| 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 | 36.3 | Very low | 35.9 | Very low | 237 Ų | 237 | 149.5 Ų | 149.5 | 100% | 1.167 | 80% | 0.8 | S | S | * | * | 0 | 98.5 | 0 | -57.6 | 171.3 | -167.3 | 0 | 0 | 105.9 | |||||
| 2 | T | 37.1 | Very low | 36 | Very low | 123 Ų | 123 | 145.1 Ų | 145.1 | 76% | 0.755 | 80% | 0.8 | S | S | * | * | trans | 36.8 | 106.9 | 159.1 | 51.2 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 3 | N | 32 | Very low | 36 | Very low | 158 Ų | 158 | 142.9 Ų | 142.9 | 85% | 0.845 | 80% | 0.797 | S | S | * | * | 81 | 114.9 | 74.4 | -60.1 | -12.2 | 0 | 0 | 0 | 114.4 | |||||
| 4 | E | 40.9 | Very low | 35.8 | Very low | 175 Ų | 175 | 146.4 Ų | 146.4 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -61.5 | 170.1 | 163.9 | -70.1 | -172.9 | 89.6 | 0 | 0 | 112.5 | ||||
| 5 | P | 44.5 | Very low | 35.4 | Very low | 125 Ų | 125 | 145.8 Ų | 145.8 | 81% | 0.812 | 79% | 0.789 | S | S | * | * | cis | -157.2 | -179.9 | 47.6 | 41.2 | -15.8 | 0 | 0 | 0 | 120.7 | ||||
| 6 | I | 41.6 | Very low | 35.7 | Very low | 151 Ų | 151 | 143.8 Ų | 143.8 | 77% | 0.774 | 79% | 0.786 | S | S | * | * | trans | -45.3 | 148.8 | 167.2 | -62.5 | 150.5 | 0 | 0 | 0 | 115 | ||||
| 7 | K | 34.5 | Very low | 35.5 | Very low | 157 Ų | 157 | 143.6 Ų | 143.6 | 68% | 0.683 | 78% | 0.784 | S | S | * | * | trans | 155 | 116.9 | 133 | 177.2 | -175.5 | 177.5 | -158.1 | 0 | 116.3 | ||||
| 8 | E | 30.9 | Very low | 35.5 | Very low | 153 Ų | 153 | 141.8 Ų | 141.8 | 72% | 0.715 | 78% | 0.78 | S | S | * | * | trans | 52.7 | 156.1 | 133.2 | -51.8 | -179.7 | 131.3 | 0 | 0 | 127.1 | ||||
| 9 | I | 36.3 | Very low | 35.4 | Very low | 129 Ų | 129 | 141.9 Ų | 141.9 | 66% | 0.662 | 79% | 0.785 | S | S | * | * | trans | 100.1 | 112.1 | 144.3 | -65 | 137.6 | 0 | 0 | 0 | 119.2 | ||||
| 10 | L | 32.3 | Very low | 35.5 | Very low | 170 Ų | 170 | 141.4 Ų | 141.4 | 89% | 0.89 | 79% | 0.786 | S | S | * | * | 39.7 | 128.4 | 126.9 | -163.7 | 69.2 | 0 | 0 | 0 | 120.8 | |||||
| 11 | G | 28.7 | Very low | 35.5 | Very low | 66 Ų | 66 | 139.7 Ų | 139.7 | 68% | 0.68 | 79% | 0.79 | S | S | * | * | trans | 107.9 | 119.4 | 132.6 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 12 | A | 37 | Very low | 35.3 | Very low | 97 Ų | 97 | 136.6 Ų | 136.6 | 80% | 0.802 | 77% | 0.773 | S | S | * | * | trans | 42 | 137.3 | 144.4 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 13 | P | 35.5 | Very low | 35 | Very low | 117 Ų | 117 | 139.4 Ų | 139.4 | 76% | 0.76 | 78% | 0.775 | S | S | * | * | trans | -140 | 158.4 | 131.4 | 35.1 | -21.2 | 0 | 0 | 0 | 112.3 | ||||
| 14 | K | 33.2 | Very low | 34.9 | Very low | 191 Ų | 191 | 137.1 Ų | 137.1 | 83% | 0.83 | 77% | 0.771 | S | S | * | * | cis | -169.6 | 137.2 | -14.3 | -106 | 164.6 | -177.4 | 157.2 | 0 | 103.9 | ||||
| 15 | H | 30.7 | Very low | 35.1 | Very low | 138 Ų | 138 | 135 Ų | 135 | 64% | 0.639 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 144.6 | 169.2 | 173.7 | -90.8 | 0 | 0 | 0 | 110.7 | D17 | H15-D17 IonicContact ND1-OD1 3.16Š|
| 16 | P | 39.8 | Very low | 34.8 | Very low | 114 Ų | 114 | 134.6 Ų | 134.6 | 74% | 0.74 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -101.1 | 133.1 | 159.9 | 9.1 | 10.6 | 0 | 0 | 0 | 111.7 | ||
| 17 | D | 31.5 | Very low | 35.1 | Very low | 141 Ų | 141 | 134.8 Ų | 134.8 | 75% | 0.754 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 153.2 | -166.1 | -52.5 | -56 | 0 | 0 | 0 | 116.5 | H15 | H15-D17 IonicContact ND1-OD1 3.16Š|
| 18 | P | 35.5 | Very low | 34.9 | Very low | 110 Ų | 110 | 134.5 Ų | 134.5 | 71% | 0.714 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -90.6 | 134.3 | 164.8 | 34.1 | -31.5 | 0 | 0 | 0 | 112.3 | ||
| 19 | V | 34.3 | Very low | 35.3 | Very low | 145 Ų | 145 | 132.7 Ų | 132.7 | 88% | 0.879 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 135.4 | 171.4 | 162.9 | 0 | 0 | 0 | 0 | 111.3 | ||
| 20 | T | 37.2 | Very low | 35.4 | Very low | 130 Ų | 130 | 132.3 Ų | 132.3 | 80% | 0.798 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 139.8 | 178.9 | -24.6 | 0 | 0 | 0 | 0 | 114 | ||
| 21 | A | 34.8 | Very low | 35.9 | Very low | 106 Ų | 106 | 130.2 Ų | 130.2 | 88% | 0.876 | 76% | 0.76 | S | S | * | * | trans | -150.1 | 117.5 | 146.6 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 22 | E | 32.4 | Very low | 36.5 | Very low | 173 Ų | 173 | 132.1 Ų | 132.1 | 81% | 0.808 | 76% | 0.758 | S | S | * | * | trans | -87.8 | 152.7 | -179.4 | -170.3 | -161.3 | 92.9 | 0 | 0 | 111.3 | ||||
| 23 | K | 30.9 | Very low | 36.9 | Very low | 181 Ų | 181 | 132.9 Ų | 132.9 | 79% | 0.787 | 75% | 0.753 | S | S | * | * | trans | 89 | 111.8 | 151 | -158.4 | 175.9 | -177 | 177.4 | 0 | 119.2 | ||||
| 24 | S | 31.2 | Very low | 37.4 | Very low | 110 Ų | 110 | 134 Ų | 134 | 77% | 0.769 | 75% | 0.751 | S | S | * | * | 158.1 | 143.3 | 106.7 | -167 | 0 | 0 | 0 | 0 | 111.7 | |||||
| 25 | N | 43.4 | Very low | 37.9 | Very low | 131 Ų | 131 | 129.4 Ų | 129.4 | 70% | 0.701 | 74% | 0.741 | S | S | * | * | trans | -55.9 | 138.1 | -178.9 | -160.3 | -9 | 0 | 0 | 0 | 113.7 | ||||
| 26 | N | 38.1 | Very low | 38.7 | Very low | 117 Ų | 117 | 129.9 Ų | 129.9 | 63% | 0.626 | 75% | 0.747 | S | S | * | * | 157.1 | 125.2 | 127.8 | -76.8 | -29.3 | 0 | 0 | 0 | 111.2 | D28 | N26-D28 PolarHBondContact O-N 3.24Å; N26-D28 VanDerWaalsContact O-N 3.16Å | |||
| 27 | N | 48.2 | Very low | 38.8 | Very low | 155 Ų | 155 | 129.5 Ų | 129.5 | 83% | 0.829 | 74% | 0.742 | S | S | * | * | trans | 6.9 | 87.4 | 156.4 | -47.3 | -54.7 | 0 | 0 | 0 | 117.2 | ||||
| 28 | D | 30.9 | Very low | 39.7 | Very low | 150 Ų | 150 | 124.7 Ų | 124.7 | 80% | 0.802 | 72% | 0.72 | S | S | * | * | trans | -129.8 | 122.6 | 158.8 | -82.3 | -46 | 0 | 0 | 0 | 108.7 | N26 V30 | N26-D28 PolarHBondContact O-N 3.24Å; N26-D28 VanDerWaalsContact O-N 3.16Å; D28-V30 PolarHBondContact O-N 3.42Å | ||
| 29 | C | 39.9 | Very low | 40.4 | Very low | 115 Ų | 115 | 125.8 Ų | 125.8 | 78% | 0.777 | 72% | 0.716 | S | S | * | * | trans | -45.2 | 110 | 168.7 | 177.9 | 0 | 0 | 0 | 0 | 108.1 | I31 | C29-I31 PolarHBondContact O-N 3.14Š| ||
| 30 | V | 36.6 | Very low | 41.2 | Very low | 121 Ų | 121 | 122.9 Ų | 122.9 | 73% | 0.733 | 70% | 0.701 | S | S | * | * | trans | -66.4 | 85.7 | 165.7 | 177.4 | 0 | 0 | 0 | 0 | 105.5 | D28 T32 | D28-V30 PolarHBondContact O-N 3.42Å; V30-T32 PolarHBondContact O-N 3.27Å | ||
| 31 | I | 43.1 | Very low | 41.7 | Very low | 127 Ų | 127 | 123.3 Ų | 123.3 | 65% | 0.651 | 69% | 0.694 | S | S | * | * | trans | -53.6 | 99.8 | 148.6 | -62.3 | 178.2 | 0 | 0 | 0 | 102.6 | C29 T33 | C29-I31 PolarHBondContact O-N 3.14Å; I31-T33 HydrophobicContact CG2-CG2 3.98Å; I31-T33 PolarHBondContact O-N 3.03Å | ||
| 32 | T | 41.2 | Very low | 42.5 | Very low | 105 Ų | 105 | 123.9 Ų | 123.9 | 64% | 0.644 | 68% | 0.681 | S | S | * | * | trans | -64.5 | 84.2 | 169.2 | -61 | 0 | 0 | 0 | 0 | 104.3 | V30 I34 | V30-T32 PolarHBondContact O-N 3.27Å; T32-I34 HydrophobicContact CG2-CG1 3.85Å; T32-I34 PolarHBondContact O-N 2.9Å | ||
