99.6 | 95.7 | -78 | -172.3 | -175.1 | -179.4 | 0 | 115 | |||||
| 346 | I | 37 | Very low | 30.9 | Very low | 141 Ų | 141 | 131.6 Ų | 131.6 | 72% | 0.723 | 75% | 0.753 | S | S | * | * | trans | -76.2 | 153.9 | 151.8 | -5.7 | 176.7 | 0 | 0 | 0 | 108.6 | N348 | I346-N348 HydrophobicContact CB-CB 4.23Å; I346-N348 HydrophobicContact CG2-CB 3.85Å | ||
| 347 | P | 37.5 | Very low | 30.6 | Very low | 123 Ų | 123 | 131.9 Ų | 131.9 | 80% | 0.799 | 75% | 0.745 | S | S | * | * | -131.4 | 149.8 | 82.9 | 38.2 | -28 | 0 | 0 | 0 | 112.8 | |||||
| 348 | N | 24.6 | Very low | 30.1 | Very low | 116 Ų | 116 | 132.9 Ų | 132.9 | 62% | 0.62 | 74% | 0.741 | S | S | * | * | cis | 86.4 | 142.6 | 18.3 | -152.7 | 15 | 0 | 0 | 0 | 116.4 | I346 | I346-N348 HydrophobicContact CB-CB 4.23Å; I346-N348 HydrophobicContact CG2-CB 3.85Å | ||
| 349 | L | 28.3 | Very low | 29.1 | Very low | 146 Ų | 146 | 133.5 Ų | 133.5 | 76% | 0.764 | 74% | 0.738 | S | S | * | * | trans | 73.2 | 146.7 | 172.7 | -51.9 | -179.5 | 0 | 0 | 0 | 117.5 | ||||
| 350 | S | 26.5 | Very low | 29 | Very low | 90 Ų | 90 | 133.2 Ų | 133.2 | 63% | 0.629 | 74% | 0.737 | S | S | * | * | cis | -170.2 | 138.3 | -28.6 | -110.6 | 0 | 0 | 0 | 0 | 109 | ||||
| 351 | S | 25.8 | Very low | 28.7 | Very low | 95 Ų | 95 | 132.4 Ų | 132.4 | 66% | 0.664 | 74% | 0.738 | S | S | * | * | 81.6 | 158.2 | 79.7 | -48.7 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 352 | L | 30.3 | Very low | 28.8 | Very low | 159 Ų | 159 | 132.1 Ų | 132.1 | 83% | 0.832 | 74% | 0.737 | S | S | * | * | trans | 87.6 | 145.8 | 165.9 | -44.6 | -175 | 0 | 0 | 0 | 116 | ||||
| 353 | L | 26.7 | Very low | 29.2 | Very low | 143 Ų | 143 | 130 Ų | 130 | 75% | 0.749 | 73% | 0.733 | S | S | * | * | cis | -159 | 147.6 | 3.7 | -155.1 | 80.6 | 0 | 0 | 0 | 112.1 | ||||
| 354 | S | 23.8 | Very low | 29.2 | Very low | 104 Ų | 104 | 130.9 Ų | 130.9 | 73% | 0.727 | 74% | 0.735 | S | S | * | * | trans | 42.5 | 176 | 145.5 | -92.5 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 355 | P | 43.9 | Very low | 29.1 | Very low | 116 Ų | 116 | 130.8 Ų | 130.8 | 75% | 0.753 | 73% | 0.734 | S | S | * | * | cis | -129.8 | -165.4 | -7.4 | 33.5 | -11.1 | 0 | 0 | 0 | 115.5 | ||||
| 356 | F | 27.5 | Very low | 28.7 | Very low | 190 Ų | 190 | 129.2 Ų | 129.2 | 83% | 0.833 | 73% | 0.729 | S | S | * | * | trans | -65.6 | 172.3 | 171.8 | -68.3 | -109.1 | 0 | 0 | 0 | 113.2 | ||||
| 357 | N | 26.5 | Very low | 28.3 | Very low | 122 Ų | 122 | 128.4 Ų | 128.4 | 65% | 0.652 | 73% | 0.726 | S | S | * | * | cis | -171.4 | 162.6 | 40.8 | -149.5 | 24.6 | 0 | 0 | 0 | 115.8 | ||||
| 358 | E | 25.4 | Very low | 27.8 | Very low | 148 Ų | 148 | 129 Ų | 129 | 69% | 0.692 | 72% | 0.718 | S | S | * | * | trans | 48.3 | 135.1 | 148.2 | -80.1 | -178.8 | 132.5 | 0 | 0 | 127.6 | ||||
| 359 | N | 25.2 | Very low | 28 | Very low | 135 Ų | 135 | 130.7 Ų | 130.7 | 72% | 0.722 | 72% | 0.72 | S | S | * | * | 106.1 | 128.9 | 126.6 | -92.3 | -27.7 | 0 | 0 | 0 | 126.2 | |||||
| 360 | V | 26.3 | Very low | 28.1 | Very low | 111 Ų | 111 | 133.2 Ų | 133.2 | 67% | 0.673 | 72% | 0.719 | S | S | * | * | trans | 88 | 114.5 | 134.1 | 167.3 | 0 | 0 | 0 | 0 | 124 | ||||
| 361 | N | 25.6 | Very low | 28.4 | Very low | 159 Ų | 159 | 137.6 Ų | 137.6 | 85% | 0.85 | 73% | 0.727 | S | S | * | * | trans | 72.6 | 157.5 | 144.6 | -73.3 | -9.1 | 0 | 0 | 0 | 124.9 | ||||
| 362 | S | 26.8 | Very low | 28.6 | Very low | 100 Ų | 100 | 140.3 Ų | 140.3 | 70% | 0.699 | 73% | 0.729 | S | S | * | * | trans | -126.4 | 167.1 | -172.5 | 59 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 363 | P | 38.1 | Very low | 28.5 | Very low | 116 Ų | 116 | 139.9 Ų | 139.9 | 75% | 0.753 | 73% | 0.726 | S | S | * | * | -135.6 | 164.7 | 120.3 | 25.4 | -5.4 | 0 | 0 | 0 | 111.7 | |||||
| 364 | S | 25.3 | Very low | 28.6 | Very low | 101 Ų | 101 | 142.1 Ų | 142.1 | 71% | 0.706 | 73% | 0.73 | S | S | * | * | cis | 73.9 | 138.6 | 39.2 | -52.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 365 | L | 27.5 | Very low | 28.7 | Very low | 139 Ų | 139 | 143.6 Ų | 143.6 | 73% | 0.728 | 73% | 0.734 | S | S | * | * | cis | -156.9 | 145.6 | 29.3 | -73.7 | 167.7 | 0 | 0 | 0 | 114.7 | ||||
| 366 | Q | 25 | Very low | 27.9 | Very low | 159 Ų | 159 | 142.3 Ų | 142.3 | 74% | 0.743 | 73% | 0.733 | S | S | * | * | trans | 56 | 172.5 | 135.4 | -53.2 | -178.5 | -4.7 | 0 | 0 | 121 | ||||
| 367 | L | 27.9 | Very low | 27.9 | Very low | 124 Ų | 124 | 138.4 Ų | 138.4 | 65% | 0.649 | 73% | 0.73 | S | S | * | * | cis | -157.4 | 125.4 | 13.1 | -171.2 | 58.4 | 0 | 0 | 0 | 116.3 | ||||
| 368 | E | 26.5 | Very low | 28.1 | Very low | 135 Ų | 135 | 140.5 Ų | 140.5 | 63% | 0.631 | 73% | 0.733 | S | S | * | * | trans | 59.2 | -173.1 | 167.7 | -79.2 | -170.7 | 86.1 | 0 | 0 | 117.8 | ||||
| 369 | K | 29.2 | Very low | 28.1 | Very low | 153 Ų | 153 | 140.8 Ų | 140.8 | 67% | 0.665 | 73% | 0.734 | S | S | * | * | cis | -151.8 | 172.8 | 10.3 | -107.9 | 111.5 | -171 | 144.1 | 0 | 109.7 | ||||
| 370 | R | 30 | Very low | 28.1 | Very low | 198 Ų | 198 | 140.3 Ų | 140.3 | 75% | 0.747 | 74% | 0.74 | S | S | * | * | cis | -177.3 | 79.2 | -32.3 | -171.5 | -150.9 | 66 | -173.9 | -4.5 | 115.7 | ||||
| 371 | K | 32.6 | Very low | 29 | Very low | 182 Ų | 182 | 140.4 Ų | 140.4 | 79% | 0.791 | 74% | 0.743 | S | S | * | * | trans | 74 | 161.7 | 163.6 | -44.7 | -172.3 | -179.9 | -172.7 | 0 | 118.5 | ||||
| 372 | H | 29.5 | Very low | 29 | Very low | 153 Ų | 153 | 139.8 Ų | 139.8 | 71% | 0.708 | 74% | 0.744 | S | S | * | * | cis | -163.1 | 159.5 | 15.4 | -133.5 | -52.6 | 0 | 0 | 0 | 113.5 | ||||
| 373 | I | 29.8 | Very low | 29 | Very low | 150 Ų | 150 | 139.7 Ų | 139.7 | 77% | 0.769 | 75% | 0.75 | S | S | * | * | trans | 93.4 | 162.3 | 161.7 | -60.2 | 165.2 | 0 | 0 | 0 | 117.2 | ||||
| 374 | F | 29.1 | Very low | 28.4 | Very low | 189 Ų | 189 | 137.4 Ų | 137.4 | 83% | 0.829 | 75% | 0.748 | S | S | * | * | trans | -87.7 | -175.2 | -154.1 | -66.2 | -73.3 | 0 | 0 | 0 | 115.8 | ||||
| 375 | V | 24.9 | Very low | 28.6 | Very low | 136 Ų | 136 | 141.3 Ų | 141.3 | 82% | 0.824 | 76% | 0.759 | S | S | * | * | cis | -162.1 | 154.9 | 30.7 | -139.9 | 0 | 0 | 0 | 0 | 116 | ||||
| 376 | A | 27.7 | Very low | 28.8 | Very low | 89 Ų | 89 | 141.1 Ų | 141.1 | 74% | 0.736 | 77% | 0.765 | S | S | * | * | trans | 68.5 | 143.1 | 148.7 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 377 | S | 27.7 | Very low | 29.3 | Very low | 108 Ų | 108 | 139.2 Ų | 139.2 | 76% | 0.755 | 77% | 0.766 | S | S | * | * | trans | 64.1 | 113.3 | 169.3 | -61.6 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 378 | K | 29.1 | Very low | 29.3 | Very low | 166 Ų | 166 | 138.3 Ų | 138.3 | 72% | 0.722 | 77% | 0.77 | S | S | * | * | 68.4 | 127.4 | 76.1 | -88.5 | 175.8 | 157.9 | -79.3 | 0 | 113 | |||||
| 379 | E | 27.3 | Very low | 29.3 | Very low | 154 Ų | 154 | 138.8 Ų | 138.8 | 72% | 0.72 | 78% | 0.775 | S | S | * | * | cis | -161.1 | 128.6 | 8.9 | -168.3 | 142 | -114.4 | 0 | 0 | 111.8 | ||||
| 380 | C | 25.2 | Very low | 29.1 | Very low | 125 Ų | 125 | 136.3 Ų | 136.3 | 85% | 0.845 | 78% | 0.776 | S | S | * | * | trans | -171.8 | 177.5 | 173 | -121.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 381 | P | 43.5 | Very low | 29 | Very low | 112 Ų | 112 | 135.4 Ų | 135.4 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | -122.7 | -152.1 | -115.2 | 36.1 | -16.3 | 0 | 0 | 0 | 115.4 | |||||
| 382 | V | 25.6 | Very low | 28.8 | Very low | 146 Ų | 146 | 132.6 Ų | 132.6 | 89% | 0.885 | 78% | 0.776 | S | S | * | * | trans | 87.9 | 157.9 | 169 | -170.1 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 383 | A | 26.9 | Very low | 28.7 | Very low | 98 Ų | 98 | 134.5 Ų | 134.5 | 81% | 0.81 | 78% | 0.782 | S | S | * | * | trans | -111.9 | 166.4 | -165 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 384 | G | 26.5 | Very low | 28.9 | Very low | 69 Ų | 69 | 136.1 Ų | 136.1 | 71% | 0.711 | 78% | 0.783 | S | S | * | * | trans | 128.1 | 112.4 | 156.1 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 385 | L | 28.6 | Very low | 28.8 | Very low | 182 Ų | 182 | 133.4 Ų | 133.4 | 95% | 0.953 | 78% | 0.782 | S | S | * | * | trans | 46.9 | 132.7 | 146.8 | -58.9 | 173.3 | 0 | 0 | 0 | 121.9 | ||||
| 386 | T | 32.2 | Very low | 28.8 | Very low | 136 Ų | 136 | 134.8 Ų | 134.8 | 83% | 0.834 | 78% | 0.78 | S | S | * | * | trans | -78.1 | 142.3 | 170.5 | 54.6 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 387 | P | 35.8 | Very low | 28.7 | Very low | 119 Ų | 119 | 135.1 Ų | 135.1 | 77% | 0.773 | 78% | 0.777 | S | S | * | * | -143 | 149.3 | 94.3 | 31.9 | -14.1 | 0 | 0 | 0 | 113.4 | |||||
| 388 | S | 27.4 | Very low | 28.7 | Very low | 104 Ų | 104 | 138.9 Ų | 138.9 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | cis | 95.4 | 134.1 | 49.1 | -157.1 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 389 | I | 26.3 | Very low | 28.6 | Very low | 145 Ų | 145 | 139.9 Ų | 139.9 | 74% | 0.744 | 79% | 0.787 | S | S | * | * | trans | 88.4 | 105.5 | 158.6 | -70.1 | 154.9 | 0 | 0 | 0 | 121.4 | ||||
| 390 | C | 25 | Very low | 28.6 | Very low | 102 Ų | 102 | 138.5 Ų | 138.5 | 69% | 0.689 | 79% | 0.788 | S | S | * | * | trans | 76 | 158 | 137.1 | -73.9 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 391 | K | 29.4 | Very low | 29.4 | Very low | 178 Ų | 178 | 137.9 Ų | 137.9 | 77% | 0.774 | 78% | 0.783 | S | S | * | * | cis | -163.7 | 158.7 | 6.5 | -123.5 | 158.1 | -166.4 | 167.1 | 0 | 113.2 | ||||
| 392 | V | 27.1 | Very low | 28.6 | Very low | 124 Ų | 124 | 140 Ų | 140 | 75% | 0.752 | 79% | 0.786 | S | S | * | * | trans | 71.6 | 145.4 | 148.2 | 162.7 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 393 | K | 28.1 | Very low | 28.7 | Very low | 192 Ų | 192 | 138 Ų | 138 | 84% | 0.835 | 78% | 0.779 | S | S | * | * | cis | -152.7 | 173.4 | 20.3 | -142.8 | 153.5 | -169.5 | 179 | 0 | 109.4 | ||||
| 394 | K | 32.8 | Very low | 28.6 | Very low | 184 Ų | 184 | 140.7 Ų | 140.7 | 80% | 0.8 | 78% | 0.78 | S | S | * | * | -179.1 | 107.2 | -60.4 | 177.1 | -153.4 | 172.1 | -171.8 | 0 | 109.5 | |||||
| 395 | T | 28.5 | Very low | 28.7 | Very low | 133 Ų | 133 | 144.4 Ų | 144.4 | 82% | 0.816 | 78% | 0.782 | S | S | * | * | trans | -155.3 | 140.4 | 157.5 | 36.9 | 0 | 0 | 0 | 0 | 107 | ||||
| 396 | E | 24.8 | Very low | 28.7 | Very low | 164 Ų | 164 | 142.1 Ų | 142.1 | 77% | 0.766 | 77% | 0.77 | S | S | * | * | cis | -147.8 | -173.1 | -17 | -147.6 | 177 | 127.8 | 0 | 0 | 109.1 | ||||
| 397 | S | 25.5 | Very low | 28.6 | Very low | 96 Ų | 96 | 141.5 Ų | 141.5 | 67% | 0.671 | 77% | 0.767 | S | S | * | * | trans | 15.7 | 135.5 | 165.4 | -22.6 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 398 | Q | 27.1 | Very low | 28.2 | Very low | 187 Ų | 187 | 140.5 Ų | 140.5 | 87% | 0.874 | 76% | 0.758 | S | S | * | * | cis | -159.3 | 176.9 | 16 | -139.9 | 172.4 | 15.9 | 0 | 0 | 112 | ||||
| 399 | K | 27.9 | Very low | 28.4 | Very low | 188 Ų | 188 | 144.4 Ų | 144.4 | 82% | 0.817 | 76% | 0.762 | S | S | * | * | trans | -61.3 | 155.3 | -168.3 | -59.7 | 174.1 | 178.9 | 177.3 | 0 | 115.4 | ||||
| 400 | V | 27.3 | Very low | 28.6 | Very low | 124 Ų | 124 | 146.7 Ų | 146.7 | 75% | 0.752 | 76% | 0.763 | S | S | * | * | cis | 72.5 | 142.2 | 37.7 | -179.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 401 | P | 40.3 | Very low | 29.1 | Very low | 112 Ų | 112 | 149.9 Ų | 149.9 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | cis | -107.5 | -170.3 | 3.6 | 9.2 | 17.9 | 0 | 0 | 0 | 113.9 | ||||
| 402 | I | 27.3 | Very low | 29.1 | Very low | 157 Ų | 157 | 147.3 Ų | 147.3 | 81% | 0.805 | 76% | 0.76 | S | S | * | * | cis | 81.6 | 147.7 | 34.5 | -48.3 | 175.8 | 0 | 0 | 0 | 114.9 | ||||
| 403 | S | 28.8 | Very low | 29.2 | Very low | 105 Ų | 105 | 148.3 Ų | 148.3 | 73% | 0.734 | 76% | 0.76 | S | S | * | * | trans | 72.7 | 138.5 | -168.5 | 52.5 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 404 | D | 24.3 | Very low | 29.4 | Very low | 154 Ų | 154 | 145 Ų | 145 | 82% | 0.824 | 76% | 0.756 | S | S | * | * | cis | 82.3 | 151.8 | 37.4 | -82 | -41 | 0 | 0 | 0 | 115.7 | ||||
| 405 | I | 28.1 | Very low | 29.3 | Very low | 146 Ų | 146 | 146.1 Ų | 146.1 | 75% | 0.749 | 76% | 0.755 | S | S | * | * | trans | 85.8 | 119.1 | 174.7 | -56 | 173 | 0 | 0 | 0 | 117 | ||||
| 406 | D | 29.4 | Very low | 29.2 | Very low | 134 Ų | 134 | 146.5 Ų | 146.5 | 72% | 0.717 | 75% | 0.749 | S | S | * | * | trans | 19.3 | 141.8 | 140.6 | -47 | -30.2 | 0 | 0 | 0 | 120.3 | ||||
| 407 | T | 28.6 | Very low | 29.4 | Very low | 124 Ų | 124 | 143 Ų | 143 | 76% | 0.761 | 74% | 0.74 | S | S | * | * | -171.7 | 142.9 | 67.9 | 27.5 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 408 | V | 27.7 | Very low | 29.6 | Very low | 98 Ų | 98 | 145.4 Ų | 145.4 | 59% | 0.594 | 74% | 0.74 | S | S | * | * | 32.2 | 134 | 127.1 | -166.4 | 0 | 0 | 0 | 0 | 119.4 | Y410 | V408-Y410 HydrophobicContact CG1-CD2 3.92Å; V408-Y410 HydrophobicContact CG1-CE2 4.49Å | |||
| 409 | K | 31.4 | Very low | 29.6 | Very low | 186 Ų | 186 | 147.2 Ų | 147.2 | 81% | 0.809 | 74% | 0.739 | S | S | * | * | 164.1 | 103.2 | 118.8 | -76.7 | -80.8 | 163.2 | 53 | 0 | 108.6 | |||||
| 410 | Y | 30.4 | Very low | 29.6 | Very low | 192 Ų | 192 | 142.3 Ų | 142.3 | 75% | 0.753 | 73% | 0.734 | S | S | * | * | 95.9 | 145.4 | 71.6 | -118.5 | -80.3 | 0 | 0 | 0 | 113.7 | V408 | V408-Y410 HydrophobicContact CG1-CD2 3.92Å; V408-Y410 HydrophobicContact CG1-CE2 4.49Å | |||
| 411 | K | 36.7 | Very low | 29.5 | Very low | 170 Ų | 170 | 141.4 Ų | 141.4 | 74% | 0.739 | 74% | 0.739 | S | S | * | * | trans | 79.2 | 145 | 165.6 | -58.4 | -168 | 166 | -159.5 | 0 | 118.6 | ||||
| 412 | D | 28.1 | Very low | 29 | Very low | 124 Ų | 124 | 142.5 Ų | 142.5 | 66% | 0.663 | 74% | 0.744 | S | S | * | * | cis | -154.6 | 144.4 | -16.7 | -107.6 | -23.9 | 0 | 0 | 0 | 114.1 | ||||
| 413 | L | 31 | Very low | 29.5 | Very low | 144 Ų | 144 | 141 Ų | 141 | 75% | 0.754 | 74% | 0.744 | S | S | * | * | trans | 35.2 | 97.1 | 138.1 | -156.1 | 68.1 | 0 | 0 | 0 | 122.4 | ||||
| 414 | T | 30.9 | Very low | 29.4 | Very low | 123 Ų | 123 | 139 Ų | 139 | 76% | 0.755 | 74% | 0.74 | S | S | * | * | 20.3 | 129.8 | 119.5 | -45.6 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 415 | R | 31.3 | Very low | 29.6 | Very low | 207 Ų | 207 | 137.8 Ų | 137.8 | 78% | 0.781 | 74% | 0.739 | S | S | * | * | trans | 160.2 | 156.8 | 142.2 | -90.8 | -179.2 | -164 | -105.8 | 0.6 | 108.7 | ||||
| 416 | M | 27.1 | Very low | 29.6 | Very low | 141 Ų | 141 | 138 Ų | 138 | 70% | 0.695 | 74% | 0.741 | S | S | * | * | cis | -162.9 | 171.6 | -9.9 | -100.2 | -133.5 | 151.2 | 0 | 0 | 107.9 | ||||
| 417 | T | 28 | Very low | 29.6 | Very low | 92 Ų | 92 | 140.3 Ų | 140.3 | 56% | 0.564 | 75% | 0.745 | S | S | * | * | cis | 177.4 | 153.7 | -31.2 | -86.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 418 | Q | 29.7 | Very low | 29.7 | Very low | 146 Ų | 146 | 141.3 Ų | 141.3 | 68% | 0.682 | 75% | 0.745 | S | S | * | * | trans | 76.7 | 136.3 | 165.6 | -86.9 | 175.5 | 72.8 | 0 | 0 | 121.5 | ||||
| 419 | R | 28.1 | Very low | 29.7 | Very low | 224 Ų | 224 | 144.5 Ų | 144.5 | 85% | 0.845 | 75% | 0.753 | S | S | * | * | trans | 51.7 | 156.7 | 131.6 | -69.2 | 179.7 | 166 | 172.1 | -9.3 | 121.6 | ||||
| 420 | A | 26.1 | Very low | 29.5 | Very low | 86 Ų | 86 | 145.4 Ų | 145.4 | 71% | 0.711 | 76% | 0.757 | S | S | * | * | cis | -171.9 | 170.2 | -21.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 421 | A | 25.6 | Very low | 29.3 | Very low | 105 Ų | 105 | 141.2 Ų | 141.2 | 87% | 0.868 | 76% | 0.756 | S | S | * | * | trans | 63.3 | 144.2 | 153.4 | 0 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 422 | V | 29.9 | Very low | 28.9 | Very low | 134 Ų | 134 | 140.6 Ų | 140.6 | 81% | 0.812 | 76% | 0.756 | S | S | * | * | trans | -84.9 | 160 | 171.3 | 152.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 423 | P | 37.4 | Very low | 28.8 | Very low | 126 Ų | 126 | 141.9 Ų | 141.9 | 82% | 0.818 | 76% | 0.758 | S | S | * | * | cis | -138.5 | -172.3 | 25 | 36.4 | -14.3 | 0 | 0 | 0 | 117.5 | ||||
| 424 | G | 26.6 | Very low | 28.6 | Very low | 63 Ų | 63 | 139.8 Ų | 139.8 | 65% | 0.649 | 75% | 0.751 | S | S | * | * | trans | 124.3 | 117.5 | 131.2 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 425 | T | 29.5 | Very low | 28.4 | Very low | 129 Ų | 129 | 142.6 Ų | 142.6 | 79% | 0.791 | 75% | 0.752 | S | S | * | * | trans | 48.6 | 121.1 | 138.3 | 52.7 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 426 | D | 27.1 | Very low | 28.4 | Very low | 151 Ų | 151 | 140.9 Ų | 140.9 | 81% | 0.807 | 75% | 0.751 | S | S | * | * | trans | 76.6 | 173.3 | 130.5 | -71.5 | -60.5 | 0 | 0 | 0 | 124 | ||||
| 427 | K | 30.8 | Very low | 28.4 | Very low | 181 Ų | 181 | 141.3 Ų | 141.3 | 79% | 0.787 | 76% | 0.756 | S | S | * | * | trans | -121.6 | 157.8 | -152 | -59 | 174.3 | -179.7 | 170.7 | 0 | 114.2 | ||||
| 428 | L | 29.5 | Very low | 28.4 | Very low | 146 Ų | 146 | 140.6 Ų | 140.6 | 76% | 0.764 | 77% | 0.767 | S | S | * | * | trans | 85.6 | 148.8 | 140.9 | -117.2 | 73.5 | 0 | 0 | 0 | 121.9 | ||||
| 429 | Q | 27.3 | Very low | 28.2 | Very low | 165 Ų | 165 | 142.1 Ų | 142.1 | 77% | 0.771 | 77% | 0.774 | S | S | * | * | trans | 67.9 | 75.7 | 149.1 | -83.4 | 174 | -24.1 | 0 | 0 | 123.2 | ||||
| 430 | K | 27.3 | Very low | 28.4 | Very low | 205 Ų | 205 | 136.6 Ų | 136.6 | 89% | 0.891 | 77% | 0.765 | S | S | * | * | 42.3 | 101.6 | 99.8 | -168.5 | -173.3 | -176.6 | -177.9 | 0 | 119.4 | |||||
| 431 | S | 26.5 | Very low | 28.4 | Very low | 104 Ų | 104 | 137.9 Ų | 137.9 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | trans | -153 | 127.9 | 143.8 | -139.3 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 432 | Q | 28.6 | Very low | 28.8 | Very low | 157 Ų | 157 | 140.8 Ų | 140.8 | 73% | 0.734 | 75% | 0.753 | S | S | * | * | 49.6 | 134.7 | 93.4 | -56.6 | -158.7 | 54.8 | 0 | 0 | 115.3 | |||||
| 433 | Q | 26 | Very low | 29.1 | Very low | 150 Ų | 150 | 142.9 Ų | 142.9 | 70% | 0.701 | 75% | 0.751 | S | S | * | * | cis | -158.1 | 144.2 | -1.1 | -124.4 | -163.2 | 78.5 | 0 | 0 | 112.5 | ||||
| 434 | V | 27 | Very low | 28.9 | Very low | 101 Ų | 101 | 143.4 Ų | 143.4 | 61% | 0.612 | 75% | 0.747 | S | S | * | * | trans | 49.9 | 114.6 | 133.7 | 172.2 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 435 | K | 27 | Very low | 29.1 | Very low | 181 Ų | 181 | 144.9 Ų | 144.9 | 79% | 0.787 | 74% | 0.744 | S | S | * | * | trans | 81.5 | 118.7 | 143.7 | -76.3 | 169.8 | -168.9 | 169.6 | 0 | 123 | ||||
| 436 | K | 30.5 | Very low | 28.9 | Very low | 172 Ų | 172 | 146.7 Ų | 146.7 | 75% | 0.748 | 74% | 0.741 | S | S | * | * | 98.6 | 126.3 | 122.1 | -86.5 | -166.5 | 170.2 | -171.1 | 0 | 121.5 | |||||
| 437 | N | 26.8 | Very low | 29.1 | Very low | 149 Ų | 149 | 147.7 Ų | 147.7 | 80% | 0.797 | 73% | 0.733 | S | S | * | * | trans | 70.5 | 159.3 | 143.9 | -60.6 | 14.5 | 0 | 0 | 0 | 118.9 | ||||
| 438 | G | 27.9 | Very low | 28.9 | Very low | 78 Ų | 78 | 146.8 Ų | 146.8 | 80% | 0.804 | 73% | 0.73 | S | S | * | * | trans | 117.1 | 53.9 | 144.7 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 439 | E | 26.8 | Very low | 29 | Very low | 177 Ų | 177 | 145 Ų | 145 | 83% | 0.827 | 73% | 0.725 | S | S | * | * | trans | -21.3 | 158.9 | 155.4 | -145.7 | -173 | 140.2 | 0 | 0 | 120.2 | ||||
| 440 | V | 31 | Very low | 29.1 | Very low | 109 Ų | 109 | 143.3 Ų | 143.3 | 66% | 0.661 | 73% | 0.726 | S | S | * | * | trans | 60.1 | 141 | 166.7 | -98.3 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 441 | N | 28 | Very low | 29.2 | Very low | 112 Ų | 112 | 139.3 Ų | 139.3 | 60% | 0.599 | 72% | 0.719 | S | S | * | * | cis | -165.5 | 152.4 | 38 | -122.9 | -45.4 | 0 | 0 | 0 | 114.6 | ||||
| 442 | K | 33.7 | Very low | 29.6 | Very low | 166 Ų | 166 | 143.5 Ų | 143.5 | 72% | 0.722 | 72% | 0.724 | S | S | * | * | trans | 47 | 116.4 | 141.9 | -73.9 | 160.5 | -166.7 | 160.5 | 0 | 124 | ||||
| 443 | K | 36.2 | Very low | 29.5 | Very low | 178 Ų | 178 | 142.1 Ų | 142.1 | 77% | 0.774 | 73% | 0.726 | S | S | * | * | 69.7 | 141.7 | 116.7 | -76.3 | -169.5 | 174.4 | -174.5 | 0 | 123.7 | |||||
| 444 | N | 32 | Very low | 29.8 | Very low | 137 Ų | 137 | 143.9 Ų | 143.9 | 73% | 0.733 | 74% | 0.737 | S | S | * | * | trans | 72.3 | 160.1 | 144.1 | -71.6 | 23.5 | 0 | 0 | 0 | 119.2 | ||||
| 445 | T | 31.3 | Very low | 29.9 | Very low | 94 Ų | 94 | 142.2 Ų | 142.2 | 58% | 0.577 | 74% | 0.74 | S | S | * | * | cis | -169.5 | 171.7 | -29.4 | -73.9 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 446 | F | 26.3 | Very low | 30.3 | Very low | 167 Ų | 167 | 144.5 Ų | 144.5 | 73% | 0.732 | 74% | 0.743 | S | S | * | * | trans | 83.2 | 157.6 | 166.9 | -60.5 | -91 | 0 | 0 | 0 | 117.4 | ||||
| 447 | R | 29.9 | Very low | 30.4 | Very low | 172 Ų | 172 | 142.1 Ų | 142.1 | 65% | 0.649 | 74% | 0.739 | S | S | * | * | cis | -175.7 | 167.4 | -35.4 | -163.3 | -167.6 | -102.9 | -177 | -5.5 | 108.6 | ||||
| 448 | F | 26.8 | Very low | 30.6 | Very low | 162 Ų | 162 | 141.8 Ų | 141.8 | 71% | 0.711 | 74% | 0.742 | S | S | * | * | trans | 77.1 | 158.8 | 160.5 | -63 | -58.1 | 0 | 0 | 0 | 117.1 | ||||
| 449 | T | 31.5 | Very low | 30.5 | Very low | 108 Ų | 108 | 142 Ų | 142 | 66% | 0.663 | 74% | 0.744 | S | S | * | * | 178.9 | 172 | -56.9 | 33.2 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 450 | T | 29.9 | Very low | 30.5 | Very low | 130 Ų | 130 | 138.4 Ų | 138.4 | 80% | 0.798 | 75% | 0.746 | S | S | * | * | trans | 78.2 | 151.5 | 173.4 | 71.7 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 451 | T | 30.4 | Very low | 30.4 | Very low | 121 Ų | 121 | 139 Ų | 139 | 74% | 0.742 | 75% | 0.754 | S | S | * | * | cis | -156.2 | 157.1 | -15.7 | 17.5 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 452 | K | 33.8 | Very low | 30.4 | Very low | 192 Ų | 192 | 138.7 Ų | 138.7 | 84% | 0.835 | 77% | 0.768 | S | S | * | * | cis | 95.4 | 148 | 33.7 | -147.5 | -175.9 | -176.8 | -174.1 | 0 | 113.7 | ||||
| 453 | V | 27.1 | Very low | 30.2 | Very low | 129 Ų | 129 | 137 Ų | 137 | 78% | 0.782 | 77% | 0.771 | S | S | * | * | trans | 86.6 | 119.8 | -174.7 | -175.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 454 | M | 31.1 | Very low | 29.9 | Very low | 186 Ų | 186 | 133.1 Ų | 133.1 | 92% | 0.916 | 77% | 0.767 | S | S | * | * | cis | 90.8 | 133.5 | 32 | -168 | -179.6 | -166 | 0 | 0 | 112.5 | ||||
| 455 | G | 30.8 | Very low | 29.8 | Very low | 66 Ų | 66 | 132 Ų | 132 | 68% | 0.68 | 76% | 0.755 | S | S | * | * | cis | 171.6 | -168 | -4.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 456 | R | 34.7 | Very low | 29.7 | Very low | 229 Ų | 229 | 132.5 Ų | 132.5 | 86% | 0.864 | 76% | 0.758 | S | S | * | * | trans | 80.5 | 118.2 | 164.9 | -79.1 | -173.4 | 152.9 | 165.7 | -6.6 | 123.1 | ||||
| 457 | N | 32.5 | Very low | 29.8 | Very low | 123 Ų | 123 | 134.4 Ų | 134.4 | 66% | 0.658 | 77% | 0.767 | S | S | * | * | 72 | 127.3 | 118.5 | -64.4 | 27.6 | 0 | 0 | 0 | 125.5 | |||||
| 458 | T | 30 | Very low | 29.6 | Very low | 141 Ų | 141 | 129.5 Ų | 129.5 | 87% | 0.865 | 77% | 0.769 | S | S | * | * | trans | 57.3 | 134.4 | 133.7 | 59.9 | 0 | 0 | 0 | 0 | 123 | ||||
| 459 | G | 26.7 | Very low | 31.1 | Very low | 82 Ų | 82 | 127.8 Ų | 127.8 | 85% | 0.845 | 77% | 0.774 | S | S | * | * | trans | 175.3 | 137.9 | 159.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 460 | A | 27.5 | Very low | 31.1 | Very low | 103 Ų | 103 | 128.7 Ų | 128.7 | 85% | 0.851 | 78% | 0.78 | S | S | * | * | trans | -106 | 176.8 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 461 | S | 28.7 | Very low | 31.3 | Very low | 121 Ų | 121 | 126 Ų | 126 | 85% | 0.846 | 78% | 0.777 | S | S | * | * | trans | -29.6 | 148.6 | 177 | -44.4 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 462 | A | 27.1 | Very low | 31.6 | Very low | 106 Ų | 106 | 128.1 Ų | 128.1 | 88% | 0.876 | 78% | 0.779 | S | S | * | * | trans | -163 | 164.9 | 134.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 463 | T | 29.9 | Very low | 31.5 | Very low | 129 Ų | 129 | 124 Ų | 124 | 79% | 0.791 | 77% | 0.77 | S | S | * | * | trans | -97.6 | 166.1 | -166.4 | 52 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 464 | S | 29.7 | Very low | 32 | Very low | 98 Ų | 98 | 126.4 Ų | 126.4 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | trans | 70.4 | 118.6 | 139.9 | 57.9 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 465 | K | 30.6 | Very low | 32 | Very low | 114 Ų | 114 | 128.5 Ų | 128.5 | 50% | 0.496 | 77% | 0.768 | S | S | . | * | trans | 72.8 | 100 | 130.2 | -65.1 | -177.4 | 178.1 | -175.9 | 0 | 123.4 | E11 | E11-K465 WeakPolarHBondContact OE1-CD 3.49Å; E11-K465 WeakPolarHBondContact OE1-CE 3.47Å; E11-K465 IonicContact OE1-NZ 2.73Å; E11-K465 PolarHBondContact OE1-NZ 3.33Å; E11-K465 IonicContact OE2-NZ 2.67Å; E11-K465 PolarHBondContact OE2-NZ 3.22Å | ||
| 466 | T | 28.9 | Very low | 31.9 | Very low | 103 Ų | 103 | 129.4 Ų | 129.4 | 63% | 0.632 | 77% | 0.769 | S | S | * | * | 62.8 | 140.2 | 117.8 | -23.6 | 0 | 0 | 0 | 0 | 123.2 | |||||
| 467 | F | 28.1 | Very low | 31.8 | Very low | 208 Ų | 208 | 123 Ų | 123 | 91% | 0.912 | 76% | 0.764 | S | S | * | * | trans | 71.5 | 145.7 | 175 | -63.3 | -81.7 | 0 | 0 | 0 | 116.1 | ||||
| 468 | G | 26.6 | Very low | 32 | Very low | 68 Ų | 68 | 121.3 Ų | 121.3 | 70% | 0.701 | 77% | 0.767 | S | S | * | * | cis | -151 | -166.7 | 8.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 469 | P | 57.3 | Low | 32.1 | Very low | 126 Ų | 126 | 120.8 Ų | 120.8 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | trans | -118.7 | -153.1 | -154.7 | 44.8 | -36 | 0 | 0 | 0 | 115.5 | ||||
| 470 | T | 31.1 | Very low | 32.3 | Very low | 128 Ų | 128 | 120.4 Ų | 120.4 | 79% | 0.785 | 77% | 0.765 | S | S | * | * | trans | 102.8 | 134.4 | 174.7 | -43 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 471 | G | 34.3 | Very low | 32.7 | Very low | 72 Ų | 72 | 123.9 Ų | 123.9 | 74% | 0.742 | 77% | 0.769 | S | S | * | * | cis | -165.6 | -149.2 | -1.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 472 | Q | 37.1 | Very low | 32.8 | Very low | 166 Ų | 166 | 124.8 Ų | 124.8 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | cis | -171.9 | -171.1 | 5.3 | -156.1 | -158.8 | 91.4 | 0 | 0 | 109.4 | ||||
| 473 | V | 32.7 | Very low | 33.1 | Very low | 107 Ų | 107 | 123.2 Ų | 123.2 | 65% | 0.648 | 76% | 0.763 | S | S | * | * | trans | 83.8 | 124.2 | 163.1 | 176 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 474 | K | 36.3 | Very low | 33.2 | Very low | 178 Ų | 178 | 126.8 Ų | 126.8 | 77% | 0.774 | 77% | 0.768 | S | S | * | * | cis | -169.9 | 168.3 | -3.7 | -106.5 | 173.7 | -152.6 | 158.3 | 0 | 106.7 | ||||
| 475 | R | 32.1 | Very low | 33.3 | Very low | 231 Ų | 231 | 126.1 Ų | 126.1 | 87% | 0.872 | 76% | 0.763 | S | S | * | * | cis | -175.4 | 162 | -19.9 | -144.8 | -156.8 | 178.6 | -165.8 | 0.9 | 105.7 | ||||
| 476 | A | 29.1 | Very low | 33.5 | Very low | 85 Ų | 85 | 125.5 Ų | 125.5 | 70% | 0.702 | 77% | 0.774 | S | S | * | * | cis | -118.2 | -108.7 | -9.9 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 477 | A | 31.6 | Very low | 33.4 | Very low | 94 Ų | 94 | 130 Ų | 130 | 78% | 0.777 | 79% | 0.787 | S | S | * | * | cis | -165.5 | 165.5 | -9.2 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 478 | A | 36.5 | Very low | 33.4 | Very low | 87 Ų | 87 | 123.5 Ų | 123.5 | 72% | 0.719 | 78% | 0.778 | S | S | * | * | cis | -168.8 | 159.5 | -36.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 479 | S | 31.8 | Very low | 33.5 | Very low | 131 Ų | 131 | 126.1 Ų | 126.1 | 92% | 0.916 | 79% | 0.785 | S | S | * | * | trans | 66.1 | 128.4 | 169.7 | -50.6 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 480 | G | 31.5 | Very low | 32 | Very low | 73 Ų | 73 | 127.4 Ų | 127.4 | 75% | 0.753 | 79% | 0.785 | S | S | * | * | cis | 167.4 | 123.9 | -18.8 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 481 | L | 34.8 | Very low | 31.9 | Very low | 177 Ų | 177 | 125.5 Ų | 125.5 | 93% | 0.927 | 78% | 0.782 | S | S | * | * | trans | 63.9 | 169 | 156.4 | -44.3 | -179.6 | 0 | 0 | 0 | 119.3 | ||||
| 482 | T | 32 | Very low | 31.7 | Very low | 139 Ų | 139 | 128.2 Ų | 128.2 | 85% | 0.853 | 78% | 0.784 | S | S | * | * | cis | -147.3 | -179.8 | 5.5 | 54.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 483 | G | 33.2 | Very low | 31.6 | Very low | 73 Ų | 73 | 125.2 Ų | 125.2 | 75% | 0.753 | 78% | 0.781 | S | S | * | * | cis | 143.8 | 74.4 | -15.9 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 484 | K | 31.6 | Very low | 31.7 | Very low | 204 Ų | 204 | 128.2 Ų | 128.2 | 89% | 0.887 | 79% | 0.792 | S | S | * | * | trans | -164.1 | 173 | 176.1 | -96.1 | -162.3 | 170.1 | -171.1 | 0 | 114.1 | ||||
| 485 | S | 32.4 | Very low | 32.2 | Very low | 84 Ų | 84 | 124.5 Ų | 124.5 | 59% | 0.587 | 79% | 0.787 | S | S | * | * | cis | -178.1 | 136.3 | -42.9 | 59.2 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 486 | S | 34.1 | Very low | 32.1 | Very low | 102 Ų | 102 | 120.3 Ų | 120.3 | 71% | 0.713 | 78% | 0.781 | S | S | * | * | trans | 72.1 | 141.5 | 151.5 | 58.1 | 0 | 0 | 0 | 0 | 125.7 | ||||
| 487 | H | 28.1 | Very low | 32.2 | Very low | 198 Ų | 198 | 123 Ų | 123 | 92% | 0.917 | 78% | 0.784 | S | S | * | * | trans | 68.6 | 134.4 | -178.8 | -60.6 | -79.2 | 0 | 0 | 0 | 117.1 | ||||
| 488 | G | 27.8 | Very low | 32.3 | Very low | 70 Ų | 70 | 126.9 Ų | 126.9 | 72% | 0.722 | 79% | 0.785 | S | S | * | * | cis | 174.3 | 131.4 | -14.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 489 | C | 27.4 | Very low | 32.7 | Very low | 124 Ų | 124 | 127.7 Ų | 127.7 | 84% | 0.838 | 78% | 0.783 | S | S | * | * | trans | 64.6 | 147.9 | 164.3 | -64.9 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 490 | D | 26.3 | Very low | 32.8 | Very low | 153 Ų | 153 | 124.9 Ų | 124.9 | 82% | 0.818 | 77% | 0.768 | S | S | * | * | trans | 62.5 | 115.6 | 151.8 | -58 | -28.4 | 0 | 0 | 0 | 125.5 | ||||
| 491 | A | 30.2 | Very low | 32.9 | Very low | 87 Ų | 87 | 127.2 Ų | 127.2 | 72% | 0.719 | 77% | 0.767 | S | S | * | * | 61.6 | 115.8 | 123.8 | 0 | 0 | 0 | 0 | 0 | 123.9 | |||||
| 492 | V | 29.6 | Very low | 32.8 | Very low | 130 Ų | 130 | 125.6 Ų | 125.6 | 79% | 0.788 | 76% | 0.755 | S | S | * | * | trans | 73.7 | 125.4 | 132.6 | 178 | 0 | 0 | 0 | 0 | 120 | ||||
| 493 | S | 34.2 | Very low | 32.8 | Very low | 103 Ų | 103 | 124 Ų | 124 | 72% | 0.72 | 74% | 0.738 | S | S | * | * | trans | 63.1 | 113.2 | 158.3 | -66.5 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 494 | L | 35.4 | Very low | 32.7 | Very low | 169 Ų | 169 | 129.1 Ų | 129.1 | 89% | 0.885 | 74% | 0.736 | S | S | * | * | trans | 60.5 | -177.7 | 161.8 | -105.8 | 66.9 | 0 | 0 | 0 | 114.2 | ||||
| 495 | P | 46.5 | Very low | 32.6 | Very low | 101 Ų | 101 | 123.1 Ų | 123.1 | 66% | 0.656 | 72% | 0.716 | S | S | * | * | cis | -120.5 | -178.6 | -34.2 | 36.8 | -22.8 | 0 | 0 | 0 | 112.4 | ||||
| 496 | D | 29.3 | Very low | 33.1 | Very low | 142 Ų | 142 | 125.2 Ų | 125.2 | 76% | 0.759 | 73% | 0.727 | S | S | * | * | trans | 67.8 | 161.3 | 144.1 | -113.9 | -35.5 | 0 | 0 | 0 | 124.3 | ||||
| 497 | L | 31.4 | Very low | 32.9 | Very low | 143 Ų | 143 | 125.7 Ų | 125.7 | 75% | 0.749 | 73% | 0.726 | S | S | * | * | trans | 45.6 | 119 | 155.8 | -69.6 | 158.7 | 0 | 0 | 0 | 122.1 | ||||
| 498 | H | 34.8 | Very low | 32.9 | Very low | 174 Ų | 174 | 121.5 Ų | 121.5 | 81% | 0.806 | 71% | 0.714 | S | S | * | * | 26.6 | 157.7 | 108.4 | -102.4 | -108.1 | 0 | 0 | 0 | 120.6 | |||||
| 499 | P | 44.3 | Very low | 33 | Very low | 104 Ų | 104 | 126.2 Ų | 126.2 | 68% | 0.675 | 72% | 0.717 | S | S | * | * | cis | -149.8 | -176.6 | 21 | 44.3 | -24.1 | 0 | 0 | 0 | 118.8 | ||||
| 500 | A | 34.3 | Very low | 32.8 | Very low | 73 Ų | 73 | 125.3 Ų | 125.3 | 60% | 0.603 | 71% | 0.711 | S | S | * | * | trans | 60.3 | -175.8 | 140.4 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 501 | V | 33.2 | Very low | 32.9 | Very low | 122 Ų | 122 | 122 Ų | 122 | 74% | 0.739 | 70% | 0.7 | S | S | * | * | cis | -142.8 | 134.6 | 18.4 | 167.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 502 | Q | 32.6 | Very low | 32.7 | Very low | 143 Ų | 143 | 126.1 Ų | 126.1 | 67% | 0.668 | 70% | 0.704 | S | S | * | * | 69.9 | 158.9 | 70.7 | -98.1 | 156.3 | -72 | 0 | 0 | 113.2 | |||||
| 503 | E | 32.4 | Very low | 32.7 | Very low | 104 Ų | 104 | 124.9 Ų | 124.9 | 49% | 0.486 | 70% | 0.701 | S | S | . | * | cis | -152.8 | 177.8 | 5.4 | -152.6 | 145.3 | -113.1 | 0 | 0 | 106.6 | V505 | E503-V505 HydrophobicContact CG-CB 4.24Å; E503-V505 HydrophobicContact CG-CG2 3.86Å | ||
| 504 | Y | 31.3 | Very low | 32.4 | Very low | 182 Ų | 182 | 127 Ų | 127 | 71% | 0.714 | 71% | 0.705 | S | S | * | * | cis | -137.4 | 159.1 | 23 | -100.1 | -98.7 | 0 | 0 | 0 | 110.9 | ||||
| 505 | V | 29.1 | Very low | 32 | Very low | 78 Ų | 78 | 127.6 Ų | 127.6 | 47% | 0.473 | 70% | 0.7 | S | S | . | * | cis | 89.9 | 121.6 | 16.1 | 179.3 | 0 | 0 | 0 | 0 | 114.4 | E503 V507 | E503-V505 HydrophobicContact CG-CB 4.24Å; E503-V505 HydrophobicContact CG-CG2 3.86Å; V505-V507 HydrophobicContact CG1-CB 4.22Å; V505-V507 HydrophobicContact CG1-CG2 3.55Å | ||
| 506 | P | 43.3 | Very low | 31.1 | Very low | 127 Ų | 127 | 130.9 Ų | 130.9 | 83% | 0.825 | 71% | 0.707 | S | S | * | * | -111.9 | 149.8 | 93.1 | -10.1 | 29.6 | 0 | 0 | 0 | 114 | |||||
| 507 | V | 28.9 | Very low | 31.1 | Very low | 113 Ų | 113 | 127 Ų | 127 | 69% | 0.685 | 70% | 0.701 | S | S | * | * | cis | 88.8 | 130.4 | 34.9 | 149 | 0 | 0 | 0 | 0 | 113.3 | V505 | V505-V507 HydrophobicContact CG1-CB 4.22Å; V505-V507 HydrophobicContact CG1-CG2 3.55Å | ||
| 508 | V | 29 | Very low | 31 | Very low | 109 Ų | 109 | 128.8 Ų | 128.8 | 66% | 0.661 | 71% | 0.707 | S | S | * | * | cis | -169.8 | -170.1 | -11.1 | 72.7 | 0 | 0 | 0 | 0 | 111 | ||||
| 509 | Q | 29.1 | Very low | 31.7 | Very low | 170 Ų | 170 | 125.5 Ų | 125.5 | 79% | 0.794 | 70% | 0.702 | S | S | * | * | trans | 78.6 | 142.9 | 164.1 | -86.8 | 152.3 | -7.7 | 0 | 0 | 117.4 | ||||
| 510 | C | 23.7 | Very low | 30.9 | Very low | 105 Ų | 105 | 124.5 Ų | 124.5 | 71% | 0.709 | 70% | 0.702 | S | S | * | * | cis | -153.7 | 168.7 | 1.1 | -148 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 511 | S | 27.5 | Very low | 30.4 | Very low | 84 Ų | 84 | 127.9 Ų | 127.9 | 59% | 0.587 | 71% | 0.71 | S | S | * | * | trans | 25.8 | 125.2 | 151.9 | -70.5 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 512 | E | 27.7 | Very low | 30.1 | Very low | 173 Ų | 173 | 127.2 Ų | 127.2 | 81% | 0.808 | 71% | 0.706 | S | S | * | * | 95.3 | 145 | 63.5 | -81.9 | 173.8 | 119.7 | 0 | 0 | 115.3 | |||||
| 513 | S | 29.1 | Very low | 29.8 | Very low | 104 Ų | 104 | 125 Ų | 125 | 73% | 0.727 | 71% | 0.707 | S | S | * | * | trans | 70.8 | 112.1 | 155.5 | 65.7 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 514 | N | 28 | Very low | 29.5 | Very low | 147 Ų | 147 | 128.4 Ų | 128.4 | 79% | 0.786 | 72% | 0.723 | S | S | * | * | 50.8 | 158.2 | 124.1 | -59.8 | -10.5 | 0 | 0 | 0 | 124.2 | |||||
| 515 | F | 26.9 | Very low | 29.3 | Very low | 182 Ų | 182 | 125.6 Ų | 125.6 | 80% | 0.798 | 72% | 0.724 | S | S | * | * | trans | 69.6 | 154.4 | 175 | -75.7 | -101.2 | 0 | 0 | 0 | 117 | ||||
| 516 | E | 28.1 | Very low | 29.3 | Very low | 170 Ų | 170 | 127.1 Ų | 127.1 | 79% | 0.794 | 74% | 0.738 | S | S | * | * | cis | -168.3 | 154.3 | -36.3 | 179.5 | 164.7 | -121 | 0 | 0 | 108.3 | ||||
| 517 | G | 27.5 | Very low | 28.7 | Very low | 61 Ų | 61 | 129.2 Ų | 129.2 | 63% | 0.629 | 73% | 0.734 | S | S | * | * | trans | 86.9 | 131.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 518 | M | 30.9 | Very low | 28.7 | Very low | 179 Ų | 179 | 131 Ų | 131 | 88% | 0.882 | 74% | 0.735 | S | S | * | * | cis | 75.6 | 140.4 | 38.8 | -60.8 | -75.2 | 150.2 | 0 | 0 | 114.4 | ||||
| 519 | P | 48.8 | Very low | 28.7 | Very low | 106 Ų | 106 | 130.8 Ų | 130.8 | 69% | 0.688 | 74% | 0.738 | S | S | * | * | cis | -142.2 | -173.5 | -37.1 | 37.9 | -20.5 | 0 | 0 | 0 | 113.5 | ||||
| 520 | A | 26.9 | Very low | 29.1 | Very low | 83 Ų | 83 | 127.4 Ų | 127.4 | 69% | 0.686 | 74% | 0.74 | S | S | * | * | trans | 75.2 | 163 | 145.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 521 | N | 25 | Very low | 29.9 | Very low | 143 Ų | 143 | 129.2 Ų | 129.2 | 77% | 0.765 | 74% | 0.737 | S | S | * | * | cis | -159.9 | 163.9 | -8.3 | -132.2 | 2.6 | 0 | 0 | 0 | 113.3 | ||||
| 522 | T | 26.5 | Very low | 30.1 | Very low | 108 Ų | 108 | 133 Ų | 133 | 66% | 0.663 | 75% | 0.746 | S | S | * | * | trans | 61.5 | 146.5 | 135.8 | -56.1 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 523 | S | 26.3 | Very low | 30.2 | Very low | 97 Ų | 97 | 129.6 Ų | 129.6 | 68% | 0.678 | 75% | 0.747 | S | S | * | * | trans | -45.7 | 177.6 | 163.8 | -33.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 524 | Q | 25.9 | Very low | 30.3 | Very low | 176 Ų | 176 | 128.6 Ų | 128.6 | 82% | 0.822 | 75% | 0.753 | S | S | * | * | trans | 85.5 | 130.7 | 142.5 | -83.3 | 179.8 | -17.3 | 0 | 0 | 121.6 | ||||
| 525 | V | 26.4 | Very low | 30.2 | Very low | 123 Ų | 123 | 125.2 Ų | 125.2 | 75% | 0.745 | 75% | 0.753 | S | S | * | * | trans | 62.4 | 99.5 | 139.3 | -177 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 526 | S | 30.2 | Very low | 30.4 | Very low | 109 Ų | 109 | 124.8 Ų | 124.8 | 76% | 0.762 | 76% | 0.758 | S | S | * | * | -177.3 | 110.4 | 119.6 | -78 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 527 | K | 30.4 | Very low | 30.3 | Very low | 172 Ų | 172 | 121.2 Ų | 121.2 | 75% | 0.748 | 75% | 0.752 | S | S | * | * | 68.9 | 97 | 94.9 | -95.9 | -175 | 168 | -88.2 | 0 | 116 | |||||
| 528 | E | 28.3 | Very low | 30.3 | Very low | 151 Ų | 151 | 123.1 Ų | 123.1 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | 73.9 | 92.1 | 111.6 | -165.6 | 166.9 | -143.7 | 0 | 0 | 119.2 | |||||
| 529 | S | 30.1 | Very low | 30.2 | Very low | 103 Ų | 103 | 121.2 Ų | 121.2 | 72% | 0.72 | 75% | 0.754 | S | S | * | * | trans | -161.6 | 150.5 | 132 | -161.4 | 0 | 0 | 0 | 0 | 112.6 | Q531 | S529-Q531 VanDerWaalsContact O-CG 3.24Å; S529-Q531 WeakPolarHBondContact O-CG 3.45Å | ||
| 530 | A | 37.7 | Very low | 29.1 | Very low | 100 Ų | 100 | 121.9 Ų | 121.9 | 83% | 0.826 | 76% | 0.762 | S | S | * | * | S | Bend | trans | 12 | 119.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||
| 531 | Q | 40.8 | Very low | 29.1 | Very low | 142 Ų | 142 | 126.6 Ų | 126.6 | 66% | 0.664 | 77% | 0.769 | S | S | * | * | trans | -145.3 | 162.9 | -148.5 | -58.5 | 172.8 | -97.2 | 0 | 0 | 115.5 | S529 | S529-Q531 VanDerWaalsContact O-CG 3.24Å; S529-Q531 WeakPolarHBondContact O-CG 3.45Å | ||
| 532 | H | 31.6 | Very low | 29.1 | Very low | 164 Ų | 164 | 127.5 Ų | 127.5 | 76% | 0.759 | 77% | 0.771 | S | S | * | * | trans | 47.8 | 113 | 160.3 | -58 | -61.8 | 0 | 0 | 0 | 118.4 | ||||
| 533 | A | 29.7 | Very low | 29.1 | Very low | 101 Ų | 101 | 128.9 Ų | 128.9 | 84% | 0.835 | 77% | 0.774 | S | S | * | * | cis | 83.5 | 127.9 | 29.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 534 | G | 29.5 | Very low | 29 | Very low | 84 Ų | 84 | 129 Ų | 129 | 87% | 0.866 | 77% | 0.774 | S | S | * | * | trans | 99.3 | 117 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 535 | G | 27.1 | Very low | 29 | Very low | 75 Ų | 75 | 126 Ų | 126 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | cis | 114.5 | 75 | -10.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 536 | L | 30.9 | Very low | 29 | Very low | 174 Ų | 174 | 131.4 Ų | 131.4 | 91% | 0.911 | 78% | 0.78 | S | S | * | * | trans | -151.5 | 151.5 | 168.5 | -70 | 179.1 | 0 | 0 | 0 | 108.5 | ||||