| 33 | T | 45.8 | Very low | 43.5 | Very low | 113 Ų | 113 | 117.8 Ų | 117.8 | 69% | 0.693 | 66% | 0.656 | S | S | * | * | trans | -64.1 | 83.1 | 159.6 | 44.2 | 0 | 0 | 0 | 0 | 103.7 | I31 P35 | I31-T33 HydrophobicContact CG2-CG2 3.98Å; I31-T33 PolarHBondContact O-N 3.03Å; T33-P35 VanDerWaalsContact C-N 3.3Å; T33-P35 WeakPolarHBondContact O-CD 3.41Å | ||
| 34 | I | 46.2 | Very low | 44.6 | Very low | 141 Ų | 141 | 112.9 Ų | 112.9 | 72% | 0.723 | 65% | 0.65 | S | S | * | * | trans | -48.6 | 105 | 167 | -61.9 | 175 | 0 | 0 | 0 | 103.3 | T32 L36 | T32-I34 HydrophobicContact CG2-CG1 3.85Å; T32-I34 PolarHBondContact O-N 2.9Å; I34-L36 PolarHBondContact O-N 3.05Å | ||
| 35 | P | 44.2 | Very low | 45.7 | Very low | 94 Ų | 94 | 111.9 Ų | 111.9 | 61% | 0.61 | 65% | 0.648 | S | S | * | * | trans | -63.4 | 127.3 | 179.4 | 24.5 | -25.1 | 0 | 0 | 0 | 103.2 | T33 V37 | T33-P35 VanDerWaalsContact C-N 3.3Å; T33-P35 WeakPolarHBondContact O-CD 3.41Å; P35-V37 HydrophobicContact CB-CG2 4.15Å; P35-V37 HydrophobicContact CG-CG2 4.05Å; P35-V37 PolarHBondContact O-N 3.47Å | ||
| 36 | L | 47.6 | Very low | 46.4 | Very low | 149 Ų | 149 | 109.6 Ų | 109.6 | 78% | 0.78 | 64% | 0.639 | S | S | * | * | trans | -58.8 | 57.5 | 171.6 | -174.6 | 69.6 | 0 | 0 | 0 | 109.1 | I34 S38 | I34-L36 PolarHBondContact O-N 3.05Å; L36-S38 VanDerWaalsContact C-N 3.26Å; L36-S38 WeakPolarHBondContact O-CA 3.04Å; L36-S38 PolarHBondContact O-N 3.48Å | ||
| 37 | V | 42.2 | Very low | 47.1 | Very low | 105 Ų | 105 | 107.4 Ų | 107.4 | 64% | 0.636 | 64% | 0.644 | S | S | * | * | trans | -66.3 | 99.4 | 171 | 173.4 | 0 | 0 | 0 | 0 | 103.2 | P35 | P35-V37 HydrophobicContact CB-CG2 4.15Å; P35-V37 HydrophobicContact CG-CG2 4.05Å; P35-V37 PolarHBondContact O-N 3.47Å | ||
| 38 | S | 50 | Low | 47.5 | Very low | 41 Ų | 41 | 101 Ų | 101 | 29% | 0.287 | 62% | 0.615 | S | S | . | * | trans | -43.6 | 131.9 | -149.9 | 67.6 | 0 | 0 | 0 | 0 | 114.2 | L36 C40 Q41 | L36-S38 VanDerWaalsContact C-N 3.26Å; L36-S38 WeakPolarHBondContact O-CA 3.04Å; L36-S38 PolarHBondContact O-N 3.48Å; S38-C40 PolarHBondContact O-N 3.44Å; S38-C40 WeakPolarHBondContact OG-CB 3.39Å; S38-Q41 PolarHBondContact O-N 3.08Å; S38-Q41 VanDerWaalsContact OG-CG 3.3Å; S38-Q41 WeakPolarHBondContact OG-CG 3.36Å; S38-Q41 PolarHBondContact OG-N 3.39Å; S38-Q41 VanDerWaalsContact OG-N 3.07Å | ||
| 39 | E | 49.8 | Very low | 48.5 | Very low | 133 Ų | 133 | 96.6 Ų | 96.6 | 62% | 0.621 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -43.9 | -29.6 | 155.8 | -54.2 | -174.4 | 96.2 | 0 | 0 | 111.2 | Q41 L42 T43 | E39-Q41 PolarHBondContact O-N 3.01Å; E39-L42 PolarHBondContact O-N 2.95Å; E39-T43 WeakPolarHBondContact O-CB 3.42Å; E39-T43 PolarHBondContact O-N 3.36Å; E39-T43 PolarHBondContact O-OG1 3.38Å |
| 40 | C | 51.5 | Low | 49.1 | Very low | 84 Ų | 84 | 93.8 Ų | 93.8 | 57% | 0.568 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -59.1 | -38.8 | 175 | -162.6 | 0 | 0 | 0 | 0 | 114.6 | S38 A44 | S38-C40 PolarHBondContact O-N 3.44Å; S38-C40 WeakPolarHBondContact OG-CB 3.39Å; C40-A44 VanDerWaalsContact O-CB 3.29Å; C40-A44 WeakPolarHBondContact O-CB 3.43Å; C40-A44 PolarHBondContact O-N 2.82Å |
| 41 | Q | 47.5 | Very low | 50 | Low | 139 Ų | 139 | 92.2 Ų | 92.2 | 65% | 0.65 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -75.3 | -36.2 | 177.4 | -69 | -127.6 | 81.4 | 0 | 0 | 111.1 | S38 E39 A44 A45 | S38-Q41 PolarHBondContact O-N 3.08Å; S38-Q41 VanDerWaalsContact OG-CG 3.3Å; S38-Q41 WeakPolarHBondContact OG-CG 3.36Å; S38-Q41 PolarHBondContact OG-N 3.39Å; S38-Q41 VanDerWaalsContact OG-N 3.07Å; E39-Q41 PolarHBondContact O-N 3.01Å; Q41-A44 PolarHBondContact O-N 3.19Å; Q41-A45 WeakPolarHBondContact O-CB 3.36Å; Q41-A45 PolarHBondContact O-N 3.28Å |
| 42 | L | 51.5 | Low | 50.5 | Low | 117 Ų | 117 | 90 Ų | 90 | 61% | 0.613 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -67.5 | -38.4 | 171.8 | -85.1 | 83.8 | 0 | 0 | 0 | 112.1 | E39 T46 | E39-L42 PolarHBondContact O-N 2.95Å; L42-T46 WeakPolarHBondContact O-CB 3.02Å; L42-T46 WeakPolarHBondContact O-CG2 3.2Å; L42-T46 PolarHBondContact O-N 3.21Å; L42-T46 PolarHBondContact O-OG1 3.13Å |
| 43 | T | 54.6 | Low | 51 | Low | 45 Ų | 45 | 88.8 Ų | 88.8 | 28% | 0.276 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.6 | -42.9 | 173.6 | -66.8 | 0 | 0 | 0 | 0 | 112 | E39 G47 G48 E50 | E39-T43 WeakPolarHBondContact O-CB 3.42Å; E39-T43 PolarHBondContact O-N 3.36Å; E39-T43 PolarHBondContact O-OG1 3.38Å; T43-G47 PolarHBondContact O-N 3.23Å; T43-G47 VanDerWaalsContact O-N 3.09Å; T43-G48 PolarHBondContact O-N 3.03Å; T43-E50 WeakPolarHBondContact CB-OE1 3.38Å; T43-E50 WeakPolarHBondContact CG2-OE1 3.29Å; T43-E50 PolarHBondContact OG1-OE1 3.26Å |
| 44 | A | 53.1 | Low | 51.6 | Low | 79 Ų | 79 | 85.6 Ų | 85.6 | 65% | 0.653 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -70 | -39.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | C40 Q41 T46 | C40-A44 VanDerWaalsContact O-CB 3.29Å; C40-A44 WeakPolarHBondContact O-CB 3.43Å; C40-A44 PolarHBondContact O-N 2.82Å; Q41-A44 PolarHBondContact O-N 3.19Å; A44-T46 VanDerWaalsContact C-N 3.31Å; A44-T46 PolarHBondContact O-N 2.97Å |
| 45 | A | 54.4 | Low | 52.1 | Low | 89 Ų | 89 | 86.8 Ų | 86.8 | 74% | 0.736 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -69.5 | -26.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q41 | Q41-A45 WeakPolarHBondContact O-CB 3.36Å; Q41-A45 PolarHBondContact O-N 3.28Å |
| 46 | T | 57.9 | Low | 52.6 | Low | 83 Ų | 83 | 85.5 Ų | 85.5 | 51% | 0.509 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -106.3 | 9 | -178.9 | 60.9 | 0 | 0 | 0 | 0 | 113.9 | L42 A44 G48 A49 | L42-T46 WeakPolarHBondContact O-CB 3.02Å; L42-T46 WeakPolarHBondContact O-CG2 3.2Å; L42-T46 PolarHBondContact O-N 3.21Å; L42-T46 PolarHBondContact O-OG1 3.13Å; A44-T46 VanDerWaalsContact C-N 3.31Å; A44-T46 PolarHBondContact O-N 2.97Å; T46-G48 VanDerWaalsContact C-N 3.26Å; T46-G48 PolarHBondContact O-N 3.2Å; T46-A49 WeakPolarHBondContact O-CB 3.44Å; T46-A49 PolarHBondContact O-N 3.09Å |
| 47 | G | 52.1 | Low | 53.4 | Low | 71 Ų | 71 | 82.2 Ų | 82.2 | 73% | 0.732 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61 | 28.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | T43 A49 | T43-G47 PolarHBondContact O-N 3.23Å; T43-G47 VanDerWaalsContact O-N 3.09Å; G47-A49 VanDerWaalsContact C-N 3.3Å; G47-A49 PolarHBondContact O-N 3Å |
| 48 | G | 57.3 | Low | 54.7 | Low | 21 Ų | 21 | 78.8 Ų | 78.8 | 22% | 0.216 | 48% | 0.481 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 70.1 | 21.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | T43 T46 E50 L51 | T43-G48 PolarHBondContact O-N 3.03Å; T46-G48 VanDerWaalsContact C-N 3.26Å; T46-G48 PolarHBondContact O-N 3.2Å; G48-E50 PolarHBondContact O-N 3.27Å; G48-L51 PolarHBondContact O-N 3.34Å; G48-L51 VanDerWaalsContact O-N 3.09Å |
| 49 | A | 52.5 | Low | 55.7 | Low | 56 Ų | 56 | 80 Ų | 80 | 46% | 0.463 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -54.8 | -21 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | T46 G47 L51 S52 C53 | T46-A49 WeakPolarHBondContact O-CB 3.44Å; T46-A49 PolarHBondContact O-N 3.09Å; G47-A49 VanDerWaalsContact C-N 3.3Å; G47-A49 PolarHBondContact O-N 3Å; A49-L51 VanDerWaalsContact C-N 3.3Å; A49-L51 PolarHBondContact O-N 3.37Å; A49-S52 PolarHBondContact O-N 3.18Å; A49-C53 WeakPolarHBondContact O-CB 3.29Å; A49-C53 PolarHBondContact O-N 3.46Å |