| 537 | S | 26.9 | Very low | 28.8 | Very low | 94 Ų | 94 | 137.5 Ų | 137.5 | 66% | 0.657 | 79% | 0.786 | S | S | * | * | cis | -168.9 | 143.5 | -17.5 | 176 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 538 | S | 26.8 | Very low | 28.6 | Very low | 101 Ų | 101 | 134.3 Ų | 134.3 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | trans | 64.4 | 150.9 | 157.4 | -57.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 539 | T | 28.1 | Very low | 28.5 | Very low | 139 Ų | 139 | 136 Ų | 136 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | cis | -151.8 | 155 | -4.4 | 1 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 540 | S | 27 | Very low | 28.4 | Very low | 121 Ų | 121 | 136.6 Ų | 136.6 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | trans | -97 | 178.2 | -177.7 | -161.7 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 541 | E | 25.5 | Very low | 27.9 | Very low | 181 Ų | 181 | 138.6 Ų | 138.6 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | trans | -96.4 | 160.4 | -156.6 | -58 | -177 | 109.3 | 0 | 0 | 117.2 | ||||
| 542 | M | 25 | Very low | 28.5 | Very low | 163 Ų | 163 | 137.3 Ų | 137.3 | 80% | 0.803 | 79% | 0.793 | S | S | * | * | trans | 13.1 | 142.8 | 148.1 | -101.2 | -167 | 150.5 | 0 | 0 | 124.5 | ||||
| 543 | L | 26.6 | Very low | 28.3 | Very low | 137 Ų | 137 | 138.9 Ų | 138.9 | 72% | 0.717 | 80% | 0.798 | S | S | * | * | trans | 95 | 143.6 | 131.6 | -82 | 169.9 | 0 | 0 | 0 | 123.2 | ||||
| 544 | S | 25.2 | Very low | 28.8 | Very low | 98 Ų | 98 | 139.9 Ų | 139.9 | 69% | 0.685 | 80% | 0.796 | S | S | * | * | trans | 71.5 | 156.4 | 146.4 | -83.5 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 545 | S | 24.8 | Very low | 28.9 | Very low | 115 Ų | 115 | 142 Ų | 142 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | cis | -160.2 | 171.5 | -21.5 | -107.6 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 546 | R | 26.3 | Very low | 30 | Very low | 236 Ų | 236 | 143.4 Ų | 143.4 | 89% | 0.891 | 79% | 0.787 | S | S | * | * | trans | -123.8 | 140.9 | -177.1 | -163.2 | -175 | -167.1 | -143.9 | 4.6 | 113.5 | ||||
| 547 | R | 26 | Very low | 29.8 | Very low | 237 Ų | 237 | 144.5 Ų | 144.5 | 89% | 0.894 | 79% | 0.785 | S | S | * | * | trans | 104.3 | 152.4 | 151.7 | -148.6 | 172.2 | -161 | -129.3 | 1.9 | 117.5 | ||||
| 548 | S | 26.3 | Very low | 30 | Very low | 104 Ų | 104 | 150.2 Ų | 150.2 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | -105.5 | 158.9 | -164.3 | -30.8 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 549 | Q | 26.8 | Very low | 30.1 | Very low | 186 Ų | 186 | 148.9 Ų | 148.9 | 87% | 0.869 | 80% | 0.8 | S | S | * | * | trans | 33.8 | 150.4 | 142.5 | -69.8 | -174.5 | 0.8 | 0 | 0 | 122.2 | ||||
| 550 | V | 27.9 | Very low | 30.2 | Very low | 116 Ų | 116 | 149.1 Ų | 149.1 | 70% | 0.703 | 80% | 0.801 | S | S | * | * | cis | -170.2 | 132.4 | -28.4 | 125.8 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 551 | D | 27.7 | Very low | 30.4 | Very low | 143 Ų | 143 | 147.6 Ų | 147.6 | 77% | 0.765 | 79% | 0.79 | S | S | * | * | trans | 49.7 | 177.4 | 162.1 | -58.7 | -35.4 | 0 | 0 | 0 | 120.8 | ||||
| 552 | P | 52.3 | Low | 30.7 | Very low | 114 Ų | 114 | 145.6 Ų | 145.6 | 74% | 0.74 | 79% | 0.786 | S | S | * | * | -131.7 | 146.5 | -73.9 | 39.5 | -25.2 | 0 | 0 | 0 | 117.6 | |||||
| 553 | K | 29.2 | Very low | 31 | Very low | 197 Ų | 197 | 146.5 Ų | 146.5 | 86% | 0.857 | 79% | 0.785 | S | S | * | * | trans | 33.2 | 121.9 | 138.8 | -162.2 | 167.1 | -174.5 | 177.5 | 0 | 119.6 | ||||
| 554 | P | 38.3 | Very low | 31.1 | Very low | 123 Ų | 123 | 145.9 Ų | 145.9 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | -151.7 | -170.2 | 87.5 | 41.1 | -22.4 | 0 | 0 | 0 | 117 | |||||
| 555 | T | 31.7 | Very low | 31.3 | Very low | 127 Ų | 127 | 144.3 Ų | 144.3 | 78% | 0.779 | 79% | 0.786 | S | S | * | * | trans | -135.8 | -177.4 | -178.9 | 58.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 556 | P | 51 | Low | 31.4 | Very low | 105 Ų | 105 | 146.3 Ų | 146.3 | 68% | 0.682 | 79% | 0.793 | S | S | * | * | cis | -127.9 | 174.6 | -36.3 | 37 | -22.7 | 0 | 0 | 0 | 113.7 | ||||
| 557 | K | 27.1 | Very low | 31.6 | Very low | 198 Ų | 198 | 138.1 Ų | 138.1 | 86% | 0.861 | 78% | 0.782 | S | S | * | * | trans | 168.9 | 143.5 | 136.9 | -94.4 | 154.6 | -174.4 | 170.9 | 0 | 116.8 | ||||
| 558 | K | 30.9 | Very low | 31.6 | Very low | 214 Ų | 214 | 133.2 Ų | 133.2 | 93% | 0.93 | 78% | 0.784 | S | S | * | * | trans | 50.7 | 125.2 | 153 | -79 | -171.5 | 172.2 | -176.2 | 0 | 122.9 | ||||
| 559 | G | 29.6 | Very low | 31.9 | Very low | 73 Ų | 73 | 132.3 Ų | 132.3 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | trans | 174.6 | 133.4 | 157.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 560 | V | 29.9 | Very low | 31.9 | Very low | 144 Ų | 144 | 129.3 Ų | 129.3 | 87% | 0.873 | 79% | 0.79 | S | S | * | * | trans | -148.2 | 144.7 | -159.8 | -175.9 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 561 | S | 29.5 | Very low | 32 | Very low | 88 Ų | 88 | 127.9 Ų | 127.9 | 62% | 0.615 | 79% | 0.791 | S | S | * | * | trans | 129.4 | 110.2 | 138.8 | -167.2 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 562 | N | 31.9 | Very low | 32.1 | Very low | 140 Ų | 140 | 128.3 Ų | 128.3 | 75% | 0.749 | 80% | 0.798 | S | S | * | * | trans | 55 | 155.6 | 131.2 | -55.5 | -33.2 | 0 | 0 | 0 | 120.9 | ||||
| 563 | K | 32.4 | Very low | 31 | Very low | 182 Ų | 182 | 125.8 Ų | 125.8 | 79% | 0.791 | 79% | 0.793 | S | S | * | * | cis | -160 | -178.9 | -1.6 | -132.7 | 178.8 | -179.4 | 177.7 | 0 | 111 | ||||
| 564 | T | 29.5 | Very low | 31 | Very low | 123 Ų | 123 | 126 Ų | 126 | 76% | 0.755 | 80% | 0.797 | S | S | * | * | trans | -20.6 | 150 | 157.1 | 49 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 565 | G | 27.5 | Very low | 30.5 | Very low | 65 Ų | 65 | 127.1 Ų | 127.1 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | cis | 115.3 | 160.9 | 22.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 566 | V | 28.4 | Very low | 30.4 | Very low | 158 Ų | 158 | 131.3 Ų | 131.3 | 96% | 0.958 | 80% | 0.798 | S | S | * | * | trans | 71.9 | 144.3 | -176.2 | -167.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 567 | G | 29.5 | Very low | 29.2 | Very low | 63 Ų | 63 | 135 Ų | 135 | 65% | 0.649 | 81% | 0.808 | S | S | * | * | cis | 160.1 | 168.3 | -10.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 568 | S | 27 | Very low | 29.1 | Very low | 135 Ų | 135 | 137.5 Ų | 137.5 | 94% | 0.944 | 81% | 0.812 | S | S | * | * | trans | 54 | 110.8 | 163.3 | -59.7 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 569 | G | 31.1 | Very low | 29 | Very low | 84 Ų | 84 | 131.7 Ų | 131.7 | 87% | 0.866 | 80% | 0.804 | S | S | * | * | trans | -166.1 | 151.8 | 165 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 570 | S | 27.8 | Very low | 28.8 | Very low | 123 Ų | 123 | 137.9 Ų | 137.9 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -133.7 | 153.6 | -167.6 | -169.8 | 0 | 0 | 0 | 0 | 115 | ||||
| 571 | A | 29.3 | Very low | 28.7 | Very low | 86 Ų | 86 | 139.9 Ų | 139.9 | 71% | 0.711 | 80% | 0.797 | S | S | * | * | trans | 90.8 | 145.2 | 151.5 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 572 | V | 30.4 | Very low | 28.5 | Very low | 152 Ų | 152 | 146.5 Ų | 146.5 | 92% | 0.921 | 81% | 0.81 | S | S | * | * | trans | 75.1 | 121.2 | 168.7 | -165.5 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 573 | G | 28.5 | Very low | 28.3 | Very low | 61 Ų | 61 | 143.9 Ų | 143.9 | 63% | 0.629 | 81% | 0.808 | S | S | * | * | cis | 173.2 | -176.4 | -4.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 574 | Q | 29.3 | Very low | 27.9 | Very low | 201 Ų | 201 | 144.7 Ų | 144.7 | 94% | 0.939 | 82% | 0.815 | S | S | * | * | trans | 68.2 | 142.9 | -168.9 | -54.7 | -176.2 | -4.7 | 0 | 0 | 113.2 | ||||
| 575 | D | 28.4 | Very low | 27.8 | Very low | 148 Ų | 148 | 142.2 Ų | 142.2 | 79% | 0.791 | 81% | 0.813 | S | S | * | * | cis | -117.7 | 178.6 | 7.4 | -160.7 | 7.6 | 0 | 0 | 0 | 113.4 | ||||
| 576 | R | 29 | Very low | 27.9 | Very low | 214 Ų | 214 | 146.4 Ų | 146.4 | 81% | 0.808 | 82% | 0.819 | S | S | * | * | trans | -84.6 | 139.1 | 178.4 | -49.4 | 178.9 | -170.2 | -149.4 | 1.4 | 111.3 | ||||
| 577 | M | 26.4 | Very low | 28.1 | Very low | 182 Ų | 182 | 144.4 Ų | 144.4 | 90% | 0.897 | 81% | 0.81 | S | S | * | * | trans | -169.3 | 145.8 | 139.4 | -97.6 | -93.6 | -107.6 | 0 | 0 | 108.9 | ||||
| 578 | W | 25.8 | Very low | 28.1 | Very low | 251 Ų | 251 | 149.3 Ų | 149.3 | 95% | 0.951 | 81% | 0.813 | S | S | * | * | trans | -80.7 | 122 | -176.5 | -84.1 | -87.6 | 0 | 0 | 0 | 111.8 | ||||
| 579 | A | 27 | Very low | 28.3 | Very low | 92 Ų | 92 | 149.3 Ų | 149.3 | 76% | 0.76 | 80% | 0.803 | S | S | * | * | trans | -152.3 | 117.3 | 169.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 580 | R | 27 | Very low | 28.2 | Very low | 203 Ų | 203 | 153.9 Ų | 153.9 | 77% | 0.766 | 80% | 0.799 | S | S | * | * | 176.7 | 130.3 | 127.1 | -97.5 | -176.4 | -157.7 | -72.9 | 4.9 | 112.6 | |||||
| 581 | R | 27.2 | Very low | 28.2 | Very low | 186 Ų | 186 | 157.1 Ų | 157.1 | 70% | 0.702 | 80% | 0.797 | S | S | * | * | trans | 27.1 | 127.5 | 137.3 | -53.1 | -173.5 | -60.1 | -168.5 | 2.9 | 119 | ||||
| 582 | Y | 26.3 | Very low | 28 | Very low | 227 Ų | 227 | 156.8 Ų | 156.8 | 89% | 0.89 | 79% | 0.794 | S | S | * | * | -148.6 | 163.6 | 89.5 | -79.3 | -84.3 | 0 | 0 | 0 | 107.4 | |||||
| 583 | A | 25.7 | Very low | 28 | Very low | 86 Ų | 86 | 156.1 Ų | 156.1 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | cis | -170.9 | -177.8 | -32.4 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 584 | E | 24.4 | Very low | 28 | Very low | 199 Ų | 199 | 161.4 Ų | 161.4 | 93% | 0.93 | 80% | 0.799 | S | S | * | * | trans | -65.9 | 155.1 | -178.5 | -61.5 | 158.1 | 126 | 0 | 0 | 113.2 | ||||
| 585 | G | 27.4 | Very low | 27.9 | Very low | 70 Ų | 70 | 155.4 Ų | 155.4 | 72% | 0.722 | 79% | 0.791 | S | S | * | * | trans | -173.1 | 58.9 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 586 | L | 31 | Very low | 27.9 | Very low | 153 Ų | 153 | 154.3 Ų | 154.3 | 80% | 0.801 | 79% | 0.79 | S | S | * | * | trans | -64 | 144.7 | 161.7 | -165.5 | 77.4 | 0 | 0 | 0 | 109.3 | K588 | L586-K588 HydrophobicContact CD2-CG 4.34Š| ||
| 587 | P | 31.6 | Very low | 27.8 | Very low | 116 Ų | 116 | 148.8 Ų | 148.8 | 75% | 0.753 | 79% | 0.79 | S | S | * | * | -141.1 | 139.1 | 125.2 | 35.2 | -22.9 | 0 | 0 | 0 | 114.4 | |||||
| 588 | K | 30.5 | Very low | 27.8 | Very low | 166 Ų | 166 | 145.3 Ų | 145.3 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | -69.4 | 149.2 | 166.8 | -73.2 | -172.4 | 178.4 | -174 | 0 | 112.7 | L586 | L586-K588 HydrophobicContact CD2-CG 4.34Š| ||
| 589 | D | 29.6 | Very low | 27.8 | Very low | 136 Ų | 136 | 136.2 Ų | 136.2 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | trans | 44 | 134.5 | 137.4 | -51.9 | -38.3 | 0 | 0 | 0 | 122.9 | ||||
| 590 | K | 29.1 | Very low | 27.9 | Very low | 180 Ų | 180 | 142 Ų | 142 | 78% | 0.783 | 78% | 0.783 | S | S | * | * | trans | -173.6 | 134.7 | 143.2 | -96.7 | 136.9 | -168 | 164.8 | 0 | 108.1 | ||||
| 591 | K | 28.1 | Very low | 28.5 | Very low | 190 Ų | 190 | 137.7 Ų | 137.7 | 83% | 0.826 | 78% | 0.781 | S | S | * | * | cis | -162.9 | 136.8 | 3.8 | 169.3 | -176.4 | 172.7 | -171.6 | 0 | 111.5 | ||||
| 592 | A | 26.2 | Very low | 28.3 | Very low | 79 Ų | 79 | 133.2 Ų | 133.2 | 65% | 0.653 | 78% | 0.784 | S | S | * | * | trans | 49.8 | 124.7 | 153.4 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 593 | T | 29.7 | Very low | 28.4 | Very low | 138 Ų | 138 | 127.5 Ų | 127.5 | 85% | 0.847 | 78% | 0.777 | S | S | * | * | -143.8 | 98.3 | 117.9 | -62.9 | 0 | 0 | 0 | 0 | 105.2 | |||||
| 594 | Q | 29.5 | Very low | 28.5 | Very low | 172 Ų | 172 | 132.7 Ų | 132.7 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | 56.7 | 93.7 | 89.4 | -168.9 | 170.4 | 2.5 | 0 | 0 | 113.4 | |||||
| 595 | G | 26.6 | Very low | 28.7 | Very low | 75 Ų | 75 | 129.1 Ų | 129.1 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | trans | -110 | 140.6 | 166.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 596 | V | 27.9 | Very low | 28.8 | Very low | 125 Ų | 125 | 133.2 Ų | 133.2 | 76% | 0.758 | 77% | 0.771 | S | S | * | * | trans | -143.9 | 100.9 | 169.8 | 179.7 | 0 | 0 | 0 | 0 | 103.5 | ||||
| 597 | A | 26.6 | Very low | 28.7 | Very low | 98 Ų | 98 | 129.8 Ų | 129.8 | 81% | 0.81 | 77% | 0.772 | S | S | * | * | 70.1 | 84.3 | 75.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 598 | A | 26.3 | Very low | 28.5 | Very low | 109 Ų | 109 | 127.8 Ų | 127.8 | 90% | 0.901 | 77% | 0.773 | S | S | * | * | trans | -162 | 131.5 | 152.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 599 | G | 26.2 | Very low | 28.9 | Very low | 61 Ų | 61 | 129.4 Ų | 129.4 | 63% | 0.629 | 78% | 0.78 | S | S | * | * | trans | -152.8 | 138.9 | 169.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 600 | F | 28.5 | Very low | 28.8 | Very low | 214 Ų | 214 | 131 Ų | 131 | 94% | 0.939 | 79% | 0.788 | S | S | * | * | trans | -159.5 | 162.6 | 172.5 | -90 | -51.4 | 0 | 0 | 0 | 108.7 | ||||
| 601 | P | 40.2 | Very low | 28.9 | Very low | 111 Ų | 111 | 127.4 Ų | 127.4 | 72% | 0.721 | 79% | 0.786 | S | S | * | * | -128.4 | 174.5 | -129.8 | 41.2 | -26.8 | 0 | 0 | 0 | 116 | |||||
| 602 | A | 23.8 | Very low | 28.9 | Very low | 92 Ų | 92 | 124.1 Ų | 124.1 | 76% | 0.76 | 78% | 0.782 | S | S | * | * | trans | -138.3 | 131.6 | 149.6 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 603 | S | 28.1 | Very low | 29 | Very low | 107 Ų | 107 | 129.9 Ų | 129.9 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | cis | 82.3 | 102.1 | 42.2 | -59.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 604 | R | 27.4 | Very low | 28.9 | Very low | 195 Ų | 195 | 128.4 Ų | 128.4 | 74% | 0.736 | 79% | 0.794 | S | S | * | * | trans | 170.7 | 143.8 | 153.3 | -99.3 | 172.3 | -179.3 | -145.5 | -2 | 108.2 | ||||
| 605 | D | 29.1 | Very low | 28.7 | Very low | 124 Ų | 124 | 123.9 Ų | 123.9 | 66% | 0.663 | 79% | 0.794 | S | S | * | * | cis | -152.3 | 160.7 | -22.5 | -147.2 | -16.2 | 0 | 0 | 0 | 106.4 | K1149 | D605-K1149 IonicContact OD2-NZ 3.15Š| ||
| 606 | D | 29.6 | Very low | 29 | Very low | 156 Ų | 156 | 125.8 Ų | 125.8 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | -117.9 | 150.4 | -177 | -163.4 | -1 | 0 | 0 | 0 | 111.9 | ||||
| 607 | G | 29.3 | Very low | 29.8 | Very low | 81 Ų | 81 | 125 Ų | 125 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | 179.9 | 60.2 | -168 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 608 | G | 27 | Very low | 29.7 | Very low | 74 Ų | 74 | 129.7 Ų | 129.7 | 76% | 0.763 | 80% | 0.795 | S | S | * | * | trans | -150.3 | 109.3 | 170 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 609 | K | 37.6 | Very low | 29.8 | Very low | 200 Ų | 200 | 130.4 Ų | 130.4 | 87% | 0.87 | 79% | 0.792 | S | S | * | * | trans | -87.3 | 150.9 | 179.7 | -63.6 | 172.9 | -177.4 | 170.7 | 0 | 111.5 | ||||
| 610 | N | 29 | Very low | 30.4 | Very low | 169 Ų | 169 | 132.8 Ų | 132.8 | 90% | 0.904 | 80% | 0.797 | S | S | * | * | trans | -169.2 | 162.7 | 130.1 | -91.5 | -23.6 | 0 | 0 | 0 | 111.4 | ||||
| 611 | S | 31.1 | Very low | 30.4 | Very low | 106 Ų | 106 | 127.4 Ų | 127.4 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | trans | -85 | 166.8 | -168.8 | 55.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 612 | T | 28.1 | Very low | 29.9 | Very low | 120 Ų | 120 | 129.9 Ų | 129.9 | 74% | 0.736 | 79% | 0.788 | S | S | * | * | -173.9 | 121.7 | 79.9 | -69.1 | 0 | 0 | 0 | 0 | 114 | |||||
| 613 | K | 27.3 | Very low | 30 | Very low | 200 Ų | 200 | 131.3 Ų | 131.3 | 87% | 0.87 | 78% | 0.782 | S | S | * | * | trans | 55.4 | 108.5 | 142.1 | -165.5 | -178.4 | -175.6 | 179.6 | 0 | 120.1 | ||||
| 614 | A | 27.1 | Very low | 30 | Very low | 107 Ų | 107 | 134 Ų | 134 | 88% | 0.884 | 78% | 0.78 | S | S | * | * | trans | -126.2 | 147.4 | 148.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 615 | G | 25.6 | Very low | 29.9 | Very low | 78 Ų | 78 | 132.6 Ų | 132.6 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | -114.6 | 141.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 616 | S | 33 | Very low | 29.8 | Very low | 115 Ų | 115 | 131.5 Ų | 131.5 | 80% | 0.804 | 78% | 0.779 | S | S | * | * | trans | -85.5 | 166.7 | 169 | 65.6 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 617 | P | 44.4 | Very low | 29.8 | Very low | 108 Ų | 108 | 132.2 Ų | 132.2 | 70% | 0.701 | 78% | 0.777 | S | S | * | * | -148.6 | 153.5 | 88.6 | 37.5 | -20.3 | 0 | 0 | 0 | 117.3 | |||||
| 618 | K | 25.3 | Very low | 29.8 | Very low | 196 Ų | 196 | 135.1 Ų | 135.1 | 85% | 0.852 | 77% | 0.769 | S | S | * | * | trans | 62 | 111.1 | 146.3 | -68.5 | 172.2 | 178.8 | -179.1 | 0 | 120.5 | ||||
| 619 | C | 28.7 | Very low | 30 | Very low | 124 Ų | 124 | 135.2 Ų | 135.2 | 84% | 0.838 | 76% | 0.763 | S | S | * | * | trans | -85.5 | 159 | 135.6 | -49.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 620 | P | 37.6 | Very low | 29.6 | Very low | 112 Ų | 112 | 132.7 Ų | 132.7 | 73% | 0.727 | 76% | 0.759 | S | S | * | * | trans | -114.5 | 129.2 | 134.6 | 33.9 | -26.1 | 0 | 0 | 0 | 108.7 | ||||
| 621 | S | 29.7 | Very low | 29.9 | Very low | 101 Ų | 101 | 128.7 Ų | 128.7 | 71% | 0.706 | 74% | 0.744 | S | S | * | * | 64.6 | 110.9 | 53.8 | 83.8 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 622 | Q | 28.9 | Very low | 30.4 | Very low | 163 Ų | 163 | 129.4 Ų | 129.4 | 76% | 0.762 | 75% | 0.746 | S | S | * | * | -178.7 | 128.2 | 127.9 | -82.7 | -113.6 | -15.5 | 0 | 0 | 111.4 | |||||
| 623 | L | 26.4 | Very low | 30.4 | Very low | 122 Ų | 122 | 128.6 Ų | 128.6 | 64% | 0.639 | 75% | 0.752 | S | S | * | * | trans | 45.1 | 149.1 | 130.8 | -72.3 | 66.5 | 0 | 0 | 0 | 120.4 | ||||
| 624 | K | 28.3 | Very low | 30.6 | Very low | 163 Ų | 163 | 124.2 Ų | 124.2 | 71% | 0.709 | 74% | 0.738 | S | S | * | * | cis | -170.8 | 151.3 | 3.7 | -122.6 | 178.4 | -172.6 | 178.1 | 0 | 110.7 | ||||
| 625 | H | 25 | Very low | 30.7 | Very low | 165 Ų | 165 | 125.5 Ų | 125.5 | 76% | 0.764 | 73% | 0.73 | S | S | * | * | trans | 58.2 | 167.7 | 149.4 | -85.1 | -125 | 0 | 0 | 0 | 119.1 | ||||
| 626 | V | 26.8 | Very low | 31 | Very low | 102 Ų | 102 | 126.6 Ų | 126.6 | 62% | 0.618 | 73% | 0.725 | S | S | * | * | cis | -179.1 | 166.9 | -41.8 | 132.6 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 627 | E | 29.6 | Very low | 31 | Very low | 170 Ų | 170 | 133.3 Ų | 133.3 | 79% | 0.794 | 73% | 0.733 | S | S | * | * | trans | 67.9 | 95.5 | 169.5 | -81.6 | 160.8 | 104.1 | 0 | 0 | 119.2 | ||||
| 628 | E | 29.5 | Very low | 30.3 | Very low | 142 Ų | 142 | 131.1 Ų | 131.1 | 66% | 0.664 | 73% | 0.73 | S | S | * | * | 34.4 | 128.4 | 107.5 | -172.8 | 156.6 | -133 | 0 | 0 | 120.6 | |||||
| 629 | A | 31.1 | Very low | 30.6 | Very low | 77 Ų | 77 | 128 Ų | 128 | 64% | 0.636 | 73% | 0.727 | S | S | * | * | -176.6 | 151.3 | 115.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 630 | N | 29.3 | Very low | 30.7 | Very low | 147 Ų | 147 | 129.9 Ų | 129.9 | 79% | 0.786 | 72% | 0.721 | S | S | * | * | trans | 65.9 | 104.7 | 151.6 | -62.3 | -38.9 | 0 | 0 | 0 | 121.6 | ||||
| 631 | S | 34.5 | Very low | 30.4 | Very low | 84 Ų | 84 | 133.9 Ų | 133.9 | 59% | 0.587 | 73% | 0.727 | S | S | * | * | trans | -64.8 | 167.2 | 144.3 | -59.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 632 | P | 42.3 | Very low | 30.3 | Very low | 122 Ų | 122 | 135 Ų | 135 | 79% | 0.792 | 73% | 0.73 | S | S | * | * | -153.4 | 170.1 | 102.1 | 40.2 | -23.9 | 0 | 0 | 0 | 117.7 | |||||
| 633 | A | 27.5 | Very low | 30 | Very low | 103 Ų | 103 | 131.8 Ų | 131.8 | 85% | 0.851 | 73% | 0.726 | S | S | * | * | trans | 78.1 | 143 | 150.1 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 634 | N | 31.7 | Very low | 30 | Very low | 108 Ų | 108 | 133.4 Ų | 133.4 | 58% | 0.578 | 73% | 0.734 | S | S | * | * | trans | -151.6 | 176.9 | 178.2 | -163.6 | -14.7 | 0 | 0 | 0 | 108 | L278 | L278-N634 HydrophobicContact CD1-CB 4.33Å; L278-N634 VanDerWaalsContact CD1-ND2 3.34Å; L278-N634 WeakPolarHBondContact CD1-ND2 3.39Å | ||
| 635 | N | 30.5 | Very low | 30 | Very low | 133 Ų | 133 | 132.3 Ų | 132.3 | 71% | 0.711 | 74% | 0.741 | S | S | * | * | trans | 77.1 | 157.1 | 176.5 | -50.1 | -52.2 | 0 | 0 | 0 | 116.5 | ||||
| 636 | S | 31.5 | Very low | 30.2 | Very low | 102 Ų | 102 | 128.8 Ų | 128.8 | 71% | 0.713 | 74% | 0.74 | S | S | * | * | cis | -171.4 | 156 | -34.7 | 63.6 | 0 | 0 | 0 | 0 | 110 | ||||
| 637 | R | 33.2 | Very low | 30.2 | Very low | 255 Ų | 255 | 132.5 Ų | 132.5 | 96% | 0.962 | 75% | 0.751 | S | S | * | * | trans | 172.5 | 139.3 | 156.1 | -99.4 | 163 | -161.7 | -125.5 | 5.2 | 108 | ||||
| 638 | G | 29.8 | Very low | 30.3 | Very low | 63 Ų | 63 | 128.2 Ų | 128.2 | 65% | 0.649 | 74% | 0.744 | S | S | * | * | cis | -157.1 | 147.3 | -15.2 | 0 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 639 | V | 30.6 | Very low | 30.5 | Very low | 129 Ų | 129 | 126.1 Ų | 126.1 | 78% | 0.782 | 75% | 0.745 | S | S | * | * | 57 | 117.4 | 62 | 178.5 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 640 | K | 31.7 | Very low | 30.6 | Very low | 165 Ų | 165 | 132 Ų | 132 | 72% | 0.717 | 76% | 0.757 | S | S | * | * | cis | -166.4 | 140.4 | -8 | -108.6 | 168.5 | -159.9 | 167.2 | 0 | 106.3 | ||||
| 641 | K | 31.2 | Very low | 30.8 | Very low | 196 Ų | 196 | 130 Ų | 130 | 85% | 0.852 | 75% | 0.754 | S | S | * | * | trans | 61.8 | 142.9 | 154.7 | -63.6 | 178.1 | 179.1 | -178.5 | 0 | 117.1 | ||||
| 642 | T | 27.2 | Very low | 30.6 | Very low | 124 Ų | 124 | 131.4 Ų | 131.4 | 76% | 0.761 | 77% | 0.771 | S | S | * | * | cis | -153.5 | 158.3 | 7.6 | 46.2 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 643 | S | 23.1 | Very low | 29.9 | Very low | 96 Ų | 96 | 129.1 Ų | 129.1 | 67% | 0.671 | 77% | 0.77 | S | S | * | * | trans | 61.9 | 112.8 | 140.4 | -174.9 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 644 | L | 24.9 | Very low | 30.1 | Very low | 155 Ų | 155 | 129.3 Ų | 129.3 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | trans | 72.2 | 123 | 144.9 | -72.6 | 168.6 | 0 | 0 | 0 | 121.6 | ||||
| 645 | V | 29.7 | Very low | 30 | Very low | 141 Ų | 141 | 131.8 Ų | 131.8 | 86% | 0.855 | 78% | 0.779 | S | S | * | * | trans | 75.7 | 104.6 | 144.5 | -177.9 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 646 | A | 27.9 | Very low | 30.1 | Very low | 91 Ų | 91 | 131.7 Ų | 131.7 | 75% | 0.752 | 78% | 0.778 | S | S | * | * | trans | -159.3 | 150.6 | 145.2 | 0 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 647 | E | 27.9 | Very low | 30 | Very low | 179 Ų | 179 | 132.4 Ų | 132.4 | 84% | 0.836 | 77% | 0.774 | S | S | * | * | cis | -148.6 | 152.5 | -1.9 | -130.3 | -171.5 | 122.5 | 0 | 0 | 110.8 | ||||
| 648 | A | 30.5 | Very low | 29.7 | Very low | 80 Ų | 80 | 126.9 Ų | 126.9 | 66% | 0.661 | 76% | 0.759 | S | S | * | * | trans | 32.1 | 150.2 | 137.8 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 649 | S | 33.9 | Very low | 29.6 | Very low | 98 Ų | 98 | 129.2 Ų | 129.2 | 69% | 0.685 | 76% | 0.756 | S | S | * | * | cis | -154.6 | 158.5 | 22.8 | -64.6 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 650 | K | 34.3 | Very low | 29.6 | Very low | 201 Ų | 201 | 131.9 Ų | 131.9 | 87% | 0.874 | 76% | 0.757 | S | S | * | * | trans | 68.4 | 140.1 | 159.4 | -64.6 | 158.9 | -176 | 174.2 | 0 | 117.8 | ||||
| 651 | S | 32.6 | Very low | 29.5 | Very low | 106 Ų | 106 | 129.6 Ų | 129.6 | 74% | 0.741 | 76% | 0.762 | S | S | * | * | cis | -166.1 | 132.2 | -13.6 | 48.6 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 652 | A | 30.4 | Very low | 29.4 | Very low | 112 Ų | 112 | 131.6 Ų | 131.6 | 93% | 0.926 | 76% | 0.764 | S | S | * | * | trans | 58.4 | 133 | 153.9 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 653 | G | 27.9 | Very low | 29.4 | Very low | 75 Ų | 75 | 130.7 Ų | 130.7 | 77% | 0.773 | 76% | 0.759 | S | S | * | * | trans | 136.5 | 64.1 | 139.9 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 654 | A | 32.1 | Very low | 29.6 | Very low | 107 Ų | 107 | 134.6 Ų | 134.6 | 88% | 0.884 | 77% | 0.766 | S | S | * | * | trans | 60.4 | 161.1 | 148.3 | 0 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 655 | H | 29.8 | Very low | 29.7 | Very low | 160 Ų | 160 | 133.6 Ų | 133.6 | 74% | 0.741 | 76% | 0.762 | S | S | * | * | cis | -175.7 | 136.6 | -26.6 | 177 | -123.2 | 0 | 0 | 0 | 110.4 | ||||
| 656 | L | 32 | Very low | 29.6 | Very low | 130 Ų | 130 | 134.4 Ų | 134.4 | 68% | 0.681 | 76% | 0.76 | S | S | * | * | trans | 63.3 | 157.7 | 166.3 | -75.6 | -178.8 | 0 | 0 | 0 | 119.7 | ||||
| 657 | N | 28.8 | Very low | 29.6 | Very low | 118 Ų | 118 | 133.7 Ų | 133.7 | 63% | 0.631 | 76% | 0.762 | S | S | * | * | cis | -147.3 | 165.2 | -19.6 | -156 | 23.6 | 0 | 0 | 0 | 114.4 | ||||
| 658 | E | 28.3 | Very low | 29.5 | Very low | 138 Ų | 138 | 130.9 Ų | 130.9 | 65% | 0.645 | 76% | 0.762 | S | S | * | * | trans | -12.6 | 160.1 | 160.1 | -77.8 | -179.6 | 109.6 | 0 | 0 | 126.9 | ||||
| 659 | N | 27.7 | Very low | 30.2 | Very low | 112 Ų | 112 | 132.4 Ų | 132.4 | 60% | 0.599 | 77% | 0.765 | S | S | * | * | trans | 81.1 | 101.9 | 134.6 | -75.1 | -30.4 | 0 | 0 | 0 | 124.2 | ||||
| 660 | K | 30.5 | Very low | 29.9 | Very low | 185 Ų | 185 | 137.5 Ų | 137.5 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | 50.5 | 119.2 | 113.7 | -89.1 | 176.8 | 179.2 | 167.6 | 0 | 121 | |||||
| 661 | S | 29.3 | Very low | 29.8 | Very low | 117 Ų | 117 | 134 Ų | 134 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | 108.6 | 159.9 | 117.8 | 80.3 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 662 | R | 28.6 | Very low | 29.5 | Very low | 239 Ų | 239 | 135.4 Ų | 135.4 | 90% | 0.902 | 76% | 0.755 | S | S | * | * | trans | 92.7 | 171.4 | 166.4 | -132.9 | 166.9 | -174.3 | 174 | 1.7 | 117.8 | ||||
| 663 | T | 26.1 | Very low | 29.4 | Very low | 104 Ų | 104 | 142.4 Ų | 142.4 | 64% | 0.638 | 76% | 0.758 | S | S | * | * | trans | -134.4 | 155.2 | -141.9 | 47.5 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 664 | Q | 27.9 | Very low | 29.5 | Very low | 179 Ų | 179 | 142.6 Ų | 142.6 | 84% | 0.836 | 76% | 0.76 | S | S | * | * | trans | 67.6 | 153.2 | 171.7 | -66.1 | 154.7 | -32.5 | 0 | 0 | 112.3 | ||||
| 665 | D | 27.5 | Very low | 29.4 | Very low | 133 Ų | 133 | 142.2 Ų | 142.2 | 71% | 0.711 | 76% | 0.756 | S | S | * | * | cis | -157.1 | -177.1 | 33.1 | -152.1 | -3.1 | 0 | 0 | 0 | 113.4 | ||||
| 666 | L | 28.5 | Very low | 30.2 | Very low | 158 Ų | 158 | 139.9 Ų | 139.9 | 83% | 0.827 | 76% | 0.755 | S | S | * | * | trans | 35.2 | 133.8 | 151.1 | -70.5 | 162.3 | 0 | 0 | 0 | 122 | ||||
| 667 | G | 27.4 | Very low | 30.1 | Very low | 76 Ų | 76 | 145 Ų | 145 | 78% | 0.784 | 77% | 0.766 | S | S | * | * | trans | 130.5 | 131.5 | 132.6 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 668 | S | 25.6 | Very low | 30.7 | Very low | 120 Ų | 120 | 145.3 Ų | 145.3 | 84% | 0.839 | 77% | 0.774 | S | S | * | * | trans | -86.6 | 175.8 | 148.9 | -62.7 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 669 | P | 46.1 | Very low | 30.8 | Very low | 112 Ų | 112 | 147.3 Ų | 147.3 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | cis | -143.6 | -175.3 | 10.7 | 41.6 | -21.2 | 0 | 0 | 0 | 117.2 | ||||
| 670 | R | 27.3 | Very low | 31.7 | Very low | 206 Ų | 206 | 147.1 Ų | 147.1 | 78% | 0.777 | 79% | 0.789 | S | S | * | * | trans | 66.9 | 123 | 143.3 | -93.8 | -167.5 | 171.3 | -148.2 | 10.9 | 122.7 | ||||
| 671 | Q | 30.6 | Very low | 32.5 | Very low | 127 Ų | 127 | 144.6 Ų | 144.6 | 59% | 0.593 | 79% | 0.791 | S | S | * | * | 83.5 | 126.4 | 127.2 | -84.7 | -174.9 | -42.3 | 0 | 0 | 123.4 | |||||
| 672 | N | 26.8 | Very low | 32.4 | Very low | 136 Ų | 136 | 143.9 Ų | 143.9 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | 79.2 | 123.9 | 137.3 | -63 | -10.7 | 0 | 0 | 0 | 121.4 | ||||
| 673 | R | 29.3 | Very low | 32.4 | Very low | 259 Ų | 259 | 137.3 Ų | 137.3 | 98% | 0.977 | 79% | 0.789 | S | S | * | * | 118.8 | 130.4 | 122.5 | -152.9 | -179.2 | -149.4 | -143 | 6.9 | 115.5 | |||||
| 674 | G | 28.9 | Very low | 32.6 | Very low | 79 Ų | 79 | 137.9 Ų | 137.9 | 81% | 0.814 | 80% | 0.797 | S | S | * | * | trans | 103.6 | 139.3 | 160.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 675 | A | 30.8 | Very low | 33.4 | Very low | 98 Ų | 98 | 134.3 Ų | 134.3 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | trans | -126.6 | -177.9 | 164.8 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 676 | P | 47.2 | Very low | 33.4 | Very low | 111 Ų | 111 | 138.7 Ų | 138.7 | 72% | 0.721 | 80% | 0.796 | S | S | * | * | cis | -142.9 | 176.9 | 7.8 | 43.5 | -25.4 | 0 | 0 | 0 | 117.6 | ||||
| 677 | R | 29.2 | Very low | 33.4 | Very low | 238 Ų | 238 | 137.8 Ų | 137.8 | 90% | 0.898 | 79% | 0.791 | S | S | * | * | trans | 63.4 | 166.4 | 162.4 | -79 | -177.6 | 165 | -155.8 | -3.4 | 117.5 | ||||
| 678 | P | 41.9 | Very low | 33.6 | Very low | 124 Ų | 124 | 139.2 Ų | 139.2 | 81% | 0.805 | 79% | 0.785 | S | S | * | * | cis | -122.9 | -151.9 | -38.2 | 37.3 | -20 | 0 | 0 | 0 | 111.9 | ||||
| 679 | Q | 30.7 | Very low | 34.2 | Very low | 180 Ų | 180 | 138.8 Ų | 138.8 | 84% | 0.841 | 78% | 0.78 | S | S | * | * | trans | -76.2 | -174.2 | 179.3 | -59.1 | 179.2 | -13.7 | 0 | 0 | 113.8 | ||||
| 680 | P | 45.9 | Very low | 33.5 | Very low | 109 Ų | 109 | 141 Ų | 141 | 71% | 0.708 | 78% | 0.784 | S | S | * | * | -123.8 | -142.4 | -62.6 | 40.9 | -23.3 | 0 | 0 | 0 | 108.5 | |||||
| 681 | P | 48 | Very low | 33.6 | Very low | 131 Ų | 131 | 136.7 Ų | 136.7 | 85% | 0.851 | 79% | 0.786 | S | S | * | * | cis | -121 | -146.9 | -28.1 | 41.3 | -23.4 | 0 | 0 | 0 | 112.6 | ||||
| 682 | A | 26 | Very low | 33.5 | Very low | 102 Ų | 102 | 134.7 Ų | 134.7 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | -94.9 | 159.8 | -162.1 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 683 | A | 29 | Very low | 33.7 | Very low | 102 Ų | 102 | 139.5 Ų | 139.5 | 84% | 0.843 | 80% | 0.799 | S | S | * | * | trans | -154.5 | 159 | 155.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 684 | S | 29.4 | Very low | 33.8 | Very low | 116 Ų | 116 | 132.2 Ų | 132.2 | 81% | 0.811 | 79% | 0.788 | S | S | * | * | trans | -108 | -169.9 | 170.6 | -66.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 685 | P | 45.8 | Very low | 33.8 | Very low | 104 Ų | 104 | 137.1 Ų | 137.1 | 68% | 0.675 | 79% | 0.787 | S | S | * | * | cis | -150.2 | 175.3 | 9.2 | 46.4 | -27 | 0 | 0 | 0 | 119.3 | ||||
| 686 | R | 27.1 | Very low | 33.7 | Very low | 225 Ų | 225 | 143.9 Ų | 143.9 | 85% | 0.849 | 79% | 0.791 | S | S | * | * | trans | 61.5 | 157.9 | 150.2 | -72.8 | 179.4 | 178.4 | -152.8 | 1.9 | 118.7 | ||||
| 687 | L | 28.3 | Very low | 32.9 | Very low | 138 Ų | 138 | 141.9 Ų | 141.9 | 72% | 0.723 | 79% | 0.791 | S | S | * | * | cis | -152.9 | 174.3 | -5 | -121.6 | 169.7 | 0 | 0 | 0 | 111.8 | ||||
| 688 | T | 32.7 | Very low | 32.9 | Very low | 106 Ų | 106 | 134.9 Ų | 134.9 | 65% | 0.65 | 78% | 0.784 | S | S | * | * | trans | -79.3 | 163.6 | -178.7 | 54.2 | 0 | 0 | 0 | 0 | 115 | ||||
| 689 | P | 38.3 | Very low | 32.2 | Very low | 112 Ų | 112 | 135.7 Ų | 135.7 | 73% | 0.727 | 78% | 0.781 | S | S | * | * | -116.7 | 144.6 | 91.7 | -6.9 | 27.2 | 0 | 0 | 0 | 113.8 | |||||
| 690 | L | 30.6 | Very low | 32.1 | Very low | 157 Ų | 157 | 136.5 Ų | 136.5 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | 57.8 | 126.6 | 90.4 | -53.1 | 177.5 | 0 | 0 | 0 | 113.3 | |||||
| 691 | S | 29.2 | Very low | 31.3 | Very low | 116 Ų | 116 | 136.5 Ų | 136.5 | 81% | 0.811 | 78% | 0.775 | S | S | * | * | cis | -146.8 | 168.4 | 25.5 | -140.5 | 0 | 0 | 0 | 0 | 111 | ||||
| 692 | A | 29.5 | Very low | 30.4 | Very low | 85 Ų | 85 | 135.5 Ų | 135.5 | 70% | 0.702 | 77% | 0.766 | S | S | * | * | cis | -148.8 | 147.1 | 12.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 693 | R | 29.9 | Very low | 30.4 | Very low | 237 Ų | 237 | 139.3 Ų | 139.3 | 89% | 0.894 | 77% | 0.766 | S | S | * | * | trans | 60.6 | 127.9 | 145.8 | -157.5 | 168.4 | -171.6 | 161.2 | 2.3 | 121.9 | ||||
| 694 | S | 31.4 | Very low | 30.4 | Very low | 106 Ų | 106 | 139.2 Ų | 139.2 | 74% | 0.741 | 76% | 0.76 | S | S | * | * | trans | 64.4 | 123.5 | 165.3 | -102.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 695 | K | 29.9 | Very low | 30.4 | Very low | 182 Ų | 182 | 144.2 Ų | 144.2 | 79% | 0.791 | 76% | 0.761 | S | S | * | * | cis | 59.7 | 133.1 | 28.8 | -69 | -171.2 | 177.9 | -179.8 | 0 | 115.5 | ||||
| 696 | R | 26.8 | Very low | 29.5 | Very low | 240 Ų | 240 | 146.3 Ų | 146.3 | 91% | 0.906 | 77% | 0.765 | S | S | * | * | cis | -173.3 | 154.3 | -22 | -126.4 | -176.8 | -166.2 | -162.8 | 3.8 | 107.8 | ||||
| 697 | G | 30.6 | Very low | 29.5 | Very low | 69 Ų | 69 | 142.1 Ų | 142.1 | 71% | 0.711 | 76% | 0.764 | S | S | * | * | trans | 121.4 | 113.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 698 | A | 29.1 | Very low | 29.5 | Very low | 92 Ų | 92 | 139.2 Ų | 139.2 | 76% | 0.76 | 77% | 0.767 | S | S | * | * | cis | 65.6 | 133.4 | 12.5 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 699 | L | 29 | Very low | 29.3 | Very low | 141 Ų | 141 | 141.2 Ų | 141.2 | 74% | 0.738 | 78% | 0.78 | S | S | * | * | cis | -157.2 | 146.9 | 9.6 | -162.3 | 82.2 | 0 | 0 | 0 | 111.7 | ||||
| 700 | R | 28.3 | Very low | 28.7 | Very low | 196 Ų | 196 | 141.2 Ų | 141.2 | 74% | 0.74 | 79% | 0.789 | S | S | * | * | trans | 66.6 | 163.4 | 165.1 | -83.4 | 170.7 | -179.4 | 178.7 | -3.5 | 115 | ||||
| 701 | T | 28.7 | Very low | 28.6 | Very low | 110 Ų | 110 | 137.3 Ų | 137.3 | 68% | 0.675 | 79% | 0.787 | S | S | * | * | cis | -142.9 | 155.6 | 18.8 | -29.6 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 702 | T | 27.8 | Very low | 28.5 | Very low | 109 Ų | 109 | 141 Ų | 141 | 67% | 0.669 | 79% | 0.788 | S | S | * | * | trans | 61.4 | 148.8 | 153.8 | 36.8 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 703 | E | 26.9 | Very low | 28.5 | Very low | 183 Ų | 183 | 140.6 Ų | 140.6 | 86% | 0.855 | 79% | 0.785 | S | S | * | * | cis | -151.2 | -157.7 | -13.1 | -145.7 | 148.8 | -135 | 0 | 0 | 110.7 | ||||
| 704 | S | 28.8 | Very low | 28.5 | Very low | 100 Ų | 100 | 136.1 Ų | 136.1 | 70% | 0.699 | 77% | 0.774 | S | S | * | * | trans | -125.3 | 151.3 | -167.6 | 67.2 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 705 | R | 29.1 | Very low | 28.4 | Very low | 221 Ų | 221 | 134.1 Ų | 134.1 | 83% | 0.834 | 76% | 0.757 | S | S | * | * | trans | 79.3 | 119 | 147.6 | -165.7 | -170.8 | -74.8 | -147.5 | -2.4 | 118.7 | ||||
| 706 | I | 27.7 | Very low | 28.4 | Very low | 148 Ų | 148 | 127.5 Ų | 127.5 | 76% | 0.759 | 73% | 0.734 | S | S | * | * | 13.4 | 119.7 | 128.9 | -40.5 | 172.4 | 0 | 0 | 0 | 114.5 | |||||
| 707 | T | 27.3 | Very low | 28.6 | Very low | 137 Ų | 137 | 120.1 Ų | 120.1 | 84% | 0.84 | 72% | 0.716 | S | S | * | * | -156.2 | 160.7 | 74.5 | 44 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 708 | G | 27.9 | Very low | 28.5 | Very low | 76 Ų | 76 | 122.7 Ų | 122.7 | 78% | 0.784 | 72% | 0.723 | S | S | * | * | trans | 110.2 | 128.7 | 153.5 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 709 | T | 28.4 | Very low | 28.4 | Very low | 149 Ų | 149 | 121.7 Ų | 121.7 | 91% | 0.914 | 72% | 0.721 | S | S | * | * | trans | -131.2 | 102.1 | 180 | 49.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 710 | A | 26.3 | Very low | 28.3 | Very low | 111 Ų | 111 | 124.6 Ų | 124.6 | 92% | 0.917 | 73% | 0.731 | S | S | * | * | trans | -167.6 | 145 | 157.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 711 | G | 27.9 | Very low | 28.3 | Very low | 76 Ų | 76 | 118.4 Ų | 118.4 | 78% | 0.784 | 73% | 0.728 | S | S | * | * | cis | -161 | -176.2 | -2.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 712 | K | 28.1 | Very low | 28.3 | Very low | 194 Ų | 194 | 117.4 Ų | 117.4 | 84% | 0.843 | 73% | 0.725 | S | S | * | * | trans | -67.7 | 168.8 | 178.5 | -63.7 | 175.2 | -178.5 | 173 | 0 | 111.6 | ||||
| 713 | A | 28.1 | Very low | 28.4 | Very low | 75 Ų | 75 | 120.2 Ų | 120.2 | 62% | 0.62 | 73% | 0.731 | S | S | * | * | cis | -149.5 | 152.9 | 21.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 714 | Q | 30.8 | Very low | 28.6 | Very low | 143 Ų | 143 | 120.7 Ų | 120.7 | 67% | 0.668 | 73% | 0.73 | S | S | * | * | 55.4 | 136.5 | 86.8 | -53.4 | -175.8 | -91.6 | 0 | 0 | 114 | |||||
| 715 | T | 29.9 | Very low | 28.6 | Very low | 65 Ų | 65 | 120.2 Ų | 120.2 | 40% | 0.399 | 73% | 0.732 | S | S | . | * | cis | -176.4 | 171.5 | 2.7 | 20.7 | 0 | 0 | 0 | 0 | 106 | L56 | L56-T715 VanDerWaalsContact CD2-C 3.41Å; L56-T715 VanDerWaalsContact CD2-O 3.26Å; L56-T715 WeakPolarHBondContact CD2-O 3.48Å | ||
| 716 | S | 29.2 | Very low | 28.5 | Very low | 42 Ų | 42 | 116.6 Ų | 116.6 | 29% | 0.294 | 73% | 0.734 | S | S | . | * | cis | 153 | 162.3 | -18.6 | 70.2 | 0 | 0 | 0 | 0 | 108.2 | L56 S57 E58 | L56-S716 WeakPolarHBondContact CD2-O 3.3Å; S57-S716 PolarHBondContact OG-N 3.16Å; S57-S716 PolarHBondContact OG-O 3.41Å; E58-S716 WeakPolarHBondContact OE1-CA 3.47Å; E58-S716 VanDerWaalsContact OE2-C 3.24Å | ||
| 717 | T | 30.1 | Very low | 28.6 | Very low | 86 Ų | 86 | 112.6 Ų | 112.6 | 53% | 0.528 | 73% | 0.729 | S | S | . | * | 172.4 | 128.6 | 120.7 | 25.1 | 0 | 0 | 0 | 0 | 112.9 | E58 | E58-T717 PolarHBondContact OE2-N 3.37Š| |||
| 718 | S | 28.8 | Very low | 28.9 | Very low | 123 Ų | 123 | 112 Ų | 112 | 86% | 0.86 | 73% | 0.726 | S | S | * | * | 64.2 | 120.2 | 88.7 | -170.3 | 0 | 0 | 0 | 0 | 116.5 | |||||
| 719 | G | 27.8 | Very low | 28.9 | Very low | 70 Ų | 70 | 115.7 Ų | 115.7 | 72% | 0.722 | 72% | 0.723 | S | S | * | * | trans | 152.4 | 140.9 | 165.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 720 | E | 27.5 | Very low | 28.9 | Very low | 202 Ų | 202 | 116.1 Ų | 116.1 | 94% | 0.944 | 72% | 0.715 | S | S | * | * | cis | -163.1 | 149.2 | -12.9 | -158.3 | 171.9 | -168.9 | 0 | 0 | 111.4 | ||||
| 721 | G | 28.1 | Very low | 28.7 | Very low | 66 Ų | 66 | 116.8 Ų | 116.8 | 68% | 0.68 | 71% | 0.707 | S | S | * | * | trans | 76.6 | 172.7 | 159.3 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 722 | S | 28.3 | Very low | 28.9 | Very low | 89 Ų | 89 | 118.1 Ų | 118.1 | 62% | 0.622 | 70% | 0.704 | S | S | * | * | cis | -166.6 | 135.8 | -20.7 | -124.8 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 723 | H | 30.2 | Very low | 28.5 | Very low | 168 Ų | 168 | 115 Ų | 115 | 78% | 0.778 | 70% | 0.702 | S | S | * | * | trans | 65.3 | 170.6 | 156.5 | -42.9 | -47 | 0 | 0 | 0 | 117.2 | ||||
| 724 | K | 29.5 | Very low | 28.5 | Very low | 193 Ų | 193 | 114.5 Ų | 114.5 | 84% | 0.839 | 70% | 0.704 | S | S | * | * | cis | -157.8 | 169.8 | 8.5 | -151.2 | 163 | -175 | 176.7 | 0 | 111.9 | ||||
| 725 | A | 29.2 | Very low | 28.2 | Very low | 90 Ų | 90 | 114.6 Ų | 114.6 | 74% | 0.744 | 71% | 0.707 | S | S | * | * | trans | 73.1 | 152.3 | 150.6 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 726 | V | 27.4 | Very low | 27.9 | Very low | 145 Ų | 145 | 120.4 Ų | 120.4 | 88% | 0.879 | 73% | 0.727 | S | S | * | * | cis | -166 | 154.1 | -36.1 | 110.1 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 727 | G | 30.3 | Very low | 28 | Very low | 64 Ų | 64 | 126.6 Ų | 126.6 | 66% | 0.66 | 76% | 0.756 | S | S | * | * | trans | 86.4 | 155.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 728 | T | 32.4 | Very low | 27.7 | Very low | 125 Ų | 125 | 130.1 Ų | 130.1 | 77% | 0.767 | 77% | 0.766 | S | S | * | * | cis | -151 | 148.6 | 6.6 | -42 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 729 | E | 29.3 | Very low | 27.5 | Very low | 153 Ų | 153 | 131.6 Ų | 131.6 | 72% | 0.715 | 76% | 0.76 | S | S | * | * | trans | 62 | 109.2 | 177.6 | -49.6 | -48.9 | 78.8 | 0 | 0 | 117.1 | ||||
| 730 | E | 28.1 | Very low | 27.4 | Very low | 159 Ų | 159 | 135 Ų | 135 | 74% | 0.743 | 76% | 0.761 | S | S | * | * | 77.7 | 105.5 | 80.3 | -63.1 | -103.3 | 124.4 | 0 | 0 | 111.7 | |||||
| 731 | T | 22.5 | Very low | 27.3 | Very low | 124 Ų | 124 | 129.1 Ų | 129.1 | 76% | 0.761 | 75% | 0.747 | S | S | * | * | cis | 81.2 | 65.4 | 40.6 | -44.4 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 732 | S | 30.2 | Very low | 27.2 | Very low | 104 Ų | 104 | 132.5 Ų | 132.5 | 73% | 0.727 | 76% | 0.757 | S | S | * | * | trans | -130.2 | 126.4 | 145.8 | 45.1 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 733 | T | 21.3 | Very low | 27.1 | Very low | 130 Ų | 130 | 137 Ų | 137 | 80% | 0.798 | 77% | 0.765 | S | S | * | * | 60 | 117.9 | 59.9 | 72.3 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 734 | G | 27 | Very low | 27.4 | Very low | 63 Ų | 63 | 134.2 Ų | 134.2 | 65% | 0.649 | 76% | 0.762 | S | S | * | * | trans | 109.6 | 86.1 | -167.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 735 | I | 25.1 | Very low | 27.8 | Very low | 146 Ų | 146 | 130.5 Ų | 130.5 | 75% | 0.749 | 76% | 0.758 | S | S | * | * | 64.1 | 108.5 | 56.9 | -50.9 | 167.7 | 0 | 0 | 0 | 112.3 | |||||
| 736 | K | 24.4 | Very low | 28.1 | Very low | 186 Ų | 186 | 134.8 Ų | 134.8 | 81% | 0.809 | 76% | 0.762 | S | S | * | * | trans | 69 | 161.4 | 167.6 | -65.3 | 165.6 | -170.4 | 171.4 | 0 | 114.2 | ||||
| 737 | L | 31.2 | Very low | 28.2 | Very low | 172 Ų | 172 | 133.4 Ų | 133.4 | 90% | 0.901 | 75% | 0.754 | S | S | * | * | cis | -106 | 136.5 | 5.1 | -72.8 | 79.5 | 0 | 0 | 0 | 113.1 | ||||
| 738 | H | 23.6 | Very low | 28.2 | Very low | 161 Ų | 161 | 139 Ų | 139 | 75% | 0.745 | 77% | 0.768 | S | S | * | * | trans | -89 | -179.4 | 160.3 | -170.8 | -83.6 | 0 | 0 | 0 | 108.5 | ||||
| 739 | Q | 24.3 | Very low | 28 | Very low | 154 Ų | 154 | 136.6 Ų | 136.6 | 72% | 0.72 | 77% | 0.769 | S | S | * | * | trans | 81.1 | 153 | 169.4 | -46.2 | 170.6 | 25.2 | 0 | 0 | 112.3 | ||||
| 740 | N | 25.9 | Very low | 28 | Very low | 142 Ų | 142 | 140.8 Ų | 140.8 | 76% | 0.759 | 78% | 0.778 | S | S | * | * | cis | -135.2 | 149.8 | 27.4 | -67.3 | -89.9 | 0 | 0 | 0 | 113.7 | ||||
| 741 | A | 23.9 | Very low | 28.3 | Very low | 77 Ų | 77 | 138.4 Ų | 138.4 | 64% | 0.636 | 78% | 0.778 | S | S | * | * | trans | -78 | 147.5 | 159.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | K743 | A741-K743 PolarHBondContact O-N 3.28Š| ||
| 742 | P | 26 | Very low | 28.7 | Very low | 137 Ų | 137 | 136.9 Ų | 136.9 | 89% | 0.89 | 77% | 0.773 | S | S | * | * | trans | -72.8 | 74.2 | 153.7 | 33.3 | -32.2 | 0 | 0 | 0 | 108.5 | ||||
| 743 | K | 28.2 | Very low | 28.9 | Very low | 184 Ų | 184 | 139.1 Ų | 139.1 | 80% | 0.8 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 154.1 | 160.6 | -99.1 | -161.8 | 171.9 | -172.4 | 0 | 109.1 | A741 | A741-K743 PolarHBondContact O-N 3.28Š|
| 744 | P | 35.7 | Very low | 29.3 | Very low | 110 Ų | 110 | 139.6 Ų | 139.6 | 71% | 0.714 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 159.4 | 171.1 | 27.6 | -35.4 | 0 | 0 | 0 | 110.9 | Q746 | P744-Q746 PolarHBondContact O-N 3.22Š|
| 745 | P | 37 | Very low | 29.3 | Very low | 115 Ų | 115 | 139.9 Ų | 139.9 | 75% | 0.747 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -62.8 | 128.8 | -174.2 | 25 | -34.7 | 0 | 0 | 0 | 112.9 | ||
| 746 | Q | 35.3 | Very low | 29.7 | Very low | 180 Ų | 180 | 144.6 Ų | 144.6 | 84% | 0.841 | 79% | 0.79 | S | S | * | * | trans | 53.1 | 134.8 | 143 | -49.2 | 178.7 | 5.9 | 0 | 0 | 117.3 | P744 | P744-Q746 PolarHBondContact O-N 3.22Š| ||
| 747 | T | 29.5 | Very low | 30.8 | Very low | 116 Ų | 116 | 140.9 Ų | 140.9 | 71% | 0.712 | 79% | 0.785 | S | S | * | * | cis | -172.6 | 151.1 | 41.5 | -29.4 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 748 | L | 31.8 | Very low | 30.7 | Very low | 180 Ų | 180 | 139 Ų | 139 | 94% | 0.942 | 78% | 0.78 | S | S | * | * | trans | 61.8 | 154.4 | 161 | -70.9 | 155.2 | 0 | 0 | 0 | 121.1 | ||||
| 749 | G | 28.7 | Very low | 31.1 | Very low | 76 Ų | 76 | 137.4 Ų | 137.4 | 78% | 0.784 | 78% | 0.781 | S | S | * | * | trans | -172.6 | -128.3 | -169.8 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 750 | R | 29 | Very low | 31.9 | Very low | 241 Ų | 241 | 135.4 Ų | 135.4 | 91% | 0.909 | 78% | 0.782 | S | S | * | * | trans | 112.2 | 125.9 | 167.9 | -163.6 | -176.1 | -174 | -167.4 | 3.3 | 119.8 | ||||
| 751 | S | 33.4 | Very low | 32 | Very low | 108 Ų | 108 | 135.1 Ų | 135.1 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | trans | 69.8 | 157.2 | 153.4 | -79.7 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 752 | S | 31.4 | Very low | 32.3 | Very low | 92 Ų | 92 | 142.6 Ų | 142.6 | 64% | 0.643 | 80% | 0.796 | S | S | * | * | cis | -174.4 | 140.5 | -9.6 | 165.8 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 753 | L | 34.5 | Very low | 33.1 | Very low | 151 Ų | 151 | 141.7 Ų | 141.7 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | 60.6 | 126.1 | 148.2 | -91.5 | 77.6 | 0 | 0 | 0 | 127.8 | ||||
| 754 | V | 29.2 | Very low | 33.8 | Very low | 140 Ų | 140 | 138.8 Ų | 138.8 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | 56 | 140 | 120.9 | 173.4 | 0 | 0 | 0 | 0 | 123.8 | |||||
| 755 | G | 27 | Very low | 33.6 | Very low | 69 Ų | 69 | 142.6 Ų | 142.6 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | 164.3 | 139.1 | 149.4 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 756 | R | 33.2 | Very low | 33.2 | Very low | 246 Ų | 246 | 146 Ų | 146 | 93% | 0.928 | 80% | 0.799 | S | S | * | * | trans | 177.5 | 177.2 | 171.5 | -115.7 | -177.2 | 177.4 | -158.5 | -1.1 | 109.3 | ||||
| 757 | P | 47.8 | Very low | 32.9 | Very low | 108 Ų | 108 | 143.8 Ų | 143.8 | 70% | 0.701 | 79% | 0.791 | S | S | * | * | cis | -131.9 | -137.9 | -13.7 | 35.2 | -11.9 | 0 | 0 | 0 | 112.3 | ||||
| 758 | V | 29.8 | Very low | 32.8 | Very low | 131 Ų | 131 | 143.3 Ų | 143.3 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | trans | 91 | 151.1 | 165 | -176.8 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 759 | V | 32.4 | Very low | 32.5 | Very low | 129 Ų | 129 | 140.1 Ų | 140.1 | 78% | 0.782 | 78% | 0.781 | S | S | * | * | trans | -141.2 | 140.7 | -165.7 | 164.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 760 | P | 41.2 | Very low | 32.5 | Very low | 112 Ų | 112 | 145.2 Ų | 145.2 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | -155.7 | 174.3 | 114.8 | 36.9 | -15.9 | 0 | 0 | 0 | 118.2 | |||||
| 761 | V | 28.1 | Very low | 32.5 | Very low | 135 Ų | 135 | 137 Ų | 137 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | 89.2 | 112.1 | 158.9 | -166.4 | 0 | 0 | 0 | 0 | 120 | ||||
| 762 | R | 29.8 | Very low | 32.3 | Very low | 235 Ų | 235 | 141 Ų | 141 | 89% | 0.887 | 78% | 0.784 | S | S | * | * | trans | -95.4 | 165.7 | 147.8 | -74.1 | 175.8 | 169.4 | 172.2 | -4.2 | 107.8 | ||||
| 763 | P | 42.2 | Very low | 32 | Very low | 117 Ų | 117 | 144.3 Ų | 144.3 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | cis | -140.2 | -148.7 | 30.3 | 42.8 | -19.3 | 0 | 0 | 0 | 111.2 | ||||
| 764 | P | 43.7 | Very low | 31.9 | Very low | 124 Ų | 124 | 141.1 Ų | 141.1 | 81% | 0.805 | 78% | 0.784 | S | S | * | * | cis | -127.7 | -153.3 | -2.7 | 40.5 | -19.3 | 0 | 0 | 0 | 115.8 | ||||
| 765 | K | 31.6 | Very low | 31.9 | Very low | 189 Ų | 189 | 143.4 Ų | 143.4 | 82% | 0.822 | 78% | 0.783 | S | S | * | * | trans | -123.5 | 162.9 | -153.7 | -54.2 | 174.3 | 177.8 | 175.6 | 0 | 114.5 | ||||
| 766 | K | 27.6 | Very low | 31.9 | Very low | 187 Ų | 187 | 147.1 Ų | 147.1 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | trans | 70.5 | 151.7 | 157.2 | -75.8 | -175.9 | 169.8 | -168.6 | 0 | 115.5 | ||||
| 767 | I | 30.1 | Very low | 31.7 | Very low | 133 Ų | 133 | 141.8 Ų | 141.8 | 68% | 0.682 | 78% | 0.781 | S | S | * | * | cis | -154.2 | 165.4 | 10.5 | -130.4 | 161 | 0 | 0 | 0 | 111.3 | ||||
| 768 | S | 26.5 | Very low | 31.3 | Very low | 106 Ų | 106 | 142 Ų | 142 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | trans | 69.5 | 153.5 | 160.5 | -81.3 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 769 | V | 25.8 | Very low | 31 | Very low | 114 Ų | 114 | 142 Ų | 142 | 69% | 0.691 | 78% | 0.783 | S | S | * | * | cis | -164.8 | 153.8 | -29.4 | 101 | 0 | 0 | 0 | 0 | 111 | ||||
| 770 | M | 27.9 | Very low | 30.7 | Very low | 182 Ų | 182 | 141.6 Ų | 141.6 | 90% | 0.897 | 79% | 0.785 | S | S | * | * | trans | 55.4 | 157.2 | 169.6 | -76.6 | -164.7 | -71.6 | 0 | 0 | 119.1 | ||||
| 771 | G | 28.6 | Very low | 29.9 | Very low | 69 Ų | 69 | 139.9 Ų | 139.9 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | trans | -140.2 | -178.4 | 165.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 772 | Q | 29.3 | Very low | 29.9 | Very low | 193 Ų | 193 | 144.9 Ų | 144.9 | 90% | 0.902 | 79% | 0.792 | S | S | * | * | trans | -159.5 | 135.2 | 170.2 | -117.7 | -179.5 | 21.1 | 0 | 0 | 111.3 | ||||
| 773 | D | 26.2 | Very low | 29.9 | Very low | 160 Ų | 160 | 138.1 Ų | 138.1 | 86% | 0.856 | 79% | 0.786 | S | S | * | * | trans | -134.1 | 149.3 | 143.4 | -99.8 | -47.4 | 0 | 0 | 0 | 106.3 | ||||
| 774 | S | 31.5 | Very low | 29.3 | Very low | 85 Ų | 85 | 136.2 Ų | 136.2 | 59% | 0.594 | 78% | 0.78 | S | S | * | * | cis | -179.8 | 121.8 | -31.6 | 167.3 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 775 | K | 29.2 | Very low | 28.7 | Very low | 188 Ų | 188 | 137.8 Ų | 137.8 | 82% | 0.817 | 78% | 0.777 | S | S | * | * | trans | 175.8 | 148.8 | 137.3 | -98.7 | 154 | -171 | 172.1 | 0 | 115.3 | ||||
| 776 | N | 28 | Very low | 28.6 | Very low | 147 Ų | 147 | 136.7 Ų | 136.7 | 79% | 0.786 | 77% | 0.772 | S | S | * | * | trans | 84 | 89.5 | 159 | -57 | -10 | 0 | 0 | 0 | 119.1 | ||||
| 777 | T | 27.8 | Very low | 28.7 | Very low | 134 Ų | 134 | 132.1 Ų | 132.1 | 82% | 0.822 | 76% | 0.764 | S | S | * | * | trans | -29.1 | 165 | 143.4 | 25.8 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 778 | P | 39.1 | Very low | 28.6 | Very low | 113 Ų | 113 | 132.1 Ų | 132.1 | 73% | 0.734 | 77% | 0.77 | S | S | * | * | cis | -146 | -172.2 | 29.1 | 31 | -4.7 | 0 | 0 | 0 | 119 | ||||
| 779 | V | 23.9 | Very low | 29.4 | Very low | 131 Ų | 131 | 133 Ų | 133 | 79% | 0.794 | 77% | 0.773 | S | S | * | * | trans | 93.7 | 94.2 | 155.2 | -169.4 | 0 | 0 | 0 | 0 | 121 | ||||
| 780 | S | 25.8 | Very low | 29.6 | Very low | 119 Ų | 119 | 133.9 Ų | 133.9 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | 63.3 | 106.8 | 127.8 | -173.3 | 0 | 0 | 0 | 0 | 124.8 | |||||
| 781 | G | 26.1 | Very low | 29.7 | Very low | 76 Ų | 76 | 134 Ų | 134 | 78% | 0.784 | 77% | 0.768 | S | S | * | * | trans | 86.7 | 165.4 | 132.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 782 | R | 27 | Very low | 29.7 | Very low | 241 Ų | 241 | 135.6 Ų | 135.6 | 91% | 0.909 | 77% | 0.769 | S | S | * | * | cis | -166.4 | 131.1 | -10.2 | 167.3 | -178.5 | 174.8 | -123.5 | 3 | 110.4 | ||||
| 783 | A | 30.1 | Very low | 29.6 | Very low | 92 Ų | 92 | 131 Ų | 131 | 76% | 0.76 | 76% | 0.758 | S | S | * | * | trans | 66.6 | 160.2 | 159.6 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 784 | A | 29.4 | Very low | 29.8 | Very low | 77 Ų | 77 | 130.8 Ų | 130.8 | 64% | 0.636 | 76% | 0.756 | S | S | * | * | cis | -171.7 | 156.6 | -25.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 785 | Q | 31.7 | Very low | 29.8 | Very low | 157 Ų | 157 | 134.2 Ų | 134.2 | 73% | 0.734 | 77% | 0.767 | S | S | * | * | trans | 70.4 | 158.3 | 152.5 | -74.5 | 171.2 | 36.7 | 0 | 0 | 117.7 | ||||
| 786 | K | 28.1 | Very low | 29.8 | Very low | 167 Ų | 167 | 135 Ų | 135 | 73% | 0.726 | 77% | 0.77 | S | S | * | * | cis | -155 | 134.3 | 8.8 | -132.9 | 158.2 | -176.9 | 148.8 | 0 | 114.9 | ||||
| 787 | S | 30.1 | Very low | 29.9 | Very low | 91 Ų | 91 | 132.4 Ų | 132.4 | 64% | 0.636 | 77% | 0.769 | S | S | * | * | trans | 46.8 | 101.9 | 139.1 | 63.6 | 0 | 0 | 0 | 0 | 124.8 | ||||
| 788 | T | 29.6 | Very low | 29.9 | Very low | 133 Ų | 133 | 134.9 Ų | 134.9 | 82% | 0.816 | 77% | 0.769 | S | S | * | * | 24.5 | 138.3 | 121.7 | 58.1 | 0 | 0 | 0 | 0 | 123.5 | |||||
| 789 | P | 42 | Very low | 29.3 | Very low | 123 Ų | 123 | 136.8 Ų | 136.8 | 80% | 0.799 | 77% | 0.772 | S | S | * | * | -135.8 | -179.6 | 124.2 | 39.6 | -28.7 | 0 | 0 | 0 | 114.4 | |||||
| 790 | I | 29.8 | Very low | 29.6 | Very low | 134 Ų | 134 | 138.3 Ų | 138.3 | 69% | 0.687 | 77% | 0.774 | S | S | * | * | -161 | 141.5 | -60 | -148.3 | 176.2 | 0 | 0 | 0 | 111.7 | |||||
| 791 | K | 29.7 | Very low | 29.7 | Very low | 183 Ų | 183 | 138 Ų | 138 | 80% | 0.796 | 77% | 0.771 | S | S | * | * | trans | 64.6 | 150.1 | 164.5 | -70.7 | 160 | -164.2 | 176.5 | 0 | 118.7 | ||||
| 792 | S | 28.7 | Very low | 29.7 | Very low | 104 Ų | 104 | 139 Ų | 139 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | cis | -161.9 | 165.9 | -4.4 | 43.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 793 | S | 28.1 | Very low | 30 | Very low | 96 Ų | 96 | 133.6 Ų | 133.6 | 67% | 0.671 | 77% | 0.769 | S | S | * | * | trans | 66.3 | 110.7 | 160.4 | 37.4 | 0 | 0 | 0 | 0 | 119 | ||||
| 794 | L | 29.7 | Very low | 30 | Very low | 156 Ų | 156 | 134.6 Ų | 134.6 | 82% | 0.817 | 77% | 0.77 | S | S | * | * | 75.7 | 128 | 71 | -68.2 | 166.1 | 0 | 0 | 0 | 112.4 | |||||
| 795 | L | 31.4 | Very low | 30.1 | Very low | 156 Ų | 156 | 141 Ų | 141 | 82% | 0.817 | 78% | 0.778 | S | S | * | * | cis | -151.6 | 155.7 | 6.3 | -101.9 | 163.8 | 0 | 0 | 0 | 112.1 | ||||
| 796 | K | 29.8 | Very low | 30.1 | Very low | 205 Ų | 205 | 139.6 Ų | 139.6 | 89% | 0.891 | 78% | 0.775 | S | S | * | * | trans | -135.2 | 140.3 | 156.9 | -165.6 | 173.3 | -175.3 | 177.8 | 0 | 108.9 | ||||
| 797 | A | 29.2 | Very low | 30.2 | Very low | 93 Ų | 93 | 139.7 Ų | 139.7 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | -88.5 | 129.8 | -166.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 798 | K | 28.3 | Very low | 30.2 | Very low | 186 Ų | 186 | 138.9 Ų | 138.9 | 81% | 0.809 | 79% | 0.79 | S | S | * | * | trans | 45.7 | 92.9 | 139.3 | -144.5 | 167.1 | -172.5 | 176.2 | 0 | 117 | ||||
| 799 | L | 27.8 | Very low | 30.1 | Very low | 152 Ų | 152 | 138.5 Ų | 138.5 | 80% | 0.796 | 79% | 0.792 | S | S | * | * | 74.6 | 121.1 | 78 | -76 | 165.1 | 0 | 0 | 0 | 115.3 | |||||
| 800 | I | 28.8 | Very low | 29.4 | Very low | 164 Ų | 164 | 135.9 Ų | 135.9 | 84% | 0.841 | 78% | 0.781 | S | S | * | * | -145.4 | 134.4 | 112.6 | -92.1 | 155.4 | 0 | 0 | 0 | 107.6 | |||||
| 801 | S | 27.9 | Very low | 29.3 | Very low | 111 Ų | 111 | 135.3 Ų | 135.3 | 78% | 0.776 | 78% | 0.784 | S | S | * | * | trans | -152.5 | 141.6 | 157.8 | -75 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 802 | A | 26 | Very low | 29.3 | Very low | 98 Ų | 98 | 133.9 Ų | 133.9 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | trans | -133.1 | 107.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 803 | P | 34.5 | Very low | 29.1 | Very low | 128 Ų | 128 | 134.4 Ų | 134.4 | 83% | 0.831 | 78% | 0.783 | S | S | * | * | trans | -91.7 | 178.4 | -179.3 | 36.7 | -35.2 | 0 | 0 | 0 | 113 | ||||
| 804 | S | 29.3 | Very low | 29 | Very low | 112 Ų | 112 | 134 Ų | 134 | 78% | 0.783 | 79% | 0.786 | S | S | * | * | trans | -59.8 | 131.6 | -174.3 | -171.9 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 805 | R | 32.2 | Very low | 28.9 | Very low | 213 Ų | 213 | 131 Ų | 131 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | 14.6 | 128.3 | 137 | -101.4 | -177.7 | 153.7 | 176.8 | -5.8 | 120 | ||||
| 806 | N | 30.2 | Very low | 29.1 | Very low | 127 Ų | 127 | 128.7 Ų | 128.7 | 68% | 0.679 | 78% | 0.781 | S | S | * | * | trans | 111.1 | 129.2 | 136.9 | -60.1 | -12.4 | 0 | 0 | 0 | 119.6 | ||||
| 807 | N | 31.7 | Very low | 29.1 | Very low | 168 Ų | 168 | 125.7 Ų | 125.7 | 90% | 0.898 | 78% | 0.78 | S | S | * | * | trans | 63.3 | 106.3 | 157.3 | -58.5 | -4.9 | 0 | 0 | 0 | 119.4 | ||||
| 808 | G | 30 | Very low | 29.2 | Very low | 74 Ų | 74 | 125.8 Ų | 125.8 | 76% | 0.763 | 77% | 0.774 | S | S | * | * | trans | 167 | 148.9 | 165.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 809 | S | 27.6 | Very low | 29.4 | Very low | 125 Ų | 125 | 126.7 Ų | 126.7 | 87% | 0.874 | 78% | 0.778 | S | S | * | * | trans | -168.2 | 159.5 | -175 | -104.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 810 | A | 26.6 | Very low | 29.3 | Very low | 69 Ų | 69 | 123 Ų | 123 | 57% | 0.57 | 78% | 0.777 | S | S | * | * | cis | -144.1 | 136.6 | 1.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 811 | T | 28 | Very low | 29.3 | Very low | 121 Ų | 121 | 120.5 Ų | 120.5 | 74% | 0.742 | 77% | 0.774 | S | S | * | * | 31.9 | 118 | 126.6 | -40.8 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 812 | L | 28.8 | Very low | 29.3 | Very low | 153 Ų | 153 | 120 Ų | 120 | 80% | 0.801 | 77% | 0.771 | S | S | * | * | trans | -162.9 | 103.4 | 135.1 | -89.1 | -161.8 | 0 | 0 | 0 | 108.9 | ||||
| 813 | T | 25.9 | Very low | 29.4 | Very low | 115 Ų | 115 | 120.8 Ų | 120.8 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | 74.4 | 137.9 | 101.9 | 55 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 814 | A | 26.3 | Very low | 29.2 | Very low | 88 Ų | 88 | 120.3 Ų | 120.3 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | cis | -170.3 | 162.1 | -10.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 815 | A | 27.6 | Very low | 29.3 | Very low | 92 Ų | 92 | 118.9 Ų | 118.9 | 76% | 0.76 | 77% | 0.765 | S | S | * | * | trans | 57.6 | 158.2 | 141.4 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 816 | S | 33.8 | Very low | 29.3 | Very low | 109 Ų | 109 | 114.9 Ų | 114.9 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | cis | -174.9 | 155.2 | -25.1 | -90.5 | 0 | 0 | 0 | 0 | 110 | ||||
| 817 | T | 30.2 | Very low | 29.6 | Very low | 142 Ų | 142 | 114.6 Ų | 114.6 | 87% | 0.871 | 77% | 0.767 | S | S | * | * | trans | -173.2 | 158.2 | 152.8 | 27.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 818 | S | 31.9 | Very low | 29.8 | Very low | 94 Ų | 94 | 113 Ų | 113 | 66% | 0.657 | 77% | 0.766 | S | S | * | * | cis | -174.7 | 156 | -33.9 | 67.4 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 819 | K | 32.6 | Very low | 29.8 | Very low | 205 Ų | 205 | 116.6 Ų | 116.6 | 89% | 0.891 | 77% | 0.767 | S | S | * | * | cis | -134.2 | -177.2 | 4.5 | -54 | 168.8 | -173.6 | 174.2 | 0 | 106.8 | ||||
| 820 | G | 25.4 | Very low | 29.9 | Very low | 75 Ų | 75 | 119.7 Ų | 119.7 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | cis | -161.1 | -173 | -0.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 821 | S | 28.1 | Very low | 30 | Very low | 111 Ų | 111 | 125.4 Ų | 125.4 | 78% | 0.776 | 78% | 0.776 | S | S | * | * | cis | -145.8 | 166.9 | 13.1 | -177.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 822 | S | 28.6 | Very low | 30.1 | Very low | 102 Ų | 102 | 125.9 Ų | 125.9 | 71% | 0.713 | 78% | 0.78 | S | S | * | * | trans | 84.3 | 115.3 | 156.3 | -51.7 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 823 | S | 28.8 | Very low | 30 | Very low | 113 Ų | 113 | 125.9 Ų | 125.9 | 79% | 0.79 | 78% | 0.78 | S | S | * | * | trans | 60.8 | 111.3 | 143 | 58.1 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 824 | S | 30.1 | Very low | 30.1 | Very low | 119 Ų | 119 | 130 Ų | 130 | 83% | 0.832 | 79% | 0.791 | S | S | * | * | 87.6 | 124.5 | 129.9 | -143.1 | 0 | 0 | 0 | 0 | 122.6 | |||||
| 825 | A | 30.5 | Very low | 30.4 | Very low | 82 Ų | 82 | 129.2 Ų | 129.2 | 68% | 0.678 | 79% | 0.792 | S | S | * | * | trans | 63.5 | 117.4 | 139.7 | 0 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 826 | V | 33.8 | Very low | 30.6 | Very low | 129 Ų | 129 | 134.4 Ų | 134.4 | 78% | 0.782 | 80% | 0.797 | S | S | * | * | 69 | 112.5 | 126 | -178.6 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 827 | T | 36.3 | Very low | 30.3 | Very low | 121 Ų | 121 | 135.9 Ų | 135.9 | 74% | 0.742 | 80% | 0.796 | S | S | * | * | trans | 19.7 | 145.1 | 148.2 | 67.6 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 828 | P | 35.2 | Very low | 30.3 | Very low | 134 Ų | 134 | 135 Ų | 135 | 87% | 0.87 | 79% | 0.789 | S | S | * | * | -142.2 | -171.7 | 103.1 | 39.3 | -26.1 | 0 | 0 | 0 | 115.6 | |||||
| 829 | L | 29.5 | Very low | 30 | Very low | 150 Ų | 150 | 137.5 Ų | 137.5 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | -136.2 | 129.9 | -161.4 | -174.4 | 77.9 | 0 | 0 | 0 | 114.8 | ||||
| 830 | K | 30.1 | Very low | 29.9 | Very low | 190 Ų | 190 | 135.2 Ų | 135.2 | 83% | 0.826 | 78% | 0.783 | S | S | * | * | trans | 57.5 | 161.1 | 154.7 | -74.7 | -179.2 | 177 | 178.4 | 0 | 121.9 | ||||
| 831 | K | 29.6 | Very low | 29.9 | Very low | 188 Ų | 188 | 136.9 Ų | 136.9 | 82% | 0.817 | 78% | 0.779 | S | S | * | * | trans | -61.9 | 152.9 | 176.9 | -59.7 | 177.7 | 176 | -179.1 | 0 | 113.5 | ||||
| 832 | T | 28.3 | Very low | 29.9 | Very low | 132 Ų | 132 | 142.1 Ų | 142.1 | 81% | 0.81 | 78% | 0.783 | S | S | * | * | trans | -69 | 154.3 | 156.2 | 45.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 833 | N | 27.8 | Very low | 30 | Very low | 152 Ų | 152 | 142.8 Ų | 142.8 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | trans | -169 | 110.8 | 151.6 | -118.1 | -4.6 | 0 | 0 | 0 | 110.4 | ||||
| 834 | H | 27.5 | Very low | 29.9 | Very low | 203 Ų | 203 | 140.9 Ų | 140.9 | 94% | 0.94 | 79% | 0.785 | S | S | * | * | trans | -164.5 | 154.4 | 143.4 | -91.6 | -64 | 0 | 0 | 0 | 107.1 | ||||
| 835 | G | 32.2 | Very low | 30.2 | Very low | 71 Ų | 71 | 141.3 Ų | 141.3 | 73% | 0.732 | 78% | 0.782 | S | S | * | * | trans | -94.6 | 169.8 | -168 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 836 | K | 32.1 | Very low | 30.1 | Very low | 200 Ų | 200 | 144.1 Ų | 144.1 | 87% | 0.87 | 79% | 0.791 | S | S | * | * | trans | 13.2 | 135.9 | 150 | -69.2 | -173.7 | 173.6 | -174 | 0 | 117.6 | ||||
| 837 | L | 28.9 | Very low | 29.9 | Very low | 141 Ų | 141 | 143.8 Ų | 143.8 | 74% | 0.738 | 79% | 0.785 | S | S | * | * | cis | -164.9 | 161.6 | 18.9 | -156.1 | 72 | 0 | 0 | 0 | 110 | ||||
| 838 | V | 28.3 | Very low | 29.7 | Very low | 122 Ų | 122 | 146 Ų | 146 | 74% | 0.739 | 78% | 0.784 | S | S | * | * | trans | 68.1 | 143.2 | 165.9 | -174.6 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 839 | E | 26.4 | Very low | 29.3 | Very low | 148 Ų | 148 | 146.5 Ų | 146.5 | 69% | 0.692 | 78% | 0.779 | S | S | * | * | cis | -167.4 | 161.4 | -28.8 | 176.8 | 163.3 | 174.1 | 0 | 0 | 109.4 | ||||
| 840 | Q | 30.5 | Very low | 29.4 | Very low | 156 Ų | 156 | 149.5 Ų | 149.5 | 73% | 0.729 | 79% | 0.786 | S | S | * | * | trans | 59.5 | 101.2 | 162.2 | -82.2 | 167.8 | 50.6 | 0 | 0 | 121.8 | ||||
| 841 | T | 26.4 | Very low | 29.3 | Very low | 110 Ų | 110 | 144.6 Ų | 144.6 | 68% | 0.675 | 78% | 0.781 | S | S | * | * | 29 | 112.5 | 121 | -24.4 | 0 | 0 | 0 | 0 | 120.9 | |||||
| 842 | Y | 27.8 | Very low | 29.5 | Very low | 222 Ų | 222 | 145 Ų | 145 | 87% | 0.871 | 78% | 0.783 | S | S | * | * | -173.8 | 175.6 | 98 | -115 | -78.7 | 0 | 0 | 0 | 113.6 | |||||
| 843 | C | 29.3 | Very low | 29.3 | Very low | 115 Ų | 115 | 145.4 Ų | 145.4 | 78% | 0.777 | 79% | 0.785 | S | S | * | * | trans | -74.6 | 148.1 | -174.1 | -175.2 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 844 | G | 27.7 | Very low | 29.4 | Very low | 74 Ų | 74 | 144.7 Ų | 144.7 | 76% | 0.763 | 79% | 0.786 | S | S | * | * | trans | -165.5 | 126.2 | 165 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 845 | T | 35.7 | Very low | 29.3 | Very low | 127 Ų | 127 | 139.6 Ų | 139.6 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | trans | -117.1 | 172.9 | 176 | 46.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 846 | V | 29.7 | Very low | 29.1 | Very low | 142 Ų | 142 | 146.3 Ų | 146.3 | 86% | 0.861 | 78% | 0.776 | S | S | * | * | trans | 83.6 | 116.4 | 176.6 | -169.4 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 847 | D | 28.3 | Very low | 28.8 | Very low | 122 Ų | 122 | 142.7 Ų | 142.7 | 65% | 0.652 | 76% | 0.763 | S | S | * | * | trans | -90 | 124.3 | 169.2 | 157.9 | 50.5 | 0 | 0 | 0 | 110.6 | ||||
| 848 | K | 32 | Very low | 28.8 | Very low | 166 Ų | 166 | 143.2 Ų | 143.2 | 72% | 0.722 | 76% | 0.761 | S | S | * | * | 177.2 | 158.4 | 126.1 | -98.7 | 147.1 | -165.4 | 163.1 | 0 | 115.4 | |||||
| 849 | N | 27.6 | Very low | 28.6 | Very low | 145 Ų | 145 | 144.1 Ų | 144.1 | 78% | 0.775 | 76% | 0.757 | S | S | * | * | trans | 79.1 | 79.1 | 158.8 | -59.4 | -26.3 | 0 | 0 | 0 | 119.9 | ||||
| 850 | K | 31.8 | Very low | 28.7 | Very low | 214 Ų | 214 | 144.2 Ų | 144.2 | 93% | 0.93 | 76% | 0.758 | S | S | * | * | 47.1 | 97.8 | 111 | -168 | -178.7 | -176.8 | -179.2 | 0 | 117.8 | |||||
| 851 | A | 28.6 | Very low | 28.3 | Very low | 87 Ų | 87 | 146 Ų | 146 | 72% | 0.719 | 77% | 0.766 | S | S | * | * | trans | -151.7 | 157.1 | 167.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 852 | K | 32.3 | Very low | 28.5 | Very low | 195 Ų | 195 | 145.8 Ų | 145.8 | 85% | 0.848 | 77% | 0.767 | S | S | * | * | cis | -164.9 | 126.8 | -5.6 | -123.8 | 175.2 | -176.6 | 173.5 | 0 | 109.4 | ||||
| 853 | T | 24.9 | Very low | 28.4 | Very low | 142 Ų | 142 | 139.8 Ų | 139.8 | 87% | 0.871 | 76% | 0.757 | S | S | * | * | trans | -167.4 | 143.3 | 159.7 | 33.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 854 | V | 28.5 | Very low | 28.3 | Very low | 136 Ų | 136 | 143.4 Ų | 143.4 | 82% | 0.824 | 76% | 0.762 | S | S | * | * | cis | -144.7 | 165.9 | 2.1 | 103.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 855 | S | 26.2 | Very low | 28.9 | Very low | 96 Ų | 96 | 149.4 Ų | 149.4 | 67% | 0.671 | 77% | 0.771 | S | S | * | * | trans | -27.2 | 136.8 | 172.5 | -173 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 856 | R | 28.1 | Very low | 28.4 | Very low | 212 Ų | 212 | 147.3 Ų | 147.3 | 80% | 0.8 | 77% | 0.766 | S | S | * | * | -173.4 | 128.5 | 112.7 | -104.3 | -179.3 | 163.8 | 153 | 3.1 | 112.3 | |||||
| 857 | Q | 25.8 | Very low | 28.3 | Very low | 124 Ų | 124 | 150.8 Ų | 150.8 | 58% | 0.579 | 77% | 0.77 | S | S | * | * | 62.4 | 132.9 | 106.8 | -83 | -177.1 | -96.6 | 0 | 0 | 117.2 | |||||
| 858 | H | 28.7 | Very low | 28.3 | Very low | 152 Ų | 152 | 148.5 Ų | 148.5 | 70% | 0.704 | 78% | 0.775 | S | S | * | * | trans | 72.2 | 152.6 | 149 | -75.2 | 28.4 | 0 | 0 | 0 | 116.4 | ||||
| 859 | Q | 24.6 | Very low | 28.2 | Very low | 141 Ų | 141 | 146.2 Ų | 146.2 | 66% | 0.659 | 78% | 0.78 | S | S | * | * | cis | -158.3 | 169.9 | -19 | 178.1 | 162.5 | 10.9 | 0 | 0 | 109.5 | ||||
| 860 | Q | 27.4 | Very low | 28.7 | Very low | 150 Ų | 150 | 144.9 Ų | 144.9 | 70% | 0.701 | 78% | 0.779 | S | S | * | * | trans | -39 | 147.8 | 171.5 | -50.8 | 131.5 | -31.2 | 0 | 0 | 114.4 | ||||
| 861 | Q | 23 | Very low | 29.1 | Very low | 195 Ų | 195 | 139.4 Ų | 139.4 | 91% | 0.911 | 77% | 0.768 | S | S | * | * | -146.5 | 153.1 | 127.1 | -88.8 | -136.9 | -32.4 | 0 | 0 | 110.7 | |||||
| 862 | P | 31.4 | Very low | 30.1 | Very low | 105 Ų | 105 | 140.4 Ų | 140.4 | 68% | 0.682 | 77% | 0.767 | S | S | * | * | trans | -132.1 | -172.8 | -132.9 | 40.4 | -23.1 | 0 | 0 | 0 | 116.2 | ||||
| 863 | S | 24.1 | Very low | 30.3 | Very low | 96 Ų | 96 | 137.4 Ų | 137.4 | 67% | 0.671 | 77% | 0.765 | S | S | * | * | trans | -42.8 | 133.6 | 174.8 | 53.1 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 864 | Q | 28.5 | Very low | 31.1 | Very low | 190 Ų | 190 | 134.9 Ų | 134.9 | 89% | 0.888 | 76% | 0.759 | S | S | * | * | 58.7 | 142.1 | 128.3 | -61.3 | -178.2 | -5.9 | 0 | 0 | 121.1 | |||||
| 865 | Q | 39.8 | Very low | 31.7 | Very low | 200 Ų | 200 | 132.2 Ų | 132.2 | 94% | 0.935 | 75% | 0.751 | S | S | * | * | trans | -66.6 | 149.3 | 175.9 | -58.4 | 158.5 | -65.8 | 0 | 0 | 112.4 | ||||
| 866 | A | 25 | Very low | 32.5 | Very low | 83 Ų | 83 | 136.7 Ų | 136.7 | 69% | 0.686 | 76% | 0.761 | S | S | * | * | trans | -152.4 | 115 | 164.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 867 | K | 27.2 | Very low | 33.6 | Very low | 215 Ų | 215 | 133.4 Ų | 133.4 | 94% | 0.935 | 76% | 0.76 | S | S | * | * | trans | 68.4 | 151.5 | 158.8 | -51.9 | 162.9 | -173.8 | 176 | 0 | 115.6 | ||||
| 868 | G | 28.8 | Very low | 35 | Very low | 74 Ų | 74 | 136.7 Ų | 136.7 | 76% | 0.763 | 78% | 0.775 | S | S | * | * | cis | -179.4 | 166.8 | -7.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 869 | S | 29.4 | Very low | 36.3 | Very low | 118 Ų | 118 | 134.3 Ų | 134.3 | 83% | 0.825 | 77% | 0.771 | S | S | * | * | trans | -36 | 157.3 | 164.3 | -131.7 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 870 | P | 37.8 | Very low | 38 | Very low | 117 Ų | 117 | 136 Ų | 136 | 76% | 0.76 | 78% | 0.776 | S | S | * | * | cis | -147 | 179.2 | 29.4 | 44.6 | -25.1 | 0 | 0 | 0 | 119 | ||||
| 871 | S | 40.7 | Very low | 39.6 | Very low | 99 Ų | 99 | 137.5 Ų | 137.5 | 69% | 0.692 | 78% | 0.783 | S | S | * | * | trans | -92.2 | -148.4 | 154.8 | 66.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 872 | P | 49.9 | Very low | 41.7 | Very low | 109 Ų | 109 | 136.1 Ų | 136.1 | 71% | 0.708 | 78% | 0.777 | S | S | * | * | cis | -93.4 | -158.8 | 4.8 | 38.5 | -27.4 | 0 | 0 | 0 | 111 | ||||
| 873 | T | 36.6 | Very low | 43.7 | Very low | 131 Ų | 131 | 136.2 Ų | 136.2 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | cis | -154.5 | 164.8 | 8.4 | -11.1 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 874 | A | 41.2 | Very low | 46.1 | Very low | 89 Ų | 89 | 137.1 Ų | 137.1 | 74% | 0.736 | 77% | 0.767 | S | S | * | * | cis | -151.5 | -175.2 | 0.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 875 | A | 42.2 | Very low | 48.3 | Very low | 80 Ų | 80 | 134.6 Ų | 134.6 | 66% | 0.661 | 76% | 0.755 | S | S | * | * | cis | -149.5 | 176.2 | 0.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 876 | Q | 41.9 | Very low | 50 | Low | 191 Ų | 191 | 133.1 Ų | 133.1 | 89% | 0.893 | 74% | 0.741 | S | S | * | * | trans | 76.9 | 146.9 | 178.6 | -49.2 | -60.8 | -7.9 | 0 | 0 | 116.1 | ||||
| 877 | D | 51 | Low | 52.6 | Low | 142 Ų | 142 | 134.4 Ų | 134.4 | 76% | 0.759 | 74% | 0.735 | S | S | * | * | trans | -156 | 138.8 | -157.5 | -175.3 | 15.5 | 0 | 0 | 0 | 112.4 | ||||
| 878 | E | 55.9 | Low | 55.1 | Low | 193 Ų | 193 | 131.4 Ų | 131.4 | 90% | 0.902 | 72% | 0.722 | S | S | * | * | trans | -161.6 | 16.4 | -176.8 | -144.2 | 175.5 | -132.1 | 0 | 0 | 116.6 | ||||
| 879 | T | 56.9 | Low | 57.5 | Low | 102 Ų | 102 | 132.9 Ų | 132.9 | 63% | 0.626 | 71% | 0.709 | S | S | * | * | trans | -125 | 114.4 | -161.9 | 57.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 880 | K | 59.2 | Low | 60 | Low | 177 Ų | 177 | 131.6 Ų | 131.6 | 77% | 0.77 | 69% | 0.692 | S | S | * | * | trans | -141.2 | -47.7 | 169 | -68.8 | -173.6 | -179.5 | 165 | 0 | 117.2 | Q882 I883 | K880-Q882 PolarHBondContact O-N 3.4Å; K880-I883 PolarHBondContact O-N 3.35Å | ||
| 881 | E | 61.6 | Low | 62.2 | Low | 181 Ų | 181 | 131.2 Ų | 131.2 | 85% | 0.846 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | -34.4 | -167.4 | -70.6 | -170.2 | 120.9 | 0 | 0 | 115.2 | I883 I884 | E881-I883 PolarHBondContact O-N 2.97Å; E881-I884 PolarHBondContact O-N 3.12Å |
| 882 | Q | 67.1 | Low | 64.1 | Low | 167 Ų | 167 | 130.6 Ų | 130.6 | 78% | 0.78 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -58.5 | -24.1 | -177.3 | -65 | 179.1 | -1.4 | 0 | 0 | 113.6 | K880 R886 | K880-Q882 PolarHBondContact O-N 3.4Å; Q882-R886 PolarHBondContact O-N 3.14Å |
| 883 | I | 72.6 | Confident | 65.6 | Low | 106 Ų | 106 | 128.4 Ų | 128.4 | 54% | 0.544 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -68.2 | -36.5 | -176.8 | -58.1 | 174.6 | 0 | 0 | 0 | 111.5 | K880 E881 L887 | K880-I883 PolarHBondContact O-N 3.35Å; E881-I883 PolarHBondContact O-N 2.97Å; I883-L887 HydrophobicContact CG2-CD1 4.32Å; I883-L887 WeakPolarHBondContact O-CG 3.45Å; I883-L887 PolarHBondContact O-N 3.3Å |
| 884 | I | 74 | Confident | 67.9 | Low | 115 Ų | 115 | 124.2 Ų | 124.2 | 59% | 0.59 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -72.6 | -37.6 | -176.3 | -62.1 | 176.9 | 0 | 0 | 0 | 111.2 | E881 L887 K888 | E881-I884 PolarHBondContact O-N 3.12Å; I884-L887 PolarHBondContact O-N 3.27Å; I884-K888 PolarHBondContact O-N 3.36Å |
| 885 | H | 76.6 | Confident | 70 | Confident | 137 Ų | 137 | 124.5 Ų | 124.5 | 63% | 0.634 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -61.9 | -48.5 | 175.9 | -165 | -77.9 | 0 | 0 | 0 | 110.9 | L887 K888 E889 | H885-L887 PolarHBondContact O-N 2.96Å; H885-K888 PolarHBondContact O-N 3.42Å; H885-K888 VanDerWaalsContact O-N 3.16Å; H885-E889 PolarHBondContact O-N 3.4Å; H885-E889 VanDerWaalsContact O-N 3.12Å |
| 886 | R | 75.6 | Confident | 72 | Confident | 170 Ų | 170 | 124.5 Ų | 124.5 | 64% | 0.642 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -56 | -35.6 | 179.1 | -163.7 | 71.1 | 173.5 | -85.3 | 0.4 | 113 | Q882 L890 | Q882-R886 PolarHBondContact O-N 3.14Å; R886-L890 WeakPolarHBondContact O-CB 3.27Å; R886-L890 WeakPolarHBondContact O-CD1 3.34Å; R886-L890 WeakPolarHBondContact O-CG 3.31Å; R886-L890 PolarHBondContact O-N 3.11Å; R886-L890 VanDerWaalsContact O-N 3.15Å |
| 887 | L | 78 | Confident | 74.2 | Confident | 109 Ų | 109 | 122.4 Ų | 122.4 | 57% | 0.571 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -74.9 | -36.6 | 179.2 | -74.9 | 169.5 | 0 | 0 | 0 | 113.5 | I883 I884 H885 L891 | I883-L887 HydrophobicContact CG2-CD1 4.32Å; I883-L887 WeakPolarHBondContact O-CG 3.45Å; I883-L887 PolarHBondContact O-N 3.3Å; I884-L887 PolarHBondContact O-N 3.27Å; H885-L887 PolarHBondContact O-N 2.96Å; L887-L891 PolarHBondContact O-N 2.95Å; L887-L891 VanDerWaalsContact O-N 3.16Å |
| 888 | K | 80.4 | Confident | 76 | Confident | 153 Ų | 153 | 121.9 Ų | 121.9 | 67% | 0.665 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.2 | -44.6 | 174.4 | -73.6 | -174.7 | 176.2 | -178.9 | 0 | 111.3 | I884 H885 L890 L891 T892 | I884-K888 PolarHBondContact O-N 3.36Å; H885-K888 PolarHBondContact O-N 3.42Å; H885-K888 VanDerWaalsContact O-N 3.16Å; K888-L890 PolarHBondContact O-N 3.15Å; K888-L891 PolarHBondContact O-N 3.49Å; K888-L891 VanDerWaalsContact O-N 3.11Å; K888-T892 PolarHBondContact O-N 2.85Å; K888-T892 PolarHBondContact O-OG1 2.91Å; K888-T892 VanDerWaalsContact O-OG1 3.14Å |
| 889 | E | 79.4 | Confident | 77.5 | Confident | 105 Ų | 105 | 118.9 Ų | 118.9 | 49% | 0.491 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -55.8 | -48.5 | 176.3 | -173.1 | 174.1 | -156.7 | 0 | 0 | 111.6 | H885 L891 T892 D893 | H885-E889 PolarHBondContact O-N 3.4Å; H885-E889 VanDerWaalsContact O-N 3.12Å; E889-L891 VanDerWaalsContact C-N 3.34Å; E889-L891 PolarHBondContact O-N 3.41Å; E889-T892 WeakPolarHBondContact CA-OG1 3.45Å; E889-T892 PolarHBondContact O-N 3.29Å; E889-T892 PolarHBondContact O-OG1 3.16Å; E889-D893 VanDerWaalsContact O-CB 3.3Å; E889-D893 WeakPolarHBondContact O-CB 3.39Å; E889-D893 PolarHBondContact O-N 2.91Å |
| 890 | L | 81.9 | Confident | 78.9 | Confident | 90 Ų | 90 | 116.5 Ų | 116.5 | 47% | 0.471 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -59.5 | -36.6 | 173.4 | -83.9 | 164.8 | 0 | 0 | 0 | 113.9 | R886 K888 S894 | R886-L890 WeakPolarHBondContact O-CB 3.27Å; R886-L890 WeakPolarHBondContact O-CD1 3.34Å; R886-L890 WeakPolarHBondContact O-CG 3.31Å; R886-L890 PolarHBondContact O-N 3.11Å; R886-L890 VanDerWaalsContact O-N 3.15Å; K888-L890 PolarHBondContact O-N 3.15Å; L890-S894 WeakPolarHBondContact O-CB 3.37Å; L890-S894 PolarHBondContact O-N 2.9Å |
| 891 | L | 83 | Confident | 80.4 | Confident | 109 Ų | 109 | 112.6 Ų | 112.6 | 57% | 0.571 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -74.2 | -39.6 | 178.8 | -175.5 | 63.4 | 0 | 0 | 0 | 111.9 | L887 K888 E889 S894 N895 | L887-L891 PolarHBondContact O-N 2.95Å; L887-L891 VanDerWaalsContact O-N 3.16Å; K888-L891 PolarHBondContact O-N 3.49Å; K888-L891 VanDerWaalsContact O-N 3.11Å; E889-L891 VanDerWaalsContact C-N 3.34Å; E889-L891 PolarHBondContact O-N 3.41Å; L891-S894 PolarHBondContact O-N 2.92Å; L891-N895 PolarHBondContact O-N 3.43Å |
| 892 | T | 81.4 | Confident | 81.7 | Confident | 87 Ų | 87 | 106.5 Ų | 106.5 | 53% | 0.534 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.4 | -43 | 172.8 | 42.9 | 0 | 0 | 0 | 0 | 111.8 | K888 E889 N895 C896 | K888-T892 PolarHBondContact O-N 2.85Å; K888-T892 PolarHBondContact O-OG1 2.91Å; K888-T892 VanDerWaalsContact O-OG1 3.14Å; E889-T892 WeakPolarHBondContact CA-OG1 3.45Å; E889-T892 PolarHBondContact O-N 3.29Å; E889-T892 PolarHBondContact O-OG1 3.16Å; T892-N895 PolarHBondContact O-N 2.84Å; T892-C896 PolarHBondContact O-N 3.24Å; T892-C896 PolarHBondContact O-SG 3.41Å |
| 893 | D | 82.1 | Confident | 82.8 | Confident | 63 Ų | 63 | 103.3 Ų | 103.3 | 34% | 0.337 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -57.9 | -50.2 | 172.7 | 172.7 | 12.1 | 0 | 0 | 0 | 110.9 | E889 N895 C896 R897 | E889-D893 VanDerWaalsContact O-CB 3.3Å; E889-D893 WeakPolarHBondContact O-CB 3.39Å; E889-D893 PolarHBondContact O-N 2.91Å; D893-N895 VanDerWaalsContact C-N 3.32Å; D893-N895 PolarHBondContact O-N 3.27Å; D893-C896 WeakPolarHBondContact O-CB 3.32Å; D893-C896 PolarHBondContact O-N 2.88Å; D893-C896 VanDerWaalsContact O-N 3.16Å; D893-R897 VanDerWaalsContact CG-NH2 3.3Å; D893-R897 WeakPolarHBondContact O-CG 3.27Å; D893-R897 PolarHBondContact O-N 3.45Å; D893-R897 IonicContact OD1-CZ 3.41Å; D893-R897 IonicContact OD1-NE 2.75Å; D893-R897 PolarHBondContact OD1-NE 2.75Å; D893-R897 IonicContact OD1-NH2 3.27Å; D893-R897 PolarHBondContact OD1-NH2 3.37Å; D893-R897 IonicContact OD2-CZ 3.55Å; D893-R897 IonicContact OD2-NE 3.7Å; D893-R897 IonicContact OD2-NH2 2.67Å; D893-R897 PolarHBondContact OD2-NH2 2.84Å |
| 894 | S | 83.2 | Confident | 83.6 | Confident | 43 Ų | 43 | 102 Ų | 102 | 30% | 0.301 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -57 | -41.8 | 175.7 | -168.4 | 0 | 0 | 0 | 0 | 113 | L890 L891 R897 F898 | L890-S894 WeakPolarHBondContact O-CB 3.37Å; L890-S894 PolarHBondContact O-N 2.9Å; L891-S894 PolarHBondContact O-N 2.92Å; S894-R897 PolarHBondContact O-N 2.82Å; S894-F898 WeakPolarHBondContact O-CD2 3.37Å; S894-F898 PolarHBondContact O-N 2.81Å |
| 895 | N | 85.3 | Confident | 84.3 | Confident | 94 Ų | 94 | 101.8 Ų | 101.8 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.3 | -39.8 | 177.2 | -76.6 | -11.4 | 0 | 0 | 0 | 112.2 | L891 T892 D893 R897 F898 Q899 | L891-N895 PolarHBondContact O-N 3.43Å; T892-N895 PolarHBondContact O-N 2.84Å; D893-N895 VanDerWaalsContact C-N 3.32Å; D893-N895 PolarHBondContact O-N 3.27Å; N895-R897 VanDerWaalsContact C-N 3.32Å; N895-R897 PolarHBondContact O-N 3.37Å; N895-F898 PolarHBondContact O-N 3.4Å; N895-Q899 WeakPolarHBondContact O-CB 3.3Å; N895-Q899 PolarHBondContact O-N 2.88Å |
| 896 | C | 86.1 | Confident | 84.9 | Confident | 81 Ų | 81 | 102 Ų | 102 | 55% | 0.547 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.4 | -40.6 | 172.2 | -70.7 | 0 | 0 | 0 | 0 | 111.8 | T892 D893 Q899 A900 | T892-C896 PolarHBondContact O-N 3.24Å; T892-C896 PolarHBondContact O-SG 3.41Å; D893-C896 WeakPolarHBondContact O-CB 3.32Å; D893-C896 PolarHBondContact O-N 2.88Å; D893-C896 VanDerWaalsContact O-N 3.16Å; C896-Q899 PolarHBondContact O-N 2.89Å; C896-A900 WeakPolarHBondContact O-CB 3.35Å; C896-A900 PolarHBondContact O-N 2.82Å |
| 897 | R | 86.4 | Confident | 85.6 | Confident | 146 Ų | 146 | 99.5 Ų | 99.5 | 55% | 0.551 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.3 | -42.4 | 173.5 | -64.4 | 178 | -154.1 | -176.8 | 6.4 | 112.3 | D893 S894 N895 A900 L901 | D893-R897 VanDerWaalsContact CG-NH2 3.3Å; D893-R897 WeakPolarHBondContact O-CG 3.27Å; D893-R897 PolarHBondContact O-N 3.45Å; D893-R897 IonicContact OD1-CZ 3.41Å; D893-R897 IonicContact OD1-NE 2.75Å; D893-R897 PolarHBondContact OD1-NE 2.75Å; D893-R897 IonicContact OD1-NH2 3.27Å; D893-R897 PolarHBondContact OD1-NH2 3.37Å; D893-R897 IonicContact OD2-CZ 3.55Å; D893-R897 IonicContact OD2-NE 3.7Å; D893-R897 IonicContact OD2-NH2 2.67Å; D893-R897 PolarHBondContact OD2-NH2 2.84Å; S894-R897 PolarHBondContact O-N 2.82Å; N895-R897 VanDerWaalsContact C-N 3.32Å; N895-R897 PolarHBondContact O-N 3.37Å; R897-A900 PolarHBondContact O-N 3.27Å; R897-L901 WeakPolarHBondContact O-CB 3.33Å; R897-L901 WeakPolarHBondContact O-CG 3.17Å; R897-L901 PolarHBondContact O-N 2.67Å |
| 898 | F | 89.6 | Confident | 86.1 | Confident | 132 Ų | 132 | 98.2 Ų | 98.2 | 58% | 0.579 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.8 | -38.2 | 175.5 | -80.7 | -61 | 0 | 0 | 0 | 112.4 | S894 N895 L901 A902 | S894-F898 WeakPolarHBondContact O-CD2 3.37Å; S894-F898 PolarHBondContact O-N 2.81Å; N895-F898 PolarHBondContact O-N 3.4Å; F898-L901 HydrophobicContact CD1-CD1 4.44Å; F898-L901 PolarHBondContact O-N 2.91Å; F898-A902 WeakPolarHBondContact O-CB 3.4Å; F898-A902 PolarHBondContact O-N 2.8Å |