| 50 | E | 52.3 | Low | 56.7 | Low | 57 Ų | 57 | 80.5 Ų | 80.5 | 27% | 0.266 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.9 | -22.4 | 175.7 | 63.8 | -162.2 | 133.2 | 0 | 0 | 115.6 | T43 G48 R110 | T43-E50 WeakPolarHBondContact CB-OE1 3.38Å; T43-E50 WeakPolarHBondContact CG2-OE1 3.29Å; T43-E50 PolarHBondContact OG1-OE1 3.26Å; G48-E50 PolarHBondContact O-N 3.27Å; E50-R110 IonicContact OE2-CZ 2.82Å; E50-R110 IonicContact OE2-NH1 3.79Å; E50-R110 PolarHBondContact OE2-NH1 3.19Å; E50-R110 IonicContact OE2-NH2 2.62Å; E50-R110 PolarHBondContact OE2-NH2 3.32Å |
| 51 | L | 55.8 | Low | 57.9 | Low | 88 Ų | 88 | 77.4 Ų | 77.4 | 46% | 0.461 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -83.8 | -33.2 | 175.6 | -99 | 139.8 | 0 | 0 | 0 | 112.3 | G48 A49 K114 | G48-L51 PolarHBondContact O-N 3.34Å; G48-L51 VanDerWaalsContact O-N 3.09Å; A49-L51 VanDerWaalsContact C-N 3.3Å; A49-L51 PolarHBondContact O-N 3.37Å; L51-K114 VanDerWaalsContact CG-NZ 3.34Å |
| 52 | S | 53 | Low | 59.4 | Low | 79 Ų | 79 | 73.8 Ų | 73.8 | 55% | 0.552 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -86.6 | -35.6 | -173.6 | -60 | 0 | 0 | 0 | 0 | 111.8 | A49 Y54 R55 C56 | A49-S52 PolarHBondContact O-N 3.18Å; S52-Y54 VanDerWaalsContact C-N 3.3Å; S52-Y54 PolarHBondContact O-N 3.09Å; S52-R55 PolarHBondContact O-N 3.44Å; S52-C56 PolarHBondContact O-N 3.14Å; S52-C56 PolarHBondContact O-SG 2.97Å |
| 53 | C | 52.3 | Low | 60.8 | Low | 81 Ų | 81 | 72.9 Ų | 72.9 | 55% | 0.547 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.6 | -39.3 | 177.7 | -169.5 | 0 | 0 | 0 | 0 | 111.7 | A49 C56 T57 | A49-C53 WeakPolarHBondContact O-CB 3.29Å; A49-C53 PolarHBondContact O-N 3.46Å; C53-C56 PolarHBondContact O-N 3.45Å; C53-T57 WeakPolarHBondContact O-CB 3.48Å; C53-T57 PolarHBondContact O-N 3.26Å; C53-T57 PolarHBondContact O-OG1 3.05Å |
| 54 | Y | 57.4 | Low | 62.1 | Low | 45 Ų | 45 | 76.7 Ų | 76.7 | 18% | 0.176 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -77.9 | -30.1 | -178.2 | -156.7 | -114.1 | 0 | 0 | 0 | 113.8 | S52 C56 V58 S103 A104 W107 | S52-Y54 VanDerWaalsContact C-N 3.3Å; S52-Y54 PolarHBondContact O-N 3.09Å; Y54-C56 PolarHBondContact O-N 2.92Å; Y54-V58 HydrophobicContact CD1-CG2 3.71Å; Y54-V58 HydrophobicContact CD2-CG2 3.96Å; Y54-V58 HydrophobicContact CE1-CG2 3.28Å; Y54-V58 HydrophobicContact CE2-CG2 3.47Å; Y54-V58 VanDerWaalsContact CE2-CG2 3.47Å; Y54-V58 HydrophobicContact CG-CG2 4.01Å; Y54-V58 WeakPolarHBondContact O-CB 3.45Å; Y54-V58 WeakPolarHBondContact O-CG2 3.4Å; Y54-V58 PolarHBondContact O-N 3.48Å; Y54-V58 VanDerWaalsContact OH-CG2 3.25Å; Y54-V58 WeakPolarHBondContact OH-CG2 3.23Å; Y54-S103 WeakPolarHBondContact CE2-OG 3.38Å; Y54-S103 VanDerWaalsContact CZ-OG 3.24Å; Y54-S103 WeakPolarHBondContact OH-CA 3.11Å; Y54-S103 WeakPolarHBondContact OH-CB 3.1Å; Y54-S103 PolarHBondContact OH-O 2.98Å; Y54-S103 PolarHBondContact OH-OG 2.87Å; Y54-S103 VanDerWaalsContact OH-OG 3.11Å; Y54-A104 PolarHBondContact OH-N 3.35Å; Y54-W107 HydrophobicContact CD1-CB 3.89Å; Y54-W107 AromaticContact CD1-CD2 3.51Å; Y54-W107 HydrophobicContact CD1-CD2 3.51Å; Y54-W107 AromaticContact CD1-CE3 3.23Å; Y54-W107 HydrophobicContact CD1-CE3 3.23Å; Y54-W107 AromaticContact CD1-CG 3.87Å; Y54-W107 HydrophobicContact CD1-CG 3.87Å; Y54-W107 HydrophobicContact CD1-CH2 4.25Å; Y54-W107 AromaticContact CD1-CZ3 3.59Å; Y54-W107 HydrophobicContact CD1-CZ3 3.59Å; Y54-W107 HydrophobicContact CE1-CB 3.47Å; Y54-W107 VanDerWaalsContact CE1-CB 3.47Å; Y54-W107 AromaticContact CE1-CD2 3.65Å; Y54-W107 HydrophobicContact CE1-CD2 3.65Å; Y54-W107 AromaticContact CE1-CE3 3.17Å; Y54-W107 HydrophobicContact CE1-CE3 3.17Å; Y54-W107 AromaticContact CE1-CG 3.87Å; Y54-W107 HydrophobicContact CE1-CG 3.87Å; Y54-W107 AromaticContact CE1-CZ3 3.83Å; Y54-W107 HydrophobicContact CE1-CZ3 3.83Å |
| 55 | R | 57 | Low | 63.4 | Low | 166 Ų | 166 | 74.2 Ų | 74.2 | 63% | 0.626 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -64.7 | -27.4 | 174.8 | -93.3 | -79.3 | 170.7 | 123.5 | -0.6 | 113 | S52 P59 W107 | S52-R55 PolarHBondContact O-N 3.44Å; R55-P59 WeakPolarHBondContact O-CD 3.39Å; R55-P59 VanDerWaalsContact O-CG 3.26Å; R55-P59 WeakPolarHBondContact O-CG 3.26Å; R55-W107 HydrophobicContact CB-CH2 4.47Å; R55-W107 HydrophobicContact CG-CH2 3.64Å; R55-W107 HydrophobicContact CG-CZ2 3.93Å; R55-W107 VanDerWaalsContact NE-CH2 3.27Å |
| 56 | C | 54.5 | Low | 64.7 | Low | 67 Ų | 67 | 74.5 Ų | 74.5 | 45% | 0.453 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -93.2 | -47.6 | 177.6 | -51.2 | 0 | 0 | 0 | 0 | 111.4 | S52 C53 Y54 V58 P59 F60 | S52-C56 PolarHBondContact O-N 3.14Å; S52-C56 PolarHBondContact O-SG 2.97Å; C53-C56 PolarHBondContact O-N 3.45Å; Y54-C56 PolarHBondContact O-N 2.92Å; C56-V58 VanDerWaalsContact C-N 3.26Å; C56-V58 PolarHBondContact O-N 3.3Å; C56-P59 WeakPolarHBondContact O-CD 3.1Å; C56-P59 VanDerWaalsContact O-CG 3.23Å; C56-P59 WeakPolarHBondContact O-CG 3.12Å; C56-F60 HydrophobicContact CB-CD2 4.41Å; C56-F60 WeakPolarHBondContact O-CD2 3.37Å; C56-F60 PolarHBondContact O-N 3.48Å |
| 57 | T | 65.1 | Low | 66 | Low | 81 Ų | 81 | 73 Ų | 73 | 50% | 0.497 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -65.7 | -28.4 | -175.1 | -56.4 | 0 | 0 | 0 | 0 | 113.1 | C53 G61 | C53-T57 WeakPolarHBondContact O-CB 3.48Å; C53-T57 PolarHBondContact O-N 3.26Å; C53-T57 PolarHBondContact O-OG1 3.05Å; T57-G61 WeakPolarHBondContact O-CA 3.46Å; T57-G61 PolarHBondContact O-N 3.44Å |
| 58 | V | 69.9 | Low | 67.4 | Low | 33 Ų | 33 | 71 Ų | 71 | 20% | 0.2 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -64.8 | -59.3 | 176.2 | 173.2 | 0 | 0 | 0 | 0 | 112.6 | Y54 C56 F60 G61 V62 W107 | Y54-V58 HydrophobicContact CD1-CG2 3.71Å; Y54-V58 HydrophobicContact CD2-CG2 3.96Å; Y54-V58 HydrophobicContact CE1-CG2 3.28Å; Y54-V58 HydrophobicContact CE2-CG2 3.47Å; Y54-V58 VanDerWaalsContact CE2-CG2 3.47Å; Y54-V58 HydrophobicContact CG-CG2 4.01Å; Y54-V58 WeakPolarHBondContact O-CB 3.45Å; Y54-V58 WeakPolarHBondContact O-CG2 3.4Å; Y54-V58 PolarHBondContact O-N 3.48Å; Y54-V58 VanDerWaalsContact OH-CG2 3.25Å; Y54-V58 WeakPolarHBondContact OH-CG2 3.23Å; C56-V58 VanDerWaalsContact C-N 3.26Å; C56-V58 PolarHBondContact O-N 3.3Å; V58-F60 VanDerWaalsContact C-N 3.34Å; V58-F60 PolarHBondContact O-N 2.96Å; V58-G61 PolarHBondContact O-N 2.95Å; V58-V62 VanDerWaalsContact O-CG2 3.27Å; V58-V62 WeakPolarHBondContact O-CG2 3.14Å; V58-V62 PolarHBondContact O-N 3.37Å; V58-W107 HydrophobicContact CB-CZ3 4.41Å; V58-W107 HydrophobicContact CG2-CE3 4.32Å; V58-W107 HydrophobicContact CG2-CZ3 4.04Å |
| 59 | P | 69.8 | Low | 68.6 | Low | 66 Ų | 66 | 72.6 Ų | 72.6 | 43% | 0.429 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.8 | -40.6 | -179.9 | 23.4 | -33.7 | 0 | 0 | 0 | 112.1 | R55 C56 V62 V63 | R55-P59 WeakPolarHBondContact O-CD 3.39Å; R55-P59 VanDerWaalsContact O-CG 3.26Å; R55-P59 WeakPolarHBondContact O-CG 3.26Å; C56-P59 WeakPolarHBondContact O-CD 3.1Å; C56-P59 VanDerWaalsContact O-CG 3.23Å; C56-P59 WeakPolarHBondContact O-CG 3.12Å; P59-V62 PolarHBondContact O-N 3.22Å; P59-V63 WeakPolarHBondContact O-CG2 3.34Å; P59-V63 PolarHBondContact O-N 3.22Å; P59-V63 VanDerWaalsContact O-N 3.09Å |
| 60 | F | 70.1 | Confident | 70 | Confident | 144 Ų | 144 | 73.9 Ų | 73.9 | 63% | 0.632 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -64.5 | -41.5 | 176.3 | -76.4 | -69 | 0 | 0 | 0 | 112.1 | C56 V58 V63 I64 | C56-F60 HydrophobicContact CB-CD2 4.41Å; C56-F60 WeakPolarHBondContact O-CD2 3.37Å; C56-F60 PolarHBondContact O-N 3.48Å; V58-F60 VanDerWaalsContact C-N 3.34Å; V58-F60 PolarHBondContact O-N 2.96Å; F60-V63 PolarHBondContact O-N 3.24Å; F60-I64 VanDerWaalsContact O-CG1 3.29Å; F60-I64 WeakPolarHBondContact O-CG1 3.46Å; F60-I64 PolarHBondContact O-N 3.5Å |
| 61 | G | 76.9 | Confident | 71.4 | Confident | 19 Ų | 19 | 76 Ų | 76 | 20% | 0.196 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -65 | -39.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | T57 V58 I64 L65 | T57-G61 WeakPolarHBondContact O-CA 3.46Å; T57-G61 PolarHBondContact O-N 3.44Å; V58-G61 PolarHBondContact O-N 2.95Å; G61-I64 PolarHBondContact O-N 3.49Å; G61-L65 VanDerWaalsContact O-CB 3.27Å; G61-L65 WeakPolarHBondContact O-CB 3.39Å; G61-L65 PolarHBondContact O-N 2.91Å |
| 62 | V | 79.7 | Confident | 72.5 | Confident | 62 Ų | 62 | 73.7 Ų | 73.7 | 38% | 0.376 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -63.2 | -45.2 | 175 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | V58 P59 L65 I66 L100 | V58-V62 VanDerWaalsContact O-CG2 3.27Å; V58-V62 WeakPolarHBondContact O-CG2 3.14Å; V58-V62 PolarHBondContact O-N 3.37Å; P59-V62 PolarHBondContact O-N 3.22Å; V62-L65 PolarHBondContact O-N 3.35Å; V62-I66 HydrophobicContact CG1-CD1 3.73Å; V62-I66 HydrophobicContact CG1-CG1 4.41Å; V62-I66 VanDerWaalsContact O-CG1 3.25Å; V62-I66 WeakPolarHBondContact O-CG1 3.21Å; V62-I66 PolarHBondContact O-N 3.07Å; V62-L100 HydrophobicContact CG2-CD1 4.17Å |
| 63 | V | 80.3 | Confident | 73.5 | Confident | 98 Ų | 98 | 72.1 Ų | 72.1 | 59% | 0.594 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -63.2 | -45.4 | 178.8 | 174.4 | 0 | 0 | 0 | 0 | 111.3 | P59 F60 L65 I66 A67 | P59-V63 WeakPolarHBondContact O-CG2 3.34Å; P59-V63 PolarHBondContact O-N 3.22Å; P59-V63 VanDerWaalsContact O-N 3.09Å; F60-V63 PolarHBondContact O-N 3.24Å; V63-L65 VanDerWaalsContact C-N 3.3Å; V63-L65 PolarHBondContact O-N 2.99Å; V63-I66 PolarHBondContact O-N 3.35Å; V63-A67 PolarHBondContact O-N 2.95Å |
| 64 | I | 81.9 | Confident | 74.7 | Confident | 125 Ų | 125 | 71.5 Ų | 71.5 | 64% | 0.641 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -62.5 | -39.9 | 176.7 | -66.8 | 167.8 | 0 | 0 | 0 | 110.8 | F60 G61 A67 G68 | F60-I64 VanDerWaalsContact O-CG1 3.29Å; F60-I64 WeakPolarHBondContact O-CG1 3.46Å; F60-I64 PolarHBondContact O-N 3.5Å; G61-I64 PolarHBondContact O-N 3.49Å; I64-A67 PolarHBondContact O-N 2.96Å; I64-G68 PolarHBondContact O-N 3.41Å |
| 65 | L | 80.5 | Confident | 75.5 | Confident | 28 Ų | 28 | 71.9 Ų | 71.9 | 15% | 0.147 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -65.8 | -44.1 | 178 | -172 | 137.3 | 0 | 0 | 0 | 111.6 | G61 V62 V63 A67 G68 V69 L97 L100 | G61-L65 VanDerWaalsContact O-CB 3.27Å; G61-L65 WeakPolarHBondContact O-CB 3.39Å; G61-L65 PolarHBondContact O-N 2.91Å; V62-L65 PolarHBondContact O-N 3.35Å; V63-L65 VanDerWaalsContact C-N 3.3Å; V63-L65 PolarHBondContact O-N 2.99Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 2.67Å; L65-G68 PolarHBondContact O-N 3.36Å; L65-V69 HydrophobicContact CD2-CG2 3.93Å; L65-V69 VanDerWaalsContact O-CG2 3.31Å; L65-V69 WeakPolarHBondContact O-CG2 3.48Å; L65-V69 PolarHBondContact O-N 3.44Å; L65-L97 HydrophobicContact CD1-CD2 4.31Å; L65-L97 HydrophobicContact CD1-CG 4.1Å; L65-L97 HydrophobicContact CD2-CD2 3.61Å; L65-L97 HydrophobicContact CD2-CG 3.94Å; L65-L100 HydrophobicContact CB-CD1 3.89Å; L65-L100 HydrophobicContact CD1-CD1 3.57Å; L65-L100 HydrophobicContact CD1-CG 4.17Å; L65-L100 HydrophobicContact CG-CD1 4.19Å |
| 66 | I | 83.1 | Confident | 76.2 | Confident | 94 Ų | 94 | 68.1 Ų | 68.1 | 48% | 0.482 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60.8 | -44.8 | 176.6 | -67.3 | 163.9 | 0 | 0 | 0 | 110.4 | V62 V63 G68 V69 V70 | V62-I66 HydrophobicContact CG1-CD1 3.73Å; V62-I66 HydrophobicContact CG1-CG1 4.41Å; V62-I66 VanDerWaalsContact O-CG1 3.25Å; V62-I66 WeakPolarHBondContact O-CG1 3.21Å; V62-I66 PolarHBondContact O-N 3.07Å; V63-I66 PolarHBondContact O-N 3.35Å; I66-G68 VanDerWaalsContact C-N 3.32Å; I66-G68 PolarHBondContact O-N 2.62Å; I66-V69 PolarHBondContact O-N 2.82Å; I66-V70 WeakPolarHBondContact O-CG2 3.35Å; I66-V70 PolarHBondContact O-N 2.57Å |
| 67 | A | 85 | Confident | 76.9 | Confident | 53 Ų | 53 | 69.8 Ų | 69.8 | 44% | 0.438 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -58.6 | -45.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | V63 I64 L65 V69 V70 V71 | V63-A67 PolarHBondContact O-N 2.95Å; I64-A67 PolarHBondContact O-N 2.96Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 2.67Å; A67-V69 PolarHBondContact O-N 2.91Å; A67-V70 PolarHBondContact O-N 3.14Å; A67-V71 VanDerWaalsContact O-CG2 3.32Å; A67-V71 WeakPolarHBondContact O-CG2 3.34Å; A67-V71 PolarHBondContact O-N 3.19Å |
| 68 | G | 81.8 | Confident | 77 | Confident | 29 Ų | 29 | 74.2 Ų | 74.2 | 30% | 0.299 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61.5 | -39.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | I64 L65 I66 T72 | I64-G68 PolarHBondContact O-N 3.41Å; L65-G68 PolarHBondContact O-N 3.36Å; I66-G68 VanDerWaalsContact C-N 3.32Å; I66-G68 PolarHBondContact O-N 2.62Å; G68-T72 VanDerWaalsContact O-CB 3.31Å; G68-T72 WeakPolarHBondContact O-CB 3.3Å; G68-T72 PolarHBondContact O-N 2.78Å; G68-T72 PolarHBondContact O-OG1 3.3Å |
| 69 | V | 81.1 | Confident | 76.8 | Confident | 53 Ų | 53 | 77.6 Ų | 77.6 | 32% | 0.321 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -60.7 | -49.4 | 174.2 | 174 | 0 | 0 | 0 | 0 | 110.3 | L65 I66 A67 T72 A73 L93 | L65-V69 HydrophobicContact CD2-CG2 3.93Å; L65-V69 VanDerWaalsContact O-CG2 3.31Å; L65-V69 WeakPolarHBondContact O-CG2 3.48Å; L65-V69 PolarHBondContact O-N 3.44Å; I66-V69 PolarHBondContact O-N 2.82Å; A67-V69 PolarHBondContact O-N 2.91Å; V69-T72 PolarHBondContact O-N 3.07Å; V69-A73 VanDerWaalsContact O-CB 3.3Å; V69-A73 WeakPolarHBondContact O-CB 3.29Å; V69-A73 PolarHBondContact O-N 2.95Å; V69-L93 HydrophobicContact CB-CD1 4.34Å; V69-L93 HydrophobicContact CB-CD2 4.07Å; V69-L93 HydrophobicContact CG1-CD1 4.39Å; V69-L93 HydrophobicContact CG2-CD1 4.07Å; V69-L93 HydrophobicContact CG2-CD2 3.26Å; V69-L93 HydrophobicContact CG2-CG 4.28Å |
| 70 | V | 82.4 | Confident | 76.2 | Confident | 83 Ų | 83 | 79.6 Ų | 79.6 | 50% | 0.503 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.6 | -46.1 | -178.7 | 175.1 | 0 | 0 | 0 | 0 | 110.4 | I66 A67 T72 A73 V74 | I66-V70 WeakPolarHBondContact O-CG2 3.35Å; I66-V70 PolarHBondContact O-N 2.57Å; A67-V70 PolarHBondContact O-N 3.14Å; V70-T72 VanDerWaalsContact C-N 3.33Å; V70-T72 PolarHBondContact O-N 3.27Å; V70-A73 PolarHBondContact O-N 2.75Å; V70-V74 HydrophobicContact CG1-CG2 4.31Å; V70-V74 WeakPolarHBondContact O-CB 3.46Å; V70-V74 VanDerWaalsContact O-CG2 3.23Å; V70-V74 WeakPolarHBondContact O-CG2 3.01Å; V70-V74 PolarHBondContact O-N 3.37Å |