| 899 | Q | 87.8 | Confident | 86.6 | Confident | 129 Ų | 129 | 96.1 Ų | 96.1 | 60% | 0.603 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67.6 | -40.3 | 175 | -169.2 | 173 | 11.2 | 0 | 0 | 111.6 | N895 C896 A902 I903 | N895-Q899 WeakPolarHBondContact O-CB 3.3Å; N895-Q899 PolarHBondContact O-N 2.88Å; C896-Q899 PolarHBondContact O-N 2.89Å; Q899-A902 PolarHBondContact O-N 3.24Å; Q899-I903 HydrophobicContact CG-CD1 4.18Å; Q899-I903 VanDerWaalsContact O-CG1 3.3Å; Q899-I903 WeakPolarHBondContact O-CG1 3.26Å; Q899-I903 PolarHBondContact O-N 2.8Å |
| 900 | A | 86.6 | Confident | 87.1 | Confident | 52 Ų | 52 | 93 Ų | 93 | 43% | 0.43 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | 172 | 0 | 0 | 0 | 0 | 0 | 111.8 | C896 R897 I903 V904 | C896-A900 WeakPolarHBondContact O-CB 3.35Å; C896-A900 PolarHBondContact O-N 2.82Å; R897-A900 PolarHBondContact O-N 3.27Å; A900-I903 PolarHBondContact O-N 3.43Å; A900-V904 WeakPolarHBondContact O-CB 3.39Å; A900-V904 VanDerWaalsContact O-CG2 3.27Å; A900-V904 WeakPolarHBondContact O-CG2 3.33Å; A900-V904 PolarHBondContact O-N 3.33Å |
| 901 | L | 89.9 | Confident | 87.5 | Confident | 96 Ų | 96 | 94.4 Ų | 94.4 | 50% | 0.503 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.9 | -39.2 | 173.7 | -76.2 | 167.9 | 0 | 0 | 0 | 112.3 | R897 F898 V904 L905 | R897-L901 WeakPolarHBondContact O-CB 3.33Å; R897-L901 WeakPolarHBondContact O-CG 3.17Å; R897-L901 PolarHBondContact O-N 2.67Å; F898-L901 HydrophobicContact CD1-CD1 4.44Å; F898-L901 PolarHBondContact O-N 2.91Å; L901-V904 PolarHBondContact O-N 3.48Å; L901-L905 VanDerWaalsContact O-CB 3.31Å; L901-L905 WeakPolarHBondContact O-CB 3.28Å; L901-L905 VanDerWaalsContact O-CG 3.27Å; L901-L905 WeakPolarHBondContact O-CG 3.16Å; L901-L905 PolarHBondContact O-N 3.38Å |
| 902 | A | 88.5 | Confident | 87.8 | Confident | 53 Ų | 53 | 92.7 Ų | 92.7 | 44% | 0.438 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66 | -42.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | F898 Q899 L905 Q906 | F898-A902 WeakPolarHBondContact O-CB 3.4Å; F898-A902 PolarHBondContact O-N 2.8Å; Q899-A902 PolarHBondContact O-N 3.24Å; A902-L905 PolarHBondContact O-N 2.93Å; A902-Q906 WeakPolarHBondContact O-CB 3.46Å; A902-Q906 PolarHBondContact O-N 3.14Å |
| 903 | I | 89.8 | Confident | 88.2 | Confident | 100 Ų | 100 | 93.3 Ų | 93.3 | 51% | 0.513 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.8 | -44.2 | 174.3 | -68.3 | 163.9 | 0 | 0 | 0 | 110.5 | Q899 A900 Q906 Q907 | Q899-I903 HydrophobicContact CG-CD1 4.18Å; Q899-I903 VanDerWaalsContact O-CG1 3.3Å; Q899-I903 WeakPolarHBondContact O-CG1 3.26Å; Q899-I903 PolarHBondContact O-N 2.8Å; A900-I903 PolarHBondContact O-N 3.43Å; I903-Q906 PolarHBondContact O-N 3.46Å; I903-Q907 VanDerWaalsContact O-CB 3.28Å; I903-Q907 WeakPolarHBondContact O-CB 3.36Å; I903-Q907 PolarHBondContact O-N 2.8Å |
| 904 | V | 89.8 | Confident | 88.6 | Confident | 79 Ų | 79 | 94.6 Ų | 94.6 | 48% | 0.479 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.1 | -41 | 176.5 | 168.7 | 0 | 0 | 0 | 0 | 111.2 | A900 L901 Q907 N908 | A900-V904 WeakPolarHBondContact O-CB 3.39Å; A900-V904 VanDerWaalsContact O-CG2 3.27Å; A900-V904 WeakPolarHBondContact O-CG2 3.33Å; A900-V904 PolarHBondContact O-N 3.33Å; L901-V904 PolarHBondContact O-N 3.48Å; V904-Q907 PolarHBondContact O-N 2.88Å; V904-N908 WeakPolarHBondContact O-CB 3.18Å; V904-N908 PolarHBondContact O-N 3.47Å; V904-N908 PolarHBondContact O-ND2 3.4Å |
| 905 | L | 89.3 | Confident | 89 | Confident | 110 Ų | 110 | 94.7 Ų | 94.7 | 58% | 0.576 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.9 | -43.7 | 175 | -77.6 | 167.5 | 0 | 0 | 0 | 111.7 | L901 A902 Q907 N908 L909 | L901-L905 VanDerWaalsContact O-CB 3.31Å; L901-L905 WeakPolarHBondContact O-CB 3.28Å; L901-L905 VanDerWaalsContact O-CG 3.27Å; L901-L905 WeakPolarHBondContact O-CG 3.16Å; L901-L905 PolarHBondContact O-N 3.38Å; A902-L905 PolarHBondContact O-N 2.93Å; L905-Q907 VanDerWaalsContact C-N 3.34Å; L905-Q907 PolarHBondContact O-N 3.41Å; L905-N908 PolarHBondContact O-N 2.82Å; L905-L909 WeakPolarHBondContact O-CB 3.45Å; L905-L909 VanDerWaalsContact O-CG 3.26Å; L905-L909 WeakPolarHBondContact O-CG 3.46Å; L905-L909 PolarHBondContact O-N 2.9Å |
| 906 | Q | 90.1 | Very high | 89.2 | Confident | 142 Ų | 142 | 93.3 Ų | 93.3 | 66% | 0.664 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.3 | -40.4 | 176.1 | -173.7 | 174.7 | 2.1 | 0 | 0 | 111.6 | A902 I903 L909 A910 | A902-Q906 WeakPolarHBondContact O-CB 3.46Å; A902-Q906 PolarHBondContact O-N 3.14Å; I903-Q906 PolarHBondContact O-N 3.46Å; Q906-L909 PolarHBondContact O-N 2.79Å; Q906-A910 WeakPolarHBondContact O-CB 3.36Å; Q906-A910 PolarHBondContact O-N 2.81Å |
| 907 | Q | 89.6 | Confident | 89.4 | Confident | 116 Ų | 116 | 91.8 Ų | 91.8 | 54% | 0.542 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.1 | -40.4 | 175.4 | -176 | 60.5 | 59.5 | 0 | 0 | 112.2 | I903 V904 L905 Q911 | I903-Q907 VanDerWaalsContact O-CB 3.28Å; I903-Q907 WeakPolarHBondContact O-CB 3.36Å; I903-Q907 PolarHBondContact O-N 2.8Å; V904-Q907 PolarHBondContact O-N 2.88Å; L905-Q907 VanDerWaalsContact C-N 3.34Å; L905-Q907 PolarHBondContact O-N 3.41Å; Q907-Q911 WeakPolarHBondContact O-CB 3.36Å; Q907-Q911 PolarHBondContact O-N 3.05Å |
| 908 | N | 88.1 | Confident | 89.6 | Confident | 82 Ų | 82 | 90.1 Ų | 90.1 | 44% | 0.439 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -68.4 | -39.5 | 175.1 | -84.5 | -95.6 | 0 | 0 | 0 | 111.5 | V904 L905 Q911 C912 | V904-N908 WeakPolarHBondContact O-CB 3.18Å; V904-N908 PolarHBondContact O-N 3.47Å; V904-N908 PolarHBondContact O-ND2 3.4Å; L905-N908 PolarHBondContact O-N 2.82Å; N908-Q911 PolarHBondContact O-N 3.31Å; N908-C912 WeakPolarHBondContact O-CB 3.35Å; N908-C912 PolarHBondContact O-N 2.84Å; N908-C912 PolarHBondContact O-SG 2.99Å |
| 909 | L | 90.1 | Very high | 89.7 | Confident | 110 Ų | 110 | 87.6 Ų | 87.6 | 58% | 0.576 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -66.5 | -46.1 | 176.6 | -73.7 | 170.4 | 0 | 0 | 0 | 111.3 | L905 Q906 Q911 C912 D913 | L905-L909 WeakPolarHBondContact O-CB 3.45Å; L905-L909 VanDerWaalsContact O-CG 3.26Å; L905-L909 WeakPolarHBondContact O-CG 3.46Å; L905-L909 PolarHBondContact O-N 2.9Å; Q906-L909 PolarHBondContact O-N 2.79Å; L909-Q911 VanDerWaalsContact C-N 3.33Å; L909-Q911 PolarHBondContact O-N 3.39Å; L909-C912 CarbonylContact O-C 3.59Å; L909-C912 WeakPolarHBondContact O-CB 3.18Å; L909-C912 PolarHBondContact O-N 3.28Å; L909-C912 VanDerWaalsContact O-N 3.14Å; L909-D913 PolarHBondContact O-N 2.87Å |
| 910 | A | 90.5 | Very high | 89.9 | Confident | 40 Ų | 40 | 89 Ų | 89 | 33% | 0.331 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.1 | -44 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q906 C912 D913 D914 | Q906-A910 WeakPolarHBondContact O-CB 3.36Å; Q906-A910 PolarHBondContact O-N 2.81Å; A910-C912 VanDerWaalsContact C-N 3.31Å; A910-C912 PolarHBondContact O-N 3.43Å; A910-D913 PolarHBondContact O-N 2.95Å; A910-D914 WeakPolarHBondContact O-CB 3.41Å; A910-D914 VanDerWaalsContact O-CG 3.29Å; A910-D914 PolarHBondContact O-N 2.98Å |
| 911 | Q | 91.6 | Very high | 90.2 | Very high | 119 Ų | 119 | 91.9 Ų | 91.9 | 56% | 0.556 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.8 | -31.3 | 176 | -173.8 | 173.7 | 10.2 | 0 | 0 | 113 | Q907 N908 L909 A915 | Q907-Q911 WeakPolarHBondContact O-CB 3.36Å; Q907-Q911 PolarHBondContact O-N 3.05Å; N908-Q911 PolarHBondContact O-N 3.31Å; L909-Q911 VanDerWaalsContact C-N 3.33Å; L909-Q911 PolarHBondContact O-N 3.39Å; Q911-A915 VanDerWaalsContact O-CB 3.27Å; Q911-A915 WeakPolarHBondContact O-CB 3.35Å; Q911-A915 PolarHBondContact O-N 3.42Å |
| 912 | C | 87.6 | Confident | 90.4 | Very high | 73 Ų | 73 | 92.5 Ų | 92.5 | 49% | 0.493 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -70.9 | -44.4 | 171 | -77.2 | 0 | 0 | 0 | 0 | 111.6 | N908 L909 A910 A915 T916 | N908-C912 WeakPolarHBondContact O-CB 3.35Å; N908-C912 PolarHBondContact O-N 2.84Å; N908-C912 PolarHBondContact O-SG 2.99Å; L909-C912 CarbonylContact O-C 3.59Å; L909-C912 WeakPolarHBondContact O-CB 3.18Å; L909-C912 PolarHBondContact O-N 3.28Å; L909-C912 VanDerWaalsContact O-N 3.14Å; A910-C912 VanDerWaalsContact C-N 3.31Å; A910-C912 PolarHBondContact O-N 3.43Å; C912-A915 CarbonylContact O-C 3.53Å; C912-A915 WeakPolarHBondContact O-CB 3.46Å; C912-A915 PolarHBondContact O-N 3.2Å; C912-T916 WeakPolarHBondContact O-CG2 3.26Å; C912-T916 PolarHBondContact O-N 3.44Å |
| 913 | D | 90.9 | Very high | 90.5 | Very high | 100 Ų | 100 | 93.2 Ų | 93.2 | 54% | 0.535 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.5 | -45.9 | 178.1 | -74.8 | -27.9 | 0 | 0 | 0 | 110.9 | L909 A910 A915 T916 T917 | L909-D913 PolarHBondContact O-N 2.87Å; A910-D913 PolarHBondContact O-N 2.95Å; D913-A915 VanDerWaalsContact C-N 3.3Å; D913-A915 PolarHBondContact O-N 3.04Å; D913-T916 CarbonylContact O-C 3.57Å; D913-T916 WeakPolarHBondContact O-CA 3.24Å; D913-T916 PolarHBondContact O-N 3.12Å; D913-T916 PolarHBondContact O-OG1 2.65Å; D913-T917 PolarHBondContact O-N 3.24Å; D913-T917 PolarHBondContact O-OG1 2.85Å |
| 914 | D | 90.9 | Very high | 90.7 | Very high | 90 Ų | 90 | 95.3 Ų | 95.3 | 48% | 0.481 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.5 | -38.6 | 171.5 | -75.1 | -24.3 | 0 | 0 | 0 | 111.9 | A910 T916 T917 Q918 | A910-D914 WeakPolarHBondContact O-CB 3.41Å; A910-D914 VanDerWaalsContact O-CG 3.29Å; A910-D914 PolarHBondContact O-N 2.98Å; D914-T916 VanDerWaalsContact C-N 3.35Å; D914-T917 WeakPolarHBondContact CA-OG1 3.37Å; D914-T917 PolarHBondContact O-OG1 2.86Å; D914-Q918 WeakPolarHBondContact O-CB 3.44Å; D914-Q918 WeakPolarHBondContact O-CG 3.27Å; D914-Q918 PolarHBondContact O-N 3.13Å |
| 915 | A | 90.4 | Very high | 91 | Very high | 44 Ų | 44 | 97 Ų | 97 | 36% | 0.364 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.7 | -34.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q911 C912 D913 C919 | Q911-A915 VanDerWaalsContact O-CB 3.27Å; Q911-A915 WeakPolarHBondContact O-CB 3.35Å; Q911-A915 PolarHBondContact O-N 3.42Å; C912-A915 CarbonylContact O-C 3.53Å; C912-A915 WeakPolarHBondContact O-CB 3.46Å; C912-A915 PolarHBondContact O-N 3.2Å; D913-A915 VanDerWaalsContact C-N 3.3Å; D913-A915 PolarHBondContact O-N 3.04Å; A915-C919 VanDerWaalsContact O-CB 3.26Å; A915-C919 WeakPolarHBondContact O-CB 3.47Å; A915-C919 PolarHBondContact O-N 2.93Å; A915-C919 PolarHBondContact O-SG 3.12Å |
| 916 | T | 89 | Confident | 91.2 | Very high | 66 Ų | 66 | 96.1 Ų | 96.1 | 41% | 0.405 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -73.6 | -31.2 | 175.4 | 80.2 | 0 | 0 | 0 | 0 | 113.5 | C912 D913 D914 R920 | C912-T916 WeakPolarHBondContact O-CG2 3.26Å; C912-T916 PolarHBondContact O-N 3.44Å; D913-T916 CarbonylContact O-C 3.57Å; D913-T916 WeakPolarHBondContact O-CA 3.24Å; D913-T916 PolarHBondContact O-N 3.12Å; D913-T916 PolarHBondContact O-OG1 2.65Å; D914-T916 VanDerWaalsContact C-N 3.35Å; T916-R920 WeakPolarHBondContact O-CB 3.27Å; T916-R920 PolarHBondContact O-N 2.8Å |
| 917 | T | 90.7 | Very high | 91.4 | Very high | 48 Ų | 48 | 94 Ų | 94 | 29% | 0.294 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -71 | -47.7 | 173.1 | 51.2 | 0 | 0 | 0 | 0 | 109.6 | D913 D914 C919 R920 E921 | D913-T917 PolarHBondContact O-N 3.24Å; D913-T917 PolarHBondContact O-OG1 2.85Å; D914-T917 WeakPolarHBondContact CA-OG1 3.37Å; D914-T917 PolarHBondContact O-OG1 2.86Å; T917-C919 PolarHBondContact O-N 2.83Å; T917-R920 CarbonylContact O-C 3.59Å; T917-R920 WeakPolarHBondContact O-CA 3.21Å; T917-R920 WeakPolarHBondContact O-CB 3.43Å; T917-R920 PolarHBondContact O-N 2.98Å; T917-E921 WeakPolarHBondContact O-CB 3.49Å; T917-E921 WeakPolarHBondContact O-CG 3.46Å; T917-E921 PolarHBondContact O-N 3.03Å |
| 918 | Q | 91.9 | Very high | 91.6 | Very high | 112 Ų | 112 | 91.3 Ų | 91.3 | 52% | 0.523 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -57.3 | -45.6 | 173 | -70.4 | 167.7 | 28.8 | 0 | 0 | 112.2 | D914 R920 E921 L922 | D914-Q918 WeakPolarHBondContact O-CB 3.44Å; D914-Q918 WeakPolarHBondContact O-CG 3.27Å; D914-Q918 PolarHBondContact O-N 3.13Å; Q918-R920 VanDerWaalsContact C-N 3.25Å; Q918-R920 PolarHBondContact O-N 2.86Å; Q918-E921 PolarHBondContact O-N 3.23Å; Q918-L922 VanDerWaalsContact O-CB 3.27Å; Q918-L922 WeakPolarHBondContact O-CB 3.21Å; Q918-L922 WeakPolarHBondContact O-CG 3.11Å; Q918-L922 PolarHBondContact O-N 3.26Å |
| 919 | C | 89.9 | Confident | 91.9 | Very high | 79 Ų | 79 | 92.3 Ų | 92.3 | 53% | 0.534 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.9 | -30.1 | 174.8 | -76.8 | 0 | 0 | 0 | 0 | 113.2 | A915 T917 S923 | A915-C919 VanDerWaalsContact O-CB 3.26Å; A915-C919 WeakPolarHBondContact O-CB 3.47Å; A915-C919 PolarHBondContact O-N 2.93Å; A915-C919 PolarHBondContact O-SG 3.12Å; T917-C919 PolarHBondContact O-N 2.83Å; C919-S923 VanDerWaalsContact O-CB 3.24Å; C919-S923 WeakPolarHBondContact O-CB 3.42Å; C919-S923 PolarHBondContact O-N 3.07Å; C919-S923 PolarHBondContact O-OG 3.13Å |
| 920 | R | 92.5 | Very high | 92.2 | Very high | 159 Ų | 159 | 92.9 Ų | 92.9 | 60% | 0.6 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -78.1 | -42.1 | 178.5 | -171.5 | -169.3 | -41.3 | -169 | 7.7 | 111.7 | T916 T917 Q918 S923 Q924 | T916-R920 WeakPolarHBondContact O-CB 3.27Å; T916-R920 PolarHBondContact O-N 2.8Å; T917-R920 CarbonylContact O-C 3.59Å; T917-R920 WeakPolarHBondContact O-CA 3.21Å; T917-R920 WeakPolarHBondContact O-CB 3.43Å; T917-R920 PolarHBondContact O-N 2.98Å; Q918-R920 VanDerWaalsContact C-N 3.25Å; Q918-R920 PolarHBondContact O-N 2.86Å; R920-S923 WeakPolarHBondContact O-CB 3.47Å; R920-S923 PolarHBondContact O-N 2.88Å; R920-Q924 WeakPolarHBondContact O-CB 3.44Å; R920-Q924 PolarHBondContact O-N 3.49Å |
| 921 | E | 93.6 | Very high | 92.3 | Very high | 112 Ų | 112 | 92.7 Ų | 92.7 | 52% | 0.523 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.6 | -52.1 | 174 | -72.4 | 161.3 | -170.6 | 0 | 0 | 110.1 | T917 Q918 S923 Q924 E925 | T917-E921 WeakPolarHBondContact O-CB 3.49Å; T917-E921 WeakPolarHBondContact O-CG 3.46Å; T917-E921 PolarHBondContact O-N 3.03Å; Q918-E921 PolarHBondContact O-N 3.23Å; E921-S923 PolarHBondContact O-N 2.63Å; E921-Q924 CarbonylContact O-C 3.57Å; E921-Q924 WeakPolarHBondContact O-CA 3.38Å; E921-Q924 WeakPolarHBondContact O-CB 3.43Å; E921-Q924 PolarHBondContact O-N 2.87Å; E921-E925 PolarHBondContact O-N 2.92Å |
| 922 | L | 93.4 | Very high | 92.5 | Very high | 108 Ų | 108 | 92 Ų | 92 | 57% | 0.565 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.2 | -32.1 | 173.3 | -69 | 169.1 | 0 | 0 | 0 | 112.7 | Q918 L926 | Q918-L922 VanDerWaalsContact O-CB 3.27Å; Q918-L922 WeakPolarHBondContact O-CB 3.21Å; Q918-L922 WeakPolarHBondContact O-CG 3.11Å; Q918-L922 PolarHBondContact O-N 3.26Å; L922-L926 WeakPolarHBondContact O-CB 3.26Å; L922-L926 PolarHBondContact O-N 2.96Å |
| 923 | S | 92 | Very high | 92.9 | Very high | 69 Ų | 69 | 93.7 Ų | 93.7 | 48% | 0.483 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -72.1 | -35.7 | 173.1 | -65.9 | 0 | 0 | 0 | 0 | 112.5 | C919 R920 E921 V927 | C919-S923 VanDerWaalsContact O-CB 3.24Å; C919-S923 WeakPolarHBondContact O-CB 3.42Å; C919-S923 PolarHBondContact O-N 3.07Å; C919-S923 PolarHBondContact O-OG 3.13Å; R920-S923 WeakPolarHBondContact O-CB 3.47Å; R920-S923 PolarHBondContact O-N 2.88Å; E921-S923 PolarHBondContact O-N 2.63Å; S923-V927 WeakPolarHBondContact O-CG2 3.15Å; S923-V927 PolarHBondContact O-N 2.77Å |
| 924 | Q | 93.3 | Very high | 93.1 | Very high | 143 Ų | 143 | 91.8 Ų | 91.8 | 67% | 0.668 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -72.5 | -41.8 | 176.4 | -177 | 171.6 | -11.9 | 0 | 0 | 111.3 | R920 E921 V927 S928 | R920-Q924 WeakPolarHBondContact O-CB 3.44Å; R920-Q924 PolarHBondContact O-N 3.49Å; E921-Q924 CarbonylContact O-C 3.57Å; E921-Q924 WeakPolarHBondContact O-CA 3.38Å; E921-Q924 WeakPolarHBondContact O-CB 3.43Å; E921-Q924 PolarHBondContact O-N 2.87Å; Q924-V927 CarbonylContact O-C 3.57Å; Q924-V927 PolarHBondContact O-N 3.39Å; Q924-V927 VanDerWaalsContact O-N 3.12Å; Q924-S928 PolarHBondContact O-N 3.23Å |
| 925 | E | 95.1 | Very high | 93.2 | Very high | 116 Ų | 116 | 91.8 Ų | 91.8 | 54% | 0.542 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.7 | -46.2 | 169 | -71.1 | -175.9 | 166.6 | 0 | 0 | 110.7 | E921 V927 S928 L929 | E921-E925 PolarHBondContact O-N 2.92Å; E925-V927 PolarHBondContact O-N 2.96Å; E925-S928 PolarHBondContact O-N 3.27Å; E925-S928 VanDerWaalsContact O-N 3.13Å; E925-L929 VanDerWaalsContact O-CB 3.32Å; E925-L929 WeakPolarHBondContact O-CB 3.37Å; E925-L929 VanDerWaalsContact O-CG 3.26Å; E925-L929 WeakPolarHBondContact O-CG 3.32Å; E925-L929 PolarHBondContact O-N 3.22Å |
| 926 | L | 93.6 | Very high | 93.3 | Very high | 90 Ų | 90 | 93 Ų | 93 | 47% | 0.471 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.1 | -27.8 | 175.2 | -178.8 | 63 | 0 | 0 | 0 | 112.9 | L922 K930 | L922-L926 WeakPolarHBondContact O-CB 3.26Å; L922-L926 PolarHBondContact O-N 2.96Å; L926-K930 HydrophobicContact CG-CD 4.49Å; L926-K930 WeakPolarHBondContact O-CB 3.08Å; L926-K930 WeakPolarHBondContact O-CD 3.34Å; L926-K930 WeakPolarHBondContact O-CG 3.16Å; L926-K930 PolarHBondContact O-N 2.94Å |
| 927 | V | 95.1 | Very high | 93.6 | Very high | 97 Ų | 97 | 94 Ų | 94 | 59% | 0.588 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -79.2 | -41.3 | 172.4 | 168.6 | 0 | 0 | 0 | 0 | 111.6 | S923 Q924 E925 K930 G931 | S923-V927 WeakPolarHBondContact O-CG2 3.15Å; S923-V927 PolarHBondContact O-N 2.77Å; Q924-V927 CarbonylContact O-C 3.57Å; Q924-V927 PolarHBondContact O-N 3.39Å; Q924-V927 VanDerWaalsContact O-N 3.12Å; E925-V927 PolarHBondContact O-N 2.96Å; V927-K930 PolarHBondContact O-N 3.16Å; V927-G931 PolarHBondContact O-N 3.39Å |
| 928 | S | 92.9 | Very high | 93.8 | Very high | 61 Ų | 61 | 97 Ų | 97 | 43% | 0.427 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.3 | -51.5 | 174.4 | -161.2 | 0 | 0 | 0 | 0 | 110.7 | Q924 E925 K930 G931 E932 | Q924-S928 PolarHBondContact O-N 3.23Å; E925-S928 PolarHBondContact O-N 3.27Å; E925-S928 VanDerWaalsContact O-N 3.13Å; S928-K930 VanDerWaalsContact C-N 3.26Å; S928-K930 PolarHBondContact O-N 3.28Å; S928-G931 CarbonylContact O-C 3.57Å; S928-G931 WeakPolarHBondContact O-CA 3.47Å; S928-G931 PolarHBondContact O-N 3.06Å; S928-E932 WeakPolarHBondContact CB-OE1 3.49Å; S928-E932 WeakPolarHBondContact O-CG 3.23Å; S928-E932 PolarHBondContact O-N 2.81Å; S928-E932 PolarHBondContact OG-OE1 2.79Å |
| 929 | L | 94.9 | Very high | 93.9 | Very high | 102 Ų | 102 | 94.5 Ų | 94.5 | 53% | 0.534 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.9 | -32.1 | 176.8 | -68.2 | 169.7 | 0 | 0 | 0 | 112.7 | E925 L933 | E925-L929 VanDerWaalsContact O-CB 3.32Å; E925-L929 WeakPolarHBondContact O-CB 3.37Å; E925-L929 VanDerWaalsContact O-CG 3.26Å; E925-L929 WeakPolarHBondContact O-CG 3.32Å; E925-L929 PolarHBondContact O-N 3.22Å; L929-L933 WeakPolarHBondContact O-CB 3.48Å; L929-L933 PolarHBondContact O-N 3.36Å |
| 930 | K | 95.6 | Very high | 94 | Very high | 123 Ų | 123 | 94 Ų | 94 | 54% | 0.535 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -70.2 | -38.6 | 170.9 | -79.1 | 167.2 | -171.7 | 168.1 | 0 | 112.4 | L926 V927 S928 A934 | L926-K930 HydrophobicContact CG-CD 4.49Å; L926-K930 WeakPolarHBondContact O-CB 3.08Å; L926-K930 WeakPolarHBondContact O-CD 3.34Å; L926-K930 WeakPolarHBondContact O-CG 3.16Å; L926-K930 PolarHBondContact O-N 2.94Å; V927-K930 PolarHBondContact O-N 3.16Å; S928-K930 VanDerWaalsContact C-N 3.26Å; S928-K930 PolarHBondContact O-N 3.28Å; K930-A934 WeakPolarHBondContact O-CB 3.48Å; K930-A934 PolarHBondContact O-N 3.43Å |
| 931 | G | 94.4 | Very high | 94.2 | Very high | 35 Ų | 35 | 91.1 Ų | 91.1 | 36% | 0.361 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -67.6 | -46.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V927 S928 L933 A934 C935 | V927-G931 PolarHBondContact O-N 3.39Å; S928-G931 CarbonylContact O-C 3.57Å; S928-G931 WeakPolarHBondContact O-CA 3.47Å; S928-G931 PolarHBondContact O-N 3.06Å; G931-L933 VanDerWaalsContact C-N 3.35Å; G931-L933 PolarHBondContact O-N 2.92Å; G931-A934 WeakPolarHBondContact O-CB 3.34Å; G931-A934 PolarHBondContact O-N 3.45Å; G931-A934 VanDerWaalsContact O-N 3.13Å; G931-C935 PolarHBondContact O-N 3.4Å; G931-C935 PolarHBondContact O-SG 3.4Å; G931-C935 VanDerWaalsContact O-SG 3.39Å |
| 932 | E | 95.3 | Very high | 94.3 | Very high | 105 Ų | 105 | 88 Ų | 88 | 49% | 0.491 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62 | -41 | 174.4 | -70 | 164.3 | -119.9 | 0 | 0 | 111.4 | S928 C935 S936 | S928-E932 WeakPolarHBondContact CB-OE1 3.49Å; S928-E932 WeakPolarHBondContact O-CG 3.23Å; S928-E932 PolarHBondContact O-N 2.81Å; S928-E932 PolarHBondContact OG-OE1 2.79Å; E932-C935 PolarHBondContact O-N 3.3Å; E932-S936 WeakPolarHBondContact O-CB 3.49Å; E932-S936 PolarHBondContact O-N 2.93Å |
| 933 | L | 95.4 | Very high | 94.4 | Very high | 108 Ų | 108 | 87.9 Ų | 87.9 | 57% | 0.565 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.9 | -41.8 | 171.3 | -180 | 62.3 | 0 | 0 | 0 | 111.7 | L929 G931 S936 V937 | L929-L933 WeakPolarHBondContact O-CB 3.48Å; L929-L933 PolarHBondContact O-N 3.36Å; G931-L933 VanDerWaalsContact C-N 3.35Å; G931-L933 PolarHBondContact O-N 2.92Å; L933-S936 PolarHBondContact O-N 2.91Å; L933-V937 HydrophobicContact CD1-CG2 4.23Å; L933-V937 HydrophobicContact CG-CG2 4.49Å; L933-V937 WeakPolarHBondContact O-CB 3.22Å; L933-V937 VanDerWaalsContact O-CG2 3.23Å; L933-V937 WeakPolarHBondContact O-CG2 3.46Å; L933-V937 PolarHBondContact O-N 2.88Å |
| 934 | A | 95.9 | Very high | 94.5 | Very high | 60 Ų | 60 | 88.9 Ų | 88.9 | 50% | 0.496 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65 | -43.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | K930 G931 S936 V937 H938 | K930-A934 WeakPolarHBondContact O-CB 3.48Å; K930-A934 PolarHBondContact O-N 3.43Å; G931-A934 WeakPolarHBondContact O-CB 3.34Å; G931-A934 PolarHBondContact O-N 3.45Å; G931-A934 VanDerWaalsContact O-N 3.13Å; A934-S936 VanDerWaalsContact C-N 3.34Å; A934-V937 PolarHBondContact O-N 2.81Å; A934-H938 WeakPolarHBondContact O-CB 3.44Å; A934-H938 PolarHBondContact O-N 2.88Å |
| 935 | C | 92.7 | Very high | 94.7 | Very high | 90 Ų | 90 | 86.6 Ų | 86.6 | 61% | 0.608 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.9 | -38 | 174.1 | -69.5 | 0 | 0 | 0 | 0 | 112.4 | G931 E932 H938 S939 | G931-C935 PolarHBondContact O-N 3.4Å; G931-C935 PolarHBondContact O-SG 3.4Å; G931-C935 VanDerWaalsContact O-SG 3.39Å; E932-C935 PolarHBondContact O-N 3.3Å; C935-H938 PolarHBondContact O-N 3.37Å; C935-S939 WeakPolarHBondContact O-CB 3.38Å; C935-S939 PolarHBondContact O-N 2.84Å; C935-S939 PolarHBondContact O-OG 2.76Å |
| 936 | S | 92.4 | Very high | 94.7 | Very high | 69 Ų | 69 | 86.1 Ų | 86.1 | 48% | 0.483 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -70.6 | -37.4 | 176.5 | -172.2 | 0 | 0 | 0 | 0 | 112.4 | E932 L933 A934 S939 S940 | E932-S936 WeakPolarHBondContact O-CB 3.49Å; E932-S936 PolarHBondContact O-N 2.93Å; L933-S936 PolarHBondContact O-N 2.91Å; A934-S936 VanDerWaalsContact C-N 3.34Å; S936-S939 PolarHBondContact O-OG 3.39Å; S936-S939 VanDerWaalsContact O-OG 3.11Å; S936-S940 VanDerWaalsContact O-CB 3.22Å; S936-S940 WeakPolarHBondContact O-CB 3.28Å; S936-S940 PolarHBondContact O-N 2.92Å |
| 937 | V | 95.4 | Very high | 94.8 | Very high | 89 Ų | 89 | 86.7 Ų | 86.7 | 54% | 0.539 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -65 | -43.5 | 171.2 | 166.5 | 0 | 0 | 0 | 0 | 110.6 | L933 A934 S940 E941 | L933-V937 HydrophobicContact CD1-CG2 4.23Å; L933-V937 HydrophobicContact CG-CG2 4.49Å; L933-V937 WeakPolarHBondContact O-CB 3.22Å; L933-V937 VanDerWaalsContact O-CG2 3.23Å; L933-V937 WeakPolarHBondContact O-CG2 3.46Å; L933-V937 PolarHBondContact O-N 2.88Å; A934-V937 PolarHBondContact O-N 2.81Å; V937-S940 PolarHBondContact O-N 3.35Å; V937-E941 WeakPolarHBondContact O-CB 3Å; V937-E941 PolarHBondContact O-N 2.92Å |
| 938 | H | 95.3 | Very high | 94.9 | Very high | 109 Ų | 109 | 87.3 Ų | 87.3 | 51% | 0.505 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -69.2 | -37.2 | 177.8 | -176.6 | 53.5 | 0 | 0 | 0 | 113 | A934 C935 E941 C942 | A934-H938 WeakPolarHBondContact O-CB 3.44Å; A934-H938 PolarHBondContact O-N 2.88Å; C935-H938 PolarHBondContact O-N 3.37Å; H938-E941 IonicContact CE1-OE2 3.71Å; H938-E941 IonicContact ND1-OE2 3.06Å; H938-E941 PolarHBondContact ND1-OE2 3.35Å; H938-E941 PolarHBondContact O-N 3.43Å; H938-C942 WeakPolarHBondContact O-CB 3.39Å; H938-C942 PolarHBondContact O-N 2.73Å; H938-C942 PolarHBondContact O-SG 2.83Å; H938-C942 VanDerWaalsContact O-SG 3.39Å |
| 939 | S | 92.3 | Very high | 95.1 | Very high | 60 Ų | 60 | 90.7 Ų | 90.7 | 42% | 0.42 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -69.3 | -36.8 | 173.5 | 68.2 | 0 | 0 | 0 | 0 | 111.9 | C935 S936 C942 L943 | C935-S939 WeakPolarHBondContact O-CB 3.38Å; C935-S939 PolarHBondContact O-N 2.84Å; C935-S939 PolarHBondContact O-OG 2.76Å; S936-S939 PolarHBondContact O-OG 3.39Å; S936-S939 VanDerWaalsContact O-OG 3.11Å; S939-C942 PolarHBondContact O-N 2.97Å; S939-L943 WeakPolarHBondContact O-CB 3.32Å; S939-L943 WeakPolarHBondContact O-CG 3.36Å; S939-L943 PolarHBondContact O-N 3.41Å |
| 940 | S | 92.8 | Very high | 95.3 | Very high | 70 Ų | 70 | 90.4 Ų | 90.4 | 49% | 0.49 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.2 | -40 | 170.5 | -173.2 | 0 | 0 | 0 | 0 | 112.3 | S936 V937 L943 E944 | S936-S940 VanDerWaalsContact O-CB 3.22Å; S936-S940 WeakPolarHBondContact O-CB 3.28Å; S936-S940 PolarHBondContact O-N 2.92Å; V937-S940 PolarHBondContact O-N 3.35Å; S940-L943 PolarHBondContact O-N 2.81Å; S940-E944 WeakPolarHBondContact O-CB 3.44Å; S940-E944 PolarHBondContact O-N 3.34Å |
| 941 | E | 96.2 | Very high | 95.3 | Very high | 98 Ų | 98 | 89.4 Ų | 89.4 | 46% | 0.458 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.1 | -40.9 | 175 | -174.6 | -155.5 | -147.3 | 0 | 0 | 111.5 | V937 H938 E944 R945 | V937-E941 WeakPolarHBondContact O-CB 3Å; V937-E941 PolarHBondContact O-N 2.92Å; H938-E941 IonicContact CE1-OE2 3.71Å; H938-E941 IonicContact ND1-OE2 3.06Å; H938-E941 PolarHBondContact ND1-OE2 3.35Å; H938-E941 PolarHBondContact O-N 3.43Å; E941-E944 PolarHBondContact O-N 2.9Å; E941-R945 VanDerWaalsContact CD-NH2 3.35Å; E941-R945 PolarHBondContact O-N 3.11Å; E941-R945 IonicContact OE2-CZ 3.78Å; E941-R945 IonicContact OE2-NH2 2.76Å; E941-R945 PolarHBondContact OE2-NH2 2.82Å |
| 942 | C | 95.6 | Very high | 95.5 | Very high | 46 Ų | 46 | 90 Ų | 90 | 31% | 0.311 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.6 | -45.1 | 172.5 | -76.8 | 0 | 0 | 0 | 0 | 112.3 | H938 S939 E944 R945 E946 | H938-C942 WeakPolarHBondContact O-CB 3.39Å; H938-C942 PolarHBondContact O-N 2.73Å; H938-C942 PolarHBondContact O-SG 2.83Å; H938-C942 VanDerWaalsContact O-SG 3.39Å; S939-C942 PolarHBondContact O-N 2.97Å; C942-E944 VanDerWaalsContact C-N 3.34Å; C942-R945 PolarHBondContact O-N 2.96Å; C942-R945 PolarHBondContact SG-NH1 3.32Å; C942-R945 VanDerWaalsContact SG-NH1 3.43Å; C942-R945 PolarHBondContact SG-NH2 2.88Å; C942-E946 PolarHBondContact O-N 3.34Å |
| 943 | L | 96 | Very high | 95.6 | Very high | 106 Ų | 106 | 87.7 Ų | 87.7 | 56% | 0.555 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -68.1 | -32.4 | 176.1 | -71.7 | 169 | 0 | 0 | 0 | 112.3 | S939 S940 K947 | S939-L943 WeakPolarHBondContact O-CB 3.32Å; S939-L943 WeakPolarHBondContact O-CG 3.36Å; S939-L943 PolarHBondContact O-N 3.41Å; S940-L943 PolarHBondContact O-N 2.81Å; L943-K947 WeakPolarHBondContact O-CB 3.03Å; L943-K947 PolarHBondContact O-N 3.21Å |
| 944 | E | 94.6 | Very high | 95.7 | Very high | 89 Ų | 89 | 88.2 Ų | 88.2 | 42% | 0.416 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.5 | -43.1 | 172.5 | -169.8 | 114.1 | -98 | 0 | 0 | 111.1 | S940 E941 C942 K947 E948 | S940-E944 WeakPolarHBondContact O-CB 3.44Å; S940-E944 PolarHBondContact O-N 3.34Å; E941-E944 PolarHBondContact O-N 2.9Å; C942-E944 VanDerWaalsContact C-N 3.34Å; E944-K947 CarbonylContact O-C 3.55Å; E944-K947 PolarHBondContact O-N 3.38Å; E944-K947 IonicContact OE1-NZ 3.74Å; E944-K947 PolarHBondContact OE1-NZ 2.84Å; E944-E948 WeakPolarHBondContact O-CG 3.32Å; E944-E948 PolarHBondContact O-N 3Å |
| 945 | R | 96.5 | Very high | 95.8 | Very high | 96 Ų | 96 | 91.4 Ų | 91.4 | 36% | 0.362 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -61.7 | -50.3 | 173.9 | -78.1 | -175.8 | -90.8 | 96.9 | -0.9 | 112.4 | E941 C942 K947 E948 E949 | E941-R945 VanDerWaalsContact CD-NH2 3.35Å; E941-R945 PolarHBondContact O-N 3.11Å; E941-R945 IonicContact OE2-CZ 3.78Å; E941-R945 IonicContact OE2-NH2 2.76Å; E941-R945 PolarHBondContact OE2-NH2 2.82Å; C942-R945 PolarHBondContact O-N 2.96Å; C942-R945 PolarHBondContact SG-NH1 3.32Å; C942-R945 VanDerWaalsContact SG-NH1 3.43Å; C942-R945 PolarHBondContact SG-NH2 2.88Å; R945-K947 VanDerWaalsContact C-N 3.3Å; R945-K947 PolarHBondContact O-N 2.83Å; R945-E948 CarbonylContact O-C 3.52Å; R945-E948 WeakPolarHBondContact O-CA 3.34Å; R945-E948 WeakPolarHBondContact O-CB 3.29Å; R945-E948 PolarHBondContact O-N 3.2Å; R945-E949 WeakPolarHBondContact O-CG 3.46Å; R945-E949 PolarHBondContact O-N 3.49Å |
| 946 | E | 96.4 | Very high | 96 | Very high | 105 Ų | 105 | 89.7 Ų | 89.7 | 49% | 0.491 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.1 | -42.2 | 176.5 | -174.2 | -174.4 | 178.9 | 0 | 0 | 111.6 | C942 E948 E949 L950 | C942-E946 PolarHBondContact O-N 3.34Å; E946-E948 VanDerWaalsContact C-N 3.28Å; E946-E948 PolarHBondContact O-N 2.85Å; E946-E949 PolarHBondContact O-N 2.8Å; E946-L950 HydrophobicContact CG-CD1 4.07Å; E946-L950 HydrophobicContact CG-CG 4.47Å; E946-L950 VanDerWaalsContact O-CB 3.32Å; E946-L950 WeakPolarHBondContact O-CB 3.22Å; E946-L950 VanDerWaalsContact O-CG 3.28Å; E946-L950 WeakPolarHBondContact O-CG 3.46Å; E946-L950 PolarHBondContact O-N 3.26Å |
| 947 | K | 95.9 | Very high | 96.3 | Very high | 102 Ų | 102 | 88.9 Ų | 88.9 | 44% | 0.443 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -65.4 | -27.1 | 174.5 | 178.6 | -156.6 | 176.7 | -169.3 | 0 | 112.2 | L943 E944 R945 R951 | L943-K947 WeakPolarHBondContact O-CB 3.03Å; L943-K947 PolarHBondContact O-N 3.21Å; E944-K947 CarbonylContact O-C 3.55Å; E944-K947 PolarHBondContact O-N 3.38Å; E944-K947 IonicContact OE1-NZ 3.74Å; E944-K947 PolarHBondContact OE1-NZ 2.84Å; R945-K947 VanDerWaalsContact C-N 3.3Å; R945-K947 PolarHBondContact O-N 2.83Å; K947-R951 WeakPolarHBondContact O-CB 3.44Å; K947-R951 VanDerWaalsContact O-CG 3.22Å; K947-R951 WeakPolarHBondContact O-CG 3.29Å; K947-R951 PolarHBondContact O-N 2.88Å; K947-R951 PolarHBondContact O-NH1 3.38Å |
| 948 | E | 97.1 | Very high | 96.3 | Very high | 111 Ų | 111 | 88.8 Ų | 88.8 | 52% | 0.519 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -78.9 | -42.8 | 172 | -77.3 | -175.6 | 175 | 0 | 0 | 112.2 | E944 R945 E946 L950 R951 A952 | E944-E948 WeakPolarHBondContact O-CG 3.32Å; E944-E948 PolarHBondContact O-N 3Å; R945-E948 CarbonylContact O-C 3.52Å; R945-E948 WeakPolarHBondContact O-CA 3.34Å; R945-E948 WeakPolarHBondContact O-CB 3.29Å; R945-E948 PolarHBondContact O-N 3.2Å; E946-E948 VanDerWaalsContact C-N 3.28Å; E946-E948 PolarHBondContact O-N 2.85Å; E948-L950 PolarHBondContact O-N 2.94Å; E948-R951 PolarHBondContact O-N 2.96Å; E948-A952 WeakPolarHBondContact O-CB 3.26Å; E948-A952 PolarHBondContact O-N 2.67Å |
| 949 | E | 97.3 | Very high | 96.5 | Very high | 131 Ų | 131 | 89.9 Ų | 89.9 | 61% | 0.612 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -59.9 | -44 | 172.5 | -70.4 | 171.5 | -152.7 | 0 | 0 | 111.6 | R945 E946 A952 A953 | R945-E949 WeakPolarHBondContact O-CG 3.46Å; R945-E949 PolarHBondContact O-N 3.49Å; E946-E949 PolarHBondContact O-N 2.8Å; E949-A952 PolarHBondContact O-N 3.49Å; E949-A953 VanDerWaalsContact O-CB 3.32Å; E949-A953 WeakPolarHBondContact O-CB 3.24Å; E949-A953 PolarHBondContact O-N 2.83Å |
| 950 | L | 97.7 | Very high | 96.7 | Very high | 97 Ų | 97 | 94 Ų | 94 | 51% | 0.508 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65 | -38.4 | 173.9 | -74.2 | 169.9 | 0 | 0 | 0 | 112.4 | E946 E948 L954 | E946-L950 HydrophobicContact CG-CD1 4.07Å; E946-L950 HydrophobicContact CG-CG 4.47Å; E946-L950 VanDerWaalsContact O-CB 3.32Å; E946-L950 WeakPolarHBondContact O-CB 3.22Å; E946-L950 VanDerWaalsContact O-CG 3.28Å; E946-L950 WeakPolarHBondContact O-CG 3.46Å; E946-L950 PolarHBondContact O-N 3.26Å; E948-L950 PolarHBondContact O-N 2.94Å; L950-L954 WeakPolarHBondContact O-CB 3.32Å; L950-L954 VanDerWaalsContact O-CG 3.29Å; L950-L954 WeakPolarHBondContact O-CG 3.24Å; L950-L954 PolarHBondContact O-N 2.85Å |
| 951 | R | 97.1 | Very high | 97 | Very high | 101 Ų | 101 | 96 Ų | 96 | 38% | 0.381 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.8 | -41.5 | 172.7 | -80.1 | -174.1 | -145.9 | 101.2 | -37.4 | 111.2 | K947 E948 L954 Q955 | K947-R951 WeakPolarHBondContact O-CB 3.44Å; K947-R951 VanDerWaalsContact O-CG 3.22Å; K947-R951 WeakPolarHBondContact O-CG 3.29Å; K947-R951 PolarHBondContact O-N 2.88Å; K947-R951 PolarHBondContact O-NH1 3.38Å; E948-R951 PolarHBondContact O-N 2.96Å; R951-L954 PolarHBondContact O-N 3.17Å; R951-Q955 WeakPolarHBondContact O-CB 3.32Å; R951-Q955 VanDerWaalsContact O-CG 3.26Å; R951-Q955 WeakPolarHBondContact O-CG 3.5Å; R951-Q955 PolarHBondContact O-N 3.43Å |
| 952 | A | 97.5 | Very high | 97.1 | Very high | 47 Ų | 47 | 97.1 Ų | 97.1 | 39% | 0.388 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66 | -46.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | E948 E949 L954 Q955 D956 | E948-A952 WeakPolarHBondContact O-CB 3.26Å; E948-A952 PolarHBondContact O-N 2.67Å; E949-A952 PolarHBondContact O-N 3.49Å; A952-L954 VanDerWaalsContact C-N 3.35Å; A952-L954 PolarHBondContact O-N 2.92Å; A952-Q955 PolarHBondContact O-N 3.49Å; A952-D956 PolarHBondContact O-N 2.76Å |
| 953 | A | 98.1 | Very high | 97.2 | Very high | 58 Ų | 58 | 99.8 Ų | 99.8 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.1 | -39.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | E949 D956 A957 | E949-A953 VanDerWaalsContact O-CB 3.32Å; E949-A953 WeakPolarHBondContact O-CB 3.24Å; E949-A953 PolarHBondContact O-N 2.83Å; A953-D956 PolarHBondContact O-N 3.06Å; A953-A957 VanDerWaalsContact O-CB 3.24Å; A953-A957 WeakPolarHBondContact O-CB 3.32Å; A953-A957 PolarHBondContact O-N 2.97Å |
| 954 | L | 96.8 | Very high | 97.2 | Very high | 118 Ų | 118 | 100.2 Ų | 100.2 | 62% | 0.618 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -67.4 | -39.7 | 173.1 | -76.7 | 169.7 | 0 | 0 | 0 | 112.5 | L950 R951 A952 T958 | L950-L954 WeakPolarHBondContact O-CB 3.32Å; L950-L954 VanDerWaalsContact O-CG 3.29Å; L950-L954 WeakPolarHBondContact O-CG 3.24Å; L950-L954 PolarHBondContact O-N 2.85Å; R951-L954 PolarHBondContact O-N 3.17Å; A952-L954 VanDerWaalsContact C-N 3.35Å; A952-L954 PolarHBondContact O-N 2.92Å; L954-T958 WeakPolarHBondContact O-CB 3.32Å; L954-T958 PolarHBondContact O-N 2.69Å; L954-T958 PolarHBondContact O-OG1 2.95Å |
| 955 | Q | 97.8 | Very high | 97.4 | Very high | 127 Ų | 127 | 100.8 Ų | 100.8 | 59% | 0.593 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63.7 | -42.9 | 174.3 | -75.5 | 173.8 | 19.7 | 0 | 0 | 111.3 | R951 A952 T958 R959 | R951-Q955 WeakPolarHBondContact O-CB 3.32Å; R951-Q955 VanDerWaalsContact O-CG 3.26Å; R951-Q955 WeakPolarHBondContact O-CG 3.5Å; R951-Q955 PolarHBondContact O-N 3.43Å; A952-Q955 PolarHBondContact O-N 3.49Å; Q955-T958 PolarHBondContact O-N 2.98Å; Q955-R959 VanDerWaalsContact O-CB 3.28Å; Q955-R959 WeakPolarHBondContact O-CB 3.38Å; Q955-R959 PolarHBondContact O-N 2.85Å |
| 956 | D | 97.7 | Very high | 97.4 | Very high | 55 Ų | 55 | 101.4 Ų | 101.4 | 29% | 0.294 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -73.1 | -34.8 | 178.5 | -81.2 | -10.5 | 0 | 0 | 0 | 113.3 | A952 A953 R959 R960 | A952-D956 PolarHBondContact O-N 2.76Å; A953-D956 PolarHBondContact O-N 3.06Å; D956-R959 PolarHBondContact O-N 3.31Å; D956-R959 IonicContact OD1-CZ 2.96Å; D956-R959 VanDerWaalsContact OD1-CZ 3.22Å; D956-R959 IonicContact OD1-NE 2.85Å; D956-R959 PolarHBondContact OD1-NE 3.4Å; D956-R959 IonicContact OD1-NH2 3.22Å; D956-R959 PolarHBondContact OD1-NH2 3.43Å; D956-R960 WeakPolarHBondContact O-CB 3.28Å; D956-R960 VanDerWaalsContact O-CG 3.29Å; D956-R960 WeakPolarHBondContact O-CG 3.3Å; D956-R960 PolarHBondContact O-N 3.15Å |
| 957 | A | 97.9 | Very high | 97.5 | Very high | 51 Ų | 51 | 101.9 Ų | 101.9 | 42% | 0.421 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.8 | -41.5 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | A953 R959 L961 | A953-A957 VanDerWaalsContact O-CB 3.24Å; A953-A957 WeakPolarHBondContact O-CB 3.32Å; A953-A957 PolarHBondContact O-N 2.97Å; A957-R959 VanDerWaalsContact C-N 3.35Å; A957-L961 WeakPolarHBondContact O-CB 3.32Å; A957-L961 PolarHBondContact O-N 3.37Å |
| 958 | T | 96.6 | Very high | 97.6 | Very high | 88 Ų | 88 | 103.5 Ų | 103.5 | 54% | 0.54 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.2 | -41.2 | 174.5 | -54.4 | 0 | 0 | 0 | 0 | 111.1 | L954 Q955 Q962 | L954-T958 WeakPolarHBondContact O-CB 3.32Å; L954-T958 PolarHBondContact O-N 2.69Å; L954-T958 PolarHBondContact O-OG1 2.95Å; Q955-T958 PolarHBondContact O-N 2.98Å; T958-Q962 VanDerWaalsContact O-CB 3.3Å; T958-Q962 WeakPolarHBondContact O-CB 3.31Å; T958-Q962 PolarHBondContact O-N 2.8Å |
| 959 | R | 98.1 | Very high | 97.7 | Very high | 132 Ų | 132 | 102.6 Ų | 102.6 | 50% | 0.498 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.2 | -51.1 | 177.2 | -168 | -151.2 | -53.5 | -104.5 | 2.2 | 111.3 | Q955 D956 A957 Q962 E963 | Q955-R959 VanDerWaalsContact O-CB 3.28Å; Q955-R959 WeakPolarHBondContact O-CB 3.38Å; Q955-R959 PolarHBondContact O-N 2.85Å; D956-R959 PolarHBondContact O-N 3.31Å; D956-R959 IonicContact OD1-CZ 2.96Å; D956-R959 VanDerWaalsContact OD1-CZ 3.22Å; D956-R959 IonicContact OD1-NE 2.85Å; D956-R959 PolarHBondContact OD1-NE 3.4Å; D956-R959 IonicContact OD1-NH2 3.22Å; D956-R959 PolarHBondContact OD1-NH2 3.43Å; A957-R959 VanDerWaalsContact C-N 3.35Å; R959-Q962 CarbonylContact O-C 3.57Å; R959-Q962 WeakPolarHBondContact O-CB 3.47Å; R959-Q962 PolarHBondContact O-N 3.15Å; R959-Q962 VanDerWaalsContact O-N 3.15Å; R959-E963 WeakPolarHBondContact CD-OE1 3.28Å; R959-E963 WeakPolarHBondContact CG-OE1 3.47Å; R959-E963 VanDerWaalsContact O-CG 3.32Å; R959-E963 WeakPolarHBondContact O-CG 3.41Å; R959-E963 PolarHBondContact O-N 2.84Å |
| 960 | R | 98.1 | Very high | 97.7 | Very high | 145 Ų | 145 | 98.7 Ų | 98.7 | 55% | 0.547 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.9 | -46.9 | 177.3 | -71.9 | 174 | -160.2 | 158.4 | 9.3 | 111.6 | D956 Q962 E963 E964 | D956-R960 WeakPolarHBondContact O-CB 3.28Å; D956-R960 VanDerWaalsContact O-CG 3.29Å; D956-R960 WeakPolarHBondContact O-CG 3.3Å; D956-R960 PolarHBondContact O-N 3.15Å; R960-Q962 VanDerWaalsContact C-N 3.25Å; R960-Q962 PolarHBondContact O-N 2.8Å; R960-E963 CarbonylContact O-C 3.59Å; R960-E963 WeakPolarHBondContact O-CB 3.47Å; R960-E963 PolarHBondContact O-N 3.18Å; R960-E964 WeakPolarHBondContact O-CB 3.3Å; R960-E964 VanDerWaalsContact O-CG 3.31Å; R960-E964 WeakPolarHBondContact O-CG 3.34Å; R960-E964 PolarHBondContact O-N 2.84Å |
| 961 | L | 97.9 | Very high | 97.7 | Very high | 114 Ų | 114 | 96.5 Ų | 96.5 | 60% | 0.597 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.5 | -34.9 | 176.7 | -177.1 | 63.3 | 0 | 0 | 0 | 112.1 | A957 H965 | A957-L961 WeakPolarHBondContact O-CB 3.32Å; A957-L961 PolarHBondContact O-N 3.37Å; L961-H965 WeakPolarHBondContact O-CB 3.44Å; L961-H965 PolarHBondContact O-N 3.23Å |
| 962 | Q | 97.6 | Very high | 97.8 | Very high | 120 Ų | 120 | 97 Ų | 97 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -72.5 | -32.1 | 174.1 | -178.5 | 176.2 | -9.6 | 0 | 0 | 112.6 | T958 R959 R960 Q966 | T958-Q962 VanDerWaalsContact O-CB 3.3Å; T958-Q962 WeakPolarHBondContact O-CB 3.31Å; T958-Q962 PolarHBondContact O-N 2.8Å; R959-Q962 CarbonylContact O-C 3.57Å; R959-Q962 WeakPolarHBondContact O-CB 3.47Å; R959-Q962 PolarHBondContact O-N 3.15Å; R959-Q962 VanDerWaalsContact O-N 3.15Å; R960-Q962 VanDerWaalsContact C-N 3.25Å; R960-Q962 PolarHBondContact O-N 2.8Å; Q962-Q966 WeakPolarHBondContact O-CB 3.45Å; Q962-Q966 VanDerWaalsContact O-CG 3.32Å; Q962-Q966 WeakPolarHBondContact O-CG 3.15Å; Q962-Q966 PolarHBondContact O-N 3.41Å; Q962-Q966 VanDerWaalsContact O-N 3.17Å; Q962-Q966 PolarHBondContact O-NE2 3.02Å |