| 71 | V | 81.2 | Confident | 75.7 | Confident | 101 Ų | 101 | 80.4 Ų | 80.4 | 61% | 0.612 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -60.1 | -43.6 | 176.8 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | A67 V74 A75 | A67-V71 VanDerWaalsContact O-CG2 3.32Å; A67-V71 WeakPolarHBondContact O-CG2 3.34Å; A67-V71 PolarHBondContact O-N 3.19Å; V71-V74 PolarHBondContact O-N 2.87Å; V71-A75 VanDerWaalsContact O-CB 3.31Å; V71-A75 WeakPolarHBondContact O-CB 3.39Å; V71-A75 PolarHBondContact O-N 3.4Å |
| 72 | T | 80.1 | Confident | 75 | Confident | 40 Ų | 40 | 82.5 Ų | 82.5 | 25% | 0.245 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -65.7 | -39.9 | 177.5 | -56.7 | 0 | 0 | 0 | 0 | 111.5 | G68 V69 V70 A75 Y76 L93 | G68-T72 VanDerWaalsContact O-CB 3.31Å; G68-T72 WeakPolarHBondContact O-CB 3.3Å; G68-T72 PolarHBondContact O-N 2.78Å; G68-T72 PolarHBondContact O-OG1 3.3Å; V69-T72 PolarHBondContact O-N 3.07Å; V70-T72 VanDerWaalsContact C-N 3.33Å; V70-T72 PolarHBondContact O-N 3.27Å; T72-A75 PolarHBondContact O-N 2.99Å; T72-Y76 VanDerWaalsContact O-CB 3.23Å; T72-Y76 WeakPolarHBondContact O-CB 3.27Å; T72-Y76 PolarHBondContact O-N 3.36Å; T72-L93 HydrophobicContact CG2-CD1 3.86Å |
| 73 | A | 74 | Confident | 74.6 | Confident | 46 Ų | 46 | 81.9 Ų | 81.9 | 38% | 0.38 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -69.5 | -36.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V69 V70 Y76 S77 | V69-A73 VanDerWaalsContact O-CB 3.3Å; V69-A73 WeakPolarHBondContact O-CB 3.29Å; V69-A73 PolarHBondContact O-N 2.95Å; V70-A73 PolarHBondContact O-N 2.75Å; A73-Y76 PolarHBondContact O-N 2.89Å; A73-S77 WeakPolarHBondContact O-CB 2.92Å; A73-S77 PolarHBondContact O-N 3.06Å; A73-S77 PolarHBondContact O-OG 2.91Å |
| 74 | V | 76.4 | Confident | 74.1 | Confident | 69 Ų | 69 | 83 Ų | 83 | 42% | 0.418 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.4 | -47.8 | 172.9 | 171.9 | 0 | 0 | 0 | 0 | 109.6 | V70 V71 Y76 S77 F78 | V70-V74 HydrophobicContact CG1-CG2 4.31Å; V70-V74 WeakPolarHBondContact O-CB 3.46Å; V70-V74 VanDerWaalsContact O-CG2 3.23Å; V70-V74 WeakPolarHBondContact O-CG2 3.01Å; V70-V74 PolarHBondContact O-N 3.37Å; V71-V74 PolarHBondContact O-N 2.87Å; V74-Y76 PolarHBondContact O-N 2.93Å; V74-S77 PolarHBondContact O-N 3.36Å; V74-F78 HydrophobicContact CG1-CD2 3.71Å; V74-F78 HydrophobicContact CG1-CE2 3.38Å; V74-F78 WeakPolarHBondContact O-CD2 3.25Å; V74-F78 PolarHBondContact O-N 3.09Å |
| 75 | A | 74.6 | Confident | 73.8 | Confident | 53 Ų | 53 | 83.2 Ų | 83.2 | 44% | 0.438 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.3 | -35.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.4 | V71 T72 | V71-A75 VanDerWaalsContact O-CB 3.31Å; V71-A75 WeakPolarHBondContact O-CB 3.39Å; V71-A75 PolarHBondContact O-N 3.4Å; T72-A75 PolarHBondContact O-N 2.99Å |
| 76 | Y | 71.3 | Confident | 73.6 | Confident | 87 Ų | 87 | 82.5 Ų | 82.5 | 34% | 0.341 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -72.2 | -40.3 | 175 | -174.8 | -124.7 | 0 | 0 | 0 | 112.6 | T72 A73 V74 F78 N79 S86 | T72-Y76 VanDerWaalsContact O-CB 3.23Å; T72-Y76 WeakPolarHBondContact O-CB 3.27Å; T72-Y76 PolarHBondContact O-N 3.36Å; A73-Y76 PolarHBondContact O-N 2.89Å; V74-Y76 PolarHBondContact O-N 2.93Å; Y76-F78 VanDerWaalsContact C-N 3.27Å; Y76-F78 PolarHBondContact O-N 3.29Å; Y76-N79 CarbonylContact O-C 3.59Å; Y76-N79 PolarHBondContact O-N 3.44Å; Y76-N79 VanDerWaalsContact O-N 3.09Å; Y76-S86 WeakPolarHBondContact CD2-OG 3.37Å; Y76-S86 WeakPolarHBondContact CE2-OG 3.42Å |
| 77 | S | 68.7 | Low | 73.1 | Confident | 102 Ų | 102 | 81.9 Ų | 81.9 | 71% | 0.713 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.8 | -30.9 | 178.7 | -66.6 | 0 | 0 | 0 | 0 | 112.4 | A73 V74 N79 | A73-S77 WeakPolarHBondContact O-CB 2.92Å; A73-S77 PolarHBondContact O-N 3.06Å; A73-S77 PolarHBondContact O-OG 2.91Å; V74-S77 PolarHBondContact O-N 3.36Å; S77-N79 VanDerWaalsContact C-N 3.31Å |
| 78 | F | 68.2 | Low | 72.8 | Confident | 173 Ų | 173 | 85.8 Ų | 85.8 | 76% | 0.759 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | -10.8 | 174.6 | -72.2 | -61.1 | 0 | 0 | 0 | 114 | V74 Y76 | V74-F78 HydrophobicContact CG1-CD2 3.71Å; V74-F78 HydrophobicContact CG1-CE2 3.38Å; V74-F78 WeakPolarHBondContact O-CD2 3.25Å; V74-F78 PolarHBondContact O-N 3.09Å; Y76-F78 VanDerWaalsContact C-N 3.27Å; Y76-F78 PolarHBondContact O-N 3.29Å |
| 79 | N | 64.9 | Low | 72.7 | Confident | 105 Ų | 105 | 84.9 Ų | 84.9 | 56% | 0.561 | 49% | 0.493 | S | S | * | . | S | Bend | trans | -124.9 | 100.8 | -179.7 | -103.4 | -61.7 | 0 | 0 | 0 | 110.9 | Y76 S77 H81 | Y76-N79 CarbonylContact O-C 3.59Å; Y76-N79 PolarHBondContact O-N 3.44Å; Y76-N79 VanDerWaalsContact O-N 3.09Å; S77-N79 VanDerWaalsContact C-N 3.31Å; N79-H81 PolarHBondContact O-N 2.99Å; N79-H81 VanDerWaalsContact O-N 3.17Å |
| 80 | S | 56.8 | Low | 72.6 | Confident | 107 Ų | 107 | 87.2 Ų | 87.2 | 75% | 0.748 | 50% | 0.503 | S | S | * | . | trans | -46.8 | 118.5 | -179.8 | -159 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 81 | H | 60.9 | Low | 72.5 | Confident | 161 Ų | 161 | 87.3 Ų | 87.3 | 75% | 0.745 | 50% | 0.504 | S | S | * | . | S | Bend | trans | 24.2 | 101.6 | 157.5 | -77.6 | -99.3 | 0 | 0 | 0 | 117.7 | N79 | N79-H81 PolarHBondContact O-N 2.99Å; N79-H81 VanDerWaalsContact O-N 3.17Å |
| 82 | G | 61.3 | Low | 72.5 | Confident | 63 Ų | 63 | 88 Ų | 88 | 65% | 0.649 | 50% | 0.503 | S | S | * | . | trans | 116.7 | -0.2 | 156 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 83 | S | 71.6 | Confident | 72.6 | Confident | 50 Ų | 50 | 87.5 Ų | 87.5 | 35% | 0.35 | 50% | 0.499 | S | S | . | . | trans | -69.1 | 143.6 | 177.6 | -173.1 | 0 | 0 | 0 | 0 | 112.3 | I85 S86 V87 | S83-I85 PolarHBondContact O-N 3.03Å; S83-I85 VanDerWaalsContact O-N 3.1Å; S83-S86 VanDerWaalsContact O-CB 3.31Å; S83-S86 WeakPolarHBondContact O-CB 3.29Å; S83-S86 PolarHBondContact O-N 3.01Å; S83-V87 PolarHBondContact O-N 3.11Å | ||
| 84 | I | 70.9 | Confident | 72.9 | Confident | 122 Ų | 122 | 88.5 Ų | 88.5 | 63% | 0.626 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -50.5 | -37.6 | 179.1 | -66.9 | 170 | 0 | 0 | 0 | 111.3 | S86 V87 F88 | I84-S86 VanDerWaalsContact C-N 3.28Å; I84-S86 PolarHBondContact O-N 2.8Å; I84-V87 PolarHBondContact O-N 2.81Å; I84-V87 VanDerWaalsContact O-N 3.13Å; I84-F88 HydrophobicContact CG2-CD2 3.4Å; I84-F88 VanDerWaalsContact CG2-CD2 3.4Å; I84-F88 HydrophobicContact CG2-CE2 3.43Å; I84-F88 VanDerWaalsContact CG2-CE2 3.43Å; I84-F88 WeakPolarHBondContact O-CD2 3.22Å; I84-F88 PolarHBondContact O-N 3.35Å |
| 85 | I | 75.1 | Confident | 73.2 | Confident | 128 Ų | 128 | 87.7 Ų | 87.7 | 66% | 0.656 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -57.7 | -37.7 | 177.2 | -74.2 | 112.6 | 0 | 0 | 0 | 112.9 | S83 G89 | S83-I85 PolarHBondContact O-N 3.03Å; S83-I85 VanDerWaalsContact O-N 3.1Å; I85-G89 PolarHBondContact O-N 2.94Å |