| 963 | E | 97.9 | Very high | 97.8 | Very high | 103 Ų | 103 | 100.2 Ų | 100.2 | 48% | 0.481 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -73 | -47.4 | 174.4 | -72.3 | 161.1 | 176.7 | 0 | 0 | 111 | R959 R960 H965 Q966 Q967 | R959-E963 WeakPolarHBondContact CD-OE1 3.28Å; R959-E963 WeakPolarHBondContact CG-OE1 3.47Å; R959-E963 VanDerWaalsContact O-CG 3.32Å; R959-E963 WeakPolarHBondContact O-CG 3.41Å; R959-E963 PolarHBondContact O-N 2.84Å; R960-E963 CarbonylContact O-C 3.59Å; R960-E963 WeakPolarHBondContact O-CB 3.47Å; R960-E963 PolarHBondContact O-N 3.18Å; E963-H965 PolarHBondContact O-N 2.9Å; E963-Q966 PolarHBondContact O-N 3.49Å; E963-Q967 PolarHBondContact O-N 2.96Å |
| 964 | E | 97.5 | Very high | 97.8 | Very high | 114 Ų | 114 | 104 Ų | 104 | 53% | 0.533 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -56.3 | -48.7 | 172.5 | -72.6 | 168.3 | 172.3 | 0 | 0 | 111.1 | R960 Q966 Q967 E968 | R960-E964 WeakPolarHBondContact O-CB 3.3Å; R960-E964 VanDerWaalsContact O-CG 3.31Å; R960-E964 WeakPolarHBondContact O-CG 3.34Å; R960-E964 PolarHBondContact O-N 2.84Å; E964-Q966 VanDerWaalsContact C-N 3.35Å; E964-Q966 PolarHBondContact O-N 2.63Å; E964-Q967 PolarHBondContact O-N 2.84Å; E964-Q967 VanDerWaalsContact O-N 3.15Å; E964-E968 WeakPolarHBondContact O-CG 3.47Å; E964-E968 PolarHBondContact O-N 2.98Å |
| 965 | H | 97.5 | Very high | 97.9 | Very high | 101 Ų | 101 | 104 Ų | 104 | 47% | 0.468 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.6 | -37 | 177.7 | -177.5 | 49.5 | 0 | 0 | 0 | 113 | L961 E963 L969 | L961-H965 WeakPolarHBondContact O-CB 3.44Å; L961-H965 PolarHBondContact O-N 3.23Å; E963-H965 PolarHBondContact O-N 2.9Å; H965-L969 WeakPolarHBondContact O-CB 3.19Å; H965-L969 VanDerWaalsContact O-CG 3.28Å; H965-L969 WeakPolarHBondContact O-CG 3.35Å; H965-L969 PolarHBondContact O-N 3.17Å |
| 966 | Q | 97.8 | Very high | 97.9 | Very high | 110 Ų | 110 | 102.3 Ų | 102.3 | 51% | 0.514 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.4 | -39 | 173.1 | -80.6 | 170.1 | 101.7 | 0 | 0 | 111.8 | Q962 E963 E964 L969 A970 | Q962-Q966 WeakPolarHBondContact O-CB 3.45Å; Q962-Q966 VanDerWaalsContact O-CG 3.32Å; Q962-Q966 WeakPolarHBondContact O-CG 3.15Å; Q962-Q966 PolarHBondContact O-N 3.41Å; Q962-Q966 VanDerWaalsContact O-N 3.17Å; Q962-Q966 PolarHBondContact O-NE2 3.02Å; E963-Q966 PolarHBondContact O-N 3.49Å; E964-Q966 VanDerWaalsContact C-N 3.35Å; E964-Q966 PolarHBondContact O-N 2.63Å; Q966-L969 PolarHBondContact O-N 2.82Å; Q966-A970 WeakPolarHBondContact O-CB 3.2Å; Q966-A970 PolarHBondContact O-N 3.44Å |
| 967 | Q | 98.3 | Very high | 97.9 | Very high | 115 Ų | 115 | 103.2 Ų | 103.2 | 54% | 0.537 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.1 | -46 | 175 | -173.3 | 60.8 | 48.6 | 0 | 0 | 111.3 | E963 E964 L969 A970 D971 | E963-Q967 PolarHBondContact O-N 2.96Å; E964-Q967 PolarHBondContact O-N 2.84Å; E964-Q967 VanDerWaalsContact O-N 3.15Å; Q967-L969 VanDerWaalsContact C-N 3.31Å; Q967-L969 PolarHBondContact O-N 3.38Å; Q967-A970 PolarHBondContact O-N 3Å; Q967-D971 PolarHBondContact NE2-OD1 2.86Å; Q967-D971 VanDerWaalsContact O-CB 3.3Å; Q967-D971 WeakPolarHBondContact O-CB 3.38Å; Q967-D971 PolarHBondContact O-N 3.49Å |
| 968 | E | 97.8 | Very high | 97.9 | Very high | 136 Ų | 136 | 103.4 Ų | 103.4 | 64% | 0.636 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -58.5 | -40.3 | 175.9 | -74.9 | -172.4 | 155.3 | 0 | 0 | 112.6 | E964 L972 | E964-E968 WeakPolarHBondContact O-CG 3.47Å; E964-E968 PolarHBondContact O-N 2.98Å; E968-L972 VanDerWaalsContact O-CB 3.23Å; E968-L972 WeakPolarHBondContact O-CB 3.4Å; E968-L972 PolarHBondContact O-N 2.79Å |
| 969 | L | 98.1 | Very high | 98 | Very high | 92 Ų | 92 | 103.1 Ų | 103.1 | 48% | 0.482 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.1 | -44.7 | 174.5 | -75 | 173.5 | 0 | 0 | 0 | 111.9 | H965 Q966 Q967 L972 E973 | H965-L969 WeakPolarHBondContact O-CB 3.19Å; H965-L969 VanDerWaalsContact O-CG 3.28Å; H965-L969 WeakPolarHBondContact O-CG 3.35Å; H965-L969 PolarHBondContact O-N 3.17Å; Q966-L969 PolarHBondContact O-N 2.82Å; Q967-L969 VanDerWaalsContact C-N 3.31Å; Q967-L969 PolarHBondContact O-N 3.38Å; L969-L972 PolarHBondContact O-N 2.98Å; L969-E973 WeakPolarHBondContact O-CB 3.34Å; L969-E973 PolarHBondContact O-N 3.42Å |
| 970 | A | 98.1 | Very high | 98 | Very high | 48 Ų | 48 | 101.6 Ų | 101.6 | 40% | 0.397 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.3 | -42.2 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q966 Q967 E973 Q974 | Q966-A970 WeakPolarHBondContact O-CB 3.2Å; Q966-A970 PolarHBondContact O-N 3.44Å; Q967-A970 PolarHBondContact O-N 3Å; A970-E973 PolarHBondContact O-N 3.37Å; A970-Q974 WeakPolarHBondContact O-CB 3.42Å; A970-Q974 PolarHBondContact O-N 2.91Å |
| 971 | D | 98 | Very high | 98 | Very high | 51 Ų | 51 | 101.9 Ų | 101.9 | 27% | 0.273 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.7 | -45.5 | 173.2 | -105.3 | 63 | 0 | 0 | 0 | 111.6 | Q967 K975 | Q967-D971 PolarHBondContact NE2-OD1 2.86Å; Q967-D971 VanDerWaalsContact O-CB 3.3Å; Q967-D971 WeakPolarHBondContact O-CB 3.38Å; Q967-D971 PolarHBondContact O-N 3.49Å; D971-K975 WeakPolarHBondContact O-CB 3.47Å; D971-K975 WeakPolarHBondContact O-CD 3.25Å; D971-K975 WeakPolarHBondContact O-CE 3.22Å; D971-K975 WeakPolarHBondContact O-CG 3.38Å; D971-K975 PolarHBondContact O-N 3.38Å; D971-K975 WeakPolarHBondContact OD2-CE 3.23Å; D971-K975 IonicContact OD2-NZ 2.96Å; D971-K975 PolarHBondContact OD2-NZ 3.34Å |
| 972 | L | 98.1 | Very high | 98.1 | Very high | 112 Ų | 112 | 99.2 Ų | 99.2 | 59% | 0.586 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -69.1 | -40.6 | 178.9 | -178.9 | 60.7 | 0 | 0 | 0 | 111.3 | E968 L969 K975 L976 | E968-L972 VanDerWaalsContact O-CB 3.23Å; E968-L972 WeakPolarHBondContact O-CB 3.4Å; E968-L972 PolarHBondContact O-N 2.79Å; L969-L972 PolarHBondContact O-N 2.98Å; L972-K975 PolarHBondContact O-N 2.95Å; L972-L976 VanDerWaalsContact O-CB 3.25Å; L972-L976 WeakPolarHBondContact O-CB 3.48Å; L972-L976 PolarHBondContact O-N 2.88Å |
| 973 | E | 97.8 | Very high | 98.1 | Very high | 114 Ų | 114 | 98.8 Ų | 98.8 | 53% | 0.533 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.4 | -45.9 | 174.3 | -164.8 | -171.2 | 151 | 0 | 0 | 110.9 | L969 A970 K975 L976 Q977 | L969-E973 WeakPolarHBondContact O-CB 3.34Å; L969-E973 PolarHBondContact O-N 3.42Å; A970-E973 PolarHBondContact O-N 3.37Å; E973-K975 VanDerWaalsContact C-N 3.35Å; E973-K975 PolarHBondContact O-N 3.45Å; E973-L976 PolarHBondContact O-N 3.46Å; E973-Q977 HydrophobicContact CG-CG 4.37Å; E973-Q977 WeakPolarHBondContact O-CB 3.23Å; E973-Q977 WeakPolarHBondContact O-CG 3.47Å; E973-Q977 PolarHBondContact O-N 3.24Å; E973-Q977 PolarHBondContact OE1-NE2 3.37Å |
| 974 | Q | 98.3 | Very high | 98.1 | Very high | 138 Ų | 138 | 103 Ų | 103 | 65% | 0.645 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.8 | -43.1 | 177.2 | -174 | 179.9 | 0.5 | 0 | 0 | 111.7 | A970 Q977 A978 | A970-Q974 WeakPolarHBondContact O-CB 3.42Å; A970-Q974 PolarHBondContact O-N 2.91Å; Q974-Q977 PolarHBondContact O-N 2.88Å; Q974-A978 VanDerWaalsContact O-CB 3.31Å; Q974-A978 WeakPolarHBondContact O-CB 3.47Å; Q974-A978 PolarHBondContact O-N 2.91Å |
| 975 | K | 98.4 | Very high | 98.1 | Very high | 119 Ų | 119 | 102.9 Ų | 102.9 | 52% | 0.517 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.5 | -42.6 | 176.1 | -71.4 | 158.7 | -160.2 | 163.7 | 0 | 111.4 | D971 L972 E973 A978 V979 | D971-K975 WeakPolarHBondContact O-CB 3.47Å; D971-K975 WeakPolarHBondContact O-CD 3.25Å; D971-K975 WeakPolarHBondContact O-CE 3.22Å; D971-K975 WeakPolarHBondContact O-CG 3.38Å; D971-K975 PolarHBondContact O-N 3.38Å; D971-K975 WeakPolarHBondContact OD2-CE 3.23Å; D971-K975 IonicContact OD2-NZ 2.96Å; D971-K975 PolarHBondContact OD2-NZ 3.34Å; L972-K975 PolarHBondContact O-N 2.95Å; E973-K975 VanDerWaalsContact C-N 3.35Å; E973-K975 PolarHBondContact O-N 3.45Å; K975-A978 PolarHBondContact O-N 3.25Å; K975-V979 WeakPolarHBondContact O-CG2 3.31Å; K975-V979 PolarHBondContact O-N 3.35Å |
| 976 | L | 98.3 | Very high | 98.2 | Very high | 91 Ų | 91 | 102.9 Ų | 102.9 | 48% | 0.476 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.2 | -43.7 | 176.4 | -177.3 | 62.8 | 0 | 0 | 0 | 111.9 | L972 E973 A978 V979 H980 | L972-L976 VanDerWaalsContact O-CB 3.25Å; L972-L976 WeakPolarHBondContact O-CB 3.48Å; L972-L976 PolarHBondContact O-N 2.88Å; E973-L976 PolarHBondContact O-N 3.46Å; L976-A978 VanDerWaalsContact C-N 3.35Å; L976-V979 PolarHBondContact O-N 2.96Å; L976-H980 WeakPolarHBondContact O-CB 3.3Å; L976-H980 VanDerWaalsContact O-CG 3.22Å; L976-H980 PolarHBondContact O-N 2.95Å; L976-H980 PolarHBondContact O-ND1 2.78Å |
| 977 | Q | 98.3 | Very high | 98.2 | Very high | 73 Ų | 73 | 100.2 Ų | 100.2 | 34% | 0.341 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.4 | -40.5 | 173.8 | -73.2 | -169.8 | 28.7 | 0 | 0 | 111.7 | E973 Q974 H980 R981 | E973-Q977 HydrophobicContact CG-CG 4.37Å; E973-Q977 WeakPolarHBondContact O-CB 3.23Å; E973-Q977 WeakPolarHBondContact O-CG 3.47Å; E973-Q977 PolarHBondContact O-N 3.24Å; E973-Q977 PolarHBondContact OE1-NE2 3.37Å; Q974-Q977 PolarHBondContact O-N 2.88Å; Q977-H980 PolarHBondContact O-N 3.46Å; Q977-R981 VanDerWaalsContact O-CG 3.22Å; Q977-R981 WeakPolarHBondContact O-CG 3.45Å; Q977-R981 PolarHBondContact O-N 3.44Å |
| 978 | A | 98.3 | Very high | 98.2 | Very high | 56 Ų | 56 | 99.6 Ų | 99.6 | 46% | 0.463 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.5 | -44.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | Q974 K975 L976 R981 A982 | Q974-A978 VanDerWaalsContact O-CB 3.31Å; Q974-A978 WeakPolarHBondContact O-CB 3.47Å; Q974-A978 PolarHBondContact O-N 2.91Å; K975-A978 PolarHBondContact O-N 3.25Å; L976-A978 VanDerWaalsContact C-N 3.35Å; A978-R981 PolarHBondContact O-N 2.83Å; A978-A982 WeakPolarHBondContact O-CB 3.32Å; A978-A982 PolarHBondContact O-N 3.13Å |
| 979 | V | 98.4 | Very high | 98.3 | Very high | 81 Ų | 81 | 97.3 Ų | 97.3 | 49% | 0.491 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61.7 | -47.8 | 173.5 | 170.8 | 0 | 0 | 0 | 0 | 110.7 | K975 L976 R981 A982 E983 | K975-V979 WeakPolarHBondContact O-CG2 3.31Å; K975-V979 PolarHBondContact O-N 3.35Å; L976-V979 PolarHBondContact O-N 2.96Å; V979-R981 VanDerWaalsContact C-N 3.33Å; V979-R981 PolarHBondContact O-N 2.9Å; V979-A982 PolarHBondContact O-N 3.43Å; V979-E983 HydrophobicContact CG1-CG 4.2Å; V979-E983 WeakPolarHBondContact O-CB 3.49Å; V979-E983 WeakPolarHBondContact O-CG 3.42Å; V979-E983 PolarHBondContact O-N 3.36Å |
| 980 | H | 98.1 | Very high | 98.3 | Very high | 100 Ų | 100 | 95.8 Ų | 95.8 | 46% | 0.463 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -58 | -43.1 | 177 | -71.1 | 161.4 | 0 | 0 | 0 | 112.5 | L976 Q977 W984 | L976-H980 WeakPolarHBondContact O-CB 3.3Å; L976-H980 VanDerWaalsContact O-CG 3.22Å; L976-H980 PolarHBondContact O-N 2.95Å; L976-H980 PolarHBondContact O-ND1 2.78Å; Q977-H980 PolarHBondContact O-N 3.46Å; H980-W984 WeakPolarHBondContact O-CB 3.29Å; H980-W984 PolarHBondContact O-N 2.89Å |
| 981 | R | 98.3 | Very high | 98.3 | Very high | 152 Ų | 152 | 101.8 Ų | 101.8 | 57% | 0.574 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -61.7 | -49.9 | 175.9 | -69.4 | 169.6 | -154.2 | -164.7 | 7.8 | 111.2 | Q977 A978 V979 E983 W984 D985 | Q977-R981 VanDerWaalsContact O-CG 3.22Å; Q977-R981 WeakPolarHBondContact O-CG 3.45Å; Q977-R981 PolarHBondContact O-N 3.44Å; A978-R981 PolarHBondContact O-N 2.83Å; V979-R981 VanDerWaalsContact C-N 3.33Å; V979-R981 PolarHBondContact O-N 2.9Å; R981-E983 VanDerWaalsContact C-N 3.33Å; R981-E983 PolarHBondContact O-N 2.94Å; R981-W984 WeakPolarHBondContact O-CB 3.45Å; R981-W984 PolarHBondContact O-N 2.9Å; R981-W984 VanDerWaalsContact O-N 3.13Å; R981-D985 WeakPolarHBondContact O-CB 3.31Å; R981-D985 PolarHBondContact O-N 3.4Å |
| 982 | A | 98.4 | Very high | 98.3 | Very high | 57 Ų | 57 | 103.2 Ų | 103.2 | 47% | 0.471 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.8 | -38.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | A978 V979 H986 | A978-A982 WeakPolarHBondContact O-CB 3.32Å; A978-A982 PolarHBondContact O-N 3.13Å; V979-A982 PolarHBondContact O-N 3.43Å; A982-H986 VanDerWaalsContact O-CB 3.23Å; A982-H986 WeakPolarHBondContact O-CB 3.24Å; A982-H986 PolarHBondContact O-N 2.87Å |
| 983 | E | 98.1 | Very high | 98.3 | Very high | 111 Ų | 111 | 101.6 Ų | 101.6 | 52% | 0.519 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -67.8 | -41.4 | 173.7 | -68.5 | -70.9 | 171.2 | 0 | 0 | 111.7 | V979 R981 V987 | V979-E983 HydrophobicContact CG1-CG 4.2Å; V979-E983 WeakPolarHBondContact O-CB 3.49Å; V979-E983 WeakPolarHBondContact O-CG 3.42Å; V979-E983 PolarHBondContact O-N 3.36Å; R981-E983 VanDerWaalsContact C-N 3.33Å; R981-E983 PolarHBondContact O-N 2.94Å; E983-V987 VanDerWaalsContact O-CB 3.31Å; E983-V987 WeakPolarHBondContact O-CB 3.5Å; E983-V987 VanDerWaalsContact O-CG2 3.24Å; E983-V987 WeakPolarHBondContact O-CG2 3.48Å; E983-V987 PolarHBondContact O-N 2.82Å |
| 984 | W | 98.4 | Very high | 98.3 | Very high | 193 Ų | 193 | 100 Ų | 100 | 73% | 0.731 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.4 | -46.7 | 173.3 | -84.2 | 117.2 | 0 | 0 | 0 | 112 | H980 R981 V987 H988 | H980-W984 WeakPolarHBondContact O-CB 3.29Å; H980-W984 PolarHBondContact O-N 2.89Å; R981-W984 WeakPolarHBondContact O-CB 3.45Å; R981-W984 PolarHBondContact O-N 2.9Å; R981-W984 VanDerWaalsContact O-N 3.13Å; W984-V987 PolarHBondContact O-N 3.45Å; W984-H988 VanDerWaalsContact O-CB 3.29Å; W984-H988 WeakPolarHBondContact O-CB 3.25Å; W984-H988 PolarHBondContact O-N 3.27Å |
| 985 | D | 98.4 | Very high | 98.2 | Very high | 111 Ų | 111 | 96 Ų | 96 | 59% | 0.594 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -63.8 | -44.1 | 179.1 | -64.8 | -30.3 | 0 | 0 | 0 | 110.8 | R981 H988 L989 | R981-D985 WeakPolarHBondContact O-CB 3.31Å; R981-D985 PolarHBondContact O-N 3.4Å; D985-H988 PolarHBondContact O-N 3.41Å; D985-L989 VanDerWaalsContact O-CB 3.3Å; D985-L989 WeakPolarHBondContact O-CB 3.44Å; D985-L989 PolarHBondContact O-N 3.14Å |
| 986 | H | 98.5 | Very high | 98.2 | Very high | 100 Ų | 100 | 94.6 Ų | 94.6 | 46% | 0.463 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -62.8 | -47.1 | 176.3 | 178.4 | 49.4 | 0 | 0 | 0 | 112.1 | A982 L989 N990 | A982-H986 VanDerWaalsContact O-CB 3.23Å; A982-H986 WeakPolarHBondContact O-CB 3.24Å; A982-H986 PolarHBondContact O-N 2.87Å; H986-L989 PolarHBondContact O-N 3.2Å; H986-N990 PolarHBondContact CE1-ND2 2.94Å; H986-N990 PolarHBondContact CE1-OD1 2.93Å; H986-N990 VanDerWaalsContact CE1-OD1 3.27Å; H986-N990 PolarHBondContact NE2-ND2 3.21Å; H986-N990 WeakPolarHBondContact O-CB 3.35Å; H986-N990 PolarHBondContact O-N 3.08Å; H986-N990 PolarHBondContact O-ND2 3.16Å |
| 987 | V | 98.4 | Very high | 98.2 | Very high | 55 Ų | 55 | 94.8 Ų | 94.8 | 33% | 0.333 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64 | -41.4 | 177.6 | 168.4 | 0 | 0 | 0 | 0 | 111.2 | E983 W984 N990 Y991 | E983-V987 VanDerWaalsContact O-CB 3.31Å; E983-V987 WeakPolarHBondContact O-CB 3.5Å; E983-V987 VanDerWaalsContact O-CG2 3.24Å; E983-V987 WeakPolarHBondContact O-CG2 3.48Å; E983-V987 PolarHBondContact O-N 2.82Å; W984-V987 PolarHBondContact O-N 3.45Å; V987-N990 PolarHBondContact O-N 2.91Å; V987-Y991 HydrophobicContact CG1-CD2 3.7Å; V987-Y991 HydrophobicContact CG1-CE2 3.47Å; V987-Y991 VanDerWaalsContact CG1-CE2 3.47Å; V987-Y991 WeakPolarHBondContact O-CD2 3.17Å; V987-Y991 PolarHBondContact O-N 3.29Å |
| 988 | H | 98.1 | Very high | 98.2 | Very high | 102 Ų | 102 | 98.9 Ų | 98.9 | 47% | 0.472 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64.3 | -44.2 | 176.8 | -168.7 | 76.8 | 0 | 0 | 0 | 112 | W984 D985 Y991 Q992 | W984-H988 VanDerWaalsContact O-CB 3.29Å; W984-H988 WeakPolarHBondContact O-CB 3.25Å; W984-H988 PolarHBondContact O-N 3.27Å; D985-H988 PolarHBondContact O-N 3.41Å; H988-Y991 PolarHBondContact O-N 2.92Å; H988-Q992 WeakPolarHBondContact O-CB 3.49Å; H988-Q992 PolarHBondContact O-N 2.97Å |
| 989 | L | 98.7 | Very high | 98.2 | Very high | 87 Ų | 87 | 103.1 Ų | 103.1 | 46% | 0.455 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -61 | -44.9 | 175.4 | -177.8 | 62.9 | 0 | 0 | 0 | 111.5 | D985 H986 Y991 Q992 E993 | D985-L989 VanDerWaalsContact O-CB 3.3Å; D985-L989 WeakPolarHBondContact O-CB 3.44Å; D985-L989 PolarHBondContact O-N 3.14Å; H986-L989 PolarHBondContact O-N 3.2Å; L989-Y991 PolarHBondContact O-N 2.83Å; L989-Q992 PolarHBondContact O-N 3.36Å; L989-E993 WeakPolarHBondContact O-CB 3.27Å; L989-E993 PolarHBondContact O-N 3.44Å |
| 990 | N | 98.3 | Very high | 98.2 | Very high | 61 Ų | 61 | 101.9 Ų | 101.9 | 33% | 0.326 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -58.5 | -45.2 | 175.5 | -68.5 | -25.9 | 0 | 0 | 0 | 111.7 | H986 V987 E993 E994 | H986-N990 PolarHBondContact CE1-ND2 2.94Å; H986-N990 PolarHBondContact CE1-OD1 2.93Å; H986-N990 VanDerWaalsContact CE1-OD1 3.27Å; H986-N990 PolarHBondContact NE2-ND2 3.21Å; H986-N990 WeakPolarHBondContact O-CB 3.35Å; H986-N990 PolarHBondContact O-N 3.08Å; H986-N990 PolarHBondContact O-ND2 3.16Å; V987-N990 PolarHBondContact O-N 2.91Å; N990-E993 PolarHBondContact O-N 3.02Å; N990-E994 WeakPolarHBondContact O-CG 3.49Å; N990-E994 PolarHBondContact O-N 3.35Å |
| 991 | Y | 97.9 | Very high | 98.2 | Very high | 173 Ų | 173 | 101.1 Ų | 101.1 | 68% | 0.678 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -63.7 | -40.1 | 176.1 | -81.9 | -61.1 | 0 | 0 | 0 | 112.5 | V987 H988 L989 A995 | V987-Y991 HydrophobicContact CG1-CD2 3.7Å; V987-Y991 HydrophobicContact CG1-CE2 3.47Å; V987-Y991 VanDerWaalsContact CG1-CE2 3.47Å; V987-Y991 WeakPolarHBondContact O-CD2 3.17Å; V987-Y991 PolarHBondContact O-N 3.29Å; H988-Y991 PolarHBondContact O-N 2.92Å; L989-Y991 PolarHBondContact O-N 2.83Å; Y991-A995 WeakPolarHBondContact O-CB 3.36Å; Y991-A995 PolarHBondContact O-N 3.2Å |
| 992 | Q | 98.3 | Very high | 98.2 | Very high | 81 Ų | 81 | 99.5 Ų | 99.5 | 38% | 0.379 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.3 | -40.1 | 176.3 | -169.8 | 179.3 | 15.2 | 0 | 0 | 111.6 | H988 L989 N996 | H988-Q992 WeakPolarHBondContact O-CB 3.49Å; H988-Q992 PolarHBondContact O-N 2.97Å; L989-Q992 PolarHBondContact O-N 3.36Å; Q992-N996 WeakPolarHBondContact O-CB 3.35Å; Q992-N996 PolarHBondContact O-N 2.81Å; Q992-N996 PolarHBondContact O-ND2 3.43Å; Q992-N996 VanDerWaalsContact O-ND2 3.16Å |
| 993 | E | 98.3 | Very high | 98.2 | Very high | 79 Ų | 79 | 101.6 Ų | 101.6 | 37% | 0.369 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.2 | -49.2 | 173.6 | -87.6 | -164.3 | -154.3 | 0 | 0 | 112.6 | L989 N990 N996 K997 | L989-E993 WeakPolarHBondContact O-CB 3.27Å; L989-E993 PolarHBondContact O-N 3.44Å; N990-E993 PolarHBondContact O-N 3.02Å; E993-N996 CarbonylContact O-C 3.52Å; E993-N996 WeakPolarHBondContact O-CB 3.32Å; E993-N996 PolarHBondContact O-N 2.84Å; E993-K997 VanDerWaalsContact O-CG 3.25Å; E993-K997 WeakPolarHBondContact O-CG 3.03Å; E993-K997 PolarHBondContact O-N 2.69Å; E993-K997 WeakPolarHBondContact OE2-CE 3.35Å; E993-K997 IonicContact OE2-NZ 3.57Å; E993-K997 PolarHBondContact OE2-NZ 2.78Å |
| 994 | E | 97.4 | Very high | 98.2 | Very high | 81 Ų | 81 | 102.1 Ų | 102.1 | 38% | 0.379 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 178.3 | -68 | -52.6 | 126 | 0 | 0 | 111.6 | N990 N996 K997 Y998 | N990-E994 WeakPolarHBondContact O-CG 3.49Å; N990-E994 PolarHBondContact O-N 3.35Å; E994-N996 VanDerWaalsContact C-N 3.29Å; E994-N996 PolarHBondContact O-N 3.36Å; E994-K997 PolarHBondContact O-N 3.43Å; E994-K997 VanDerWaalsContact O-N 3.14Å; E994-K997 VanDerWaalsContact OE1-CD 3.27Å; E994-K997 WeakPolarHBondContact OE1-CD 3.23Å; E994-K997 WeakPolarHBondContact OE1-CE 3.39Å; E994-K997 IonicContact OE1-NZ 2.67Å; E994-K997 PolarHBondContact OE1-NZ 2.86Å; E994-Y998 HydrophobicContact CB-CE2 4.27Å; E994-Y998 WeakPolarHBondContact O-CD2 3.4Å; E994-Y998 PolarHBondContact O-N 3.36Å |
| 995 | A | 97.6 | Very high | 98.2 | Very high | 53 Ų | 53 | 97.5 Ų | 97.5 | 44% | 0.438 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -58.2 | -40.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y991 K999 | Y991-A995 WeakPolarHBondContact O-CB 3.36Å; Y991-A995 PolarHBondContact O-N 3.2Å; A995-K999 WeakPolarHBondContact O-CB 3.5Å; A995-K999 PolarHBondContact O-N 2.98Å |
| 996 | N | 98.2 | Very high | 98.1 | Very high | 90 Ų | 90 | 98.6 Ų | 98.6 | 48% | 0.481 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -67.7 | -38.5 | 174.7 | -74.9 | -29 | 0 | 0 | 0 | 112.6 | Q992 E993 E994 K999 A1000 | Q992-N996 WeakPolarHBondContact O-CB 3.35Å; Q992-N996 PolarHBondContact O-N 2.81Å; Q992-N996 PolarHBondContact O-ND2 3.43Å; Q992-N996 VanDerWaalsContact O-ND2 3.16Å; E993-N996 CarbonylContact O-C 3.52Å; E993-N996 WeakPolarHBondContact O-CB 3.32Å; E993-N996 PolarHBondContact O-N 2.84Å; E994-N996 VanDerWaalsContact C-N 3.29Å; E994-N996 PolarHBondContact O-N 3.36Å; N996-K999 PolarHBondContact O-N 2.94Å; N996-A1000 VanDerWaalsContact O-CB 3.32Å; N996-A1000 WeakPolarHBondContact O-CB 3.35Å; N996-A1000 PolarHBondContact O-N 2.94Å |
| 997 | K | 98.6 | Very high | 98.1 | Very high | 95 Ų | 95 | 99 Ų | 99 | 41% | 0.413 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.9 | -45.2 | 175.6 | -70.3 | 160.6 | -158.1 | 167.4 | 0 | 111.2 | E993 E994 A1000 L1001 | E993-K997 VanDerWaalsContact O-CG 3.25Å; E993-K997 WeakPolarHBondContact O-CG 3.03Å; E993-K997 PolarHBondContact O-N 2.69Å; E993-K997 WeakPolarHBondContact OE2-CE 3.35Å; E993-K997 IonicContact OE2-NZ 3.57Å; E993-K997 PolarHBondContact OE2-NZ 2.78Å; E994-K997 PolarHBondContact O-N 3.43Å; E994-K997 VanDerWaalsContact O-N 3.14Å; E994-K997 VanDerWaalsContact OE1-CD 3.27Å; E994-K997 WeakPolarHBondContact OE1-CD 3.23Å; E994-K997 WeakPolarHBondContact OE1-CE 3.39Å; E994-K997 IonicContact OE1-NZ 2.67Å; E994-K997 PolarHBondContact OE1-NZ 2.86Å; K997-A1000 PolarHBondContact O-N 3.14Å; K997-L1001 WeakPolarHBondContact O-CB 3.4Å; K997-L1001 PolarHBondContact O-N 3.37Å |
| 998 | Y | 97.9 | Very high | 98.1 | Very high | 159 Ų | 159 | 101.9 Ų | 101.9 | 62% | 0.624 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.5 | -40.3 | 174.8 | -68.1 | -59.9 | 0 | 0 | 0 | 112.6 | E994 L1001 M1002 | E994-Y998 HydrophobicContact CB-CE2 4.27Å; E994-Y998 WeakPolarHBondContact O-CD2 3.4Å; E994-Y998 PolarHBondContact O-N 3.36Å; Y998-L1001 PolarHBondContact O-N 2.86Å; Y998-M1002 WeakPolarHBondContact O-CB 3.39Å; Y998-M1002 PolarHBondContact O-N 3.38Å |
| 999 | K | 98.1 | Very high | 98.1 | Very high | 144 Ų | 144 | 102.2 Ų | 102.2 | 63% | 0.626 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.7 | -45.6 | 174.8 | -176.1 | 179.5 | 177.3 | -177.8 | 0 | 111.8 | A995 N996 M1002 Q1003 | A995-K999 WeakPolarHBondContact O-CB 3.5Å; A995-K999 PolarHBondContact O-N 2.98Å; N996-K999 PolarHBondContact O-N 2.94Å; K999-M1002 PolarHBondContact O-N 3.42Å; K999-Q1003 WeakPolarHBondContact O-CB 3.48Å; K999-Q1003 PolarHBondContact O-N 3.42Å |
| 1000 | A | 98.4 | Very high | 98.1 | Very high | 56 Ų | 56 | 104.6 Ų | 104.6 | 46% | 0.463 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.9 | -42.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112 | N996 K997 Q1003 Q1004 | N996-A1000 VanDerWaalsContact O-CB 3.32Å; N996-A1000 WeakPolarHBondContact O-CB 3.35Å; N996-A1000 PolarHBondContact O-N 2.94Å; K997-A1000 PolarHBondContact O-N 3.14Å; A1000-Q1003 PolarHBondContact O-N 3.01Å; A1000-Q1004 WeakPolarHBondContact O-CB 3.47Å; A1000-Q1004 PolarHBondContact O-N 2.84Å |
| 1001 | L | 98.5 | Very high | 98.1 | Very high | 84 Ų | 84 | 104.3 Ų | 104.3 | 44% | 0.44 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.5 | -42.7 | 176.1 | -179.2 | 63 | 0 | 0 | 0 | 112.2 | K997 Y998 Q1004 Q1005 | K997-L1001 WeakPolarHBondContact O-CB 3.4Å; K997-L1001 PolarHBondContact O-N 3.37Å; Y998-L1001 PolarHBondContact O-N 2.86Å; L1001-Q1004 PolarHBondContact O-N 3Å; L1001-Q1005 WeakPolarHBondContact O-CG 3.39Å; L1001-Q1005 PolarHBondContact O-N 3.41Å |
| 1002 | M | 97.4 | Very high | 98.1 | Very high | 117 Ų | 117 | 99.9 Ų | 99.9 | 58% | 0.576 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64 | -42.5 | 176 | -176.8 | 61.6 | 65.3 | 0 | 0 | 111.6 | Y998 K999 Q1005 M1006 | Y998-M1002 WeakPolarHBondContact O-CB 3.39Å; Y998-M1002 PolarHBondContact O-N 3.38Å; K999-M1002 PolarHBondContact O-N 3.42Å; M1002-Q1005 PolarHBondContact O-N 2.96Å; M1002-M1006 PolarHBondContact O-N 2.95Å |
| 1003 | Q | 98.1 | Very high | 98.1 | Very high | 102 Ų | 102 | 102.1 Ų | 102.1 | 48% | 0.477 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.3 | -46.7 | 175 | 178.8 | 171.5 | -14.4 | 0 | 0 | 111.4 | K999 A1000 Q1005 M1006 E1007 | K999-Q1003 WeakPolarHBondContact O-CB 3.48Å; K999-Q1003 PolarHBondContact O-N 3.42Å; A1000-Q1003 PolarHBondContact O-N 3.01Å; Q1003-Q1005 VanDerWaalsContact C-N 3.32Å; Q1003-Q1005 PolarHBondContact O-N 2.88Å; Q1003-M1006 WeakPolarHBondContact O-CB 3.39Å; Q1003-M1006 PolarHBondContact O-N 3.11Å; Q1003-M1006 VanDerWaalsContact O-N 3.11Å; Q1003-E1007 HydrophobicContact CG-CG 4.41Å; Q1003-E1007 VanDerWaalsContact CG-OE1 3.23Å; Q1003-E1007 WeakPolarHBondContact CG-OE1 3.31Å; Q1003-E1007 PolarHBondContact NE2-OE1 2.94Å; Q1003-E1007 WeakPolarHBondContact O-CB 3.29Å; Q1003-E1007 WeakPolarHBondContact O-CG 3.3Å; Q1003-E1007 PolarHBondContact O-N 3.45Å |
| 1004 | Q | 98.4 | Very high | 98.1 | Very high | 122 Ų | 122 | 104 Ų | 104 | 57% | 0.57 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -58.9 | -41.7 | 176.5 | -176.2 | -177.3 | -4.5 | 0 | 0 | 111.9 | A1000 L1001 E1007 E1008 | A1000-Q1004 WeakPolarHBondContact O-CB 3.47Å; A1000-Q1004 PolarHBondContact O-N 2.84Å; L1001-Q1004 PolarHBondContact O-N 3Å; Q1004-E1007 PolarHBondContact O-N 2.86Å; Q1004-E1008 WeakPolarHBondContact O-CB 3.24Å; Q1004-E1008 PolarHBondContact O-N 2.88Å |
| 1005 | Q | 98.1 | Very high | 98.1 | Very high | 96 Ų | 96 | 102.3 Ų | 102.3 | 45% | 0.449 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.9 | -37.6 | 175.6 | -75.3 | -178.3 | -8.6 | 0 | 0 | 112.3 | L1001 M1002 Q1003 L1009 | L1001-Q1005 WeakPolarHBondContact O-CG 3.39Å; L1001-Q1005 PolarHBondContact O-N 3.41Å; M1002-Q1005 PolarHBondContact O-N 2.96Å; Q1003-Q1005 VanDerWaalsContact C-N 3.32Å; Q1003-Q1005 PolarHBondContact O-N 2.88Å; Q1005-L1009 VanDerWaalsContact O-CB 3.31Å; Q1005-L1009 WeakPolarHBondContact O-CB 3.39Å; Q1005-L1009 WeakPolarHBondContact O-CG 3.32Å; Q1005-L1009 PolarHBondContact O-N 3.19Å |
| 1006 | M | 97.3 | Very high | 98.1 | Very high | 133 Ų | 133 | 105.6 Ų | 105.6 | 66% | 0.655 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.4 | -40.8 | 174.5 | -172.1 | 179 | -66.6 | 0 | 0 | 111.8 | M1002 Q1003 L1009 K1010 | M1002-M1006 PolarHBondContact O-N 2.95Å; Q1003-M1006 WeakPolarHBondContact O-CB 3.39Å; Q1003-M1006 PolarHBondContact O-N 3.11Å; Q1003-M1006 VanDerWaalsContact O-N 3.11Å; M1006-L1009 PolarHBondContact O-N 3.41Å; M1006-K1010 VanDerWaalsContact O-CB 3.29Å; M1006-K1010 WeakPolarHBondContact O-CB 3.5Å; M1006-K1010 PolarHBondContact O-N 2.93Å |
| 1007 | E | 98.2 | Very high | 98.1 | Very high | 109 Ų | 109 | 107.1 Ų | 107.1 | 51% | 0.509 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -67.8 | -41.8 | 176.7 | -72.2 | 170.1 | -175.3 | 0 | 0 | 111.8 | Q1003 Q1004 K1010 A1011 | Q1003-E1007 HydrophobicContact CG-CG 4.41Å; Q1003-E1007 VanDerWaalsContact CG-OE1 3.23Å; Q1003-E1007 WeakPolarHBondContact CG-OE1 3.31Å; Q1003-E1007 PolarHBondContact NE2-OE1 2.94Å; Q1003-E1007 WeakPolarHBondContact O-CB 3.29Å; Q1003-E1007 WeakPolarHBondContact O-CG 3.3Å; Q1003-E1007 PolarHBondContact O-N 3.45Å; Q1004-E1007 PolarHBondContact O-N 2.86Å; E1007-K1010 PolarHBondContact O-N 3.39Å; E1007-A1011 WeakPolarHBondContact O-CB 2.8Å; E1007-A1011 PolarHBondContact O-N 2.93Å |
| 1008 | E | 98.5 | Very high | 98.1 | Very high | 115 Ų | 115 | 106.6 Ų | 106.6 | 54% | 0.537 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.9 | -43.4 | 173.3 | -179.2 | 177.2 | -175.5 | 0 | 0 | 111.8 | Q1004 A1011 N1012 | Q1004-E1008 WeakPolarHBondContact O-CB 3.24Å; Q1004-E1008 PolarHBondContact O-N 2.88Å; E1008-A1011 PolarHBondContact O-N 3.14Å; E1008-N1012 WeakPolarHBondContact CG-ND2 3.21Å; E1008-N1012 WeakPolarHBondContact O-CB 3.4Å; E1008-N1012 PolarHBondContact O-N 2.88Å; E1008-N1012 PolarHBondContact O-ND2 3.45Å |
| 1009 | L | 98.1 | Very high | 98.1 | Very high | 109 Ų | 109 | 103.4 Ų | 103.4 | 57% | 0.571 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.8 | -42.4 | 175.6 | -75.9 | 169.8 | 0 | 0 | 0 | 111.6 | Q1005 M1006 N1012 Q1013 | Q1005-L1009 VanDerWaalsContact O-CB 3.31Å; Q1005-L1009 WeakPolarHBondContact O-CB 3.39Å; Q1005-L1009 WeakPolarHBondContact O-CG 3.32Å; Q1005-L1009 PolarHBondContact O-N 3.19Å; M1006-L1009 PolarHBondContact O-N 3.41Å; L1009-N1012 PolarHBondContact O-N 3.39Å; L1009-Q1013 VanDerWaalsContact O-CG 3.3Å; L1009-Q1013 WeakPolarHBondContact O-CG 3.45Å; L1009-Q1013 PolarHBondContact O-N 2.9Å |
| 1010 | K | 98.1 | Very high | 98.1 | Very high | 137 Ų | 137 | 100.8 Ų | 100.8 | 60% | 0.596 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.3 | -47.7 | 175.6 | -175.8 | -175.8 | 174.7 | -170.7 | 0 | 111.4 | M1006 E1007 N1012 Q1013 E1014 | M1006-K1010 VanDerWaalsContact O-CB 3.29Å; M1006-K1010 WeakPolarHBondContact O-CB 3.5Å; M1006-K1010 PolarHBondContact O-N 2.93Å; E1007-K1010 PolarHBondContact O-N 3.39Å; K1010-N1012 VanDerWaalsContact C-N 3.32Å; K1010-N1012 PolarHBondContact O-N 3.5Å; K1010-Q1013 PolarHBondContact O-N 2.93Å; K1010-E1014 WeakPolarHBondContact O-CB 3.45Å; K1010-E1014 PolarHBondContact O-N 2.83Å |
| 1011 | A | 98.4 | Very high | 98.1 | Very high | 56 Ų | 56 | 102.9 Ų | 102.9 | 46% | 0.463 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.3 | -38 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | E1007 E1008 A1015 | E1007-A1011 WeakPolarHBondContact O-CB 2.8Å; E1007-A1011 PolarHBondContact O-N 2.93Å; E1008-A1011 PolarHBondContact O-N 3.14Å; A1011-A1015 VanDerWaalsContact O-CB 3.24Å; A1011-A1015 WeakPolarHBondContact O-CB 3.42Å; A1011-A1015 PolarHBondContact O-N 3.01Å |
| 1012 | N | 98.1 | Very high | 98.1 | Very high | 79 Ų | 79 | 101.7 Ų | 101.7 | 42% | 0.422 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.8 | -38.6 | 173.7 | -83.1 | -69.9 | 0 | 0 | 0 | 112.8 | E1008 L1009 K1010 M1016 | E1008-N1012 WeakPolarHBondContact CG-ND2 3.21Å; E1008-N1012 WeakPolarHBondContact O-CB 3.4Å; E1008-N1012 PolarHBondContact O-N 2.88Å; E1008-N1012 PolarHBondContact O-ND2 3.45Å; L1009-N1012 PolarHBondContact O-N 3.39Å; K1010-N1012 VanDerWaalsContact C-N 3.32Å; K1010-N1012 PolarHBondContact O-N 3.5Å; N1012-M1016 WeakPolarHBondContact O-CB 3.41Å; N1012-M1016 WeakPolarHBondContact O-CG 3.43Å; N1012-M1016 PolarHBondContact O-N 3.34Å |
| 1013 | Q | 97.4 | Very high | 98.1 | Very high | 128 Ų | 128 | 102 Ų | 102 | 60% | 0.598 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.4 | -44.8 | 173.9 | -74.4 | 172.6 | 3.2 | 0 | 0 | 111.4 | L1009 K1010 M1016 K1017 | L1009-Q1013 VanDerWaalsContact O-CG 3.3Å; L1009-Q1013 WeakPolarHBondContact O-CG 3.45Å; L1009-Q1013 PolarHBondContact O-N 2.9Å; K1010-Q1013 PolarHBondContact O-N 2.93Å; Q1013-M1016 PolarHBondContact O-N 3.49Å; Q1013-K1017 WeakPolarHBondContact O-CB 3.44Å; Q1013-K1017 PolarHBondContact O-N 3.24Å |
| 1014 | E | 98.2 | Very high | 98.1 | Very high | 118 Ų | 118 | 101.4 Ų | 101.4 | 55% | 0.551 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.5 | -45.8 | 177.2 | -171.7 | 164.4 | -171.8 | 0 | 0 | 111.5 | K1010 M1016 K1017 V1018 | K1010-E1014 WeakPolarHBondContact O-CB 3.45Å; K1010-E1014 PolarHBondContact O-N 2.83Å; E1014-M1016 PolarHBondContact O-N 2.91Å; E1014-K1017 WeakPolarHBondContact O-CB 3.31Å; E1014-K1017 PolarHBondContact O-N 2.87Å; E1014-V1018 WeakPolarHBondContact O-CG2 3.32Å; E1014-V1018 PolarHBondContact O-N 3.48Å |
| 1015 | A | 98.5 | Very high | 98.1 | Very high | 46 Ų | 46 | 98.3 Ų | 98.3 | 38% | 0.38 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63 | -37 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | A1011 Q1019 | A1011-A1015 VanDerWaalsContact O-CB 3.24Å; A1011-A1015 WeakPolarHBondContact O-CB 3.42Å; A1011-A1015 PolarHBondContact O-N 3.01Å; A1015-Q1019 WeakPolarHBondContact O-CB 3.41Å; A1015-Q1019 VanDerWaalsContact O-CG 3.31Å; A1015-Q1019 WeakPolarHBondContact O-CG 3.48Å; A1015-Q1019 PolarHBondContact O-N 2.95Å |
| 1016 | M | 97.8 | Very high | 98.1 | Very high | 122 Ų | 122 | 98.7 Ų | 98.7 | 60% | 0.601 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -71 | -36.7 | 174.2 | -80.1 | -165.1 | -80.7 | 0 | 0 | 112.6 | N1012 Q1013 E1014 Q1019 L1020 | N1012-M1016 WeakPolarHBondContact O-CB 3.41Å; N1012-M1016 WeakPolarHBondContact O-CG 3.43Å; N1012-M1016 PolarHBondContact O-N 3.34Å; Q1013-M1016 PolarHBondContact O-N 3.49Å; E1014-M1016 PolarHBondContact O-N 2.91Å; M1016-Q1019 PolarHBondContact O-N 2.84Å; M1016-L1020 WeakPolarHBondContact O-CB 3.48Å; M1016-L1020 PolarHBondContact O-N 2.94Å |
| 1017 | K | 98.2 | Very high | 98.2 | Very high | 123 Ų | 123 | 98 Ų | 98 | 54% | 0.535 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.5 | -53.1 | 172.8 | 179.4 | -172.7 | 164.5 | -173.7 | 0 | 110.6 | Q1013 E1014 Q1019 L1020 E1021 | Q1013-K1017 WeakPolarHBondContact O-CB 3.44Å; Q1013-K1017 PolarHBondContact O-N 3.24Å; E1014-K1017 WeakPolarHBondContact O-CB 3.31Å; E1014-K1017 PolarHBondContact O-N 2.87Å; K1017-Q1019 VanDerWaalsContact C-N 3.3Å; K1017-Q1019 PolarHBondContact O-N 3.43Å; K1017-L1020 WeakPolarHBondContact O-CB 3.42Å; K1017-L1020 PolarHBondContact O-N 3.33Å; K1017-E1021 VanDerWaalsContact CE-CD 3.44Å; K1017-E1021 WeakPolarHBondContact CE-OE1 3.47Å; K1017-E1021 WeakPolarHBondContact CE-OE2 3.23Å; K1017-E1021 IonicContact NZ-OE1 2.63Å; K1017-E1021 WeakPolarHBondContact O-CG 3.43Å; K1017-E1021 PolarHBondContact O-N 2.62Å |
| 1018 | V | 98.3 | Very high | 98.2 | Very high | 84 Ų | 84 | 97.9 Ų | 97.9 | 51% | 0.509 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.9 | -37.2 | 179.8 | 173.9 | 0 | 0 | 0 | 0 | 111.7 | E1014 L1020 E1021 S1022 | E1014-V1018 WeakPolarHBondContact O-CG2 3.32Å; E1014-V1018 PolarHBondContact O-N 3.48Å; V1018-L1020 PolarHBondContact O-N 3.04Å; V1018-E1021 PolarHBondContact O-N 3.01Å; V1018-S1022 WeakPolarHBondContact O-CB 3.39Å; V1018-S1022 PolarHBondContact O-N 3.49Å |
| 1019 | Q | 98.3 | Very high | 98.2 | Very high | 92 Ų | 92 | 97.9 Ų | 97.9 | 43% | 0.43 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.9 | -35.1 | 172.4 | -80.3 | -179.6 | 49.2 | 0 | 0 | 113.6 | A1015 M1016 K1017 R1023 | A1015-Q1019 WeakPolarHBondContact O-CB 3.41Å; A1015-Q1019 VanDerWaalsContact O-CG 3.31Å; A1015-Q1019 WeakPolarHBondContact O-CG 3.48Å; A1015-Q1019 PolarHBondContact O-N 2.95Å; M1016-Q1019 PolarHBondContact O-N 2.84Å; K1017-Q1019 VanDerWaalsContact C-N 3.3Å; K1017-Q1019 PolarHBondContact O-N 3.43Å; Q1019-R1023 VanDerWaalsContact O-CG 3.27Å; Q1019-R1023 WeakPolarHBondContact O-CG 3.18Å; Q1019-R1023 PolarHBondContact O-N 3.32Å; Q1019-R1023 VanDerWaalsContact O-N 3.11Å |
| 1020 | L | 98.1 | Very high | 98.2 | Very high | 89 Ų | 89 | 95.2 Ų | 95.2 | 47% | 0.466 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -71 | -43.3 | 176.5 | -174.5 | 64.7 | 0 | 0 | 0 | 110.7 | M1016 K1017 V1018 R1023 H1024 | M1016-L1020 WeakPolarHBondContact O-CB 3.48Å; M1016-L1020 PolarHBondContact O-N 2.94Å; K1017-L1020 WeakPolarHBondContact O-CB 3.42Å; K1017-L1020 PolarHBondContact O-N 3.33Å; V1018-L1020 PolarHBondContact O-N 3.04Å; L1020-R1023 PolarHBondContact O-N 3.46Å; L1020-H1024 WeakPolarHBondContact CD1-NE2 3.33Å; L1020-H1024 VanDerWaalsContact O-CG 3.27Å; L1020-H1024 PolarHBondContact O-N 2.9Å |
| 1021 | E | 98.1 | Very high | 98.2 | Very high | 100 Ų | 100 | 91.8 Ų | 91.8 | 47% | 0.467 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -61.9 | -42.7 | 175.5 | -70.5 | 170.7 | 156.2 | 0 | 0 | 111.6 | K1017 V1018 H1024 A1025 | K1017-E1021 VanDerWaalsContact CE-CD 3.44Å; K1017-E1021 WeakPolarHBondContact CE-OE1 3.47Å; K1017-E1021 WeakPolarHBondContact CE-OE2 3.23Å; K1017-E1021 IonicContact NZ-OE1 2.63Å; K1017-E1021 WeakPolarHBondContact O-CG 3.43Å; K1017-E1021 PolarHBondContact O-N 2.62Å; V1018-E1021 PolarHBondContact O-N 3.01Å; E1021-H1024 PolarHBondContact O-N 3.45Å; E1021-A1025 WeakPolarHBondContact O-CB 3.35Å; E1021-A1025 PolarHBondContact O-N 2.9Å |
| 1022 | S | 98.1 | Very high | 98.2 | Very high | 58 Ų | 58 | 97.8 Ų | 97.8 | 41% | 0.406 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -58 | -51.7 | 171.8 | -167.5 | 0 | 0 | 0 | 0 | 111.5 | V1018 H1024 A1025 E1026 | V1018-S1022 WeakPolarHBondContact O-CB 3.39Å; V1018-S1022 PolarHBondContact O-N 3.49Å; S1022-H1024 VanDerWaalsContact C-N 3.3Å; S1022-H1024 PolarHBondContact O-N 3.1Å; S1022-A1025 WeakPolarHBondContact O-CB 3.27Å; S1022-A1025 PolarHBondContact O-N 2.81Å; S1022-A1025 VanDerWaalsContact O-N 3.1Å; S1022-E1026 WeakPolarHBondContact CB-OE1 3.4Å; S1022-E1026 WeakPolarHBondContact O-CB 3.22Å; S1022-E1026 VanDerWaalsContact O-CG 3.23Å; S1022-E1026 WeakPolarHBondContact O-CG 3.28Å; S1022-E1026 PolarHBondContact O-N 3.3Å; S1022-E1026 PolarHBondContact OG-OE1 2.68Å |
| 1023 | R | 98.3 | Very high | 98.2 | Very high | 123 Ų | 123 | 98.5 Ų | 98.5 | 46% | 0.464 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.1 | -37.1 | 179.4 | -73 | 171.5 | -168.3 | 136.1 | 14.7 | 112.8 | Q1019 L1020 Q1027 | Q1019-R1023 VanDerWaalsContact O-CG 3.27Å; Q1019-R1023 WeakPolarHBondContact O-CG 3.18Å; Q1019-R1023 PolarHBondContact O-N 3.32Å; Q1019-R1023 VanDerWaalsContact O-N 3.11Å; L1020-R1023 PolarHBondContact O-N 3.46Å; R1023-Q1027 WeakPolarHBondContact O-CB 3.28Å; R1023-Q1027 WeakPolarHBondContact O-CG 3.46Å; R1023-Q1027 PolarHBondContact O-N 2.96Å |
| 1024 | H | 98.1 | Very high | 98.2 | Very high | 91 Ų | 91 | 98.7 Ų | 98.7 | 42% | 0.421 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -70.1 | -38.4 | 175.2 | -67.7 | 170.8 | 0 | 0 | 0 | 111.8 | L1020 E1021 S1022 Q1027 L1028 | L1020-H1024 WeakPolarHBondContact CD1-NE2 3.33Å; L1020-H1024 VanDerWaalsContact O-CG 3.27Å; L1020-H1024 PolarHBondContact O-N 2.9Å; E1021-H1024 PolarHBondContact O-N 3.45Å; S1022-H1024 VanDerWaalsContact C-N 3.3Å; S1022-H1024 PolarHBondContact O-N 3.1Å; H1024-Q1027 PolarHBondContact O-N 3.36Å; H1024-L1028 WeakPolarHBondContact O-CB 3.22Å; H1024-L1028 VanDerWaalsContact O-CG 3.28Å; H1024-L1028 WeakPolarHBondContact O-CG 3.34Å; H1024-L1028 PolarHBondContact O-N 2.95Å |
| 1025 | A | 98.3 | Very high | 98.2 | Very high | 57 Ų | 57 | 101 Ų | 101 | 47% | 0.471 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.6 | -44.9 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112 | E1021 S1022 Q1027 L1028 Q1029 | E1021-A1025 WeakPolarHBondContact O-CB 3.35Å; E1021-A1025 PolarHBondContact O-N 2.9Å; S1022-A1025 WeakPolarHBondContact O-CB 3.27Å; S1022-A1025 PolarHBondContact O-N 2.81Å; S1022-A1025 VanDerWaalsContact O-N 3.1Å; A1025-Q1027 VanDerWaalsContact C-N 3.34Å; A1025-Q1027 PolarHBondContact O-N 3.31Å; A1025-L1028 PolarHBondContact O-N 2.92Å; A1025-Q1029 WeakPolarHBondContact O-CB 3.44Å; A1025-Q1029 PolarHBondContact O-N 3.42Å |
| 1026 | E | 98.4 | Very high | 98.2 | Very high | 104 Ų | 104 | 105 Ų | 105 | 49% | 0.486 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.5 | -43 | 173.7 | -69.6 | 157.6 | -132.9 | 0 | 0 | 111.7 | S1022 Q1029 S1030 | S1022-E1026 WeakPolarHBondContact CB-OE1 3.4Å; S1022-E1026 WeakPolarHBondContact O-CB 3.22Å; S1022-E1026 VanDerWaalsContact O-CG 3.23Å; S1022-E1026 WeakPolarHBondContact O-CG 3.28Å; S1022-E1026 PolarHBondContact O-N 3.3Å; S1022-E1026 PolarHBondContact OG-OE1 2.68Å; E1026-Q1029 PolarHBondContact O-N 2.91Å; E1026-S1030 VanDerWaalsContact O-CB 3.28Å; E1026-S1030 WeakPolarHBondContact O-CB 3.41Å; E1026-S1030 PolarHBondContact O-N 3.11Å |
| 1027 | Q | 98.1 | Very high | 98.2 | Very high | 119 Ų | 119 | 105.2 Ų | 105.2 | 56% | 0.556 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65.5 | -46.8 | 175.5 | -77 | 170.1 | -2.8 | 0 | 0 | 112.1 | R1023 H1024 A1025 Q1029 S1030 V1031 | R1023-Q1027 WeakPolarHBondContact O-CB 3.28Å; R1023-Q1027 WeakPolarHBondContact O-CG 3.46Å; R1023-Q1027 PolarHBondContact O-N 2.96Å; H1024-Q1027 PolarHBondContact O-N 3.36Å; A1025-Q1027 VanDerWaalsContact C-N 3.34Å; A1025-Q1027 PolarHBondContact O-N 3.31Å; Q1027-Q1029 VanDerWaalsContact C-N 3.31Å; Q1027-Q1029 PolarHBondContact O-N 2.94Å; Q1027-S1030 PolarHBondContact O-N 3.29Å; Q1027-V1031 WeakPolarHBondContact O-CB 3.5Å; Q1027-V1031 WeakPolarHBondContact O-CG2 3.38Å; Q1027-V1031 PolarHBondContact O-N 3.46Å |