| 86 | S | 75.1 | Confident | 73.5 | Confident | 13 Ų | 13 | 86.2 Ų | 86.2 | 9% | 0.091 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -67.1 | -44.8 | 175.6 | 174.4 | 0 | 0 | 0 | 0 | 111.9 | Y76 S83 I84 F88 G89 L90 | Y76-S86 WeakPolarHBondContact CD2-OG 3.37Å; Y76-S86 WeakPolarHBondContact CE2-OG 3.42Å; S83-S86 VanDerWaalsContact O-CB 3.31Å; S83-S86 WeakPolarHBondContact O-CB 3.29Å; S83-S86 PolarHBondContact O-N 3.01Å; I84-S86 VanDerWaalsContact C-N 3.28Å; I84-S86 PolarHBondContact O-N 2.8Å; S86-F88 VanDerWaalsContact C-N 3.33Å; S86-F88 PolarHBondContact O-N 2.89Å; S86-G89 PolarHBondContact O-N 2.62Å; S86-G89 VanDerWaalsContact O-N 3.14Å; S86-L90 PolarHBondContact O-N 3.39Å |
| 87 | V | 73.4 | Confident | 73.9 | Confident | 82 Ų | 82 | 86.4 Ų | 86.4 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.5 | -44.8 | 179.6 | -178.7 | 0 | 0 | 0 | 0 | 109.7 | S83 I84 G89 L90 V91 | S83-V87 PolarHBondContact O-N 3.11Å; I84-V87 PolarHBondContact O-N 2.81Å; I84-V87 VanDerWaalsContact O-N 3.13Å; V87-G89 PolarHBondContact O-N 3.17Å; V87-L90 PolarHBondContact O-N 3.49Å; V87-V91 HydrophobicContact CG1-CG2 4.46Å; V87-V91 WeakPolarHBondContact O-CB 3.36Å; V87-V91 VanDerWaalsContact O-CG2 3.24Å; V87-V91 WeakPolarHBondContact O-CG2 3.27Å; V87-V91 PolarHBondContact O-N 3.32Å |
| 88 | F | 78.1 | Confident | 74.6 | Confident | 134 Ų | 134 | 87.7 Ų | 87.7 | 59% | 0.588 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.8 | -42 | 173.1 | -89.8 | -90 | 0 | 0 | 0 | 112.2 | I84 S86 V91 L92 | I84-F88 HydrophobicContact CG2-CD2 3.4Å; I84-F88 VanDerWaalsContact CG2-CD2 3.4Å; I84-F88 HydrophobicContact CG2-CE2 3.43Å; I84-F88 VanDerWaalsContact CG2-CE2 3.43Å; I84-F88 WeakPolarHBondContact O-CD2 3.22Å; I84-F88 PolarHBondContact O-N 3.35Å; S86-F88 VanDerWaalsContact C-N 3.33Å; S86-F88 PolarHBondContact O-N 2.89Å; F88-V91 PolarHBondContact O-N 3.45Å; F88-L92 WeakPolarHBondContact O-CB 3.42Å; F88-L92 VanDerWaalsContact O-CG 3.23Å; F88-L92 WeakPolarHBondContact O-CG 3.44Å; F88-L92 PolarHBondContact O-N 3.34Å |
| 89 | G | 81.1 | Confident | 75.2 | Confident | 11 Ų | 11 | 85.2 Ų | 85.2 | 11% | 0.113 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -60.6 | -43.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | I85 S86 V87 L93 | I85-G89 PolarHBondContact O-N 2.94Å; S86-G89 PolarHBondContact O-N 2.62Å; S86-G89 VanDerWaalsContact O-N 3.14Å; V87-G89 PolarHBondContact O-N 3.17Å; G89-L93 VanDerWaalsContact O-CB 3.29Å; G89-L93 WeakPolarHBondContact O-CB 3.37Å; G89-L93 WeakPolarHBondContact O-CG 3.37Å; G89-L93 PolarHBondContact O-N 3.41Å |
| 90 | L | 77.8 | Confident | 75.9 | Confident | 101 Ų | 101 | 82.5 Ų | 82.5 | 53% | 0.529 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.7 | -41.6 | 175.5 | -80.4 | 160.5 | 0 | 0 | 0 | 112.4 | S86 V87 L93 S94 | S86-L90 PolarHBondContact O-N 3.39Å; V87-L90 PolarHBondContact O-N 3.49Å; L90-L93 PolarHBondContact O-N 2.82Å; L90-S94 WeakPolarHBondContact O-CB 3.25Å; L90-S94 PolarHBondContact O-N 3.22Å; L90-S94 PolarHBondContact O-OG 2.91Å |
| 91 | V | 80.6 | Confident | 76.9 | Confident | 85 Ų | 85 | 79.7 Ų | 79.7 | 52% | 0.515 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -64.4 | -46.5 | 175.9 | 171.4 | 0 | 0 | 0 | 0 | 110.7 | V87 F88 L93 S94 S95 | V87-V91 HydrophobicContact CG1-CG2 4.46Å; V87-V91 WeakPolarHBondContact O-CB 3.36Å; V87-V91 VanDerWaalsContact O-CG2 3.24Å; V87-V91 WeakPolarHBondContact O-CG2 3.27Å; V87-V91 PolarHBondContact O-N 3.32Å; F88-V91 PolarHBondContact O-N 3.45Å; V91-L93 PolarHBondContact O-N 3Å; V91-S94 WeakPolarHBondContact CA-OG 3.49Å; V91-S94 PolarHBondContact O-N 3.43Å; V91-S94 PolarHBondContact O-OG 3.44Å; V91-S95 WeakPolarHBondContact O-CB 3.27Å; V91-S95 PolarHBondContact O-N 3.28Å |
| 92 | L | 80.9 | Confident | 77.6 | Confident | 116 Ų | 116 | 74.8 Ų | 74.8 | 61% | 0.607 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -62.5 | -43.3 | 176.1 | -71.5 | 171.9 | 0 | 0 | 0 | 111.4 | F88 S95 G96 | F88-L92 WeakPolarHBondContact O-CB 3.42Å; F88-L92 VanDerWaalsContact O-CG 3.23Å; F88-L92 WeakPolarHBondContact O-CG 3.44Å; F88-L92 PolarHBondContact O-N 3.34Å; L92-S95 PolarHBondContact O-N 2.88Å; L92-S95 PolarHBondContact O-OG 3.49Å; L92-G96 PolarHBondContact O-N 3.04Å |
| 93 | L | 82.4 | Confident | 78.4 | Confident | 30 Ų | 30 | 74 Ų | 74 | 16% | 0.157 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -61.5 | -47.7 | 176.2 | -88.6 | 178.4 | 0 | 0 | 0 | 113.3 | V69 T72 G89 L90 V91 S95 G96 L97 | V69-L93 HydrophobicContact CB-CD1 4.34Å; V69-L93 HydrophobicContact CB-CD2 4.07Å; V69-L93 HydrophobicContact CG1-CD1 4.39Å; V69-L93 HydrophobicContact CG2-CD1 4.07Å; V69-L93 HydrophobicContact CG2-CD2 3.26Å; V69-L93 HydrophobicContact CG2-CG 4.28Å; T72-L93 HydrophobicContact CG2-CD1 3.86Å; G89-L93 VanDerWaalsContact O-CB 3.29Å; G89-L93 WeakPolarHBondContact O-CB 3.37Å; G89-L93 WeakPolarHBondContact O-CG 3.37Å; G89-L93 PolarHBondContact O-N 3.41Å; L90-L93 PolarHBondContact O-N 2.82Å; V91-L93 PolarHBondContact O-N 3Å; L93-S95 VanDerWaalsContact C-N 3.31Å; L93-S95 PolarHBondContact O-N 3.4Å; L93-G96 PolarHBondContact O-N 2.99Å; L93-L97 PolarHBondContact O-N 2.93Å |
| 94 | S | 80.6 | Confident | 78.7 | Confident | 67 Ų | 67 | 73.7 Ų | 73.7 | 47% | 0.469 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -62.6 | -40.2 | 178.4 | 54.9 | 0 | 0 | 0 | 0 | 111.3 | L90 V91 G96 L97 L98 | L90-S94 WeakPolarHBondContact O-CB 3.25Å; L90-S94 PolarHBondContact O-N 3.22Å; L90-S94 PolarHBondContact O-OG 2.91Å; V91-S94 WeakPolarHBondContact CA-OG 3.49Å; V91-S94 PolarHBondContact O-N 3.43Å; V91-S94 PolarHBondContact O-OG 3.44Å; S94-G96 PolarHBondContact O-N 3.34Å; S94-L97 PolarHBondContact O-N 3.49Å; S94-L98 WeakPolarHBondContact O-CB 3.27Å; S94-L98 PolarHBondContact O-N 3.06Å |
| 95 | S | 81.9 | Confident | 79 | Confident | 52 Ų | 52 | 71.7 Ų | 71.7 | 36% | 0.364 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -60.7 | -42.3 | 173.4 | 77.6 | 0 | 0 | 0 | 0 | 112.4 | V91 L92 L93 L98 L99 | V91-S95 WeakPolarHBondContact O-CB 3.27Å; V91-S95 PolarHBondContact O-N 3.28Å; L92-S95 PolarHBondContact O-N 2.88Å; L92-S95 PolarHBondContact O-OG 3.49Å; L93-S95 VanDerWaalsContact C-N 3.31Å; L93-S95 PolarHBondContact O-N 3.4Å; S95-L98 PolarHBondContact O-N 2.86Å; S95-L99 WeakPolarHBondContact O-CB 3.25Å; S95-L99 VanDerWaalsContact O-CG 3.29Å; S95-L99 WeakPolarHBondContact O-CG 3.23Å; S95-L99 PolarHBondContact O-N 2.96Å |
| 96 | G | 81.6 | Confident | 78.9 | Confident | 21 Ų | 21 | 69.6 Ų | 69.6 | 22% | 0.216 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -63.8 | -43.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L92 L93 S94 L99 L100 | L92-G96 PolarHBondContact O-N 3.04Å; L93-G96 PolarHBondContact O-N 2.99Å; S94-G96 PolarHBondContact O-N 3.34Å; G96-L99 PolarHBondContact O-N 3.3Å; G96-L100 WeakPolarHBondContact O-CG 3.44Å; G96-L100 PolarHBondContact O-N 2.89Å |
| 97 | L | 80.8 | Confident | 78.8 | Confident | 92 Ų | 92 | 71.6 Ų | 71.6 | 48% | 0.482 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -62.9 | -41.6 | 175.2 | -79.9 | 162.9 | 0 | 0 | 0 | 111.7 | L65 L93 S94 L100 A101 | L65-L97 HydrophobicContact CD1-CD2 4.31Å; L65-L97 HydrophobicContact CD1-CG 4.1Å; L65-L97 HydrophobicContact CD2-CD2 3.61Å; L65-L97 HydrophobicContact CD2-CG 3.94Å; L93-L97 PolarHBondContact O-N 2.93Å; S94-L97 PolarHBondContact O-N 3.49Å; L97-L100 PolarHBondContact O-N 2.8Å; L97-A101 VanDerWaalsContact O-CB 3.25Å; L97-A101 WeakPolarHBondContact O-CB 3.3Å; L97-A101 PolarHBondContact O-N 2.85Å |