| 1028 | L | 98.1 | Very high | 98.3 | Very high | 105 Ų | 105 | 103 Ų | 103 | 55% | 0.55 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62 | -38.9 | 176.2 | -74.7 | 167.3 | 0 | 0 | 0 | 111.8 | H1024 A1025 R1032 | H1024-L1028 WeakPolarHBondContact O-CB 3.22Å; H1024-L1028 VanDerWaalsContact O-CG 3.28Å; H1024-L1028 WeakPolarHBondContact O-CG 3.34Å; H1024-L1028 PolarHBondContact O-N 2.95Å; A1025-L1028 PolarHBondContact O-N 2.92Å; L1028-R1032 WeakPolarHBondContact O-CB 3.39Å; L1028-R1032 WeakPolarHBondContact O-CG 3.35Å; L1028-R1032 PolarHBondContact O-N 2.9Å |
| 1029 | Q | 98.4 | Very high | 98.3 | Very high | 115 Ų | 115 | 103.3 Ų | 103.3 | 54% | 0.537 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67 | -45 | 175.7 | -172.6 | 176.4 | 14.4 | 0 | 0 | 111.6 | A1025 E1026 Q1027 V1031 R1032 Q1033 | A1025-Q1029 WeakPolarHBondContact O-CB 3.44Å; A1025-Q1029 PolarHBondContact O-N 3.42Å; E1026-Q1029 PolarHBondContact O-N 2.91Å; Q1027-Q1029 VanDerWaalsContact C-N 3.31Å; Q1027-Q1029 PolarHBondContact O-N 2.94Å; Q1029-V1031 PolarHBondContact O-N 3.43Å; Q1029-R1032 PolarHBondContact O-N 2.86Å; Q1029-Q1033 WeakPolarHBondContact O-CB 3.48Å; Q1029-Q1033 WeakPolarHBondContact O-CG 3.12Å; Q1029-Q1033 PolarHBondContact O-N 3.27Å |
| 1030 | S | 98.3 | Very high | 98.2 | Very high | 54 Ų | 54 | 103.9 Ų | 103.9 | 38% | 0.378 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.4 | -43.9 | 176.1 | -178.8 | 0 | 0 | 0 | 0 | 112.1 | E1026 Q1027 Q1033 Q1034 | E1026-S1030 VanDerWaalsContact O-CB 3.28Å; E1026-S1030 WeakPolarHBondContact O-CB 3.41Å; E1026-S1030 PolarHBondContact O-N 3.11Å; Q1027-S1030 PolarHBondContact O-N 3.29Å; S1030-Q1033 PolarHBondContact O-N 2.94Å; S1030-Q1034 WeakPolarHBondContact O-CG 3.48Å; S1030-Q1034 PolarHBondContact O-N 3.22Å |
| 1031 | V | 98.5 | Very high | 98.3 | Very high | 65 Ų | 65 | 104.2 Ų | 104.2 | 39% | 0.394 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.3 | -42 | 175.7 | 169.3 | 0 | 0 | 0 | 0 | 111.5 | Q1027 Q1029 Q1034 Y1035 | Q1027-V1031 WeakPolarHBondContact O-CB 3.5Å; Q1027-V1031 WeakPolarHBondContact O-CG2 3.38Å; Q1027-V1031 PolarHBondContact O-N 3.46Å; Q1029-V1031 PolarHBondContact O-N 3.43Å; V1031-Q1034 PolarHBondContact O-N 3.36Å; V1031-Y1035 HydrophobicContact CG1-CD2 3.76Å; V1031-Y1035 HydrophobicContact CG1-CE2 3.45Å; V1031-Y1035 VanDerWaalsContact CG1-CE2 3.45Å; V1031-Y1035 WeakPolarHBondContact O-CD2 3.15Å; V1031-Y1035 PolarHBondContact O-N 3.28Å |
| 1032 | R | 98.2 | Very high | 98.3 | Very high | 181 Ų | 181 | 104.9 Ų | 104.9 | 68% | 0.683 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60 | -46 | 173.5 | -75.8 | 169.5 | -179 | -175.8 | 0.3 | 111.9 | L1028 Q1029 Q1034 Y1035 E1036 | L1028-R1032 WeakPolarHBondContact O-CB 3.39Å; L1028-R1032 WeakPolarHBondContact O-CG 3.35Å; L1028-R1032 PolarHBondContact O-N 2.9Å; Q1029-R1032 PolarHBondContact O-N 2.86Å; R1032-Q1034 VanDerWaalsContact C-N 3.32Å; R1032-Q1034 PolarHBondContact O-N 2.88Å; R1032-Y1035 PolarHBondContact O-N 3.43Å; R1032-E1036 WeakPolarHBondContact O-CB 3.31Å; R1032-E1036 PolarHBondContact O-N 3.49Å |
| 1033 | Q | 98.5 | Very high | 98.3 | Very high | 95 Ų | 95 | 108.5 Ų | 108.5 | 44% | 0.444 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.3 | -38.5 | 176.1 | -74.1 | 170.8 | -9.9 | 0 | 0 | 112.1 | Q1029 S1030 E1036 L1037 | Q1029-Q1033 WeakPolarHBondContact O-CB 3.48Å; Q1029-Q1033 WeakPolarHBondContact O-CG 3.12Å; Q1029-Q1033 PolarHBondContact O-N 3.27Å; S1030-Q1033 PolarHBondContact O-N 2.94Å; Q1033-E1036 PolarHBondContact O-N 2.92Å; Q1033-L1037 WeakPolarHBondContact O-CB 3.38Å; Q1033-L1037 VanDerWaalsContact O-CG 3.22Å; Q1033-L1037 WeakPolarHBondContact O-CG 3.43Å; Q1033-L1037 PolarHBondContact O-N 2.8Å |
| 1034 | Q | 98.3 | Very high | 98.3 | Very high | 131 Ų | 131 | 107.9 Ų | 107.9 | 61% | 0.612 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.4 | -41.1 | 174.7 | -74.7 | 179.8 | 2.8 | 0 | 0 | 112.5 | S1030 V1031 R1032 S1038 | S1030-Q1034 WeakPolarHBondContact O-CG 3.48Å; S1030-Q1034 PolarHBondContact O-N 3.22Å; V1031-Q1034 PolarHBondContact O-N 3.36Å; R1032-Q1034 VanDerWaalsContact C-N 3.32Å; R1032-Q1034 PolarHBondContact O-N 2.88Å; Q1034-S1038 VanDerWaalsContact O-CB 3.26Å; Q1034-S1038 WeakPolarHBondContact O-CB 3.33Å; Q1034-S1038 PolarHBondContact O-N 2.91Å |
| 1035 | Y | 97.9 | Very high | 98.3 | Very high | 166 Ų | 166 | 105.5 Ų | 105.5 | 65% | 0.651 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.3 | -41.5 | 173.4 | -76.1 | -59.7 | 0 | 0 | 0 | 112.5 | V1031 R1032 S1038 L1039 | V1031-Y1035 HydrophobicContact CG1-CD2 3.76Å; V1031-Y1035 HydrophobicContact CG1-CE2 3.45Å; V1031-Y1035 VanDerWaalsContact CG1-CE2 3.45Å; V1031-Y1035 WeakPolarHBondContact O-CD2 3.15Å; V1031-Y1035 PolarHBondContact O-N 3.28Å; R1032-Y1035 PolarHBondContact O-N 3.43Å; Y1035-S1038 PolarHBondContact O-N 3.38Å; Y1035-L1039 WeakPolarHBondContact O-CB 3.46Å; Y1035-L1039 VanDerWaalsContact O-CG 3.3Å; Y1035-L1039 WeakPolarHBondContact O-CG 3.21Å; Y1035-L1039 PolarHBondContact O-N 2.92Å |
| 1036 | E | 98.4 | Very high | 98.3 | Very high | 132 Ų | 132 | 107.7 Ų | 107.7 | 62% | 0.617 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.3 | -47.9 | 177.8 | -173.5 | 168.2 | -148.2 | 0 | 0 | 111.6 | R1032 Q1033 S1038 L1039 E1040 | R1032-E1036 WeakPolarHBondContact O-CB 3.31Å; R1032-E1036 PolarHBondContact O-N 3.49Å; Q1033-E1036 PolarHBondContact O-N 2.92Å; E1036-S1038 VanDerWaalsContact C-N 3.34Å; E1036-S1038 PolarHBondContact O-N 3.33Å; E1036-L1039 PolarHBondContact O-N 3.29Å; E1036-E1040 WeakPolarHBondContact O-CB 3.31Å; E1036-E1040 PolarHBondContact O-N 3.47Å |
| 1037 | L | 98.4 | Very high | 98.3 | Very high | 125 Ų | 125 | 105.5 Ų | 105.5 | 65% | 0.654 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.4 | -38.2 | 173.4 | -70.5 | 168.9 | 0 | 0 | 0 | 112.5 | Q1033 E1040 E1041 | Q1033-L1037 WeakPolarHBondContact O-CB 3.38Å; Q1033-L1037 VanDerWaalsContact O-CG 3.22Å; Q1033-L1037 WeakPolarHBondContact O-CG 3.43Å; Q1033-L1037 PolarHBondContact O-N 2.8Å; L1037-E1040 PolarHBondContact O-N 3.45Å; L1037-E1041 WeakPolarHBondContact O-CB 3.41Å; L1037-E1041 PolarHBondContact O-N 2.84Å |
| 1038 | S | 98.3 | Very high | 98.3 | Very high | 78 Ų | 78 | 105 Ų | 105 | 55% | 0.545 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68.7 | -34.4 | 176.6 | -172.5 | 0 | 0 | 0 | 0 | 112.9 | Q1034 Y1035 E1036 L1042 | Q1034-S1038 VanDerWaalsContact O-CB 3.26Å; Q1034-S1038 WeakPolarHBondContact O-CB 3.33Å; Q1034-S1038 PolarHBondContact O-N 2.91Å; Y1035-S1038 PolarHBondContact O-N 3.38Å; E1036-S1038 VanDerWaalsContact C-N 3.34Å; E1036-S1038 PolarHBondContact O-N 3.33Å; S1038-L1042 WeakPolarHBondContact O-CB 3.3Å; S1038-L1042 PolarHBondContact O-N 2.94Å; S1038-L1042 VanDerWaalsContact O-N 3.16Å |
| 1039 | L | 98.3 | Very high | 98.3 | Very high | 89 Ų | 89 | 105.2 Ų | 105.2 | 47% | 0.466 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -71.8 | -38.3 | 174.1 | -74 | 169.7 | 0 | 0 | 0 | 110.9 | Y1035 E1036 L1042 R1043 | Y1035-L1039 WeakPolarHBondContact O-CB 3.46Å; Y1035-L1039 VanDerWaalsContact O-CG 3.3Å; Y1035-L1039 WeakPolarHBondContact O-CG 3.21Å; Y1035-L1039 PolarHBondContact O-N 2.92Å; E1036-L1039 PolarHBondContact O-N 3.29Å; L1039-L1042 PolarHBondContact O-N 3.42Å; L1039-R1043 WeakPolarHBondContact O-CG 3.45Å; L1039-R1043 PolarHBondContact O-N 3.28Å |
| 1040 | E | 98.3 | Very high | 98.3 | Very high | 105 Ų | 105 | 104.2 Ų | 104.2 | 49% | 0.491 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -70.7 | -40.5 | 178.6 | -162.6 | 58.5 | -154.6 | 0 | 0 | 112.3 | E1036 L1037 L1042 R1043 R1044 | E1036-E1040 WeakPolarHBondContact O-CB 3.31Å; E1036-E1040 PolarHBondContact O-N 3.47Å; L1037-E1040 PolarHBondContact O-N 3.45Å; E1040-L1042 VanDerWaalsContact C-N 3.32Å; E1040-L1042 PolarHBondContact O-N 2.89Å; E1040-R1043 PolarHBondContact O-N 2.93Å; E1040-R1043 WeakPolarHBondContact OE2-CD 3.26Å; E1040-R1043 IonicContact OE2-CZ 2.69Å; E1040-R1043 IonicContact OE2-NE 3.68Å; E1040-R1043 IonicContact OE2-NH1 2.82Å; E1040-R1043 PolarHBondContact OE2-NH1 2.88Å; E1040-R1044 WeakPolarHBondContact O-CB 3.34Å; E1040-R1044 PolarHBondContact O-N 3.42Å |
| 1041 | E | 98.3 | Very high | 98.3 | Very high | 96 Ų | 96 | 108.1 Ų | 108.1 | 45% | 0.449 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.1 | -38 | 171.6 | -180 | 59.4 | -166.6 | 0 | 0 | 111.6 | L1037 R1044 V1045 | L1037-E1041 WeakPolarHBondContact O-CB 3.41Å; L1037-E1041 PolarHBondContact O-N 2.84Å; E1041-R1044 PolarHBondContact O-N 2.86Å; E1041-R1044 IonicContact OE1-CZ 3.68Å; E1041-R1044 IonicContact OE1-NE 3.72Å; E1041-R1044 PolarHBondContact OE1-NE 3.27Å; E1041-R1044 IonicContact OE1-NH2 3.68Å; E1041-R1044 PolarHBondContact OE1-NH2 3.45Å; E1041-R1044 IonicContact OE2-CZ 2.68Å; E1041-R1044 IonicContact OE2-NE 3.44Å; E1041-R1044 PolarHBondContact OE2-NE 2.93Å; E1041-R1044 IonicContact OE2-NH2 3.94Å; E1041-V1045 WeakPolarHBondContact O-CG2 3.37Å; E1041-V1045 PolarHBondContact O-N 3.43Å |
| 1042 | L | 98.3 | Very high | 98.3 | Very high | 113 Ų | 113 | 108.6 Ų | 108.6 | 59% | 0.592 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.5 | -41.6 | 174.3 | -178.7 | 62 | 0 | 0 | 0 | 112.2 | S1038 L1039 E1040 R1044 V1045 H1046 | S1038-L1042 WeakPolarHBondContact O-CB 3.3Å; S1038-L1042 PolarHBondContact O-N 2.94Å; S1038-L1042 VanDerWaalsContact O-N 3.16Å; L1039-L1042 PolarHBondContact O-N 3.42Å; E1040-L1042 VanDerWaalsContact C-N 3.32Å; E1040-L1042 PolarHBondContact O-N 2.89Å; L1042-R1044 VanDerWaalsContact C-N 3.35Å; L1042-V1045 PolarHBondContact O-N 3.4Å; L1042-H1046 WeakPolarHBondContact O-CB 2.9Å; L1042-H1046 PolarHBondContact O-N 3.38Å |
| 1043 | R | 98.4 | Very high | 98.3 | Very high | 134 Ų | 134 | 105 Ų | 105 | 51% | 0.506 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.4 | -43.7 | 172.3 | -71.2 | 171.7 | -165.8 | 123.1 | 5.6 | 111.3 | L1039 E1040 H1046 A1047 | L1039-R1043 WeakPolarHBondContact O-CG 3.45Å; L1039-R1043 PolarHBondContact O-N 3.28Å; E1040-R1043 PolarHBondContact O-N 2.93Å; E1040-R1043 WeakPolarHBondContact OE2-CD 3.26Å; E1040-R1043 IonicContact OE2-CZ 2.69Å; E1040-R1043 IonicContact OE2-NE 3.68Å; E1040-R1043 IonicContact OE2-NH1 2.82Å; E1040-R1043 PolarHBondContact OE2-NH1 2.88Å; R1043-H1046 PolarHBondContact O-N 2.92Å; R1043-A1047 VanDerWaalsContact O-CB 3.31Å; R1043-A1047 WeakPolarHBondContact O-CB 3.26Å; R1043-A1047 PolarHBondContact O-N 3.14Å |
| 1044 | R | 98.6 | Very high | 98.3 | Very high | 110 Ų | 110 | 105.4 Ų | 105.4 | 42% | 0.415 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.9 | -41.4 | 179.7 | -166.3 | -152.2 | 62.4 | 64.1 | 0.5 | 112 | E1040 E1041 L1042 Q1048 | E1040-R1044 WeakPolarHBondContact O-CB 3.34Å; E1040-R1044 PolarHBondContact O-N 3.42Å; E1041-R1044 PolarHBondContact O-N 2.86Å; E1041-R1044 IonicContact OE1-CZ 3.68Å; E1041-R1044 IonicContact OE1-NE 3.72Å; E1041-R1044 PolarHBondContact OE1-NE 3.27Å; E1041-R1044 IonicContact OE1-NH2 3.68Å; E1041-R1044 PolarHBondContact OE1-NH2 3.45Å; E1041-R1044 IonicContact OE2-CZ 2.68Å; E1041-R1044 IonicContact OE2-NE 3.44Å; E1041-R1044 PolarHBondContact OE2-NE 2.93Å; E1041-R1044 IonicContact OE2-NH2 3.94Å; L1042-R1044 VanDerWaalsContact C-N 3.35Å; R1044-Q1048 WeakPolarHBondContact O-CB 3.38Å; R1044-Q1048 PolarHBondContact O-N 3.29Å; R1044-Q1048 VanDerWaalsContact O-N 3.11Å |
| 1045 | V | 98.4 | Very high | 98.3 | Very high | 42 Ų | 42 | 103.8 Ų | 103.8 | 26% | 0.255 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65 | -51.9 | 173.8 | 169.8 | 0 | 0 | 0 | 0 | 110.5 | E1041 L1042 A1047 Q1048 E1049 | E1041-V1045 WeakPolarHBondContact O-CG2 3.37Å; E1041-V1045 PolarHBondContact O-N 3.43Å; L1042-V1045 PolarHBondContact O-N 3.4Å; V1045-A1047 VanDerWaalsContact C-N 3.33Å; V1045-A1047 PolarHBondContact O-N 3.42Å; V1045-Q1048 CarbonylContact O-C 3.57Å; V1045-Q1048 WeakPolarHBondContact O-CA 3.46Å; V1045-Q1048 WeakPolarHBondContact O-CB 3.11Å; V1045-Q1048 PolarHBondContact O-N 2.88Å; V1045-E1049 HydrophobicContact CG1-CG 4.25Å; V1045-E1049 WeakPolarHBondContact CG1-OE1 3.32Å; V1045-E1049 WeakPolarHBondContact O-CG 3.33Å; V1045-E1049 PolarHBondContact O-N 3.28Å |
| 1046 | H | 98 | Very high | 98.3 | Very high | 103 Ų | 103 | 101.9 Ų | 101.9 | 48% | 0.477 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.2 | -39.9 | -179.9 | 179.6 | -146.3 | 0 | 0 | 0 | 112.6 | L1042 R1043 Q1048 E1049 L1050 | L1042-H1046 WeakPolarHBondContact O-CB 2.9Å; L1042-H1046 PolarHBondContact O-N 3.38Å; R1043-H1046 PolarHBondContact O-N 2.92Å; H1046-Q1048 VanDerWaalsContact C-N 3.35Å; H1046-Q1048 PolarHBondContact O-N 3.16Å; H1046-E1049 PolarHBondContact O-N 2.93Å; H1046-L1050 WeakPolarHBondContact O-CB 3.3Å; H1046-L1050 WeakPolarHBondContact O-CG 3.43Å; H1046-L1050 PolarHBondContact O-N 3.11Å |
| 1047 | A | 98.2 | Very high | 98.3 | Very high | 57 Ų | 57 | 100.9 Ų | 100.9 | 47% | 0.471 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.3 | -37.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | R1043 V1045 Q1051 | R1043-A1047 VanDerWaalsContact O-CB 3.31Å; R1043-A1047 WeakPolarHBondContact O-CB 3.26Å; R1043-A1047 PolarHBondContact O-N 3.14Å; V1045-A1047 VanDerWaalsContact C-N 3.33Å; V1045-A1047 PolarHBondContact O-N 3.42Å; A1047-Q1051 WeakPolarHBondContact O-CB 3.38Å; A1047-Q1051 PolarHBondContact O-N 2.87Å |
| 1048 | Q | 98.4 | Very high | 98.3 | Very high | 110 Ų | 110 | 99.3 Ų | 99.3 | 51% | 0.514 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.2 | -38.4 | 174.8 | -177.1 | -178.8 | -8.5 | 0 | 0 | 112 | R1044 V1045 H1046 Q1051 S1052 | R1044-Q1048 WeakPolarHBondContact O-CB 3.38Å; R1044-Q1048 PolarHBondContact O-N 3.29Å; R1044-Q1048 VanDerWaalsContact O-N 3.11Å; V1045-Q1048 CarbonylContact O-C 3.57Å; V1045-Q1048 WeakPolarHBondContact O-CA 3.46Å; V1045-Q1048 WeakPolarHBondContact O-CB 3.11Å; V1045-Q1048 PolarHBondContact O-N 2.88Å; H1046-Q1048 VanDerWaalsContact C-N 3.35Å; H1046-Q1048 PolarHBondContact O-N 3.16Å; Q1048-Q1051 PolarHBondContact O-N 3.17Å; Q1048-S1052 WeakPolarHBondContact O-CB 3.27Å; Q1048-S1052 PolarHBondContact O-N 2.6Å |
| 1049 | E | 97.9 | Very high | 98.2 | Very high | 109 Ų | 109 | 100 Ų | 100 | 51% | 0.509 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.1 | -46.2 | 175.4 | -72 | 170.2 | 164.8 | 0 | 0 | 111.1 | V1045 H1046 Q1051 S1052 L1053 | V1045-E1049 HydrophobicContact CG1-CG 4.25Å; V1045-E1049 WeakPolarHBondContact CG1-OE1 3.32Å; V1045-E1049 WeakPolarHBondContact O-CG 3.33Å; V1045-E1049 PolarHBondContact O-N 3.28Å; H1046-E1049 PolarHBondContact O-N 2.93Å; E1049-Q1051 VanDerWaalsContact C-N 3.35Å; E1049-Q1051 PolarHBondContact O-N 3.23Å; E1049-S1052 PolarHBondContact O-N 2.95Å; E1049-L1053 WeakPolarHBondContact O-CG 3.45Å; E1049-L1053 PolarHBondContact O-N 3.01Å |
| 1050 | L | 98.4 | Very high | 98.2 | Very high | 94 Ų | 94 | 98.2 Ų | 98.2 | 49% | 0.492 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.9 | -45.5 | 173.3 | -73 | 171.5 | 0 | 0 | 0 | 111.8 | H1046 S1052 L1053 E1054 | H1046-L1050 WeakPolarHBondContact O-CB 3.3Å; H1046-L1050 WeakPolarHBondContact O-CG 3.43Å; H1046-L1050 PolarHBondContact O-N 3.11Å; L1050-S1052 VanDerWaalsContact C-N 3.33Å; L1050-S1052 PolarHBondContact O-N 2.71Å; L1050-L1053 PolarHBondContact O-N 2.78Å; L1050-E1054 WeakPolarHBondContact O-CB 3.32Å; L1050-E1054 PolarHBondContact O-N 3.34Å |
| 1051 | Q | 98.1 | Very high | 98.2 | Very high | 136 Ų | 136 | 99 Ų | 99 | 64% | 0.636 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64 | -37.4 | 176.6 | -172 | -179.7 | 10.1 | 0 | 0 | 112.3 | A1047 Q1048 E1049 Q1055 | A1047-Q1051 WeakPolarHBondContact O-CB 3.38Å; A1047-Q1051 PolarHBondContact O-N 2.87Å; Q1048-Q1051 PolarHBondContact O-N 3.17Å; E1049-Q1051 VanDerWaalsContact C-N 3.35Å; E1049-Q1051 PolarHBondContact O-N 3.23Å; Q1051-Q1055 PolarHBondContact O-N 2.76Å |
| 1052 | S | 98.3 | Very high | 98.1 | Very high | 75 Ų | 75 | 97.2 Ų | 97.2 | 52% | 0.524 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -67.7 | -41.9 | 177.1 | -165.3 | 0 | 0 | 0 | 0 | 111.9 | Q1048 E1049 L1050 Q1055 E1056 | Q1048-S1052 WeakPolarHBondContact O-CB 3.27Å; Q1048-S1052 PolarHBondContact O-N 2.6Å; E1049-S1052 PolarHBondContact O-N 2.95Å; L1050-S1052 VanDerWaalsContact C-N 3.33Å; L1050-S1052 PolarHBondContact O-N 2.71Å; S1052-Q1055 PolarHBondContact O-N 3.29Å; S1052-E1056 WeakPolarHBondContact O-CB 3.3Å; S1052-E1056 PolarHBondContact O-N 3.49Å |
| 1053 | L | 98.2 | Very high | 98.1 | Very high | 105 Ų | 105 | 94.9 Ų | 94.9 | 55% | 0.55 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -68.5 | -36.3 | 175.8 | -71.2 | 172.4 | 0 | 0 | 0 | 112 | E1049 L1050 Q1055 E1056 L1057 | E1049-L1053 WeakPolarHBondContact O-CG 3.45Å; E1049-L1053 PolarHBondContact O-N 3.01Å; L1050-L1053 PolarHBondContact O-N 2.78Å; L1053-Q1055 VanDerWaalsContact C-N 3.32Å; L1053-E1056 PolarHBondContact O-N 3.13Å; L1053-L1057 VanDerWaalsContact O-CB 3.27Å; L1053-L1057 WeakPolarHBondContact O-CB 3.19Å; L1053-L1057 PolarHBondContact O-N 3.22Å |
| 1054 | E | 98.3 | Very high | 98.1 | Very high | 104 Ų | 104 | 93.1 Ų | 93.1 | 49% | 0.486 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.6 | -35.6 | 173.7 | -163 | -164.3 | 163 | 0 | 0 | 111.6 | L1050 K1058 | L1050-E1054 WeakPolarHBondContact O-CB 3.32Å; L1050-E1054 PolarHBondContact O-N 3.34Å; E1054-K1058 VanDerWaalsContact CD-NZ 3.25Å; E1054-K1058 WeakPolarHBondContact O-CD 3.5Å; E1054-K1058 VanDerWaalsContact O-CG 3.27Å; E1054-K1058 WeakPolarHBondContact O-CG 3.34Å; E1054-K1058 PolarHBondContact O-N 3.35Å; E1054-K1058 WeakPolarHBondContact OE1-CE 3.41Å; E1054-K1058 IonicContact OE1-NZ 2.71Å; E1054-K1058 PolarHBondContact OE1-NZ 3.45Å |
| 1055 | Q | 98.1 | Very high | 98 | Very high | 97 Ų | 97 | 90.9 Ų | 90.9 | 45% | 0.453 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -71.5 | -47.1 | 173.8 | -172.3 | 61.8 | 50.8 | 0 | 0 | 111.8 | Q1051 S1052 L1053 L1057 K1058 D1059 | Q1051-Q1055 PolarHBondContact O-N 2.76Å; S1052-Q1055 PolarHBondContact O-N 3.29Å; L1053-Q1055 VanDerWaalsContact C-N 3.32Å; Q1055-L1057 VanDerWaalsContact C-N 3.28Å; Q1055-L1057 PolarHBondContact O-N 3.24Å; Q1055-K1058 PolarHBondContact O-N 3.36Å; Q1055-K1058 VanDerWaalsContact O-N 3.12Å; Q1055-D1059 PolarHBondContact NE2-OD1 2.83Å; Q1055-D1059 VanDerWaalsContact O-CG 3.26Å; Q1055-D1059 PolarHBondContact O-N 2.86Å |
| 1056 | E | 98.2 | Very high | 98 | Very high | 126 Ų | 126 | 91.5 Ų | 91.5 | 59% | 0.589 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -59.6 | -39.2 | 176.9 | -175.5 | 173.3 | -167.4 | 0 | 0 | 111.6 | S1052 L1053 D1059 S1060 | S1052-E1056 WeakPolarHBondContact O-CB 3.3Å; S1052-E1056 PolarHBondContact O-N 3.49Å; L1053-E1056 PolarHBondContact O-N 3.13Å; E1056-D1059 PolarHBondContact O-N 3.07Å; E1056-S1060 WeakPolarHBondContact O-CB 3.19Å; E1056-S1060 PolarHBondContact O-N 3.49Å; E1056-S1060 PolarHBondContact O-OG 2.86Å |
| 1057 | L | 98.2 | Very high | 98 | Very high | 111 Ų | 111 | 91.8 Ų | 91.8 | 58% | 0.581 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.7 | -49.6 | 172.6 | -179.6 | 62.3 | 0 | 0 | 0 | 111.4 | L1053 Q1055 D1059 S1060 E1061 | L1053-L1057 VanDerWaalsContact O-CB 3.27Å; L1053-L1057 WeakPolarHBondContact O-CB 3.19Å; L1053-L1057 PolarHBondContact O-N 3.22Å; Q1055-L1057 VanDerWaalsContact C-N 3.28Å; Q1055-L1057 PolarHBondContact O-N 3.24Å; L1057-D1059 PolarHBondContact O-N 3.01Å; L1057-S1060 PolarHBondContact O-N 2.78Å; L1057-S1060 PolarHBondContact O-OG 3.46Å; L1057-E1061 WeakPolarHBondContact O-CB 3.27Å; L1057-E1061 PolarHBondContact O-N 2.81Å |
| 1058 | K | 98.1 | Very high | 98 | Very high | 92 Ų | 92 | 94 Ų | 94 | 40% | 0.4 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.8 | -38.9 | 178.3 | -72.3 | 165.3 | -172.8 | 166.2 | 0 | 112.9 | E1054 Q1055 S1060 E1061 A1062 | E1054-K1058 VanDerWaalsContact CD-NZ 3.25Å; E1054-K1058 WeakPolarHBondContact O-CD 3.5Å; E1054-K1058 VanDerWaalsContact O-CG 3.27Å; E1054-K1058 WeakPolarHBondContact O-CG 3.34Å; E1054-K1058 PolarHBondContact O-N 3.35Å; E1054-K1058 WeakPolarHBondContact OE1-CE 3.41Å; E1054-K1058 IonicContact OE1-NZ 2.71Å; E1054-K1058 PolarHBondContact OE1-NZ 3.45Å; Q1055-K1058 PolarHBondContact O-N 3.36Å; Q1055-K1058 VanDerWaalsContact O-N 3.12Å; K1058-S1060 VanDerWaalsContact C-N 3.33Å; K1058-E1061 PolarHBondContact O-N 2.86Å; K1058-A1062 WeakPolarHBondContact O-CB 3.36Å; K1058-A1062 PolarHBondContact O-N 3.27Å |
| 1059 | D | 98 | Very high | 97.9 | Very high | 93 Ų | 93 | 95.4 Ų | 95.4 | 50% | 0.497 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.4 | -38.6 | 176.6 | -66.7 | -15.9 | 0 | 0 | 0 | 110.3 | Q1055 E1056 L1057 A1063 | Q1055-D1059 PolarHBondContact NE2-OD1 2.83Å; Q1055-D1059 VanDerWaalsContact O-CG 3.26Å; Q1055-D1059 PolarHBondContact O-N 2.86Å; E1056-D1059 PolarHBondContact O-N 3.07Å; L1057-D1059 PolarHBondContact O-N 3.01Å; D1059-A1063 WeakPolarHBondContact O-CB 3.38Å; D1059-A1063 PolarHBondContact O-N 2.63Å |
| 1060 | S | 97.3 | Very high | 97.9 | Very high | 51 Ų | 51 | 97.1 Ų | 97.1 | 36% | 0.357 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -70 | -37.8 | 174 | 80.6 | 0 | 0 | 0 | 0 | 113.1 | E1056 L1057 K1058 A1063 L1064 | E1056-S1060 WeakPolarHBondContact O-CB 3.19Å; E1056-S1060 PolarHBondContact O-N 3.49Å; E1056-S1060 PolarHBondContact O-OG 2.86Å; L1057-S1060 PolarHBondContact O-N 2.78Å; L1057-S1060 PolarHBondContact O-OG 3.46Å; K1058-S1060 VanDerWaalsContact C-N 3.33Å; S1060-A1063 PolarHBondContact O-N 2.88Å; S1060-L1064 WeakPolarHBondContact O-CB 3.48Å; S1060-L1064 VanDerWaalsContact O-CG 3.31Å; S1060-L1064 WeakPolarHBondContact O-CG 3.39Å; S1060-L1064 PolarHBondContact O-N 3.38Å |
| 1061 | E | 98.1 | Very high | 97.9 | Very high | 120 Ų | 120 | 97 Ų | 97 | 56% | 0.561 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.5 | -42.8 | 175.1 | -177.3 | 179.2 | -170.5 | 0 | 0 | 110.7 | L1057 K1058 S1065 | L1057-E1061 WeakPolarHBondContact O-CB 3.27Å; L1057-E1061 PolarHBondContact O-N 2.81Å; K1058-E1061 PolarHBondContact O-N 2.86Å; E1061-S1065 VanDerWaalsContact O-CB 3.24Å; E1061-S1065 WeakPolarHBondContact O-CB 3.43Å; E1061-S1065 PolarHBondContact O-N 3.04Å; E1061-S1065 PolarHBondContact O-OG 2.92Å |
| 1062 | A | 97.3 | Very high | 97.8 | Very high | 60 Ų | 60 | 93.9 Ų | 93.9 | 50% | 0.496 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.9 | -43.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | K1058 S1065 A1066 | K1058-A1062 WeakPolarHBondContact O-CB 3.36Å; K1058-A1062 PolarHBondContact O-N 3.27Å; A1062-S1065 PolarHBondContact O-N 3.45Å; A1062-A1066 WeakPolarHBondContact O-CB 3.32Å; A1062-A1066 PolarHBondContact O-N 3.33Å |
| 1063 | A | 98.1 | Very high | 97.8 | Very high | 63 Ų | 63 | 94.9 Ų | 94.9 | 52% | 0.521 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.3 | -43.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | D1059 S1060 A1066 Q1067 | D1059-A1063 WeakPolarHBondContact O-CB 3.38Å; D1059-A1063 PolarHBondContact O-N 2.63Å; S1060-A1063 PolarHBondContact O-N 2.88Å; A1063-A1066 PolarHBondContact O-N 3.49Å; A1063-Q1067 PolarHBondContact O-N 2.96Å |
| 1064 | L | 97.6 | Very high | 97.7 | Very high | 97 Ų | 97 | 95.2 Ų | 95.2 | 51% | 0.508 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.6 | -38.5 | 174.7 | -72.3 | 171.3 | 0 | 0 | 0 | 111.8 | S1060 Q1067 I1068 | S1060-L1064 WeakPolarHBondContact O-CB 3.48Å; S1060-L1064 VanDerWaalsContact O-CG 3.31Å; S1060-L1064 WeakPolarHBondContact O-CG 3.39Å; S1060-L1064 PolarHBondContact O-N 3.38Å; L1064-Q1067 PolarHBondContact O-N 3.49Å; L1064-I1068 WeakPolarHBondContact O-CB 3.47Å; L1064-I1068 WeakPolarHBondContact O-CD1 3.41Å; L1064-I1068 VanDerWaalsContact O-CG1 3.22Å; L1064-I1068 WeakPolarHBondContact O-CG1 3.41Å; L1064-I1068 PolarHBondContact O-N 3.46Å |
| 1065 | S | 97.4 | Very high | 97.7 | Very high | 63 Ų | 63 | 94.6 Ų | 94.6 | 44% | 0.441 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.6 | -43.2 | 175.2 | -62 | 0 | 0 | 0 | 0 | 111.8 | E1061 A1062 I1068 E1069 | E1061-S1065 VanDerWaalsContact O-CB 3.24Å; E1061-S1065 WeakPolarHBondContact O-CB 3.43Å; E1061-S1065 PolarHBondContact O-N 3.04Å; E1061-S1065 PolarHBondContact O-OG 2.92Å; A1062-S1065 PolarHBondContact O-N 3.45Å; S1065-I1068 PolarHBondContact O-N 3.44Å; S1065-E1069 PolarHBondContact O-N 2.78Å |
| 1066 | A | 97.8 | Very high | 97.6 | Very high | 56 Ų | 56 | 94 Ų | 94 | 46% | 0.463 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.8 | -40.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A1062 A1063 E1069 E1070 | A1062-A1066 WeakPolarHBondContact O-CB 3.32Å; A1062-A1066 PolarHBondContact O-N 3.33Å; A1063-A1066 PolarHBondContact O-N 3.49Å; A1066-E1069 PolarHBondContact O-N 3.03Å; A1066-E1070 PolarHBondContact O-N 3.34Å |
| 1067 | Q | 98.1 | Very high | 97.5 | Very high | 108 Ų | 108 | 89.6 Ų | 89.6 | 51% | 0.505 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.4 | -37.1 | 174.3 | -177.5 | 172.8 | 63.6 | 0 | 0 | 112.3 | A1063 L1064 E1069 E1070 L1071 | A1063-Q1067 PolarHBondContact O-N 2.96Å; L1064-Q1067 PolarHBondContact O-N 3.49Å; Q1067-E1069 VanDerWaalsContact C-N 3.35Å; Q1067-E1070 PolarHBondContact O-N 3.34Å; Q1067-L1071 HydrophobicContact CG-CD1 3.94Å; Q1067-L1071 HydrophobicContact CG-CG 4.36Å; Q1067-L1071 VanDerWaalsContact O-CB 3.31Å; Q1067-L1071 WeakPolarHBondContact O-CB 3.38Å; Q1067-L1071 VanDerWaalsContact O-CG 3.28Å; Q1067-L1071 WeakPolarHBondContact O-CG 3.4Å; Q1067-L1071 PolarHBondContact O-N 2.91Å |
| 1068 | I | 97.5 | Very high | 97.4 | Very high | 105 Ų | 105 | 88.4 Ų | 88.4 | 54% | 0.538 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.1 | -39.9 | 173.7 | -71.8 | 163.7 | 0 | 0 | 0 | 110.4 | L1064 S1065 T1072 | L1064-I1068 WeakPolarHBondContact O-CB 3.47Å; L1064-I1068 WeakPolarHBondContact O-CD1 3.41Å; L1064-I1068 VanDerWaalsContact O-CG1 3.22Å; L1064-I1068 WeakPolarHBondContact O-CG1 3.41Å; L1064-I1068 PolarHBondContact O-N 3.46Å; S1065-I1068 PolarHBondContact O-N 3.44Å; I1068-T1072 WeakPolarHBondContact O-CB 3.42Å; I1068-T1072 PolarHBondContact O-N 2.84Å; I1068-T1072 PolarHBondContact O-OG1 3.33Å |
| 1069 | E | 97.8 | Very high | 97.3 | Very high | 139 Ų | 139 | 88.2 Ų | 88.2 | 65% | 0.65 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.3 | -48.2 | 175.1 | -172.2 | 171 | -163.2 | 0 | 0 | 111.5 | S1065 A1066 Q1067 T1072 V1073 | S1065-E1069 PolarHBondContact O-N 2.78Å; A1066-E1069 PolarHBondContact O-N 3.03Å; Q1067-E1069 VanDerWaalsContact C-N 3.35Å; E1069-T1072 WeakPolarHBondContact O-CB 3.34Å; E1069-T1072 PolarHBondContact O-N 3.03Å; E1069-T1072 VanDerWaalsContact O-N 3.17Å; E1069-V1073 WeakPolarHBondContact O-CG2 3.18Å; E1069-V1073 PolarHBondContact O-N 3.4Å |
| 1070 | E | 97.6 | Very high | 97.2 | Very high | 145 Ų | 145 | 90.7 Ų | 90.7 | 68% | 0.678 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58.1 | -50.4 | 176.1 | -177.2 | 173.7 | -149.3 | 0 | 0 | 112 | A1066 Q1067 T1072 V1073 E1074 | A1066-E1070 PolarHBondContact O-N 3.34Å; Q1067-E1070 PolarHBondContact O-N 3.34Å; E1070-T1072 VanDerWaalsContact C-N 3.28Å; E1070-T1072 PolarHBondContact O-N 2.93Å; E1070-V1073 PolarHBondContact O-N 3.03Å; E1070-E1074 PolarHBondContact O-N 3.48Å |
| 1071 | L | 97.4 | Very high | 97.1 | Very high | 92 Ų | 92 | 94.7 Ų | 94.7 | 48% | 0.482 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -65.1 | -30.3 | 176.6 | -71.6 | 172.9 | 0 | 0 | 0 | 112.5 | Q1067 N1075 | Q1067-L1071 HydrophobicContact CG-CD1 3.94Å; Q1067-L1071 HydrophobicContact CG-CG 4.36Å; Q1067-L1071 VanDerWaalsContact O-CB 3.31Å; Q1067-L1071 WeakPolarHBondContact O-CB 3.38Å; Q1067-L1071 VanDerWaalsContact O-CG 3.28Å; Q1067-L1071 WeakPolarHBondContact O-CG 3.4Å; Q1067-L1071 PolarHBondContact O-N 2.91Å; L1071-N1075 WeakPolarHBondContact O-CB 3.4Å; L1071-N1075 PolarHBondContact O-N 2.94Å |
| 1072 | T | 96.6 | Very high | 96.8 | Very high | 70 Ų | 70 | 92.5 Ų | 92.5 | 43% | 0.429 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -70 | -40.3 | 174.3 | -63.4 | 0 | 0 | 0 | 0 | 110.9 | I1068 E1069 E1070 N1075 N1076 | I1068-T1072 WeakPolarHBondContact O-CB 3.42Å; I1068-T1072 PolarHBondContact O-N 2.84Å; I1068-T1072 PolarHBondContact O-OG1 3.33Å; E1069-T1072 WeakPolarHBondContact O-CB 3.34Å; E1069-T1072 PolarHBondContact O-N 3.03Å; E1069-T1072 VanDerWaalsContact O-N 3.17Å; E1070-T1072 VanDerWaalsContact C-N 3.28Å; E1070-T1072 PolarHBondContact O-N 2.93Å; T1072-N1075 PolarHBondContact O-N 3.34Å; T1072-N1076 WeakPolarHBondContact O-CB 3.48Å; T1072-N1076 VanDerWaalsContact O-CG 3.24Å; T1072-N1076 PolarHBondContact O-N 2.9Å; T1072-N1076 PolarHBondContact O-ND2 3.28Å |
| 1073 | V | 97.8 | Very high | 96.7 | Very high | 96 Ų | 96 | 92 Ų | 92 | 58% | 0.582 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.4 | -44.3 | 173.4 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | E1069 E1070 N1076 A1077 | E1069-V1073 WeakPolarHBondContact O-CG2 3.18Å; E1069-V1073 PolarHBondContact O-N 3.4Å; E1070-V1073 PolarHBondContact O-N 3.03Å; V1073-N1076 PolarHBondContact O-N 2.88Å; V1073-A1077 WeakPolarHBondContact O-CB 3.42Å; V1073-A1077 PolarHBondContact O-N 3.47Å |
| 1074 | E | 97.3 | Very high | 96.3 | Very high | 112 Ų | 112 | 92.1 Ų | 92.1 | 52% | 0.523 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63 | -46.4 | 175 | -173.8 | 178.9 | -158.9 | 0 | 0 | 111.6 | E1070 N1076 A1077 L1078 | E1070-E1074 PolarHBondContact O-N 3.48Å; E1074-N1076 PolarHBondContact O-N 2.95Å; E1074-A1077 CarbonylContact O-C 3.59Å; E1074-A1077 PolarHBondContact O-N 2.94Å; E1074-A1077 VanDerWaalsContact O-N 3.15Å; E1074-L1078 HydrophobicContact CG-CD1 3.96Å; E1074-L1078 HydrophobicContact CG-CG 4.25Å; E1074-L1078 WeakPolarHBondContact O-CB 3.44Å; E1074-L1078 WeakPolarHBondContact O-CG 3.43Å; E1074-L1078 PolarHBondContact O-N 2.86Å |
| 1075 | N | 96.8 | Very high | 95.9 | Very high | 90 Ų | 90 | 89.5 Ų | 89.5 | 48% | 0.481 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.5 | -44.6 | 179.5 | -166.8 | -38 | 0 | 0 | 0 | 111.1 | L1071 T1072 A1077 L1078 L1079 | L1071-N1075 WeakPolarHBondContact O-CB 3.4Å; L1071-N1075 PolarHBondContact O-N 2.94Å; T1072-N1075 PolarHBondContact O-N 3.34Å; N1075-A1077 PolarHBondContact O-N 3.34Å; N1075-L1078 CarbonylContact O-C 3.56Å; N1075-L1078 PolarHBondContact O-N 3.35Å; N1075-L1079 WeakPolarHBondContact O-CB 3.43Å; N1075-L1079 VanDerWaalsContact O-CG 3.31Å; N1075-L1079 WeakPolarHBondContact O-CG 3.31Å; N1075-L1079 PolarHBondContact O-N 2.89Å; N1075-L1079 WeakPolarHBondContact OD1-CD1 3.46Å; N1075-L1079 WeakPolarHBondContact OD1-CG 3.46Å |
| 1076 | N | 96.3 | Very high | 95.4 | Very high | 86 Ų | 86 | 91.8 Ų | 91.8 | 46% | 0.46 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59 | -46.3 | 172.9 | -74.1 | -35.1 | 0 | 0 | 0 | 111.9 | T1072 V1073 E1074 L1078 L1079 E1080 | T1072-N1076 WeakPolarHBondContact O-CB 3.48Å; T1072-N1076 VanDerWaalsContact O-CG 3.24Å; T1072-N1076 PolarHBondContact O-N 2.9Å; T1072-N1076 PolarHBondContact O-ND2 3.28Å; V1073-N1076 PolarHBondContact O-N 2.88Å; E1074-N1076 PolarHBondContact O-N 2.95Å; N1076-L1078 VanDerWaalsContact C-N 3.29Å; N1076-L1078 PolarHBondContact O-N 2.76Å; N1076-L1079 PolarHBondContact O-N 3.05Å; N1076-E1080 WeakPolarHBondContact O-CG 3.44Å; N1076-E1080 PolarHBondContact O-N 2.8Å |
| 1077 | A | 96.7 | Very high | 94.8 | Very high | 32 Ų | 32 | 90.9 Ų | 90.9 | 26% | 0.264 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.7 | -30.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | V1073 E1074 N1075 K1081 | V1073-A1077 WeakPolarHBondContact O-CB 3.42Å; V1073-A1077 PolarHBondContact O-N 3.47Å; E1074-A1077 CarbonylContact O-C 3.59Å; E1074-A1077 PolarHBondContact O-N 2.94Å; E1074-A1077 VanDerWaalsContact O-N 3.15Å; N1075-A1077 PolarHBondContact O-N 3.34Å; A1077-K1081 VanDerWaalsContact O-CD 3.23Å; A1077-K1081 WeakPolarHBondContact O-CD 3.28Å; A1077-K1081 WeakPolarHBondContact O-CG 3.48Å; A1077-K1081 PolarHBondContact O-N 3.24Å |
| 1078 | L | 96.8 | Very high | 94.2 | Very high | 87 Ų | 87 | 93.2 Ų | 93.2 | 46% | 0.455 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -75.5 | -36.8 | 172.2 | -70.9 | 173.5 | 0 | 0 | 0 | 112 | E1074 N1075 N1076 K1081 L1082 | E1074-L1078 HydrophobicContact CG-CD1 3.96Å; E1074-L1078 HydrophobicContact CG-CG 4.25Å; E1074-L1078 WeakPolarHBondContact O-CB 3.44Å; E1074-L1078 WeakPolarHBondContact O-CG 3.43Å; E1074-L1078 PolarHBondContact O-N 2.86Å; N1075-L1078 CarbonylContact O-C 3.56Å; N1075-L1078 PolarHBondContact O-N 3.35Å; N1076-L1078 VanDerWaalsContact C-N 3.29Å; N1076-L1078 PolarHBondContact O-N 2.76Å; L1078-K1081 HydrophobicContact CD2-CD 4.35Å; L1078-K1081 PolarHBondContact O-N 3.49Å; L1078-L1082 WeakPolarHBondContact O-CB 3.27Å; L1078-L1082 PolarHBondContact O-N 2.81Å |
| 1079 | L | 96.1 | Very high | 93.6 | Very high | 87 Ų | 87 | 95.2 Ų | 95.2 | 46% | 0.455 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.6 | -40.6 | 173.9 | -75.5 | 172.1 | 0 | 0 | 0 | 111.6 | N1075 N1076 L1082 A1083 | N1075-L1079 WeakPolarHBondContact O-CB 3.43Å; N1075-L1079 VanDerWaalsContact O-CG 3.31Å; N1075-L1079 WeakPolarHBondContact O-CG 3.31Å; N1075-L1079 PolarHBondContact O-N 2.89Å; N1075-L1079 WeakPolarHBondContact OD1-CD1 3.46Å; N1075-L1079 WeakPolarHBondContact OD1-CG 3.46Å; N1076-L1079 PolarHBondContact O-N 3.05Å; L1079-L1082 CarbonylContact O-C 3.58Å; L1079-L1082 PolarHBondContact O-N 3.41Å; L1079-A1083 VanDerWaalsContact O-CB 3.25Å; L1079-A1083 WeakPolarHBondContact O-CB 3.35Å; L1079-A1083 PolarHBondContact O-N 3.48Å |
| 1080 | E | 94.6 | Very high | 92.6 | Very high | 145 Ų | 145 | 96.1 Ų | 96.1 | 68% | 0.678 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.7 | -50.2 | 172.9 | -74.6 | -177.4 | 168.7 | 0 | 0 | 111.6 | N1076 L1082 A1083 A1084 | N1076-E1080 WeakPolarHBondContact O-CG 3.44Å; N1076-E1080 PolarHBondContact O-N 2.8Å; E1080-L1082 VanDerWaalsContact C-N 3.28Å; E1080-L1082 PolarHBondContact O-N 2.59Å; E1080-A1083 PolarHBondContact O-N 2.82Å; E1080-A1083 VanDerWaalsContact O-N 3.14Å; E1080-A1084 PolarHBondContact O-N 2.74Å |
| 1081 | K | 94.7 | Very high | 91.4 | Very high | 136 Ų | 136 | 94.7 Ų | 94.7 | 59% | 0.591 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -56.5 | -42.6 | 174 | -70.8 | 162.5 | -167.5 | 164.3 | 0 | 111.5 | A1077 L1078 E1085 | A1077-K1081 VanDerWaalsContact O-CD 3.23Å; A1077-K1081 WeakPolarHBondContact O-CD 3.28Å; A1077-K1081 WeakPolarHBondContact O-CG 3.48Å; A1077-K1081 PolarHBondContact O-N 3.24Å; L1078-K1081 HydrophobicContact CD2-CD 4.35Å; L1078-K1081 PolarHBondContact O-N 3.49Å; K1081-E1085 WeakPolarHBondContact O-CB 3.39Å; K1081-E1085 PolarHBondContact O-N 3.18Å |
| 1082 | L | 93.8 | Very high | 90 | Very high | 74 Ų | 74 | 95.6 Ų | 95.6 | 39% | 0.387 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -70.7 | -32.1 | 178.5 | -177.5 | 61.3 | 0 | 0 | 0 | 112.5 | L1078 L1079 E1080 K1086 | L1078-L1082 WeakPolarHBondContact O-CB 3.27Å; L1078-L1082 PolarHBondContact O-N 2.81Å; L1079-L1082 CarbonylContact O-C 3.58Å; L1079-L1082 PolarHBondContact O-N 3.41Å; E1080-L1082 VanDerWaalsContact C-N 3.28Å; E1080-L1082 PolarHBondContact O-N 2.59Å; L1082-K1086 HydrophobicContact CD1-CD 4.4Å; L1082-K1086 HydrophobicContact CD1-CG 4.39Å; L1082-K1086 HydrophobicContact CG-CD 4.07Å; L1082-K1086 WeakPolarHBondContact O-CB 3.47Å; L1082-K1086 WeakPolarHBondContact O-CD 3.33Å; L1082-K1086 WeakPolarHBondContact O-CG 3.37Å; L1082-K1086 PolarHBondContact O-N 3.2Å |
| 1083 | A | 93.1 | Very high | 88.7 | Confident | 50 Ų | 50 | 95.9 Ų | 95.9 | 41% | 0.413 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -73.2 | -38.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L1079 E1080 S1087 | L1079-A1083 VanDerWaalsContact O-CB 3.25Å; L1079-A1083 WeakPolarHBondContact O-CB 3.35Å; L1079-A1083 PolarHBondContact O-N 3.48Å; E1080-A1083 PolarHBondContact O-N 2.82Å; E1080-A1083 VanDerWaalsContact O-N 3.14Å; A1083-S1087 WeakPolarHBondContact O-CB 3.47Å; A1083-S1087 PolarHBondContact O-N 3.12Å; A1083-S1087 PolarHBondContact O-OG 2.9Å |
| 1084 | A | 91.3 | Very high | 86.9 | Confident | 64 Ų | 64 | 99.5 Ų | 99.5 | 53% | 0.529 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.5 | -49.4 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | E1080 K1086 S1087 R1088 | E1080-A1084 PolarHBondContact O-N 2.74Å; A1084-K1086 PolarHBondContact O-N 3.49Å; A1084-S1087 WeakPolarHBondContact O-CB 3.32Å; A1084-S1087 PolarHBondContact O-N 3.36Å; A1084-R1088 PolarHBondContact O-N 2.9Å |
| 1085 | E | 88.5 | Confident | 85 | Confident | 43 Ų | 43 | 100.6 Ų | 100.6 | 20% | 0.201 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -63.4 | -38.5 | 177.3 | 177.1 | 62.1 | 178.3 | 0 | 0 | 112.9 | K1081 S1087 R1088 R1089 | K1081-E1085 WeakPolarHBondContact O-CB 3.39Å; K1081-E1085 PolarHBondContact O-N 3.18Å; E1085-S1087 VanDerWaalsContact C-N 3.26Å; E1085-S1087 PolarHBondContact O-N 3.41Å; E1085-R1088 PolarHBondContact O-N 3.13Å; E1085-R1088 IonicContact OE1-CZ 2.67Å; E1085-R1088 IonicContact OE1-NE 2.66Å; E1085-R1088 IonicContact OE1-NH2 2.74Å; E1085-R1088 PolarHBondContact OE1-NH2 2.89Å; E1085-R1088 IonicContact OE2-CZ 3.85Å; E1085-R1088 IonicContact OE2-NE 3.98Å; E1085-R1088 PolarHBondContact OE2-NE 3.43Å; E1085-R1088 IonicContact OE2-NH2 2.88Å; E1085-R1088 PolarHBondContact OE2-NH2 2.85Å; E1085-R1089 WeakPolarHBondContact O-CB 3.49Å; E1085-R1089 VanDerWaalsContact O-CG 3.32Å; E1085-R1089 WeakPolarHBondContact O-CG 3.34Å; E1085-R1089 PolarHBondContact O-N 3.05Å; E1085-R1089 IonicContact OE1-CZ 3.78Å; E1085-R1089 IonicContact OE1-NE 3.16Å; E1085-R1089 PolarHBondContact OE1-NE 2.9Å; E1085-R1089 IonicContact OE1-NH2 2.61Å; E1085-R1089 PolarHBondContact OE1-NH2 3.38Å |
| 1086 | K | 87.6 | Confident | 83.2 | Confident | 111 Ų | 111 | 100 Ų | 100 | 48% | 0.483 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67 | -25.3 | 172.3 | -79.2 | 167.5 | 179.6 | 168.7 | 0 | 112.7 | L1082 A1084 R1090 | L1082-K1086 HydrophobicContact CD1-CD 4.4Å; L1082-K1086 HydrophobicContact CD1-CG 4.39Å; L1082-K1086 HydrophobicContact CG-CD 4.07Å; L1082-K1086 WeakPolarHBondContact O-CB 3.47Å; L1082-K1086 WeakPolarHBondContact O-CD 3.33Å; L1082-K1086 WeakPolarHBondContact O-CG 3.37Å; L1082-K1086 PolarHBondContact O-N 3.2Å; A1084-K1086 PolarHBondContact O-N 3.49Å; K1086-R1090 WeakPolarHBondContact O-CB 3.25Å; K1086-R1090 VanDerWaalsContact O-CG 3.22Å; K1086-R1090 WeakPolarHBondContact O-CG 3.48Å; K1086-R1090 PolarHBondContact O-N 3.03Å; K1086-R1090 PolarHBondContact O-NE 3.47Å |
| 1087 | S | 84.6 | Confident | 80.9 | Confident | 36 Ų | 36 | 105.3 Ų | 105.3 | 25% | 0.252 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -78.1 | -48.6 | 174.7 | -56 | 0 | 0 | 0 | 0 | 109.8 | A1083 A1084 E1085 R1089 R1090 E1091 | A1083-S1087 WeakPolarHBondContact O-CB 3.47Å; A1083-S1087 PolarHBondContact O-N 3.12Å; A1083-S1087 PolarHBondContact O-OG 2.9Å; A1084-S1087 WeakPolarHBondContact O-CB 3.32Å; A1084-S1087 PolarHBondContact O-N 3.36Å; E1085-S1087 VanDerWaalsContact C-N 3.26Å; E1085-S1087 PolarHBondContact O-N 3.41Å; S1087-R1089 VanDerWaalsContact C-N 3.25Å; S1087-R1089 PolarHBondContact O-N 2.9Å; S1087-R1090 CarbonylContact O-C 3.27Å; S1087-R1090 WeakPolarHBondContact O-CA 3.31Å; S1087-R1090 PolarHBondContact O-N 3.28Å; S1087-R1090 PolarHBondContact OG-NH2 3.38Å; S1087-E1091 WeakPolarHBondContact O-CG 3.48Å; S1087-E1091 PolarHBondContact O-N 3.44Å |
| 1088 | R | 86.2 | Confident | 79 | Confident | 158 Ų | 158 | 112.5 Ų | 112.5 | 60% | 0.596 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -52.4 | -39.3 | 169.1 | -170.1 | 177.7 | 74.6 | 127 | 2.8 | 113.4 | A1084 E1085 L1092 | A1084-R1088 PolarHBondContact O-N 2.9Å; E1085-R1088 PolarHBondContact O-N 3.13Å; E1085-R1088 IonicContact OE1-CZ 2.67Å; E1085-R1088 IonicContact OE1-NE 2.66Å; E1085-R1088 IonicContact OE1-NH2 2.74Å; E1085-R1088 PolarHBondContact OE1-NH2 2.89Å; E1085-R1088 IonicContact OE2-CZ 3.85Å; E1085-R1088 IonicContact OE2-NE 3.98Å; E1085-R1088 PolarHBondContact OE2-NE 3.43Å; E1085-R1088 IonicContact OE2-NH2 2.88Å; E1085-R1088 PolarHBondContact OE2-NH2 2.85Å; R1088-L1092 WeakPolarHBondContact O-CB 3.37Å; R1088-L1092 PolarHBondContact O-N 2.98Å; R1088-L1092 VanDerWaalsContact O-N 3.1Å |