| 98 | L | 82.6 | Confident | 78.8 | Confident | 129 Ų | 129 | 74.1 Ų | 74.1 | 68% | 0.675 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -67.1 | -38 | 179.3 | -153.8 | 74.7 | 0 | 0 | 0 | 111.6 | S94 S95 A101 S102 | S94-L98 WeakPolarHBondContact O-CB 3.27Å; S94-L98 PolarHBondContact O-N 3.06Å; S95-L98 PolarHBondContact O-N 2.86Å; L98-A101 PolarHBondContact O-N 3.2Å; L98-S102 VanDerWaalsContact O-CB 3.3Å; L98-S102 WeakPolarHBondContact O-CB 3.3Å; L98-S102 PolarHBondContact O-N 3.23Å; L98-S102 PolarHBondContact O-OG 3.42Å |
| 99 | L | 80.9 | Confident | 78.5 | Confident | 121 Ų | 121 | 72.2 Ų | 72.2 | 63% | 0.634 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -65.1 | -44.2 | 173.2 | -73.3 | 168.9 | 0 | 0 | 0 | 111.4 | S95 G96 S102 S103 | S95-L99 WeakPolarHBondContact O-CB 3.25Å; S95-L99 VanDerWaalsContact O-CG 3.29Å; S95-L99 WeakPolarHBondContact O-CG 3.23Å; S95-L99 PolarHBondContact O-N 2.96Å; G96-L99 PolarHBondContact O-N 3.3Å; L99-S102 WeakPolarHBondContact CA-OG 3.01Å; L99-S102 PolarHBondContact O-OG 3.3Å; L99-S103 VanDerWaalsContact O-CB 3.27Å; L99-S103 WeakPolarHBondContact O-CB 3.43Å; L99-S103 PolarHBondContact O-N 3.39Å |
| 100 | L | 79.1 | Confident | 77.8 | Confident | 47 Ų | 47 | 76 Ų | 76 | 25% | 0.246 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -64.3 | -42.8 | 174.8 | -71.2 | -172.6 | 0 | 0 | 0 | 112 | V62 L65 G96 L97 S103 A104 | V62-L100 HydrophobicContact CG2-CD1 4.17Å; L65-L100 HydrophobicContact CB-CD1 3.89Å; L65-L100 HydrophobicContact CD1-CD1 3.57Å; L65-L100 HydrophobicContact CD1-CG 4.17Å; L65-L100 HydrophobicContact CG-CD1 4.19Å; G96-L100 WeakPolarHBondContact O-CG 3.44Å; G96-L100 PolarHBondContact O-N 2.89Å; L97-L100 PolarHBondContact O-N 2.8Å; L100-S103 PolarHBondContact O-N 3.28Å; L100-A104 WeakPolarHBondContact O-CB 3.3Å; L100-A104 PolarHBondContact O-N 3.47Å |
| 101 | A | 78.8 | Confident | 77.4 | Confident | 48 Ų | 48 | 74.4 Ų | 74.4 | 40% | 0.397 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64 | -47.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | L97 L98 S103 A104 V105 | L97-A101 VanDerWaalsContact O-CB 3.25Å; L97-A101 WeakPolarHBondContact O-CB 3.3Å; L97-A101 PolarHBondContact O-N 2.85Å; L98-A101 PolarHBondContact O-N 3.2Å; A101-S103 VanDerWaalsContact C-N 3.29Å; A101-S103 PolarHBondContact O-N 3.33Å; A101-A104 PolarHBondContact O-N 2.92Å; A101-V105 WeakPolarHBondContact O-CB 3.31Å; A101-V105 VanDerWaalsContact O-CG2 3.27Å; A101-V105 WeakPolarHBondContact O-CG2 3.29Å; A101-V105 PolarHBondContact O-N 3.34Å |
| 102 | S | 75.3 | Confident | 76.9 | Confident | 58 Ų | 58 | 75.5 Ų | 75.5 | 41% | 0.406 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -60.5 | -41.5 | 177.2 | 58.9 | 0 | 0 | 0 | 0 | 111.2 | L98 L99 A104 V105 C106 | L98-S102 VanDerWaalsContact O-CB 3.3Å; L98-S102 WeakPolarHBondContact O-CB 3.3Å; L98-S102 PolarHBondContact O-N 3.23Å; L98-S102 PolarHBondContact O-OG 3.42Å; L99-S102 WeakPolarHBondContact CA-OG 3.01Å; L99-S102 PolarHBondContact O-OG 3.3Å; S102-A104 PolarHBondContact O-N 3.45Å; S102-V105 PolarHBondContact O-N 2.87Å; S102-C106 VanDerWaalsContact O-CB 3.3Å; S102-C106 WeakPolarHBondContact O-CB 3.31Å; S102-C106 PolarHBondContact O-N 2.96Å; S102-C106 PolarHBondContact O-SG 2.99Å |
| 103 | S | 77.7 | Confident | 76.1 | Confident | 46 Ų | 46 | 75 Ų | 75 | 32% | 0.322 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -66.5 | -39.6 | 177 | -147.8 | 0 | 0 | 0 | 0 | 111.5 | Y54 L99 L100 A101 C106 W107 | Y54-S103 WeakPolarHBondContact CE2-OG 3.38Å; Y54-S103 VanDerWaalsContact CZ-OG 3.24Å; Y54-S103 WeakPolarHBondContact OH-CA 3.11Å; Y54-S103 WeakPolarHBondContact OH-CB 3.1Å; Y54-S103 PolarHBondContact OH-O 2.98Å; Y54-S103 PolarHBondContact OH-OG 2.87Å; Y54-S103 VanDerWaalsContact OH-OG 3.11Å; L99-S103 VanDerWaalsContact O-CB 3.27Å; L99-S103 WeakPolarHBondContact O-CB 3.43Å; L99-S103 PolarHBondContact O-N 3.39Å; L100-S103 PolarHBondContact O-N 3.28Å; A101-S103 VanDerWaalsContact C-N 3.29Å; A101-S103 PolarHBondContact O-N 3.33Å; S103-C106 PolarHBondContact O-N 2.83Å; S103-W107 PolarHBondContact O-N 3.33Å |
| 104 | A | 77.4 | Confident | 75.2 | Confident | 44 Ų | 44 | 77.5 Ų | 77.5 | 36% | 0.364 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -67.6 | -37.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y54 L100 A101 S102 W107 K108 | Y54-A104 PolarHBondContact OH-N 3.35Å; L100-A104 WeakPolarHBondContact O-CB 3.3Å; L100-A104 PolarHBondContact O-N 3.47Å; A101-A104 PolarHBondContact O-N 2.92Å; S102-A104 PolarHBondContact O-N 3.45Å; A104-W107 WeakPolarHBondContact O-CB 3.32Å; A104-W107 PolarHBondContact O-N 2.82Å; A104-K108 PolarHBondContact O-N 2.88Å |
| 105 | V | 77.4 | Confident | 74.2 | Confident | 81 Ų | 81 | 80.6 Ų | 80.6 | 49% | 0.491 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -68.2 | -44.8 | 175 | 170.6 | 0 | 0 | 0 | 0 | 110.5 | A101 S102 W107 K108 I109 | A101-V105 WeakPolarHBondContact O-CB 3.31Å; A101-V105 VanDerWaalsContact O-CG2 3.27Å; A101-V105 WeakPolarHBondContact O-CG2 3.29Å; A101-V105 PolarHBondContact O-N 3.34Å; S102-V105 PolarHBondContact O-N 2.87Å; V105-W107 PolarHBondContact O-N 2.94Å; V105-K108 WeakPolarHBondContact O-CB 3.48Å; V105-K108 PolarHBondContact O-N 2.75Å; V105-I109 HydrophobicContact CG1-CD1 3.75Å; V105-I109 HydrophobicContact CG1-CG1 4.38Å; V105-I109 WeakPolarHBondContact O-CG1 3.34Å; V105-I109 PolarHBondContact O-N 2.92Å |
| 106 | C | 74.4 | Confident | 73.2 | Confident | 84 Ų | 84 | 80.5 Ų | 80.5 | 57% | 0.568 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -55.8 | -40.6 | 171.5 | -78.4 | 0 | 0 | 0 | 0 | 111.3 | S102 S103 R110 | S102-C106 VanDerWaalsContact O-CB 3.3Å; S102-C106 WeakPolarHBondContact O-CB 3.31Å; S102-C106 PolarHBondContact O-N 2.96Å; S102-C106 PolarHBondContact O-SG 2.99Å; S103-C106 PolarHBondContact O-N 2.83Å; C106-R110 VanDerWaalsContact O-CB 3.22Å; C106-R110 WeakPolarHBondContact O-CB 3.09Å; C106-R110 PolarHBondContact O-N 2.7Å |
| 107 | W | 71.6 | Confident | 71.9 | Confident | 55 Ų | 55 | 85.9 Ų | 85.9 | 21% | 0.208 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -63.8 | -49.5 | 171.8 | -175.8 | 8.4 | 0 | 0 | 0 | 112.1 | Y54 R55 V58 S103 A104 V105 I109 R110 Q111 | Y54-W107 HydrophobicContact CD1-CB 3.89Å; Y54-W107 AromaticContact CD1-CD2 3.51Å; Y54-W107 HydrophobicContact CD1-CD2 3.51Å; Y54-W107 AromaticContact CD1-CE3 3.23Å; Y54-W107 HydrophobicContact CD1-CE3 3.23Å; Y54-W107 AromaticContact CD1-CG 3.87Å; Y54-W107 HydrophobicContact CD1-CG 3.87Å; Y54-W107 HydrophobicContact CD1-CH2 4.25Å; Y54-W107 AromaticContact CD1-CZ3 3.59Å; Y54-W107 HydrophobicContact CD1-CZ3 3.59Å; Y54-W107 HydrophobicContact CE1-CB 3.47Å; Y54-W107 VanDerWaalsContact CE1-CB 3.47Å; Y54-W107 AromaticContact CE1-CD2 3.65Å; Y54-W107 HydrophobicContact CE1-CD2 3.65Å; Y54-W107 AromaticContact CE1-CE3 3.17Å; Y54-W107 HydrophobicContact CE1-CE3 3.17Å; Y54-W107 AromaticContact CE1-CG 3.87Å; Y54-W107 HydrophobicContact CE1-CG 3.87Å; Y54-W107 AromaticContact CE1-CZ3 3.83Å; Y54-W107 HydrophobicContact CE1-CZ3 3.83Å; R55-W107 HydrophobicContact CB-CH2 4.47Å; R55-W107 HydrophobicContact CG-CH2 3.64Å; R55-W107 HydrophobicContact CG-CZ2 3.93Å; R55-W107 VanDerWaalsContact NE-CH2 3.27Å; V58-W107 HydrophobicContact CB-CZ3 4.41Å; V58-W107 HydrophobicContact CG2-CE3 4.32Å; V58-W107 HydrophobicContact CG2-CZ3 4.04Å; S103-W107 PolarHBondContact O-N 3.33Å; A104-W107 WeakPolarHBondContact O-CB 3.32Å; A104-W107 PolarHBondContact O-N 2.82Å; V105-W107 PolarHBondContact O-N 2.94Å; W107-I109 VanDerWaalsContact C-N 3.33Å; W107-I109 PolarHBondContact O-N 2.8Å; W107-R110 CarbonylContact O-C 3.43Å; W107-R110 PolarHBondContact O-N 2.88Å; W107-Q111 WeakPolarHBondContact O-CB 3.23Å; W107-Q111 PolarHBondContact O-N 3.07Å |