| 1089 | R | 83.4 | Confident | 77.2 | Confident | 146 Ų | 146 | 113.6 Ų | 113.6 | 55% | 0.551 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -77.6 | -31.5 | 175.5 | -72.2 | -177.7 | -164.2 | -179.8 | 8.2 | 113.7 | E1085 S1087 L1092 V1093 | E1085-R1089 WeakPolarHBondContact O-CB 3.49Å; E1085-R1089 VanDerWaalsContact O-CG 3.32Å; E1085-R1089 WeakPolarHBondContact O-CG 3.34Å; E1085-R1089 PolarHBondContact O-N 3.05Å; E1085-R1089 IonicContact OE1-CZ 3.78Å; E1085-R1089 IonicContact OE1-NE 3.16Å; E1085-R1089 PolarHBondContact OE1-NE 2.9Å; E1085-R1089 IonicContact OE1-NH2 2.61Å; E1085-R1089 PolarHBondContact OE1-NH2 3.38Å; S1087-R1089 VanDerWaalsContact C-N 3.25Å; S1087-R1089 PolarHBondContact O-N 2.9Å; R1089-L1092 PolarHBondContact O-N 2.92Å; R1089-V1093 WeakPolarHBondContact O-CB 3.44Å; R1089-V1093 VanDerWaalsContact O-CG2 3.29Å; R1089-V1093 WeakPolarHBondContact O-CG2 3.47Å; R1089-V1093 PolarHBondContact O-N 2.91Å |
| 1090 | R | 78.2 | Confident | 76 | Confident | 159 Ų | 159 | 113.5 Ų | 113.5 | 60% | 0.6 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.9 | -44.5 | 171 | -81.8 | -179.7 | -60.5 | 160.7 | 6 | 110.2 | K1086 S1087 L1092 V1093 E1094 | K1086-R1090 WeakPolarHBondContact O-CB 3.25Å; K1086-R1090 VanDerWaalsContact O-CG 3.22Å; K1086-R1090 WeakPolarHBondContact O-CG 3.48Å; K1086-R1090 PolarHBondContact O-N 3.03Å; K1086-R1090 PolarHBondContact O-NE 3.47Å; S1087-R1090 CarbonylContact O-C 3.27Å; S1087-R1090 WeakPolarHBondContact O-CA 3.31Å; S1087-R1090 PolarHBondContact O-N 3.28Å; S1087-R1090 PolarHBondContact OG-NH2 3.38Å; R1090-L1092 PolarHBondContact O-N 3.34Å; R1090-V1093 PolarHBondContact O-N 3.4Å; R1090-V1093 VanDerWaalsContact O-N 3.12Å; R1090-E1094 WeakPolarHBondContact O-CB 3.46Å; R1090-E1094 PolarHBondContact O-N 2.89Å |
| 1091 | E | 71 | Confident | 75.2 | Confident | 114 Ų | 114 | 112.1 Ų | 112.1 | 53% | 0.533 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -53.6 | -42 | 170 | -67.7 | 150.8 | -146.5 | 0 | 0 | 111 | S1087 N1095 | S1087-E1091 WeakPolarHBondContact O-CG 3.48Å; S1087-E1091 PolarHBondContact O-N 3.44Å; E1091-N1095 WeakPolarHBondContact O-CB 3.48Å; E1091-N1095 PolarHBondContact O-N 2.74Å; E1091-N1095 PolarHBondContact O-ND2 3.48Å |
| 1092 | L | 68.6 | Low | 74.3 | Confident | 112 Ų | 112 | 109.8 Ų | 109.8 | 59% | 0.586 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -71.8 | -32.7 | 177.6 | -167.7 | 64.7 | 0 | 0 | 0 | 114.4 | R1088 R1089 R1090 N1095 T1096 | R1088-L1092 WeakPolarHBondContact O-CB 3.37Å; R1088-L1092 PolarHBondContact O-N 2.98Å; R1088-L1092 VanDerWaalsContact O-N 3.1Å; R1089-L1092 PolarHBondContact O-N 2.92Å; R1090-L1092 PolarHBondContact O-N 3.34Å; L1092-N1095 CarbonylContact O-C 3.46Å; L1092-N1095 WeakPolarHBondContact O-CB 3.45Å; L1092-T1096 PolarHBondContact O-N 3.42Å; L1092-T1096 VanDerWaalsContact O-N 3.17Å; L1092-T1096 PolarHBondContact O-OG1 3.33Å |
| 1093 | V | 69.6 | Low | 73.5 | Confident | 75 Ų | 75 | 111.9 Ų | 111.9 | 46% | 0.455 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -91.7 | -26 | -177.2 | 172.4 | 0 | 0 | 0 | 0 | 112.8 | R1089 R1090 N1095 T1096 | R1089-V1093 WeakPolarHBondContact O-CB 3.44Å; R1089-V1093 VanDerWaalsContact O-CG2 3.29Å; R1089-V1093 WeakPolarHBondContact O-CG2 3.47Å; R1089-V1093 PolarHBondContact O-N 2.91Å; R1090-V1093 PolarHBondContact O-N 3.4Å; R1090-V1093 VanDerWaalsContact O-N 3.12Å; V1093-N1095 PolarHBondContact O-N 3.15Å; V1093-T1096 CarbonylContact O-C 3.6Å; V1093-T1096 VanDerWaalsContact O-C 3.27Å; V1093-T1096 PolarHBondContact O-N 2.7Å |
| 1094 | E | 60.1 | Low | 73 | Confident | 172 Ų | 172 | 115.6 Ų | 115.6 | 80% | 0.804 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -63.1 | -29.3 | 162 | -170.8 | 165.1 | -168.9 | 0 | 0 | 110.2 | R1090 | R1090-E1094 WeakPolarHBondContact O-CB 3.46Å; R1090-E1094 PolarHBondContact O-N 2.89Å |
| 1095 | N | 56.9 | Low | 72.5 | Confident | 135 Ų | 135 | 116.2 Ų | 116.2 | 72% | 0.722 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -6.1 | 167.2 | -74.8 | -56.2 | 0 | 0 | 0 | 115 | E1091 L1092 V1093 | E1091-N1095 WeakPolarHBondContact O-CB 3.48Å; E1091-N1095 PolarHBondContact O-N 2.74Å; E1091-N1095 PolarHBondContact O-ND2 3.48Å; L1092-N1095 CarbonylContact O-C 3.46Å; L1092-N1095 WeakPolarHBondContact O-CB 3.45Å; V1093-N1095 PolarHBondContact O-N 3.15Å |
| 1096 | T | 59 | Low | 72.1 | Confident | 79 Ų | 79 | 120.2 Ų | 120.2 | 49% | 0.485 | 58% | 0.578 | S | S | . | * | S | Bend | trans | -145.4 | 111.4 | -178.9 | 50.5 | 0 | 0 | 0 | 0 | 114.5 | L1092 V1093 | L1092-T1096 PolarHBondContact O-N 3.42Å; L1092-T1096 VanDerWaalsContact O-N 3.17Å; L1092-T1096 PolarHBondContact O-OG1 3.33Å; V1093-T1096 CarbonylContact O-C 3.6Å; V1093-T1096 VanDerWaalsContact O-C 3.27Å; V1093-T1096 PolarHBondContact O-N 2.7Å |
| 1097 | Q | 47.9 | Very low | 71.9 | Confident | 197 Ų | 197 | 121.7 Ų | 121.7 | 92% | 0.921 | 59% | 0.587 | S | S | * | * | trans | -72.7 | 145.1 | -173.6 | -169.2 | 166.3 | -18.3 | 0 | 0 | 113.8 | ||||
| 1098 | K | 57.5 | Low | 72.1 | Confident | 183 Ų | 183 | 123.9 Ų | 123.9 | 80% | 0.796 | 59% | 0.593 | S | S | * | * | trans | -71.3 | 150.1 | -176 | -64.9 | -174.9 | 178 | -175.7 | 0 | 113.9 | ||||
| 1099 | D | 57.6 | Low | 72.1 | Confident | 109 Ų | 109 | 122 Ų | 122 | 58% | 0.583 | 59% | 0.594 | S | S | * | * | trans | -107.4 | 154.3 | 179.4 | -177.2 | 27.4 | 0 | 0 | 0 | 113.7 | H1101 T1102 | D1099-H1101 PolarHBondContact O-N 3.22Å; D1099-T1102 PolarHBondContact O-N 3.02Å | ||
| 1100 | S | 71.3 | Confident | 72.1 | Confident | 86 Ų | 86 | 119.8 Ų | 119.8 | 60% | 0.601 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -48.1 | -42.6 | 179.2 | 57.7 | 0 | 0 | 0 | 0 | 115.8 | T1102 L1103 | S1100-T1102 PolarHBondContact O-N 3.39Å; S1100-L1103 PolarHBondContact O-N 2.89Å; S1100-L1103 VanDerWaalsContact O-N 3.09Å |
| 1101 | H | 77.8 | Confident | 72.5 | Confident | 116 Ų | 116 | 116 Ų | 116 | 54% | 0.537 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -60.2 | -32 | -175.9 | -179.6 | 33.3 | 0 | 0 | 0 | 112.7 | D1099 L1103 Y1104 L1105 | D1099-H1101 PolarHBondContact O-N 3.22Å; H1101-L1103 VanDerWaalsContact C-N 3.31Å; H1101-L1103 PolarHBondContact O-N 2.93Å; H1101-Y1104 PolarHBondContact O-N 3.48Å; H1101-L1105 PolarHBondContact O-N 3.44Å |
| 1102 | T | 76.5 | Confident | 73.5 | Confident | 86 Ų | 86 | 115.7 Ų | 115.7 | 53% | 0.528 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.9 | -35.7 | 177.9 | -52.5 | 0 | 0 | 0 | 0 | 112.5 | D1099 S1100 E1106 | D1099-T1102 PolarHBondContact O-N 3.02Å; S1100-T1102 PolarHBondContact O-N 3.39Å; T1102-E1106 PolarHBondContact O-N 2.88Å |
| 1103 | L | 77.7 | Confident | 74.6 | Confident | 118 Ų | 118 | 115.8 Ų | 115.8 | 62% | 0.618 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -73.5 | -31.6 | -179.6 | -62.7 | 173.5 | 0 | 0 | 0 | 112.5 | S1100 H1101 E1106 Q1107 | S1100-L1103 PolarHBondContact O-N 2.89Å; S1100-L1103 VanDerWaalsContact O-N 3.09Å; H1101-L1103 VanDerWaalsContact C-N 3.31Å; H1101-L1103 PolarHBondContact O-N 2.93Å; L1103-E1106 PolarHBondContact O-N 2.72Å; L1103-Q1107 PolarHBondContact O-N 3.33Å |
| 1104 | Y | 81.3 | Confident | 75.6 | Confident | 129 Ų | 129 | 116.3 Ų | 116.3 | 51% | 0.506 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -66 | -45.4 | 176.4 | 177 | -94.4 | 0 | 0 | 0 | 111.6 | H1101 E1106 Q1107 E1108 | H1101-Y1104 PolarHBondContact O-N 3.48Å; Y1104-E1106 VanDerWaalsContact C-N 3.27Å; Y1104-E1106 PolarHBondContact O-N 3.1Å; Y1104-Q1107 WeakPolarHBondContact O-CB 3.48Å; Y1104-Q1107 PolarHBondContact O-N 2.97Å; Y1104-Q1107 VanDerWaalsContact O-N 3.12Å; Y1104-E1108 HydrophobicContact CD1-CG 4.4Å; Y1104-E1108 HydrophobicContact CE1-CG 3.81Å; Y1104-E1108 WeakPolarHBondContact CE1-OE1 3.06Å; Y1104-E1108 WeakPolarHBondContact CE1-OE2 3.29Å; Y1104-E1108 VanDerWaalsContact CZ-OE1 3.27Å; Y1104-E1108 PolarHBondContact O-N 3.21Å; Y1104-E1108 VanDerWaalsContact O-N 3.13Å; Y1104-E1108 PolarHBondContact OH-OE1 2.77Å |
| 1105 | L | 81.8 | Confident | 77.3 | Confident | 76 Ų | 76 | 111.6 Ų | 111.6 | 40% | 0.398 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.2 | -34.2 | 177.2 | -66.1 | 171 | 0 | 0 | 0 | 112.2 | H1101 Q1107 E1108 L1109 | H1101-L1105 PolarHBondContact O-N 3.44Å; L1105-Q1107 VanDerWaalsContact C-N 3.31Å; L1105-Q1107 PolarHBondContact O-N 2.89Å; L1105-E1108 PolarHBondContact O-N 2.88Å; L1105-L1109 VanDerWaalsContact O-CG 3.32Å; L1105-L1109 WeakPolarHBondContact O-CG 3.29Å; L1105-L1109 PolarHBondContact O-N 2.7Å; L1105-L1109 VanDerWaalsContact O-N 3.15Å |
| 1106 | E | 80 | Confident | 79 | Confident | 127 Ų | 127 | 111.1 Ų | 111.1 | 59% | 0.593 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.2 | -36.5 | 174.7 | -166.2 | 164.2 | -157.2 | 0 | 0 | 111.7 | T1102 L1103 Y1104 E1110 | T1102-E1106 PolarHBondContact O-N 2.88Å; L1103-E1106 PolarHBondContact O-N 2.72Å; Y1104-E1106 VanDerWaalsContact C-N 3.27Å; Y1104-E1106 PolarHBondContact O-N 3.1Å; E1106-E1110 PolarHBondContact O-N 2.9Å |
| 1107 | Q | 83.6 | Confident | 80.5 | Confident | 143 Ų | 143 | 112.1 Ų | 112.1 | 67% | 0.668 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -71.1 | -39.5 | 174.7 | -172.2 | 177.8 | 0.9 | 0 | 0 | 113.2 | L1103 Y1104 L1105 L1109 E1110 S1111 | L1103-Q1107 PolarHBondContact O-N 3.33Å; Y1104-Q1107 WeakPolarHBondContact O-CB 3.48Å; Y1104-Q1107 PolarHBondContact O-N 2.97Å; Y1104-Q1107 VanDerWaalsContact O-N 3.12Å; L1105-Q1107 VanDerWaalsContact C-N 3.31Å; L1105-Q1107 PolarHBondContact O-N 2.89Å; Q1107-L1109 VanDerWaalsContact C-N 3.33Å; Q1107-L1109 PolarHBondContact O-N 3.31Å; Q1107-E1110 PolarHBondContact O-N 2.92Å; Q1107-S1111 PolarHBondContact O-N 3.02Å; Q1107-S1111 VanDerWaalsContact O-N 3.1Å |
| 1108 | E | 87.2 | Confident | 82.5 | Confident | 82 Ų | 82 | 108.2 Ų | 108.2 | 38% | 0.383 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.7 | -38.5 | 176.4 | -70.1 | -170.2 | 140.2 | 0 | 0 | 112.1 | Y1104 L1105 S1111 L1112 | Y1104-E1108 HydrophobicContact CD1-CG 4.4Å; Y1104-E1108 HydrophobicContact CE1-CG 3.81Å; Y1104-E1108 WeakPolarHBondContact CE1-OE1 3.06Å; Y1104-E1108 WeakPolarHBondContact CE1-OE2 3.29Å; Y1104-E1108 VanDerWaalsContact CZ-OE1 3.27Å; Y1104-E1108 PolarHBondContact O-N 3.21Å; Y1104-E1108 VanDerWaalsContact O-N 3.13Å; Y1104-E1108 PolarHBondContact OH-OE1 2.77Å; L1105-E1108 PolarHBondContact O-N 2.88Å; E1108-S1111 WeakPolarHBondContact O-CB 3.38Å; E1108-S1111 PolarHBondContact O-N 3.44Å; E1108-L1112 PolarHBondContact O-N 2.85Å |
| 1109 | L | 86.4 | Confident | 84.3 | Confident | 118 Ų | 118 | 105.1 Ų | 105.1 | 62% | 0.618 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -65.7 | -41.3 | 176.4 | -70.3 | 170.2 | 0 | 0 | 0 | 112.6 | L1105 Q1107 S1111 L1112 K1113 | L1105-L1109 VanDerWaalsContact O-CG 3.32Å; L1105-L1109 WeakPolarHBondContact O-CG 3.29Å; L1105-L1109 PolarHBondContact O-N 2.7Å; L1105-L1109 VanDerWaalsContact O-N 3.15Å; Q1107-L1109 VanDerWaalsContact C-N 3.33Å; Q1107-L1109 PolarHBondContact O-N 3.31Å; L1109-S1111 VanDerWaalsContact C-N 3.3Å; L1109-S1111 PolarHBondContact O-N 2.93Å; L1109-L1112 PolarHBondContact O-N 2.88Å; L1109-K1113 WeakPolarHBondContact O-CB 3.31Å; L1109-K1113 PolarHBondContact O-N 3.38Å |
| 1110 | E | 83.8 | Confident | 86 | Confident | 99 Ų | 99 | 103.7 Ų | 103.7 | 46% | 0.463 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -67.3 | -31.4 | 176.3 | -168.1 | 63.5 | -159.1 | 0 | 0 | 111.8 | E1106 Q1107 K1113 V1114 | E1106-E1110 PolarHBondContact O-N 2.9Å; Q1107-E1110 PolarHBondContact O-N 2.92Å; E1110-K1113 WeakPolarHBondContact O-CB 3.41Å; E1110-K1113 WeakPolarHBondContact OE1-CD 3.24Å; E1110-K1113 IonicContact OE1-NZ 2.66Å; E1110-K1113 PolarHBondContact OE1-NZ 3.28Å; E1110-K1113 WeakPolarHBondContact OE2-CD 3.45Å; E1110-K1113 IonicContact OE2-NZ 2.69Å; E1110-K1113 PolarHBondContact OE2-NZ 3.32Å; E1110-V1114 PolarHBondContact O-N 2.98Å |
| 1111 | S | 87.7 | Confident | 87 | Confident | 79 Ų | 79 | 105.4 Ų | 105.4 | 55% | 0.552 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.8 | -48.8 | 171.6 | -174.4 | 0 | 0 | 0 | 0 | 112.4 | Q1107 E1108 L1109 K1113 V1114 V1115 | Q1107-S1111 PolarHBondContact O-N 3.02Å; Q1107-S1111 VanDerWaalsContact O-N 3.1Å; E1108-S1111 WeakPolarHBondContact O-CB 3.38Å; E1108-S1111 PolarHBondContact O-N 3.44Å; L1109-S1111 VanDerWaalsContact C-N 3.3Å; L1109-S1111 PolarHBondContact O-N 2.93Å; S1111-K1113 VanDerWaalsContact C-N 3.28Å; S1111-K1113 PolarHBondContact O-N 3.37Å; S1111-V1114 PolarHBondContact O-N 2.97Å; S1111-V1115 PolarHBondContact O-N 2.86Å |
| 1112 | L | 92.3 | Very high | 87.8 | Confident | 109 Ų | 109 | 104.2 Ų | 104.2 | 57% | 0.571 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.1 | -38 | 177.6 | -80.9 | 161.9 | 0 | 0 | 0 | 112.8 | E1108 L1109 V1114 V1115 L1116 | E1108-L1112 PolarHBondContact O-N 2.85Å; L1109-L1112 PolarHBondContact O-N 2.88Å; L1112-V1114 PolarHBondContact O-N 3.47Å; L1112-V1115 PolarHBondContact O-N 3.35Å; L1112-L1116 PolarHBondContact O-N 3.47Å |
| 1113 | K | 90.9 | Very high | 88.6 | Confident | 114 Ų | 114 | 104.9 Ų | 104.9 | 50% | 0.496 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59 | -40.9 | 176.5 | 177.8 | -165.7 | -179.2 | -168.4 | 0 | 112.7 | L1109 E1110 S1111 L1116 E1117 | L1109-K1113 WeakPolarHBondContact O-CB 3.31Å; L1109-K1113 PolarHBondContact O-N 3.38Å; E1110-K1113 WeakPolarHBondContact O-CB 3.41Å; E1110-K1113 WeakPolarHBondContact OE1-CD 3.24Å; E1110-K1113 IonicContact OE1-NZ 2.66Å; E1110-K1113 PolarHBondContact OE1-NZ 3.28Å; E1110-K1113 WeakPolarHBondContact OE2-CD 3.45Å; E1110-K1113 IonicContact OE2-NZ 2.69Å; E1110-K1113 PolarHBondContact OE2-NZ 3.32Å; S1111-K1113 VanDerWaalsContact C-N 3.28Å; S1111-K1113 PolarHBondContact O-N 3.37Å; K1113-L1116 PolarHBondContact O-N 3.04Å; K1113-E1117 PolarHBondContact O-N 3.29Å |
| 1114 | V | 90.8 | Very high | 89.4 | Confident | 85 Ų | 85 | 103.7 Ų | 103.7 | 52% | 0.515 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.5 | -39.6 | 176.7 | 176.2 | 0 | 0 | 0 | 0 | 111.5 | E1110 S1111 L1112 E1117 M1118 | E1110-V1114 PolarHBondContact O-N 2.98Å; S1111-V1114 PolarHBondContact O-N 2.97Å; L1112-V1114 PolarHBondContact O-N 3.47Å; V1114-E1117 PolarHBondContact O-N 3.07Å; V1114-M1118 PolarHBondContact O-N 3.42Å |
| 1115 | V | 94.7 | Very high | 90 | Very high | 73 Ų | 73 | 102.1 Ų | 102.1 | 44% | 0.442 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.6 | -40.3 | 176.3 | -179.2 | 0 | 0 | 0 | 0 | 111.1 | S1111 L1112 M1118 K1119 | S1111-V1115 PolarHBondContact O-N 2.86Å; L1112-V1115 PolarHBondContact O-N 3.35Å; V1115-M1118 PolarHBondContact O-N 3.39Å; V1115-K1119 WeakPolarHBondContact O-CG 3.35Å; V1115-K1119 PolarHBondContact O-N 2.85Å |
| 1116 | L | 92.4 | Very high | 90.5 | Very high | 126 Ų | 126 | 104.4 Ų | 104.4 | 66% | 0.66 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.8 | -44.6 | 172.6 | -88.5 | 162.4 | 0 | 0 | 0 | 112.3 | L1112 K1113 M1118 K1119 N1120 | L1112-L1116 PolarHBondContact O-N 3.47Å; K1113-L1116 PolarHBondContact O-N 3.04Å; L1116-M1118 PolarHBondContact O-N 3.34Å; L1116-K1119 PolarHBondContact O-N 2.91Å; L1116-N1120 WeakPolarHBondContact O-CB 3.38Å; L1116-N1120 PolarHBondContact O-N 2.89Å |
| 1117 | E | 90.4 | Very high | 91.1 | Very high | 100 Ų | 100 | 103.6 Ų | 103.6 | 47% | 0.467 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.9 | -42.4 | 176.8 | -161.4 | -162.5 | 163.7 | 0 | 0 | 111.6 | K1113 V1114 N1120 K1121 | K1113-E1117 PolarHBondContact O-N 3.29Å; V1114-E1117 PolarHBondContact O-N 3.07Å; E1117-N1120 PolarHBondContact O-N 3.17Å; E1117-K1121 WeakPolarHBondContact O-CG 3.47Å; E1117-K1121 PolarHBondContact O-N 2.83Å; E1117-K1121 WeakPolarHBondContact OE1-CE 3.41Å; E1117-K1121 IonicContact OE1-NZ 3.69Å; E1117-K1121 PolarHBondContact OE1-NZ 3.02Å; E1117-K1121 IonicContact OE2-NZ 2.64Å |
| 1118 | M | 91.8 | Very high | 91.7 | Very high | 115 Ų | 115 | 103 Ų | 103 | 57% | 0.567 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62 | -43.3 | 175.2 | -178.6 | 174.4 | 61.5 | 0 | 0 | 112 | V1114 V1115 L1116 K1121 Q1122 | V1114-M1118 PolarHBondContact O-N 3.42Å; V1115-M1118 PolarHBondContact O-N 3.39Å; L1116-M1118 PolarHBondContact O-N 3.34Å; M1118-K1121 PolarHBondContact O-N 3.46Å; M1118-Q1122 PolarHBondContact O-N 3.17Å |
| 1119 | K | 94.3 | Very high | 92 | Very high | 117 Ų | 117 | 105.8 Ų | 105.8 | 51% | 0.509 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68.5 | -35.7 | 177.1 | -73.2 | -72 | 168.5 | -167.4 | 0 | 112.6 | V1115 L1116 Q1122 L1123 | V1115-K1119 WeakPolarHBondContact O-CG 3.35Å; V1115-K1119 PolarHBondContact O-N 2.85Å; L1116-K1119 PolarHBondContact O-N 2.91Å; K1119-Q1122 WeakPolarHBondContact O-CB 3.5Å; K1119-Q1122 PolarHBondContact O-N 2.91Å; K1119-L1123 PolarHBondContact O-N 2.92Å |
| 1120 | N | 93.4 | Very high | 92.5 | Very high | 80 Ų | 80 | 106.2 Ų | 106.2 | 43% | 0.428 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.3 | -43 | 173.2 | 178.5 | -86.4 | 0 | 0 | 0 | 112 | L1116 E1117 Q1122 L1123 H1124 | L1116-N1120 WeakPolarHBondContact O-CB 3.38Å; L1116-N1120 PolarHBondContact O-N 2.89Å; E1117-N1120 PolarHBondContact O-N 3.17Å; N1120-Q1122 VanDerWaalsContact C-N 3.3Å; N1120-Q1122 PolarHBondContact O-N 3.37Å; N1120-L1123 WeakPolarHBondContact O-CB 3.28Å; N1120-L1123 PolarHBondContact O-N 2.67Å; N1120-H1124 PolarHBondContact O-CD2 3.06Å; N1120-H1124 PolarHBondContact O-N 2.71Å; N1120-H1124 PolarHBondContact OD1-CD2 3.33Å; N1120-H1124 VanDerWaalsContact OD1-CD2 3.26Å; N1120-H1124 PolarHBondContact OD1-NE2 3.34Å |
| 1121 | K | 92.9 | Very high | 93 | Very high | 121 Ų | 121 | 106.2 Ų | 106.2 | 53% | 0.526 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.7 | -38.7 | 171.6 | -72 | 167.3 | -177 | 167.8 | 0 | 112.3 | E1117 M1118 K1125 | E1117-K1121 WeakPolarHBondContact O-CG 3.47Å; E1117-K1121 PolarHBondContact O-N 2.83Å; E1117-K1121 WeakPolarHBondContact OE1-CE 3.41Å; E1117-K1121 IonicContact OE1-NZ 3.69Å; E1117-K1121 PolarHBondContact OE1-NZ 3.02Å; E1117-K1121 IonicContact OE2-NZ 2.64Å; M1118-K1121 PolarHBondContact O-N 3.46Å; K1121-K1125 PolarHBondContact O-N 3.42Å; K1121-K1125 VanDerWaalsContact O-N 3.16Å |
| 1122 | Q | 93.4 | Very high | 93.3 | Very high | 91 Ų | 91 | 105.4 Ų | 105.4 | 43% | 0.425 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.5 | -41.9 | 174.8 | -168.9 | 172 | 27 | 0 | 0 | 112 | M1118 K1119 N1120 K1125 Q1126 | M1118-Q1122 PolarHBondContact O-N 3.17Å; K1119-Q1122 WeakPolarHBondContact O-CB 3.5Å; K1119-Q1122 PolarHBondContact O-N 2.91Å; N1120-Q1122 VanDerWaalsContact C-N 3.3Å; N1120-Q1122 PolarHBondContact O-N 3.37Å; Q1122-K1125 PolarHBondContact O-N 2.93Å; Q1122-Q1126 PolarHBondContact O-N 3.25Å; Q1122-Q1126 VanDerWaalsContact O-N 3.15Å |
| 1123 | L | 94.3 | Very high | 93.4 | Very high | 100 Ų | 100 | 104.2 Ų | 104.2 | 52% | 0.524 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.4 | -52.6 | 175.1 | -171.6 | 82 | 0 | 0 | 0 | 111.4 | K1119 N1120 K1125 Q1126 E1127 | K1119-L1123 PolarHBondContact O-N 2.92Å; N1120-L1123 WeakPolarHBondContact O-CB 3.28Å; N1120-L1123 PolarHBondContact O-N 2.67Å; L1123-K1125 PolarHBondContact O-N 2.83Å; L1123-Q1126 WeakPolarHBondContact O-CA 3.43Å; L1123-Q1126 WeakPolarHBondContact O-CB 3.25Å; L1123-Q1126 PolarHBondContact O-N 3.32Å; L1123-E1127 WeakPolarHBondContact O-CB 3.44Å; L1123-E1127 PolarHBondContact O-N 2.65Å |
| 1124 | H | 94.1 | Very high | 93.6 | Very high | 94 Ų | 94 | 100 Ų | 100 | 44% | 0.435 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.3 | -30 | 179.2 | -71.7 | -47.8 | 0 | 0 | 0 | 113 | N1120 E1127 K1128 | N1120-H1124 PolarHBondContact O-CD2 3.06Å; N1120-H1124 PolarHBondContact O-N 2.71Å; N1120-H1124 PolarHBondContact OD1-CD2 3.33Å; N1120-H1124 VanDerWaalsContact OD1-CD2 3.26Å; N1120-H1124 PolarHBondContact OD1-NE2 3.34Å; H1124-E1127 IonicContact CE1-OE2 2.74Å; H1124-E1127 IonicContact CG-OE2 2.71Å; H1124-E1127 IonicContact ND1-OE2 2.67Å; H1124-E1127 PolarHBondContact ND1-OE2 3.14Å; H1124-K1128 WeakPolarHBondContact O-CB 3.49Å; H1124-K1128 PolarHBondContact O-N 3.05Å |
| 1125 | K | 93.8 | Very high | 93.9 | Very high | 96 Ų | 96 | 100.3 Ų | 100.3 | 42% | 0.417 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -68.5 | -33 | 172.6 | -170.6 | 173.2 | 178.8 | 175.2 | 0 | 112.3 | E310 K1121 Q1122 L1123 K1129 | E310-K1125 IonicContact OE1-NZ 2.68Å; E310-K1125 PolarHBondContact OE1-NZ 3.24Å; E310-K1125 IonicContact OE2-NZ 3.57Å; E310-K1125 PolarHBondContact OE2-NZ 2.91Å; K1121-K1125 PolarHBondContact O-N 3.42Å; K1121-K1125 VanDerWaalsContact O-N 3.16Å; Q1122-K1125 PolarHBondContact O-N 2.93Å; L1123-K1125 PolarHBondContact O-N 2.83Å; K1125-K1129 WeakPolarHBondContact O-CG 3.41Å |
| 1126 | Q | 93 | Very high | 94 | Very high | 123 Ų | 123 | 102.4 Ų | 102.4 | 58% | 0.575 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -76.4 | -44.2 | 173.1 | -69.8 | 178.4 | -26.3 | 0 | 0 | 111.9 | Q1122 L1123 K1128 K1129 L1130 | Q1122-Q1126 PolarHBondContact O-N 3.25Å; Q1122-Q1126 VanDerWaalsContact O-N 3.15Å; L1123-Q1126 WeakPolarHBondContact O-CA 3.43Å; L1123-Q1126 WeakPolarHBondContact O-CB 3.25Å; L1123-Q1126 PolarHBondContact O-N 3.32Å; Q1126-K1128 VanDerWaalsContact C-N 3.32Å; Q1126-K1128 PolarHBondContact O-N 2.99Å; Q1126-K1129 WeakPolarHBondContact O-CB 3.22Å; Q1126-K1129 PolarHBondContact O-N 3.5Å; Q1126-K1129 VanDerWaalsContact O-N 3.08Å; Q1126-L1130 PolarHBondContact O-N 3.2Å |
| 1127 | E | 92.7 | Very high | 94.1 | Very high | 110 Ų | 110 | 100 Ų | 100 | 51% | 0.514 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -56.3 | -43.4 | 175.8 | -175.9 | 179.4 | -147.9 | 0 | 0 | 111.9 | L1123 H1124 K1129 L1130 M1131 | L1123-E1127 WeakPolarHBondContact O-CB 3.44Å; L1123-E1127 PolarHBondContact O-N 2.65Å; H1124-E1127 IonicContact CE1-OE2 2.74Å; H1124-E1127 IonicContact CG-OE2 2.71Å; H1124-E1127 IonicContact ND1-OE2 2.67Å; H1124-E1127 PolarHBondContact ND1-OE2 3.14Å; E1127-K1129 PolarHBondContact O-N 2.9Å; E1127-L1130 WeakPolarHBondContact O-CB 3.45Å; E1127-L1130 PolarHBondContact O-N 3.47Å; E1127-M1131 PolarHBondContact O-N 3.17Å |
| 1128 | K | 95.1 | Very high | 94.4 | Very high | 132 Ų | 132 | 99.7 Ų | 99.7 | 57% | 0.574 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.3 | -44.3 | 173.6 | -175.6 | 175.6 | 179 | -179.8 | 0 | 112.5 | H1124 Q1126 L1130 M1131 D1132 | H1124-K1128 WeakPolarHBondContact O-CB 3.49Å; H1124-K1128 PolarHBondContact O-N 3.05Å; Q1126-K1128 VanDerWaalsContact C-N 3.32Å; Q1126-K1128 PolarHBondContact O-N 2.99Å; K1128-L1130 VanDerWaalsContact C-N 3.34Å; K1128-L1130 PolarHBondContact O-N 2.92Å; K1128-M1131 HydrophobicContact CB-CE 4.5Å; K1128-M1131 HydrophobicContact CG-CE 4.08Å; K1128-M1131 PolarHBondContact O-N 3.37Å; K1128-D1132 PolarHBondContact O-N 2.91Å |
| 1129 | K | 94.7 | Very high | 94.6 | Very high | 139 Ų | 139 | 100.1 Ų | 100.1 | 60% | 0.604 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62 | -41.5 | 175.5 | -72.7 | -179.5 | 176.9 | -173.7 | 0 | 111.4 | K1125 Q1126 E1127 D1132 V1133 | K1125-K1129 WeakPolarHBondContact O-CG 3.41Å; Q1126-K1129 WeakPolarHBondContact O-CB 3.22Å; Q1126-K1129 PolarHBondContact O-N 3.5Å; Q1126-K1129 VanDerWaalsContact O-N 3.08Å; E1127-K1129 PolarHBondContact O-N 2.9Å; K1129-D1132 PolarHBondContact O-N 3.5Å; K1129-V1133 WeakPolarHBondContact O-CG2 3.36Å; K1129-V1133 PolarHBondContact O-N 2.9Å |
| 1130 | L | 95.1 | Very high | 94.6 | Very high | 128 Ų | 128 | 100.4 Ų | 100.4 | 67% | 0.67 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -63 | -44.7 | 178.2 | -172.1 | 67.4 | 0 | 0 | 0 | 111.6 | Q1126 E1127 K1128 D1132 V1133 G1134 | Q1126-L1130 PolarHBondContact O-N 3.2Å; E1127-L1130 WeakPolarHBondContact O-CB 3.45Å; E1127-L1130 PolarHBondContact O-N 3.47Å; K1128-L1130 VanDerWaalsContact C-N 3.34Å; K1128-L1130 PolarHBondContact O-N 2.92Å; L1130-D1132 VanDerWaalsContact C-N 3.33Å; L1130-D1132 PolarHBondContact O-N 3.01Å; L1130-V1133 PolarHBondContact O-N 3.49Å; L1130-G1134 PolarHBondContact O-N 2.91Å |
| 1131 | M | 94.9 | Very high | 94.8 | Very high | 98 Ų | 98 | 100 Ų | 100 | 48% | 0.483 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.6 | -42.3 | 173 | 166.3 | -179 | 47.4 | 0 | 0 | 112.2 | E1127 K1128 G1134 K1135 | E1127-M1131 PolarHBondContact O-N 3.17Å; K1128-M1131 HydrophobicContact CB-CE 4.5Å; K1128-M1131 HydrophobicContact CG-CE 4.08Å; K1128-M1131 PolarHBondContact O-N 3.37Å; M1131-G1134 PolarHBondContact O-N 2.87Å; M1131-K1135 VanDerWaalsContact CG-CE 3.45Å; M1131-K1135 WeakPolarHBondContact O-CG 3.28Å; M1131-K1135 PolarHBondContact O-N 3.02Å; M1131-K1135 VanDerWaalsContact O-N 3.1Å; M1131-K1135 PolarHBondContact SD-NZ 2.92Å; M1131-K1135 VanDerWaalsContact SD-NZ 3.43Å |
| 1132 | D | 94.3 | Very high | 95 | Very high | 63 Ų | 63 | 99.8 Ų | 99.8 | 34% | 0.337 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -72.7 | -29.9 | -179.5 | -68.7 | -27.8 | 0 | 0 | 0 | 112.3 | K1128 K1129 L1130 K1135 L1136 | K1128-D1132 PolarHBondContact O-N 2.91Å; K1129-D1132 PolarHBondContact O-N 3.5Å; L1130-D1132 VanDerWaalsContact C-N 3.33Å; L1130-D1132 PolarHBondContact O-N 3.01Å; D1132-K1135 IonicContact OD1-NZ 3.14Å; D1132-K1135 PolarHBondContact OD1-NZ 3.29Å; D1132-L1136 WeakPolarHBondContact O-CG 3.31Å; D1132-L1136 PolarHBondContact O-N 3.28Å |
| 1133 | V | 95.4 | Very high | 95.1 | Very high | 83 Ų | 83 | 101 Ų | 101 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.1 | -38.6 | 167.5 | 170.5 | 0 | 0 | 0 | 0 | 111.6 | K1129 L1130 L1136 T1137 | K1129-V1133 WeakPolarHBondContact O-CG2 3.36Å; K1129-V1133 PolarHBondContact O-N 2.9Å; L1130-V1133 PolarHBondContact O-N 3.49Å; V1133-L1136 PolarHBondContact O-N 3.03Å; V1133-T1137 PolarHBondContact O-N 3.38Å; V1133-T1137 PolarHBondContact O-OG1 3.38Å |
| 1134 | G | 94.8 | Very high | 95.2 | Very high | 26 Ų | 26 | 99.3 Ų | 99.3 | 27% | 0.268 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -54.8 | -55.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | L1130 M1131 L1136 T1137 D1138 | L1130-G1134 PolarHBondContact O-N 2.91Å; M1131-G1134 PolarHBondContact O-N 2.87Å; G1134-L1136 PolarHBondContact O-N 3.43Å; G1134-L1136 VanDerWaalsContact O-N 3.11Å; G1134-T1137 CarbonylContact O-C 3.59Å; G1134-T1137 WeakPolarHBondContact O-CA 3.49Å; G1134-T1137 VanDerWaalsContact O-CB 3.27Å; G1134-T1137 WeakPolarHBondContact O-CB 3.18Å; G1134-T1137 PolarHBondContact O-N 3.43Å; G1134-D1138 VanDerWaalsContact O-CG 3.27Å; G1134-D1138 PolarHBondContact O-N 3.25Å |
| 1135 | K | 96.2 | Very high | 95.3 | Very high | 92 Ų | 92 | 100.1 Ų | 100.1 | 40% | 0.4 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -56.5 | -30.5 | 177.6 | -64.5 | 166.3 | -165.1 | 158.9 | 0 | 114.2 | M1131 D1132 K1139 | M1131-K1135 VanDerWaalsContact CG-CE 3.45Å; M1131-K1135 WeakPolarHBondContact O-CG 3.28Å; M1131-K1135 PolarHBondContact O-N 3.02Å; M1131-K1135 VanDerWaalsContact O-N 3.1Å; M1131-K1135 PolarHBondContact SD-NZ 2.92Å; M1131-K1135 VanDerWaalsContact SD-NZ 3.43Å; D1132-K1135 IonicContact OD1-NZ 3.14Å; D1132-K1135 PolarHBondContact OD1-NZ 3.29Å; K1135-K1139 WeakPolarHBondContact O-CD 3.45Å; K1135-K1139 VanDerWaalsContact O-CG 3.27Å; K1135-K1139 WeakPolarHBondContact O-CG 3.42Å; K1135-K1139 PolarHBondContact O-N 3.1Å |
| 1136 | L | 96.4 | Very high | 95.5 | Very high | 116 Ų | 116 | 101.3 Ų | 101.3 | 61% | 0.607 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -76.5 | -33.9 | 174.7 | -72.1 | 171.2 | 0 | 0 | 0 | 111.8 | D1132 V1133 G1134 K1140 | D1132-L1136 WeakPolarHBondContact O-CG 3.31Å; D1132-L1136 PolarHBondContact O-N 3.28Å; V1133-L1136 PolarHBondContact O-N 3.03Å; G1134-L1136 PolarHBondContact O-N 3.43Å; G1134-L1136 VanDerWaalsContact O-N 3.11Å; L1136-K1140 PolarHBondContact O-N 3.02Å |
| 1137 | T | 95.3 | Very high | 95.7 | Very high | 75 Ų | 75 | 100.6 Ų | 100.6 | 46% | 0.46 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.5 | -46.2 | 174.9 | -52.3 | 0 | 0 | 0 | 0 | 110.7 | V1133 G1134 K1139 K1140 V1141 | V1133-T1137 PolarHBondContact O-N 3.38Å; V1133-T1137 PolarHBondContact O-OG1 3.38Å; G1134-T1137 CarbonylContact O-C 3.59Å; G1134-T1137 WeakPolarHBondContact O-CA 3.49Å; G1134-T1137 VanDerWaalsContact O-CB 3.27Å; G1134-T1137 WeakPolarHBondContact O-CB 3.18Å; G1134-T1137 PolarHBondContact O-N 3.43Å; T1137-K1139 VanDerWaalsContact C-N 3.31Å; T1137-K1139 PolarHBondContact O-N 3.46Å; T1137-K1140 WeakPolarHBondContact O-CB 3.33Å; T1137-K1140 PolarHBondContact O-N 3.46Å; T1137-V1141 PolarHBondContact O-N 3.13Å |
| 1138 | D | 95.8 | Very high | 95.9 | Very high | 94 Ų | 94 | 100.8 Ų | 100.8 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -57 | -45 | 176.8 | -55.4 | -33.5 | 0 | 0 | 0 | 111.6 | G1134 K1140 V1141 Q1142 | G1134-D1138 VanDerWaalsContact O-CG 3.27Å; G1134-D1138 PolarHBondContact O-N 3.25Å; D1138-K1140 VanDerWaalsContact C-N 3.33Å; D1138-K1140 PolarHBondContact O-N 3.16Å; D1138-V1141 PolarHBondContact O-N 3.48Å; D1138-Q1142 WeakPolarHBondContact O-CG 3.39Å; D1138-Q1142 PolarHBondContact O-N 3.24Å; D1138-Q1142 VanDerWaalsContact O-N 3.08Å |
| 1139 | K | 96.4 | Very high | 96 | Very high | 125 Ų | 125 | 99.5 Ų | 99.5 | 54% | 0.543 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.4 | -36 | 176.1 | -74.4 | 173.8 | -178.9 | -176.4 | 0 | 112.6 | K1135 T1137 Q1142 L1143 | K1135-K1139 WeakPolarHBondContact O-CD 3.45Å; K1135-K1139 VanDerWaalsContact O-CG 3.27Å; K1135-K1139 WeakPolarHBondContact O-CG 3.42Å; K1135-K1139 PolarHBondContact O-N 3.1Å; T1137-K1139 VanDerWaalsContact C-N 3.31Å; T1137-K1139 PolarHBondContact O-N 3.46Å; K1139-Q1142 PolarHBondContact O-N 3.14Å; K1139-L1143 WeakPolarHBondContact O-CG 3.36Å; K1139-L1143 PolarHBondContact O-N 2.9Å; K1139-L1143 VanDerWaalsContact O-N 3.1Å |
| 1140 | K | 95.8 | Very high | 96.1 | Very high | 122 Ų | 122 | 97.2 Ų | 97.2 | 53% | 0.53 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.8 | -47.9 | 175 | -171.3 | -171.7 | 177.2 | -66.5 | 0 | 110.5 | L1136 T1137 D1138 Q1142 L1143 D1144 | L1136-K1140 PolarHBondContact O-N 3.02Å; T1137-K1140 WeakPolarHBondContact O-CB 3.33Å; T1137-K1140 PolarHBondContact O-N 3.46Å; D1138-K1140 VanDerWaalsContact C-N 3.33Å; D1138-K1140 PolarHBondContact O-N 3.16Å; K1140-Q1142 VanDerWaalsContact C-N 3.33Å; K1140-Q1142 PolarHBondContact O-N 3.34Å; K1140-L1143 PolarHBondContact O-N 2.87Å; K1140-L1143 VanDerWaalsContact O-N 3.13Å; K1140-D1144 IonicContact NZ-OD1 2.75Å; K1140-D1144 IonicContact NZ-OD2 2.73Å; K1140-D1144 PolarHBondContact NZ-OD2 3.35Å; K1140-D1144 VanDerWaalsContact O-CG 3.32Å; K1140-D1144 PolarHBondContact O-N 2.96Å |
| 1141 | V | 96.8 | Very high | 96.1 | Very high | 71 Ų | 71 | 96.7 Ų | 96.7 | 43% | 0.43 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -58.8 | -44.3 | 178.2 | 175.8 | 0 | 0 | 0 | 0 | 111.1 | T1137 D1138 L1143 D1144 E1145 | T1137-V1141 PolarHBondContact O-N 3.13Å; D1138-V1141 PolarHBondContact O-N 3.48Å; V1141-L1143 VanDerWaalsContact C-N 3.33Å; V1141-L1143 PolarHBondContact O-N 2.76Å; V1141-D1144 PolarHBondContact O-N 2.77Å; V1141-E1145 WeakPolarHBondContact O-CG 3.01Å; V1141-E1145 PolarHBondContact O-N 3.18Å |
| 1142 | Q | 96.3 | Very high | 96.2 | Very high | 118 Ų | 118 | 97.5 Ų | 97.5 | 55% | 0.551 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.8 | -38.8 | 176 | -70.1 | 171.2 | 11.8 | 0 | 0 | 113 | D1138 K1139 K1140 M1146 | D1138-Q1142 WeakPolarHBondContact O-CG 3.39Å; D1138-Q1142 PolarHBondContact O-N 3.24Å; D1138-Q1142 VanDerWaalsContact O-N 3.08Å; K1139-Q1142 PolarHBondContact O-N 3.14Å; K1140-Q1142 VanDerWaalsContact C-N 3.33Å; K1140-Q1142 PolarHBondContact O-N 3.34Å; Q1142-M1146 WeakPolarHBondContact O-CG 3.36Å; Q1142-M1146 PolarHBondContact O-N 2.82Å |
| 1143 | L | 96.3 | Very high | 96.3 | Very high | 115 Ų | 115 | 100.2 Ų | 100.2 | 60% | 0.602 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -71.2 | -38.8 | 175.6 | -70.2 | 170.8 | 0 | 0 | 0 | 112.4 | K1139 K1140 V1141 M1146 L1147 | K1139-L1143 WeakPolarHBondContact O-CG 3.36Å; K1139-L1143 PolarHBondContact O-N 2.9Å; K1139-L1143 VanDerWaalsContact O-N 3.1Å; K1140-L1143 PolarHBondContact O-N 2.87Å; K1140-L1143 VanDerWaalsContact O-N 3.13Å; V1141-L1143 VanDerWaalsContact C-N 3.33Å; V1141-L1143 PolarHBondContact O-N 2.76Å; L1143-M1146 PolarHBondContact O-N 3.34Å; L1143-L1147 WeakPolarHBondContact O-CB 3.49Å; L1143-L1147 PolarHBondContact O-N 3.17Å |
| 1144 | D | 96.1 | Very high | 96.3 | Very high | 65 Ų | 65 | 100.1 Ų | 100.1 | 35% | 0.348 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -64.6 | -39.5 | 175.3 | -67.6 | -30.4 | 0 | 0 | 0 | 110.6 | K1140 V1141 L1147 I1148 | K1140-D1144 IonicContact NZ-OD1 2.75Å; K1140-D1144 IonicContact NZ-OD2 2.73Å; K1140-D1144 PolarHBondContact NZ-OD2 3.35Å; K1140-D1144 VanDerWaalsContact O-CG 3.32Å; K1140-D1144 PolarHBondContact O-N 2.96Å; V1141-D1144 PolarHBondContact O-N 2.77Å; D1144-L1147 PolarHBondContact O-N 2.86Å; D1144-I1148 WeakPolarHBondContact O-CD1 3.42Å; D1144-I1148 VanDerWaalsContact O-CG1 3.3Å; D1144-I1148 WeakPolarHBondContact O-CG1 3.35Å; D1144-I1148 PolarHBondContact O-N 3.36Å; D1144-I1148 VanDerWaalsContact O-N 3.1Å |
| 1145 | E | 97.1 | Very high | 96.4 | Very high | 111 Ų | 111 | 103.4 Ų | 103.4 | 52% | 0.519 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.8 | -45.4 | 172.1 | -75.9 | 179 | -164.4 | 0 | 0 | 112.7 | V1141 L1147 I1148 K1149 | V1141-E1145 WeakPolarHBondContact O-CG 3.01Å; V1141-E1145 PolarHBondContact O-N 3.18Å; E1145-L1147 VanDerWaalsContact C-N 3.32Å; E1145-L1147 PolarHBondContact O-N 2.68Å; E1145-I1148 PolarHBondContact O-N 2.92Å; E1145-K1149 PolarHBondContact O-N 2.64Å |
| 1146 | M | 96.3 | Very high | 96.5 | Very high | 122 Ų | 122 | 102.4 Ų | 102.4 | 60% | 0.601 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.3 | -40 | 176.8 | -75.6 | -178.7 | 68.5 | 0 | 0 | 111.9 | Q1142 L1143 I1148 K1149 V1150 | Q1142-M1146 WeakPolarHBondContact O-CG 3.36Å; Q1142-M1146 PolarHBondContact O-N 2.82Å; L1143-M1146 PolarHBondContact O-N 3.34Å; M1146-I1148 VanDerWaalsContact C-N 3.35Å; M1146-I1148 PolarHBondContact O-N 3.47Å; M1146-K1149 PolarHBondContact O-N 3.15Å; M1146-V1150 WeakPolarHBondContact O-CG2 3.49Å; M1146-V1150 PolarHBondContact O-N 3.44Å |
| 1147 | L | 97.4 | Very high | 96.6 | Very high | 108 Ų | 108 | 101.2 Ų | 101.2 | 57% | 0.565 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60 | -44.1 | 174.7 | 177.4 | 62 | 0 | 0 | 0 | 111.5 | L1143 D1144 E1145 V1150 Q1151 | L1143-L1147 WeakPolarHBondContact O-CB 3.49Å; L1143-L1147 PolarHBondContact O-N 3.17Å; D1144-L1147 PolarHBondContact O-N 2.86Å; E1145-L1147 VanDerWaalsContact C-N 3.32Å; E1145-L1147 PolarHBondContact O-N 2.68Å; L1147-V1150 PolarHBondContact O-N 3.43Å; L1147-Q1151 WeakPolarHBondContact O-CB 3.25Å; L1147-Q1151 PolarHBondContact O-N 3.38Å |
| 1148 | I | 97.1 | Very high | 96.7 | Very high | 113 Ų | 113 | 101.8 Ų | 101.8 | 58% | 0.579 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.3 | -42.9 | 176.4 | -69.2 | 163.8 | 0 | 0 | 0 | 111.3 | D1144 E1145 M1146 Q1151 Q1152 | D1144-I1148 WeakPolarHBondContact O-CD1 3.42Å; D1144-I1148 VanDerWaalsContact O-CG1 3.3Å; D1144-I1148 WeakPolarHBondContact O-CG1 3.35Å; D1144-I1148 PolarHBondContact O-N 3.36Å; D1144-I1148 VanDerWaalsContact O-N 3.1Å; E1145-I1148 PolarHBondContact O-N 2.92Å; M1146-I1148 VanDerWaalsContact C-N 3.35Å; M1146-I1148 PolarHBondContact O-N 3.47Å; I1148-Q1151 PolarHBondContact O-N 3.36Å; I1148-Q1152 PolarHBondContact O-N 3.07Å |
| 1149 | K | 97.8 | Very high | 96.7 | Very high | 105 Ų | 105 | 98.9 Ų | 98.9 | 46% | 0.457 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.1 | -49.6 | 176.4 | -69.9 | -167.2 | -179.5 | -157.8 | 0 | 111.7 | D605 E1145 M1146 Q1151 Q1152 E1153 | D605-K1149 IonicContact OD2-NZ 3.15Å; E1145-K1149 PolarHBondContact O-N 2.64Å; M1146-K1149 PolarHBondContact O-N 3.15Å; K1149-Q1151 VanDerWaalsContact C-N 3.31Å; K1149-Q1151 PolarHBondContact O-N 2.9Å; K1149-Q1152 PolarHBondContact O-N 3.11Å; K1149-Q1152 VanDerWaalsContact O-N 3.16Å; K1149-E1153 PolarHBondContact O-N 3.28Å |
| 1150 | V | 96.2 | Very high | 96.7 | Very high | 91 Ų | 91 | 98.7 Ų | 98.7 | 55% | 0.552 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.4 | -38.5 | 177.8 | 172.3 | 0 | 0 | 0 | 0 | 111.7 | M1146 L1147 E1153 N1154 | M1146-V1150 WeakPolarHBondContact O-CG2 3.49Å; M1146-V1150 PolarHBondContact O-N 3.44Å; L1147-V1150 PolarHBondContact O-N 3.43Å; V1150-E1153 PolarHBondContact O-N 3.1Å; V1150-N1154 WeakPolarHBondContact O-CB 3.31Å; V1150-N1154 PolarHBondContact O-N 3.28Å |
| 1151 | Q | 96.6 | Very high | 96.8 | Very high | 118 Ų | 118 | 99.1 Ų | 99.1 | 55% | 0.551 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -66.4 | -39.5 | 175.9 | -171.7 | 170.8 | -3.5 | 0 | 0 | 112 | L1147 I1148 K1149 N1154 E1155 | L1147-Q1151 WeakPolarHBondContact O-CB 3.25Å; L1147-Q1151 PolarHBondContact O-N 3.38Å; I1148-Q1151 PolarHBondContact O-N 3.36Å; K1149-Q1151 VanDerWaalsContact C-N 3.31Å; K1149-Q1151 PolarHBondContact O-N 2.9Å; Q1151-N1154 WeakPolarHBondContact O-CB 3.41Å; Q1151-N1154 PolarHBondContact O-N 3.13Å; Q1151-E1155 PolarHBondContact O-N 3.39Å; Q1151-E1155 VanDerWaalsContact O-N 3.13Å |
| 1152 | Q | 96.3 | Very high | 96.8 | Very high | 114 Ų | 114 | 102.2 Ų | 102.2 | 53% | 0.533 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.1 | -41.6 | 175.4 | -171.7 | 176.8 | 36 | 0 | 0 | 112.2 | I1148 K1149 N1154 E1155 D1156 | I1148-Q1152 PolarHBondContact O-N 3.07Å; K1149-Q1152 PolarHBondContact O-N 3.11Å; K1149-Q1152 VanDerWaalsContact O-N 3.16Å; Q1152-N1154 VanDerWaalsContact C-N 3.33Å; Q1152-E1155 PolarHBondContact O-N 3.23Å; Q1152-D1156 PolarHBondContact O-N 3.41Å; Q1152-D1156 VanDerWaalsContact O-N 3.14Å |
| 1153 | E | 95.4 | Very high | 96.8 | Very high | 121 Ų | 121 | 103.4 Ų | 103.4 | 57% | 0.565 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.5 | -36.2 | 175.8 | -70.1 | 174.6 | -174.7 | 0 | 0 | 112.2 | K1149 V1150 D1156 L1157 | K1149-E1153 PolarHBondContact O-N 3.28Å; V1150-E1153 PolarHBondContact O-N 3.1Å; E1153-D1156 PolarHBondContact O-N 2.86Å; E1153-L1157 WeakPolarHBondContact O-CB 3.49Å; E1153-L1157 WeakPolarHBondContact O-CG 3.23Å; E1153-L1157 PolarHBondContact O-N 3.49Å |
| 1154 | N | 96.9 | Very high | 96.9 | Very high | 80 Ų | 80 | 104.2 Ų | 104.2 | 43% | 0.428 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.7 | -40 | 176.3 | -161.8 | -102.1 | 0 | 0 | 0 | 112.5 | V1150 Q1151 Q1152 L1157 K1158 | V1150-N1154 WeakPolarHBondContact O-CB 3.31Å; V1150-N1154 PolarHBondContact O-N 3.28Å; Q1151-N1154 WeakPolarHBondContact O-CB 3.41Å; Q1151-N1154 PolarHBondContact O-N 3.13Å; Q1152-N1154 VanDerWaalsContact C-N 3.33Å; N1154-L1157 PolarHBondContact O-N 3.08Å; N1154-K1158 WeakPolarHBondContact O-CG 3.46Å; N1154-K1158 PolarHBondContact O-N 2.87Å; N1154-K1158 WeakPolarHBondContact OD1-CE 3.37Å; N1154-K1158 PolarHBondContact OD1-NZ 3.1Å |
| 1155 | E | 97.1 | Very high | 96.9 | Very high | 95 Ų | 95 | 102.9 Ų | 102.9 | 44% | 0.444 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -70.4 | -37 | 175.5 | -64.1 | -50.1 | 137 | 0 | 0 | 112.9 | Q1151 Q1152 K1158 A1159 | Q1151-E1155 PolarHBondContact O-N 3.39Å; Q1151-E1155 VanDerWaalsContact O-N 3.13Å; Q1152-E1155 PolarHBondContact O-N 3.23Å; E1155-K1158 PolarHBondContact O-N 3.47Å; E1155-K1158 IonicContact OE1-NZ 2.7Å; E1155-K1158 PolarHBondContact OE1-NZ 3.24Å; E1155-K1158 WeakPolarHBondContact OE2-CD 3.18Å; E1155-K1158 IonicContact OE2-NZ 3.91Å; E1155-A1159 WeakPolarHBondContact O-CB 3.48Å; E1155-A1159 PolarHBondContact O-N 2.91Å |
| 1156 | D | 97.8 | Very high | 96.9 | Very high | 72 Ų | 72 | 99.8 Ų | 99.8 | 39% | 0.385 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.9 | -40.4 | 172.3 | 174.7 | 67.3 | 0 | 0 | 0 | 112.1 | Q1152 E1153 K1158 A1159 R1160 | Q1152-D1156 PolarHBondContact O-N 3.41Å; Q1152-D1156 VanDerWaalsContact O-N 3.14Å; E1153-D1156 PolarHBondContact O-N 2.86Å; D1156-K1158 PolarHBondContact O-N 3.05Å; D1156-A1159 PolarHBondContact O-N 3.26Å; D1156-R1160 PolarHBondContact O-N 2.77Å; D1156-R1160 IonicContact OD1-NE 3.13Å; D1156-R1160 IonicContact OD2-CZ 3.34Å; D1156-R1160 IonicContact OD2-NE 2.63Å; D1156-R1160 PolarHBondContact OD2-NE 3.43Å; D1156-R1160 IonicContact OD2-NH2 3.68Å; D1156-R1160 PolarHBondContact OD2-NH2 3.03Å |
| 1157 | L | 97.4 | Very high | 96.9 | Very high | 90 Ų | 90 | 96.9 Ų | 96.9 | 47% | 0.471 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.9 | -43.2 | 173.5 | -78.9 | 164.7 | 0 | 0 | 0 | 111.9 | E1153 N1154 R1160 M1161 | E1153-L1157 WeakPolarHBondContact O-CB 3.49Å; E1153-L1157 WeakPolarHBondContact O-CG 3.23Å; E1153-L1157 PolarHBondContact O-N 3.49Å; N1154-L1157 PolarHBondContact O-N 3.08Å; L1157-R1160 PolarHBondContact O-N 3.33Å; L1157-M1161 WeakPolarHBondContact O-CB 3.13Å; L1157-M1161 PolarHBondContact O-N 3.02Å |
| 1158 | K | 96.9 | Very high | 96.9 | Very high | 88 Ų | 88 | 95.3 Ų | 95.3 | 38% | 0.383 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.3 | -48.1 | 172.5 | -71.8 | 166.4 | -168.7 | 160.7 | 0 | 111.6 | N1154 E1155 D1156 R1160 M1161 E1162 | N1154-K1158 WeakPolarHBondContact O-CG 3.46Å; N1154-K1158 PolarHBondContact O-N 2.87Å; N1154-K1158 WeakPolarHBondContact OD1-CE 3.37Å; N1154-K1158 PolarHBondContact OD1-NZ 3.1Å; E1155-K1158 PolarHBondContact O-N 3.47Å; E1155-K1158 IonicContact OE1-NZ 2.7Å; E1155-K1158 PolarHBondContact OE1-NZ 3.24Å; E1155-K1158 WeakPolarHBondContact OE2-CD 3.18Å; E1155-K1158 IonicContact OE2-NZ 3.91Å; D1156-K1158 PolarHBondContact O-N 3.05Å; K1158-R1160 VanDerWaalsContact C-N 3.28Å; K1158-R1160 PolarHBondContact O-N 2.88Å; K1158-M1161 WeakPolarHBondContact O-CB 3.27Å; K1158-M1161 PolarHBondContact O-N 2.82Å; K1158-M1161 VanDerWaalsContact O-N 3.17Å; K1158-E1162 PolarHBondContact O-N 3.43Å |
| 1159 | A | 96.4 | Very high | 96.8 | Very high | 33 Ų | 33 | 98.1 Ų | 98.1 | 27% | 0.273 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64.9 | -29.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | E1155 D1156 R1163 | E1155-A1159 WeakPolarHBondContact O-CB 3.48Å; E1155-A1159 PolarHBondContact O-N 2.91Å; D1156-A1159 PolarHBondContact O-N 3.26Å; A1159-R1163 VanDerWaalsContact O-CG 3.25Å; A1159-R1163 WeakPolarHBondContact O-CG 3.39Å; A1159-R1163 PolarHBondContact O-N 2.85Å; A1159-R1163 PolarHBondContact O-NH1 3Å |
| 1160 | R | 97.6 | Very high | 96.8 | Very high | 121 Ų | 121 | 96.5 Ų | 96.5 | 46% | 0.457 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -72.8 | -43.7 | 170.7 | -79.5 | -172.5 | -82.5 | 136.2 | -6.9 | 111.8 | D1156 L1157 K1158 E1162 R1163 H1164 | D1156-R1160 PolarHBondContact O-N 2.77Å; D1156-R1160 IonicContact OD1-NE 3.13Å; D1156-R1160 IonicContact OD2-CZ 3.34Å; D1156-R1160 IonicContact OD2-NE 2.63Å; D1156-R1160 PolarHBondContact OD2-NE 3.43Å; D1156-R1160 IonicContact OD2-NH2 3.68Å; D1156-R1160 PolarHBondContact OD2-NH2 3.03Å; L1157-R1160 PolarHBondContact O-N 3.33Å; K1158-R1160 VanDerWaalsContact C-N 3.28Å; K1158-R1160 PolarHBondContact O-N 2.88Å; R1160-E1162 VanDerWaalsContact C-N 3.35Å; R1160-E1162 PolarHBondContact O-N 2.92Å; R1160-R1163 PolarHBondContact O-N 2.98Å; R1160-H1164 PolarHBondContact O-CD2 2.93Å; R1160-H1164 PolarHBondContact O-N 3.39Å; R1160-H1164 VanDerWaalsContact O-N 3.07Å |
| 1161 | M | 97.3 | Very high | 96.8 | Very high | 131 Ų | 131 | 97.2 Ų | 97.2 | 65% | 0.645 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -60.1 | -42.3 | 175.5 | -178.1 | 173.8 | 62 | 0 | 0 | 112 | L1157 K1158 H1164 A1165 | L1157-M1161 WeakPolarHBondContact O-CB 3.13Å; L1157-M1161 PolarHBondContact O-N 3.02Å; K1158-M1161 WeakPolarHBondContact O-CB 3.27Å; K1158-M1161 PolarHBondContact O-N 2.82Å; K1158-M1161 VanDerWaalsContact O-N 3.17Å; M1161-H1164 PolarHBondContact O-N 3.26Å; M1161-A1165 PolarHBondContact O-N 2.94Å |
| 1162 | E | 97.2 | Very high | 96.8 | Very high | 136 Ų | 136 | 95 Ų | 95 | 64% | 0.636 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -64.7 | -42.6 | 177.1 | -176.3 | 171.1 | -147.4 | 0 | 0 | 112.3 | K1158 R1160 H1164 A1165 A1166 | K1158-E1162 PolarHBondContact O-N 3.43Å; R1160-E1162 VanDerWaalsContact C-N 3.35Å; R1160-E1162 PolarHBondContact O-N 2.92Å; E1162-H1164 VanDerWaalsContact C-N 3.3Å; E1162-H1164 PolarHBondContact O-N 3.05Å; E1162-A1165 PolarHBondContact O-N 3.49Å; E1162-A1166 WeakPolarHBondContact O-CB 3.37Å; E1162-A1166 PolarHBondContact O-N 3.23Å |
| 1163 | R | 96.6 | Very high | 96.8 | Very high | 143 Ų | 143 | 93.5 Ų | 93.5 | 54% | 0.54 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -60.5 | -38.8 | 174.2 | -71.7 | 174.3 | -166.3 | 111.1 | -14.1 | 112.2 | A1159 R1160 L1167 | A1159-R1163 VanDerWaalsContact O-CG 3.25Å; A1159-R1163 WeakPolarHBondContact O-CG 3.39Å; A1159-R1163 PolarHBondContact O-N 2.85Å; A1159-R1163 PolarHBondContact O-NH1 3Å; R1160-R1163 PolarHBondContact O-N 2.98Å; R1163-L1167 PolarHBondContact O-N 2.96Å |
| 1164 | H | 97.6 | Very high | 96.9 | Very high | 131 Ų | 131 | 91.7 Ų | 91.7 | 61% | 0.606 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -66 | -45 | 172.5 | -90 | -84.6 | 0 | 0 | 0 | 112 | R1160 M1161 E1162 A1166 L1167 S1168 | R1160-H1164 PolarHBondContact O-CD2 2.93Å; R1160-H1164 PolarHBondContact O-N 3.39Å; R1160-H1164 VanDerWaalsContact O-N 3.07Å; M1161-H1164 PolarHBondContact O-N 3.26Å; E1162-H1164 VanDerWaalsContact C-N 3.3Å; E1162-H1164 PolarHBondContact O-N 3.05Å; H1164-A1166 VanDerWaalsContact C-N 3.31Å; H1164-A1166 PolarHBondContact O-N 3.44Å; H1164-L1167 WeakPolarHBondContact O-CB 3.27Å; H1164-L1167 PolarHBondContact O-N 3.08Å; H1164-S1168 PolarHBondContact O-N 3.41Å; H1164-S1168 PolarHBondContact O-OG 3.3Å; H1164-S1168 VanDerWaalsContact O-OG 3.13Å |
| 1165 | A | 96.9 | Very high | 96.8 | Very high | 37 Ų | 37 | 94.5 Ų | 94.5 | 31% | 0.306 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.9 | -37.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | M1161 E1162 S1168 R1169 | M1161-A1165 PolarHBondContact O-N 2.94Å; E1162-A1165 PolarHBondContact O-N 3.49Å; A1165-S1168 PolarHBondContact O-N 2.87Å; A1165-R1169 VanDerWaalsContact O-CG 3.28Å; A1165-R1169 WeakPolarHBondContact O-CG 3.43Å; A1165-R1169 PolarHBondContact O-N 2.9Å |
| 1166 | A | 96.4 | Very high | 96.8 | Very high | 47 Ų | 47 | 92.5 Ų | 92.5 | 39% | 0.388 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.3 | -43.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | E1162 H1164 R1169 Q1170 | E1162-A1166 WeakPolarHBondContact O-CB 3.37Å; E1162-A1166 PolarHBondContact O-N 3.23Å; H1164-A1166 VanDerWaalsContact C-N 3.31Å; H1164-A1166 PolarHBondContact O-N 3.44Å; A1166-R1169 PolarHBondContact O-N 2.67Å; A1166-Q1170 WeakPolarHBondContact O-CB 3.46Å; A1166-Q1170 PolarHBondContact O-N 3.39Å |
| 1167 | L | 97.1 | Very high | 96.7 | Very high | 60 Ų | 60 | 94.3 Ų | 94.3 | 31% | 0.314 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.2 | -45.2 | 172.7 | -86 | 163 | 0 | 0 | 0 | 112.4 | R1163 H1164 R1169 Q1170 L1171 | R1163-L1167 PolarHBondContact O-N 2.96Å; H1164-L1167 WeakPolarHBondContact O-CB 3.27Å; H1164-L1167 PolarHBondContact O-N 3.08Å; L1167-R1169 VanDerWaalsContact C-N 3.33Å; L1167-R1169 PolarHBondContact O-N 3.47Å; L1167-Q1170 WeakPolarHBondContact O-CB 3.3Å; L1167-Q1170 PolarHBondContact O-N 2.93Å; L1167-L1171 WeakPolarHBondContact O-CG 3.46Å; L1167-L1171 PolarHBondContact O-N 2.83Å |
| 1168 | S | 95.4 | Very high | 96.7 | Very high | 75 Ų | 75 | 96 Ų | 96 | 52% | 0.524 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.2 | -38.6 | 177.7 | -60.1 | 0 | 0 | 0 | 0 | 112.3 | H1164 A1165 S1172 | H1164-S1168 PolarHBondContact O-N 3.41Å; H1164-S1168 PolarHBondContact O-OG 3.3Å; H1164-S1168 VanDerWaalsContact O-OG 3.13Å; A1165-S1168 PolarHBondContact O-N 2.87Å; S1168-S1172 WeakPolarHBondContact O-CB 3.36Å; S1168-S1172 PolarHBondContact O-N 2.99Å |
| 1169 | R | 96.4 | Very high | 96.6 | Very high | 172 Ų | 172 | 97.4 Ų | 97.4 | 65% | 0.649 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.7 | -44.7 | 172.3 | -71.8 | 168.8 | -173.6 | 154.9 | 2.5 | 111.5 | A1165 A1166 L1167 S1172 T1173 | A1165-R1169 VanDerWaalsContact O-CG 3.28Å; A1165-R1169 WeakPolarHBondContact O-CG 3.43Å; A1165-R1169 PolarHBondContact O-N 2.9Å; A1166-R1169 PolarHBondContact O-N 2.67Å; L1167-R1169 VanDerWaalsContact C-N 3.33Å; L1167-R1169 PolarHBondContact O-N 3.47Å; R1169-S1172 PolarHBondContact O-N 2.72Å; R1169-T1173 PolarHBondContact O-N 3.18Å; R1169-T1173 PolarHBondContact O-OG1 3.49Å |
| 1170 | Q | 97.2 | Very high | 96.5 | Very high | 72 Ų | 72 | 100 Ų | 100 | 34% | 0.336 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.6 | -53 | 177.5 | -177.6 | -175.2 | -21.4 | 0 | 0 | 111.2 | A1166 L1167 S1172 T1173 E1174 | A1166-Q1170 WeakPolarHBondContact O-CB 3.46Å; A1166-Q1170 PolarHBondContact O-N 3.39Å; L1167-Q1170 WeakPolarHBondContact O-CB 3.3Å; L1167-Q1170 PolarHBondContact O-N 2.93Å; Q1170-S1172 VanDerWaalsContact C-N 3.29Å; Q1170-S1172 PolarHBondContact O-N 2.97Å; Q1170-T1173 WeakPolarHBondContact CA-OG1 3.34Å; Q1170-T1173 PolarHBondContact O-N 3.26Å; Q1170-T1173 VanDerWaalsContact O-N 3.1Å; Q1170-T1173 PolarHBondContact O-OG1 2.74Å; Q1170-E1174 VanDerWaalsContact CG-OE1 3.29Å; Q1170-E1174 WeakPolarHBondContact CG-OE1 3.49Å; Q1170-E1174 PolarHBondContact NE2-OE1 3.47Å; Q1170-E1174 WeakPolarHBondContact O-CG 3.43Å; Q1170-E1174 PolarHBondContact O-N 2.86Å |
| 1171 | L | 96.5 | Very high | 96.4 | Very high | 106 Ų | 106 | 97.5 Ų | 97.5 | 56% | 0.555 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60 | -38.5 | 178.1 | -69.1 | 171.5 | 0 | 0 | 0 | 112.2 | L1167 E1174 Q1175 | L1167-L1171 WeakPolarHBondContact O-CG 3.46Å; L1167-L1171 PolarHBondContact O-N 2.83Å; L1171-E1174 PolarHBondContact O-N 3.12Å; L1171-Q1175 VanDerWaalsContact O-CB 3.32Å; L1171-Q1175 WeakPolarHBondContact O-CB 3.49Å; L1171-Q1175 PolarHBondContact O-N 3.28Å |
| 1172 | S | 96.5 | Very high | 96.4 | Very high | 72 Ų | 72 | 96.8 Ų | 96.8 | 50% | 0.503 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.1 | -40.7 | 174.4 | -178.5 | 0 | 0 | 0 | 0 | 112.4 | S1168 R1169 Q1170 A1176 | S1168-S1172 WeakPolarHBondContact O-CB 3.36Å; S1168-S1172 PolarHBondContact O-N 2.99Å; R1169-S1172 PolarHBondContact O-N 2.72Å; Q1170-S1172 VanDerWaalsContact C-N 3.29Å; Q1170-S1172 PolarHBondContact O-N 2.97Å; S1172-A1176 WeakPolarHBondContact O-CB 3.21Å; S1172-A1176 PolarHBondContact O-N 2.96Å |
| 1173 | T | 96 | Very high | 96.3 | Very high | 82 Ų | 82 | 96.1 Ų | 96.1 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.8 | -38.3 | 174.4 | 51.6 | 0 | 0 | 0 | 0 | 112.8 | R1169 Q1170 A1176 L1177 | R1169-T1173 PolarHBondContact O-N 3.18Å; R1169-T1173 PolarHBondContact O-OG1 3.49Å; Q1170-T1173 WeakPolarHBondContact CA-OG1 3.34Å; Q1170-T1173 PolarHBondContact O-N 3.26Å; Q1170-T1173 VanDerWaalsContact O-N 3.1Å; Q1170-T1173 PolarHBondContact O-OG1 2.74Å; T1173-A1176 PolarHBondContact O-N 2.88Å; T1173-L1177 WeakPolarHBondContact O-CB 3.35Å; T1173-L1177 VanDerWaalsContact O-CG 3.29Å; T1173-L1177 WeakPolarHBondContact O-CG 3.44Å; T1173-L1177 PolarHBondContact O-N 2.67Å |
| 1174 | E | 96.8 | Very high | 96.2 | Very high | 82 Ų | 82 | 94.5 Ų | 94.5 | 38% | 0.383 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.8 | -43.4 | 175.3 | -72.7 | 171.6 | -168.6 | 0 | 0 | 111 | Q1170 L1171 A1176 L1177 L1178 | Q1170-E1174 VanDerWaalsContact CG-OE1 3.29Å; Q1170-E1174 WeakPolarHBondContact CG-OE1 3.49Å; Q1170-E1174 PolarHBondContact NE2-OE1 3.47Å; Q1170-E1174 WeakPolarHBondContact O-CG 3.43Å; Q1170-E1174 PolarHBondContact O-N 2.86Å; L1171-E1174 PolarHBondContact O-N 3.12Å; E1174-A1176 PolarHBondContact O-N 2.74Å; E1174-L1177 PolarHBondContact O-N 2.66Å; E1174-L1178 WeakPolarHBondContact O-CB 3.42Å; E1174-L1178 VanDerWaalsContact O-CG 3.28Å; E1174-L1178 WeakPolarHBondContact O-CG 3.39Å; E1174-L1178 PolarHBondContact O-N 2.79Å |
| 1175 | Q | 96.1 | Very high | 96 | Very high | 140 Ų | 140 | 94.5 Ų | 94.5 | 65% | 0.654 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -60.5 | -43 | 174.4 | -174.1 | 178.7 | 6.7 | 0 | 0 | 112.2 | L1171 L1178 Q1179 | L1171-Q1175 VanDerWaalsContact O-CB 3.32Å; L1171-Q1175 WeakPolarHBondContact O-CB 3.49Å; L1171-Q1175 PolarHBondContact O-N 3.28Å; Q1175-L1178 PolarHBondContact O-N 2.73Å; Q1175-Q1179 WeakPolarHBondContact O-CB 3.14Å; Q1175-Q1179 PolarHBondContact O-N 2.75Å |
| 1176 | A | 95.8 | Very high | 95.9 | Very high | 53 Ų | 53 | 96.3 Ų | 96.3 | 44% | 0.438 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.5 | -43.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | S1172 T1173 E1174 Q1179 E1180 | S1172-A1176 WeakPolarHBondContact O-CB 3.21Å; S1172-A1176 PolarHBondContact O-N 2.96Å; T1173-A1176 PolarHBondContact O-N 2.88Å; E1174-A1176 PolarHBondContact O-N 2.74Å; A1176-Q1179 PolarHBondContact O-N 3.16Å; A1176-E1180 WeakPolarHBondContact O-CB 3.17Å; A1176-E1180 PolarHBondContact O-N 3.25Å |
| 1177 | L | 96.8 | Very high | 95.9 | Very high | 110 Ų | 110 | 101.1 Ų | 101.1 | 58% | 0.576 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.9 | -38.5 | 176.5 | -71.7 | 169 | 0 | 0 | 0 | 112.2 | T1173 E1174 E1180 S1181 | T1173-L1177 WeakPolarHBondContact O-CB 3.35Å; T1173-L1177 VanDerWaalsContact O-CG 3.29Å; T1173-L1177 WeakPolarHBondContact O-CG 3.44Å; T1173-L1177 PolarHBondContact O-N 2.67Å; E1174-L1177 PolarHBondContact O-N 2.66Å; L1177-E1180 PolarHBondContact O-N 3.15Å; L1177-S1181 VanDerWaalsContact O-CB 3.31Å; L1177-S1181 WeakPolarHBondContact O-CB 3.14Å; L1177-S1181 PolarHBondContact O-N 3.29Å |
| 1178 | L | 96.7 | Very high | 95.8 | Very high | 125 Ų | 125 | 101.4 Ų | 101.4 | 65% | 0.654 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.1 | -41.9 | 173.6 | -74 | 168.9 | 0 | 0 | 0 | 111.6 | E1174 Q1175 S1181 L1182 | E1174-L1178 WeakPolarHBondContact O-CB 3.42Å; E1174-L1178 VanDerWaalsContact O-CG 3.28Å; E1174-L1178 WeakPolarHBondContact O-CG 3.39Å; E1174-L1178 PolarHBondContact O-N 2.79Å; Q1175-L1178 PolarHBondContact O-N 2.73Å; L1178-S1181 PolarHBondContact O-N 2.61Å; L1178-L1182 WeakPolarHBondContact O-CB 3.33Å; L1178-L1182 PolarHBondContact O-N 3.3Å |
| 1179 | Q | 95.2 | Very high | 95.8 | Very high | 118 Ų | 118 | 102.9 Ų | 102.9 | 55% | 0.551 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66 | -40.3 | 176.2 | -168.8 | 175.5 | 16.4 | 0 | 0 | 112 | Q1175 A1176 L1182 Q1183 | Q1175-Q1179 WeakPolarHBondContact O-CB 3.14Å; Q1175-Q1179 PolarHBondContact O-N 2.75Å; A1176-Q1179 PolarHBondContact O-N 3.16Å; Q1179-L1182 PolarHBondContact O-N 2.98Å; Q1179-Q1183 WeakPolarHBondContact O-CG 3.47Å; Q1179-Q1183 PolarHBondContact O-N 2.66Å |
| 1180 | E | 95.6 | Very high | 95.9 | Very high | 88 Ų | 88 | 99.7 Ų | 99.7 | 41% | 0.411 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.3 | -40.3 | 174 | -160.7 | -148 | -176.9 | 0 | 0 | 111.6 | A1176 L1177 Q1183 K1184 | A1176-E1180 WeakPolarHBondContact O-CB 3.17Å; A1176-E1180 PolarHBondContact O-N 3.25Å; L1177-E1180 PolarHBondContact O-N 3.15Å; E1180-Q1183 PolarHBondContact O-N 3.32Å; E1180-K1184 HydrophobicContact CG-CD 4.49Å; E1180-K1184 VanDerWaalsContact O-CG 3.31Å; E1180-K1184 WeakPolarHBondContact O-CG 3.5Å; E1180-K1184 PolarHBondContact O-N 2.94Å; E1180-K1184 WeakPolarHBondContact OE1-CE 3.36Å; E1180-K1184 IonicContact OE1-NZ 2.59Å; E1180-K1184 PolarHBondContact OE1-NZ 2.87Å; E1180-K1184 IonicContact OE2-NZ 2.79Å; E1180-K1184 PolarHBondContact OE2-NZ 3.39Å |
| 1181 | S | 95.1 | Very high | 95.8 | Very high | 68 Ų | 68 | 103.2 Ų | 103.2 | 48% | 0.476 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.3 | -43.7 | 176.7 | -157.3 | 0 | 0 | 0 | 0 | 111.5 | L1177 L1178 Q1183 K1184 E1185 | L1177-S1181 VanDerWaalsContact O-CB 3.31Å; L1177-S1181 WeakPolarHBondContact O-CB 3.14Å; L1177-S1181 PolarHBondContact O-N 3.29Å; L1178-S1181 PolarHBondContact O-N 2.61Å; S1181-Q1183 VanDerWaalsContact C-N 3.33Å; S1181-Q1183 PolarHBondContact O-N 2.93Å; S1181-K1184 WeakPolarHBondContact O-CB 3.22Å; S1181-K1184 PolarHBondContact O-N 3.37Å; S1181-K1184 VanDerWaalsContact O-N 3.15Å; S1181-E1185 WeakPolarHBondContact O-CB 3.38Å; S1181-E1185 PolarHBondContact O-N 3.03Å |
| 1182 | L | 96.1 | Very high | 95.7 | Very high | 116 Ų | 116 | 102.7 Ų | 102.7 | 61% | 0.607 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.3 | -39.2 | 173.5 | 179.5 | 62.7 | 0 | 0 | 0 | 112.3 | L1178 Q1179 S1186 | L1178-L1182 WeakPolarHBondContact O-CB 3.33Å; L1178-L1182 PolarHBondContact O-N 3.3Å; Q1179-L1182 PolarHBondContact O-N 2.98Å; L1182-S1186 WeakPolarHBondContact O-CB 3.5Å; L1182-S1186 PolarHBondContact O-N 2.69Å |
| 1183 | Q | 95.1 | Very high | 95.4 | Very high | 122 Ų | 122 | 101.3 Ų | 101.3 | 57% | 0.57 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67.2 | -40.7 | 173.6 | -72.6 | 178.1 | 10.5 | 0 | 0 | 112.2 | Q1179 E1180 S1181 K1187 | Q1179-Q1183 WeakPolarHBondContact O-CG 3.47Å; Q1179-Q1183 PolarHBondContact O-N 2.66Å; E1180-Q1183 PolarHBondContact O-N 3.32Å; S1181-Q1183 VanDerWaalsContact C-N 3.33Å; S1181-Q1183 PolarHBondContact O-N 2.93Å; Q1183-K1187 VanDerWaalsContact O-CB 3.25Å; Q1183-K1187 WeakPolarHBondContact O-CB 3.34Å; Q1183-K1187 PolarHBondContact O-N 3.19Å |
| 1184 | K | 96.1 | Very high | 95.3 | Very high | 109 Ų | 109 | 102.5 Ų | 102.5 | 47% | 0.474 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 175.1 | -74.6 | 165.6 | 178.6 | 169.8 | 0 | 111.4 | E1180 S1181 K1187 V1188 | E1180-K1184 HydrophobicContact CG-CD 4.49Å; E1180-K1184 VanDerWaalsContact O-CG 3.31Å; E1180-K1184 WeakPolarHBondContact O-CG 3.5Å; E1180-K1184 PolarHBondContact O-N 2.94Å; E1180-K1184 WeakPolarHBondContact OE1-CE 3.36Å; E1180-K1184 IonicContact OE1-NZ 2.59Å; E1180-K1184 PolarHBondContact OE1-NZ 2.87Å; E1180-K1184 IonicContact OE2-NZ 2.79Å; E1180-K1184 PolarHBondContact OE2-NZ 3.39Å; S1181-K1184 WeakPolarHBondContact O-CB 3.22Å; S1181-K1184 PolarHBondContact O-N 3.37Å; S1181-K1184 VanDerWaalsContact O-N 3.15Å; K1184-K1187 PolarHBondContact O-N 2.94Å; K1184-V1188 WeakPolarHBondContact O-CG2 3.48Å; K1184-V1188 PolarHBondContact O-N 2.73Å |
| 1185 | E | 92.8 | Very high | 95.2 | Very high | 131 Ų | 131 | 103.5 Ų | 103.5 | 61% | 0.612 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.6 | -48.2 | 177.1 | -173.7 | 177.2 | -179.1 | 0 | 0 | 111.3 | S1181 K1187 V1188 N1189 | S1181-E1185 WeakPolarHBondContact O-CB 3.38Å; S1181-E1185 PolarHBondContact O-N 3.03Å; E1185-K1187 VanDerWaalsContact C-N 3.26Å; E1185-K1187 PolarHBondContact O-N 2.85Å; E1185-V1188 CarbonylContact O-C 3.59Å; E1185-V1188 WeakPolarHBondContact O-CA 3.5Å; E1185-V1188 WeakPolarHBondContact O-CB 3.32Å; E1185-V1188 PolarHBondContact O-N 3.33Å; E1185-N1189 WeakPolarHBondContact O-CB 3.5Å; E1185-N1189 PolarHBondContact O-N 3.28Å |
| 1186 | S | 94.4 | Very high | 95 | Very high | 75 Ų | 75 | 102 Ų | 102 | 52% | 0.524 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -55.9 | -40.8 | 174.1 | -179.3 | 0 | 0 | 0 | 0 | 112 | L1182 V1188 N1189 K1190 | L1182-S1186 WeakPolarHBondContact O-CB 3.5Å; L1182-S1186 PolarHBondContact O-N 2.69Å; S1186-V1188 PolarHBondContact O-N 2.89Å; S1186-N1189 PolarHBondContact O-N 3.48Å; S1186-K1190 PolarHBondContact O-N 3.02Å |
| 1187 | K | 96.1 | Very high | 94.9 | Very high | 147 Ų | 147 | 104.2 Ų | 104.2 | 64% | 0.639 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -69.3 | -26.5 | 174.1 | -174.1 | 173.5 | -179.3 | 176.1 | 0 | 113.5 | Q1183 K1184 E1185 R1191 | Q1183-K1187 VanDerWaalsContact O-CB 3.25Å; Q1183-K1187 WeakPolarHBondContact O-CB 3.34Å; Q1183-K1187 PolarHBondContact O-N 3.19Å; K1184-K1187 PolarHBondContact O-N 2.94Å; E1185-K1187 VanDerWaalsContact C-N 3.26Å; E1185-K1187 PolarHBondContact O-N 2.85Å; K1187-R1191 WeakPolarHBondContact O-CG 3.07Å; K1187-R1191 PolarHBondContact O-NE 3Å; K1187-R1191 PolarHBondContact O-NH2 3.41Å |
| 1188 | V | 96.1 | Very high | 94.7 | Very high | 67 Ų | 67 | 103.9 Ų | 103.9 | 41% | 0.406 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -74.8 | -48.9 | 168.7 | 171.4 | 0 | 0 | 0 | 0 | 109.9 | K1184 E1185 S1186 K1190 R1191 L1192 | K1184-V1188 WeakPolarHBondContact O-CG2 3.48Å; K1184-V1188 PolarHBondContact O-N 2.73Å; E1185-V1188 CarbonylContact O-C 3.59Å; E1185-V1188 WeakPolarHBondContact O-CA 3.5Å; E1185-V1188 WeakPolarHBondContact O-CB 3.32Å; E1185-V1188 PolarHBondContact O-N 3.33Å; S1186-V1188 PolarHBondContact O-N 2.89Å; V1188-K1190 PolarHBondContact O-N 3.1Å; V1188-R1191 VanDerWaalsContact CG2-NH2 3.28Å; V1188-R1191 WeakPolarHBondContact O-CA 3.34Å; V1188-R1191 WeakPolarHBondContact O-CB 3.43Å; V1188-R1191 PolarHBondContact O-N 3.42Å; V1188-L1192 HydrophobicContact CG1-CD1 3.81Å; V1188-L1192 HydrophobicContact CG1-CG 4.23Å; V1188-L1192 PolarHBondContact O-N 3.2Å |
| 1189 | N | 95.3 | Very high | 94.5 | Very high | 106 Ų | 106 | 102.3 Ų | 102.3 | 57% | 0.567 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59 | -45 | -178.9 | -167.1 | -5.6 | 0 | 0 | 0 | 111.6 | E1185 S1186 R1191 L1192 S1193 | E1185-N1189 WeakPolarHBondContact O-CB 3.5Å; E1185-N1189 PolarHBondContact O-N 3.28Å; S1186-N1189 PolarHBondContact O-N 3.48Å; N1189-R1191 VanDerWaalsContact C-N 3.32Å; N1189-R1191 PolarHBondContact O-N 2.72Å; N1189-L1192 CarbonylContact O-C 3.57Å; N1189-L1192 PolarHBondContact O-N 3.17Å; N1189-S1193 WeakPolarHBondContact O-CB 3.14Å; N1189-S1193 PolarHBondContact O-N 3.31Å |
| 1190 | K | 96.8 | Very high | 94.2 | Very high | 105 Ų | 105 | 102 Ų | 102 | 46% | 0.457 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.5 | -30.5 | 175.6 | -174.5 | 56 | -166.4 | 161 | 0 | 113.4 | S1186 V1188 M1194 E1197 | S1186-K1190 PolarHBondContact O-N 3.02Å; V1188-K1190 PolarHBondContact O-N 3.1Å; K1190-M1194 HydrophobicContact CD-CG 4.43Å; K1190-M1194 HydrophobicContact CG-SD 4.47Å; K1190-M1194 WeakPolarHBondContact O-CG 3.35Å; K1190-M1194 PolarHBondContact O-N 3.42Å; K1190-E1197 IonicContact NZ-OE1 3.82Å; K1190-E1197 PolarHBondContact NZ-OE1 3.42Å; K1190-E1197 VanDerWaalsContact NZ-OE1 3.13Å; K1190-E1197 IonicContact NZ-OE2 2.74Å |
| 1191 | R | 95.9 | Very high | 94 | Very high | 145 Ų | 145 | 105.8 Ų | 105.8 | 55% | 0.547 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.8 | -46.3 | 171.1 | -80.1 | 178.5 | -73.7 | 166.1 | -0.1 | 111.3 | K1187 V1188 N1189 S1193 M1194 E1195 | K1187-R1191 WeakPolarHBondContact O-CG 3.07Å; K1187-R1191 PolarHBondContact O-NE 3Å; K1187-R1191 PolarHBondContact O-NH2 3.41Å; V1188-R1191 VanDerWaalsContact CG2-NH2 3.28Å; V1188-R1191 WeakPolarHBondContact O-CA 3.34Å; V1188-R1191 WeakPolarHBondContact O-CB 3.43Å; V1188-R1191 PolarHBondContact O-N 3.42Å; N1189-R1191 VanDerWaalsContact C-N 3.32Å; N1189-R1191 PolarHBondContact O-N 2.72Å; R1191-S1193 VanDerWaalsContact C-N 3.32Å; R1191-S1193 PolarHBondContact O-N 3.47Å; R1191-M1194 PolarHBondContact O-N 3.33Å; R1191-E1195 WeakPolarHBondContact O-CB 3.38Å; R1191-E1195 PolarHBondContact O-N 3.46Å |
| 1192 | L | 93.8 | Very high | 93.7 | Very high | 95 Ų | 95 | 106.2 Ų | 106.2 | 50% | 0.497 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.1 | -34.1 | 175.7 | -67.5 | 174.3 | 0 | 0 | 0 | 112.4 | V1188 N1189 E1195 N1196 | V1188-L1192 HydrophobicContact CG1-CD1 3.81Å; V1188-L1192 HydrophobicContact CG1-CG 4.23Å; V1188-L1192 PolarHBondContact O-N 3.2Å; N1189-L1192 CarbonylContact O-C 3.57Å; N1189-L1192 PolarHBondContact O-N 3.17Å; L1192-E1195 PolarHBondContact O-N 3.1Å; L1192-N1196 WeakPolarHBondContact O-CB 3.41Å; L1192-N1196 PolarHBondContact O-N 3Å |
| 1193 | S | 91.9 | Very high | 93.1 | Very high | 43 Ų | 43 | 107.1 Ų | 107.1 | 30% | 0.301 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.8 | -49.6 | 171.5 | -169.3 | 0 | 0 | 0 | 0 | 110.3 | N1189 R1191 E1195 N1196 E1197 | N1189-S1193 WeakPolarHBondContact O-CB 3.14Å; N1189-S1193 PolarHBondContact O-N 3.31Å; R1191-S1193 VanDerWaalsContact C-N 3.32Å; R1191-S1193 PolarHBondContact O-N 3.47Å; S1193-E1195 PolarHBondContact O-N 3.38Å; S1193-N1196 PolarHBondContact O-N 3.26Å; S1193-E1197 VanDerWaalsContact C-OE1 3.22Å; S1193-E1197 WeakPolarHBondContact CB-OE1 3.47Å; S1193-E1197 VanDerWaalsContact O-CB 3.3Å; S1193-E1197 WeakPolarHBondContact O-CB 3.47Å; S1193-E1197 VanDerWaalsContact O-CD 3.3Å; S1193-E1197 WeakPolarHBondContact O-CG 3.29Å; S1193-E1197 PolarHBondContact O-N 3.47Å; S1193-E1197 VanDerWaalsContact O-OE1 3.12Å; S1193-E1197 PolarHBondContact OG-OE1 3.33Å |
| 1194 | M | 93.8 | Very high | 92.5 | Very high | 107 Ų | 107 | 109.1 Ų | 109.1 | 53% | 0.527 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.9 | -41.2 | 176.5 | -72.6 | 172.3 | 58.5 | 0 | 0 | 112.7 | K1190 R1191 E1197 E1198 | K1190-M1194 HydrophobicContact CD-CG 4.43Å; K1190-M1194 HydrophobicContact CG-SD 4.47Å; K1190-M1194 WeakPolarHBondContact O-CG 3.35Å; K1190-M1194 PolarHBondContact O-N 3.42Å; R1191-M1194 PolarHBondContact O-N 3.33Å; M1194-E1197 PolarHBondContact O-N 3Å; M1194-E1198 VanDerWaalsContact O-CB 3.3Å; M1194-E1198 WeakPolarHBondContact O-CB 3.36Å; M1194-E1198 PolarHBondContact O-N 3.37Å |
| 1195 | E | 93.3 | Very high | 91.8 | Very high | 104 Ų | 104 | 108.4 Ų | 108.4 | 49% | 0.486 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.3 | -40.3 | 175.8 | -174.8 | 178.9 | 174.9 | 0 | 0 | 111.5 | R1191 L1192 S1193 E1198 L1199 | R1191-E1195 WeakPolarHBondContact O-CB 3.38Å; R1191-E1195 PolarHBondContact O-N 3.46Å; L1192-E1195 PolarHBondContact O-N 3.1Å; S1193-E1195 PolarHBondContact O-N 3.38Å; E1195-E1198 PolarHBondContact O-N 3.45Å; E1195-L1199 HydrophobicContact CG-CD1 4.03Å; E1195-L1199 HydrophobicContact CG-CG 4.47Å; E1195-L1199 VanDerWaalsContact O-CB 3.32Å; E1195-L1199 WeakPolarHBondContact O-CB 3.49Å; E1195-L1199 WeakPolarHBondContact O-CG 3.45Å; E1195-L1199 PolarHBondContact O-N 3.32Å |
| 1196 | N | 93.4 | Very high | 90.4 | Very high | 108 Ų | 108 | 104.4 Ų | 104.4 | 58% | 0.578 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.4 | -40.6 | 176 | -171.1 | 23.7 | 0 | 0 | 0 | 111.7 | L1192 S1193 E1198 L1199 L1200 | L1192-N1196 WeakPolarHBondContact O-CB 3.41Å; L1192-N1196 PolarHBondContact O-N 3Å; S1193-N1196 PolarHBondContact O-N 3.26Å; N1196-E1198 VanDerWaalsContact C-N 3.34Å; N1196-L1199 PolarHBondContact O-N 2.96Å; N1196-L1200 WeakPolarHBondContact O-CB 3.49Å; N1196-L1200 PolarHBondContact O-N 3.4Å |
| 1197 | E | 93.6 | Very high | 88.6 | Confident | 99 Ų | 99 | 106.9 Ų | 106.9 | 46% | 0.463 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -57.9 | -45.5 | 170.2 | -71.6 | 157.2 | -129.5 | 0 | 0 | 110.3 | K1190 S1193 M1194 W1201 | K1190-E1197 IonicContact NZ-OE1 3.82Å; K1190-E1197 PolarHBondContact NZ-OE1 3.42Å; K1190-E1197 VanDerWaalsContact NZ-OE1 3.13Å; K1190-E1197 IonicContact NZ-OE2 2.74Å; S1193-E1197 VanDerWaalsContact C-OE1 3.22Å; S1193-E1197 WeakPolarHBondContact CB-OE1 3.47Å; S1193-E1197 VanDerWaalsContact O-CB 3.3Å; S1193-E1197 WeakPolarHBondContact O-CB 3.47Å; S1193-E1197 VanDerWaalsContact O-CD 3.3Å; S1193-E1197 WeakPolarHBondContact O-CG 3.29Å; S1193-E1197 PolarHBondContact O-N 3.47Å; S1193-E1197 VanDerWaalsContact O-OE1 3.12Å; S1193-E1197 PolarHBondContact OG-OE1 3.33Å; M1194-E1197 PolarHBondContact O-N 3Å; E1197-W1201 VanDerWaalsContact O-CB 3.27Å; E1197-W1201 WeakPolarHBondContact O-CB 3.47Å; E1197-W1201 PolarHBondContact O-N 3.48Å |
| 1198 | E | 91.6 | Very high | 86.5 | Confident | 103 Ų | 103 | 106 Ų | 106 | 48% | 0.481 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.6 | -42.9 | 177.1 | -173.8 | -174.4 | 160.9 | 0 | 0 | 112.7 | M1194 E1195 N1196 W1201 K1202 | M1194-E1198 VanDerWaalsContact O-CB 3.3Å; M1194-E1198 WeakPolarHBondContact O-CB 3.36Å; M1194-E1198 PolarHBondContact O-N 3.37Å; E1195-E1198 PolarHBondContact O-N 3.45Å; N1196-E1198 VanDerWaalsContact C-N 3.34Å; E1198-W1201 PolarHBondContact O-N 3.15Å; E1198-K1202 HydrophobicContact CG-CD 4.41Å; E1198-K1202 WeakPolarHBondContact O-CB 3.32Å; E1198-K1202 WeakPolarHBondContact O-CG 3.44Å; E1198-K1202 PolarHBondContact O-N 3.37Å; E1198-K1202 WeakPolarHBondContact OE1-CE 3.45Å; E1198-K1202 IonicContact OE1-NZ 2.78Å; E1198-K1202 PolarHBondContact OE1-NZ 3.04Å |
| 1199 | L | 91.7 | Very high | 84.1 | Confident | 93 Ų | 93 | 105.8 Ų | 105.8 | 49% | 0.487 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -68 | -40.2 | 177.5 | -73.9 | 170.2 | 0 | 0 | 0 | 111.8 | E1195 N1196 W1201 K1202 L1203 | E1195-L1199 HydrophobicContact CG-CD1 4.03Å; E1195-L1199 HydrophobicContact CG-CG 4.47Å; E1195-L1199 VanDerWaalsContact O-CB 3.32Å; E1195-L1199 WeakPolarHBondContact O-CB 3.49Å; E1195-L1199 WeakPolarHBondContact O-CG 3.45Å; E1195-L1199 PolarHBondContact O-N 3.32Å; N1196-L1199 PolarHBondContact O-N 2.96Å; L1199-W1201 VanDerWaalsContact C-N 3.34Å; L1199-K1202 PolarHBondContact O-N 3.26Å; L1199-L1203 VanDerWaalsContact O-CB 3.31Å; L1199-L1203 WeakPolarHBondContact O-CB 3.19Å; L1199-L1203 PolarHBondContact O-N 3.13Å |
| 1200 | L | 90.1 | Very high | 81.9 | Confident | 112 Ų | 112 | 105.7 Ų | 105.7 | 59% | 0.586 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.5 | -40.4 | 173.6 | -175.1 | 64.5 | 0 | 0 | 0 | 110.9 | N1196 L1203 H1204 | N1196-L1200 WeakPolarHBondContact O-CB 3.49Å; N1196-L1200 PolarHBondContact O-N 3.4Å; L1200-L1203 PolarHBondContact O-N 3.33Å; L1200-H1204 WeakPolarHBondContact O-CB 3.47Å; L1200-H1204 PolarHBondContact O-N 3.38Å |
| 1201 | W | 90.2 | Very high | 79.7 | Confident | 167 Ų | 167 | 107 Ų | 107 | 63% | 0.633 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.9 | -45.6 | 174 | -170.3 | 93.9 | 0 | 0 | 0 | 111.8 | E1197 E1198 L1199 L1203 H1204 N1205 | E1197-W1201 VanDerWaalsContact O-CB 3.27Å; E1197-W1201 WeakPolarHBondContact O-CB 3.47Å; E1197-W1201 PolarHBondContact O-N 3.48Å; E1198-W1201 PolarHBondContact O-N 3.15Å; L1199-W1201 VanDerWaalsContact C-N 3.34Å; W1201-L1203 PolarHBondContact O-N 3.47Å; W1201-H1204 PolarHBondContact O-N 3.12Å; W1201-N1205 VanDerWaalsContact CD2-ND2 3.32Å; W1201-N1205 VanDerWaalsContact CE2-ND2 3.26Å; W1201-N1205 HydrophobicContact CZ3-CB 4.41Å; W1201-N1205 WeakPolarHBondContact O-CB 3.44Å; W1201-N1205 PolarHBondContact O-N 3.28Å; W1201-N1205 PolarHBondContact O-ND2 3.06Å |
| 1202 | K | 89.9 | Confident | 76.8 | Confident | 77 Ų | 77 | 110.9 Ų | 110.9 | 34% | 0.335 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -62.2 | -40.3 | 174.9 | -74.9 | 172.2 | -175.3 | 169.5 | 0 | 112.5 | E1198 L1199 N1205 G1206 D1207 | E1198-K1202 HydrophobicContact CG-CD 4.41Å; E1198-K1202 WeakPolarHBondContact O-CB 3.32Å; E1198-K1202 WeakPolarHBondContact O-CG 3.44Å; E1198-K1202 PolarHBondContact O-N 3.37Å; E1198-K1202 WeakPolarHBondContact OE1-CE 3.45Å; E1198-K1202 IonicContact OE1-NZ 2.78Å; E1198-K1202 PolarHBondContact OE1-NZ 3.04Å; L1199-K1202 PolarHBondContact O-N 3.26Å; K1202-N1205 PolarHBondContact O-N 3.09Å; K1202-G1206 PolarHBondContact O-N 3.39Å; K1202-D1207 PolarHBondContact O-N 3.35Å |
| 1203 | L | 83.4 | Confident | 74.3 | Confident | 134 Ų | 134 | 117.4 Ų | 117.4 | 70% | 0.702 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -63.7 | -41.7 | 175.8 | 179.6 | 63.2 | 0 | 0 | 0 | 111.6 | L1199 L1200 W1201 | L1199-L1203 VanDerWaalsContact O-CB 3.31Å; L1199-L1203 WeakPolarHBondContact O-CB 3.19Å; L1199-L1203 PolarHBondContact O-N 3.13Å; L1200-L1203 PolarHBondContact O-N 3.33Å; W1201-L1203 PolarHBondContact O-N 3.47Å |
| 1204 | H | 81.4 | Confident | 71.4 | Confident | 165 Ų | 165 | 123.8 Ų | 123.8 | 76% | 0.764 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -69.4 | -38 | 177.8 | -168.3 | 87.2 | 0 | 0 | 0 | 112.5 | L1200 W1201 | L1200-H1204 WeakPolarHBondContact O-CB 3.47Å; L1200-H1204 PolarHBondContact O-N 3.38Å; W1201-H1204 PolarHBondContact O-N 3.12Å |
| 1205 | N | 81.6 | Confident | 68.7 | Low | 93 Ų | 93 | 124.3 Ų | 124.3 | 50% | 0.497 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -88.2 | -1.4 | -179.9 | -68.2 | -84 | 0 | 0 | 0 | 114 | W1201 K1202 | W1201-N1205 VanDerWaalsContact CD2-ND2 3.32Å; W1201-N1205 VanDerWaalsContact CE2-ND2 3.26Å; W1201-N1205 HydrophobicContact CZ3-CB 4.41Å; W1201-N1205 WeakPolarHBondContact O-CB 3.44Å; W1201-N1205 PolarHBondContact O-N 3.28Å; W1201-N1205 PolarHBondContact O-ND2 3.06Å; K1202-N1205 PolarHBondContact O-N 3.09Å |
| 1206 | G | 64.5 | Low | 66.6 | Low | 48 Ų | 48 | 124.9 Ų | 124.9 | 50% | 0.495 | 66% | 0.664 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 84.9 | 13.6 | 163.7 | 0 | 0 | 0 | 0 | 0 | 117.4 | K1202 V1208 | K1202-G1206 PolarHBondContact O-N 3.39Å; G1206-V1208 VanDerWaalsContact C-N 3.33Å; G1206-V1208 PolarHBondContact O-N 3.2Å |
| 1207 | D | 57.1 | Low | 63.6 | Low | 127 Ų | 127 | 125.3 Ų | 125.3 | 68% | 0.679 | 68% | 0.676 | S | S | * | * | trans | -79.6 | 74.6 | -176.3 | -169.2 | 17.5 | 0 | 0 | 0 | 113.1 | K1202 G1209 | K1202-D1207 PolarHBondContact O-N 3.35Å; D1207-G1209 VanDerWaalsContact C-N 3.31Å; D1207-G1209 PolarHBondContact O-N 3.38Å; D1207-G1209 VanDerWaalsContact O-N 3.07Å | ||
| 1208 | V | 51.8 | Low | 61.7 | Low | 127 Ų | 127 | 125.6 Ų | 125.6 | 77% | 0.77 | 69% | 0.686 | S | S | * | * | trans | -83.4 | 68.3 | 179.2 | -72.4 | 0 | 0 | 0 | 0 | 112.4 | G1206 S1210 | G1206-V1208 VanDerWaalsContact C-N 3.33Å; G1206-V1208 PolarHBondContact O-N 3.2Å; V1208-S1210 PolarHBondContact O-N 3.36Å; V1208-S1210 VanDerWaalsContact O-N 3.14Å | ||
| 1209 | G | 45.6 | Very low | 58.9 | Low | 64 Ų | 64 | 126.9 Ų | 126.9 | 66% | 0.66 | 70% | 0.701 | S | S | * | * | trans | -53.5 | 111.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | D1207 P1211 | D1207-G1209 VanDerWaalsContact C-N 3.31Å; D1207-G1209 PolarHBondContact O-N 3.38Å; D1207-G1209 VanDerWaalsContact O-N 3.07Å; G1209-P1211 WeakPolarHBondContact O-CD 3.14Å | ||
| 1210 | S | 48.2 | Very low | 55.9 | Low | 104 Ų | 104 | 127.6 Ų | 127.6 | 73% | 0.727 | 71% | 0.714 | S | S | * | * | trans | -90.8 | 114.3 | -176.7 | 150.3 | 0 | 0 | 0 | 0 | 112.7 | V1208 R1212 | V1208-S1210 PolarHBondContact O-N 3.36Å; V1208-S1210 VanDerWaalsContact O-N 3.14Å; S1210-R1212 PolarHBondContact O-N 2.71Å | ||
| 1211 | P | 51.6 | Low | 54.5 | Low | 133 Ų | 133 | 128 Ų | 128 | 86% | 0.864 | 72% | 0.724 | S | S | * | * | trans | -82.4 | 103.3 | -179.5 | 31.9 | -34 | 0 | 0 | 0 | 113 | G1209 | G1209-P1211 WeakPolarHBondContact O-CD 3.14Š| ||
| 1212 | R | 35.5 | Very low | 52.7 | Low | 226 Ų | 226 | 125.2 Ų | 125.2 | 85% | 0.853 | 73% | 0.727 | S | S | * | * | trans | -113.4 | 99.6 | 172.6 | -179.3 | 178.1 | -90 | -115.7 | 2.5 | 112.7 | S1210 | S1210-R1212 PolarHBondContact O-N 2.71Š| ||
| 1213 | R | 39.5 | Very low | 50.1 | Low | 232 Ų | 232 | 130 Ų | 130 | 88% | 0.875 | 75% | 0.75 | S | S | * | * | trans | 34.9 | 112 | 143.1 | -70 | -81.8 | -171.3 | 174.3 | -0 | 118.8 | ||||
| 1214 | L | 32.6 | Very low | 48.7 | Very low | 177 Ų | 177 | 128.2 Ų | 128.2 | 93% | 0.927 | 75% | 0.746 | S | S | * | * | trans | -148.2 | 146 | 142.6 | -81.2 | -171 | 0 | 0 | 0 | 112.9 | ||||
| 1215 | S | 36.2 | Very low | 46.4 | Very low | 117 Ų | 117 | 129.8 Ų | 129.8 | 82% | 0.818 | 75% | 0.751 | S | S | * | * | trans | -179.8 | 154.6 | 172.4 | -70.5 | 0 | 0 | 0 | 0 | 106 | ||||
| 1216 | P | 48.6 | Very low | 44.1 | Very low | 117 Ų | 117 | 133.8 Ų | 133.8 | 76% | 0.76 | 76% | 0.764 | S | S | * | * | cis | -148.2 | 170 | 25.7 | 43.4 | -24.1 | 0 | 0 | 0 | 119.2 | ||||
| 1217 | S | 32 | Very low | 42.8 | Very low | 116 Ų | 116 | 138.8 Ų | 138.8 | 81% | 0.811 | 78% | 0.779 | S | S | * | * | trans | 63.4 | 175 | 148.7 | -116.4 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 1218 | P | 53.6 | Low | 41.5 | Very low | 106 Ų | 106 | 141.1 Ų | 141.1 | 69% | 0.688 | 79% | 0.786 | S | S | * | * | cis | -134.9 | 179.7 | -10.1 | 40.6 | -24.3 | 0 | 0 | 0 | 116.3 | ||||
| 1219 | T | 32.4 | Very low | 40.6 | Very low | 130 Ų | 130 | 140 Ų | 140 | 80% | 0.798 | 78% | 0.783 | S | S | * | * | trans | 152.9 | 151.5 | 134.7 | -63.2 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 1220 | S | 28 | Very low | 40.8 | Very low | 108 Ų | 108 | 141.9 Ų | 141.9 | 76% | 0.755 | 78% | 0.784 | S | S | * | * | trans | -165.1 | -172.9 | -179.6 | -47.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 1221 | P | 60.7 | Low | 40.2 | Very low | 121 Ų | 121 | 148.3 Ų | 148.3 | 79% | 0.786 | 79% | 0.792 | S | S | * | * | cis | -115.2 | -124.2 | -35.7 | 27.5 | -2.7 | 0 | 0 | 0 | 108.8 | ||||
| 1222 | P | 53.7 | Low | 39.3 | Very low | 107 Ų | 107 | 145.7 Ų | 145.7 | 70% | 0.695 | 78% | 0.782 | S | S | * | * | cis | -136.1 | 178.7 | -30.2 | 41 | -21.7 | 0 | 0 | 0 | 118 | ||||
| 1223 | H | 33.6 | Very low | 39.2 | Very low | 178 Ų | 178 | 140.8 Ų | 140.8 | 82% | 0.824 | 78% | 0.782 | S | S | * | * | trans | -5.6 | 171.1 | 149.4 | -63.3 | -38.3 | 0 | 0 | 0 | 125.2 | ||||
| 1224 | P | 54.2 | Low | 38.8 | Very low | 96 Ų | 96 | 132.3 Ų | 132.3 | 62% | 0.623 | 77% | 0.767 | S | S | * | * | cis | -134.5 | -177 | -14.2 | 35.6 | -16.8 | 0 | 0 | 0 | 115.2 | ||||
| 1225 | F | 32.9 | Very low | 38.9 | Very low | 198 Ų | 198 | 132.9 Ų | 132.9 | 87% | 0.868 | 76% | 0.762 | S | S | * | * | -180 | -168.6 | 122.9 | -98 | -64.4 | 0 | 0 | 0 | 113.6 | |||||
| 1226 | K | 34.2 | Very low | 38.6 | Very low | 178 Ų | 178 | 136.3 Ų | 136.3 | 77% | 0.774 | 76% | 0.763 | S | S | * | * | trans | -138.2 | 144.1 | -152.8 | -79.6 | -177.3 | 177.2 | 177.9 | 0 | 116.4 | ||||
| 1227 | L | 36.1 | Very low | 37.7 | Very low | 152 Ų | 152 | 136.3 Ų | 136.3 | 80% | 0.796 | 77% | 0.766 | S | S | * | * | trans | 64.8 | 161.9 | 153.8 | -59.9 | 163.5 | 0 | 0 | 0 | 115.4 | ||||
| 1228 | Q | 31.3 | Very low | 37.7 | Very low | 177 Ų | 177 | 135.9 Ų | 135.9 | 83% | 0.827 | 76% | 0.763 | S | S | * | * | cis | -152.3 | 159.4 | 11.4 | -150.9 | 171.2 | -50.2 | 0 | 0 | 111.7 | ||||
| 1229 | S | 32.4 | Very low | 37.3 | Very low | 103 Ų | 103 | 136.2 Ų | 136.2 | 72% | 0.72 | 77% | 0.765 | S | S | * | * | trans | -105.5 | 166.8 | 168.1 | -145.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 1230 | P | 49.8 | Very low | 37.7 | Very low | 103 Ų | 103 | 135.9 Ų | 135.9 | 67% | 0.669 | 77% | 0.765 | S | S | * | * | -162.8 | -175.1 | 58.1 | 46.8 | -24.6 | 0 | 0 | 0 | 119.9 | |||||
| 1231 | R | 35.8 | Very low | 38.2 | Very low | 239 Ų | 239 | 138.3 Ų | 138.3 | 90% | 0.902 | 77% | 0.768 | S | S | * | * | trans | 74.3 | 152.8 | 155.3 | -70.9 | -176.6 | 174 | 170.6 | -3.2 | 119.3 | ||||
| 1232 | A | 31.7 | Very low | 36.9 | Very low | 78 Ų | 78 | 137.8 Ų | 137.8 | 65% | 0.645 | 77% | 0.768 | S | S | * | * | cis | -171.8 | 163.6 | -22.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 1233 | S | 33.3 | Very low | 36.8 | Very low | 123 Ų | 123 | 138.4 Ų | 138.4 | 86% | 0.86 | 77% | 0.772 | S | S | * | * | trans | 63.4 | 151.4 | 165.9 | 54.6 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 1234 | G | 31.4 | Very low | 36.6 | Very low | 55 Ų | 55 | 141 Ų | 141 | 57% | 0.567 | 78% | 0.775 | S | S | * | * | cis | 167.7 | 166.3 | -7.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 1235 | F | 34.2 | Very low | 35.7 | Very low | 188 Ų | 188 | 143.3 Ų | 143.3 | 83% | 0.825 | 78% | 0.782 | S | S | * | * | trans | 69.5 | 147.2 | 178.7 | -40.7 | -77.4 | 0 | 0 | 0 | 115.1 | ||||
| 1236 | F | 31.6 | Very low | 35.9 | Very low | 190 Ų | 190 | 140.4 Ų | 140.4 | 83% | 0.833 | 78% | 0.778 | S | S | * | * | cis | -134.1 | 147.7 | 8.2 | -82.1 | -85.2 | 0 | 0 | 0 | 114.3 | ||||
| 1237 | S | 28.1 | Very low | 36 | Very low | 116 Ų | 116 | 138.3 Ų | 138.3 | 81% | 0.811 | 78% | 0.778 | S | S | * | * | trans | 38.8 | 134.2 | 142 | -113.3 | 0 | 0 | 0 | 0 | 124.6 | ||||
| 1238 | S | 32.2 | Very low | 36 | Very low | 107 Ų | 107 | 137.5 Ų | 137.5 | 75% | 0.748 | 78% | 0.777 | S | S | * | * | trans | -108.4 | -170.5 | 150.5 | -38.4 | 0 | 0 | 0 | 0 | 109 | ||||
| 1239 | P | 45.3 | Very low | 36.3 | Very low | 114 Ų | 114 | 135 Ų | 135 | 74% | 0.74 | 77% | 0.773 | S | S | * | * | cis | -120.6 | -159.5 | -11.4 | 37.9 | -16.6 | 0 | 0 | 0 | 111.1 | ||||
| 1240 | P | 41.1 | Very low | 36.5 | Very low | 122 Ų | 122 | 137.1 Ų | 137.1 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | -141 | 167 | 77.4 | 38.5 | -22.2 | 0 | 0 | 0 | 115.4 | |||||
| 1241 | L | 38.1 | Very low | 35.6 | Very low | 159 Ų | 159 | 139.6 Ų | 139.6 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | trans | -102.6 | 154.5 | 164.2 | -75.9 | 167.9 | 0 | 0 | 0 | 110.7 | ||||
| 1242 | S | 33.5 | Very low | 35.6 | Very low | 111 Ų | 111 | 131.9 Ų | 131.9 | 78% | 0.776 | 78% | 0.776 | S | S | * | * | trans | 97.3 | 155.3 | 144.3 | -67.8 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 1243 | P | 51.5 | Low | 35.9 | Very low | 120 Ų | 120 | 136.4 Ų | 136.4 | 78% | 0.779 | 79% | 0.787 | S | S | * | * | cis | -127.6 | 154.2 | 0.6 | 37.7 | -23 | 0 | 0 | 0 | 116 | ||||
| 1244 | R | 30.4 | Very low | 36.1 | Very low | 232 Ų | 232 | 137.6 Ų | 137.6 | 88% | 0.875 | 78% | 0.78 | S | S | * | * | -152.7 | 0 | 121 | -147.2 | 173.7 | -167.4 | 165.3 | 7.7 | 111.1 |
Retrieved 1,244 of 1,244 residues in 385.2 ms
(Link to these results)