| 108 | K | 74.8 | Confident | 70.6 | Confident | 135 Ų | 135 | 90.6 Ų | 90.6 | 59% | 0.587 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -54.6 | -49.4 | 179.6 | -93.6 | -77.1 | -168.6 | 165.7 | 0 | 111.5 | A104 V105 Q111 Q112 | A104-K108 PolarHBondContact O-N 2.88Å; V105-K108 WeakPolarHBondContact O-CB 3.48Å; V105-K108 PolarHBondContact O-N 2.75Å; K108-Q111 WeakPolarHBondContact O-CB 3.41Å; K108-Q111 PolarHBondContact O-N 3.45Å; K108-Q112 VanDerWaalsContact O-CG 3.29Å; K108-Q112 WeakPolarHBondContact O-CG 3.33Å; K108-Q112 PolarHBondContact O-N 2.8Å |
| 109 | I | 71.4 | Confident | 69.1 | Low | 94 Ų | 94 | 94 Ų | 94 | 48% | 0.482 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.5 | -45.8 | 178.9 | -63.5 | 166.3 | 0 | 0 | 0 | 110.3 | V105 W107 Q111 Q112 N113 | V105-I109 HydrophobicContact CG1-CD1 3.75Å; V105-I109 HydrophobicContact CG1-CG1 4.38Å; V105-I109 WeakPolarHBondContact O-CG1 3.34Å; V105-I109 PolarHBondContact O-N 2.92Å; W107-I109 VanDerWaalsContact C-N 3.33Å; W107-I109 PolarHBondContact O-N 2.8Å; I109-Q111 VanDerWaalsContact C-N 3.32Å; I109-Q111 PolarHBondContact O-N 2.8Å; I109-Q112 WeakPolarHBondContact O-CB 3.29Å; I109-Q112 PolarHBondContact O-N 3.44Å; I109-Q112 VanDerWaalsContact O-N 3.14Å; I109-N113 PolarHBondContact O-N 3.37Å |
| 110 | R | 66.6 | Low | 67.6 | Low | 91 Ų | 91 | 93.9 Ų | 93.9 | 34% | 0.343 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.7 | -35.9 | 177.3 | -165.8 | 170.6 | -163.6 | -158.5 | -1 | 112.8 | E50 C106 W107 N113 K114 | E50-R110 IonicContact OE2-CZ 2.82Å; E50-R110 IonicContact OE2-NH1 3.79Å; E50-R110 PolarHBondContact OE2-NH1 3.19Å; E50-R110 IonicContact OE2-NH2 2.62Å; E50-R110 PolarHBondContact OE2-NH2 3.32Å; C106-R110 VanDerWaalsContact O-CB 3.22Å; C106-R110 WeakPolarHBondContact O-CB 3.09Å; C106-R110 PolarHBondContact O-N 2.7Å; W107-R110 CarbonylContact O-C 3.43Å; W107-R110 PolarHBondContact O-N 2.88Å; R110-N113 PolarHBondContact O-N 3.18Å; R110-K114 WeakPolarHBondContact O-CG 3.37Å; R110-K114 PolarHBondContact O-N 2.88Å |
| 111 | Q | 69.3 | Low | 66.3 | Low | 66 Ų | 66 | 95.1 Ų | 95.1 | 31% | 0.308 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.7 | -43.2 | 173 | -107.6 | -170 | 44.2 | 0 | 0 | 111.3 | W107 K108 I109 N113 K114 K115 | W107-Q111 WeakPolarHBondContact O-CB 3.23Å; W107-Q111 PolarHBondContact O-N 3.07Å; K108-Q111 WeakPolarHBondContact O-CB 3.41Å; K108-Q111 PolarHBondContact O-N 3.45Å; I109-Q111 VanDerWaalsContact C-N 3.32Å; I109-Q111 PolarHBondContact O-N 2.8Å; Q111-N113 VanDerWaalsContact C-N 3.31Å; Q111-N113 PolarHBondContact O-N 3.42Å; Q111-K114 PolarHBondContact O-N 3.42Å; Q111-K115 WeakPolarHBondContact O-CG 3.23Å; Q111-K115 PolarHBondContact O-N 3.2Å |
| 112 | Q | 69.4 | Low | 64.9 | Low | 109 Ų | 109 | 98.8 Ų | 98.8 | 51% | 0.509 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.3 | -41.8 | 176.4 | -65.6 | -70.4 | 22.5 | 0 | 0 | 110.9 | K108 I109 K114 K115 A116 | K108-Q112 VanDerWaalsContact O-CG 3.29Å; K108-Q112 WeakPolarHBondContact O-CG 3.33Å; K108-Q112 PolarHBondContact O-N 2.8Å; I109-Q112 WeakPolarHBondContact O-CB 3.29Å; I109-Q112 PolarHBondContact O-N 3.44Å; I109-Q112 VanDerWaalsContact O-N 3.14Å; Q112-K114 PolarHBondContact O-N 3.46Å; Q112-K115 WeakPolarHBondContact O-CB 3.31Å; Q112-K115 PolarHBondContact O-N 2.95Å; Q112-K115 VanDerWaalsContact O-N 3.14Å; Q112-A116 PolarHBondContact O-N 3.48Å |
| 113 | N | 64.3 | Low | 63.8 | Low | 104 Ų | 104 | 100.7 Ų | 100.7 | 56% | 0.556 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.7 | -37.6 | 175.5 | -69.4 | -7.9 | 0 | 0 | 0 | 112.3 | I109 R110 Q111 K115 A116 K117 | I109-N113 PolarHBondContact O-N 3.37Å; R110-N113 PolarHBondContact O-N 3.18Å; Q111-N113 VanDerWaalsContact C-N 3.31Å; Q111-N113 PolarHBondContact O-N 3.42Å; N113-K115 VanDerWaalsContact C-N 3.34Å; N113-K115 PolarHBondContact O-N 2.9Å; N113-A116 PolarHBondContact O-N 2.98Å; N113-K117 PolarHBondContact O-N 3.46Å |
| 114 | K | 63 | Low | 62.5 | Low | 83 Ų | 83 | 101.4 Ų | 101.4 | 36% | 0.361 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.4 | -36.4 | 172.5 | -75.3 | 179.5 | 178.6 | -174.6 | 0 | 112.4 | L51 R110 Q111 Q112 R118 | L51-K114 VanDerWaalsContact CG-NZ 3.34Å; R110-K114 WeakPolarHBondContact O-CG 3.37Å; R110-K114 PolarHBondContact O-N 2.88Å; Q111-K114 PolarHBondContact O-N 3.42Å; Q112-K114 PolarHBondContact O-N 3.46Å; K114-R118 PolarHBondContact O-N 2.82Å |
| 115 | K | 61 | Low | 61.3 | Low | 133 Ų | 133 | 105.6 Ų | 105.6 | 58% | 0.578 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -70.1 | -38.5 | 174.9 | -70 | -178.6 | -178.9 | -167.3 | 0 | 112 | Q111 Q112 N113 R118 R119 | Q111-K115 WeakPolarHBondContact O-CG 3.23Å; Q111-K115 PolarHBondContact O-N 3.2Å; Q112-K115 WeakPolarHBondContact O-CB 3.31Å; Q112-K115 PolarHBondContact O-N 2.95Å; Q112-K115 VanDerWaalsContact O-N 3.14Å; N113-K115 VanDerWaalsContact C-N 3.34Å; N113-K115 PolarHBondContact O-N 2.9Å; K115-R118 PolarHBondContact O-N 2.87Å; K115-R119 PolarHBondContact O-N 2.75Å |
| 116 | A | 60.3 | Low | 60.2 | Low | 49 Ų | 49 | 105 Ų | 105 | 41% | 0.405 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62 | -46.5 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q112 N113 R118 R119 E120 | Q112-A116 PolarHBondContact O-N 3.48Å; N113-A116 PolarHBondContact O-N 2.98Å; A116-R118 VanDerWaalsContact C-N 3.32Å; A116-R118 PolarHBondContact O-N 2.7Å; A116-R119 WeakPolarHBondContact O-CA 3.35Å; A116-R119 WeakPolarHBondContact O-CB 3.45Å; A116-R119 PolarHBondContact O-N 2.95Å; A116-E120 PolarHBondContact O-N 3.37Å; A116-E120 VanDerWaalsContact O-N 3.13Å |
| 117 | K | 55.1 | Low | 59.2 | Low | 135 Ų | 135 | 103.7 Ų | 103.7 | 59% | 0.587 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.5 | -35.7 | 178.3 | -129.3 | -174.1 | -176.7 | -162.3 | 0 | 113.5 | N113 R119 E120 S121 | N113-K117 PolarHBondContact O-N 3.46Å; K117-R119 PolarHBondContact O-N 3.09Å; K117-E120 PolarHBondContact O-N 3.37Å; K117-S121 PolarHBondContact O-N 2.91Å; K117-S121 PolarHBondContact O-OG 2.86Å |
| 118 | R | 53 | Low | 58.2 | Low | 191 Ų | 191 | 107.2 Ų | 107.2 | 72% | 0.721 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66.5 | -25.5 | 174.3 | -127.8 | -170.8 | -167.4 | -94.3 | 2.5 | 112.9 | K114 K115 A116 Q122 | K114-R118 PolarHBondContact O-N 2.82Å; K115-R118 PolarHBondContact O-N 2.87Å; A116-R118 VanDerWaalsContact C-N 3.32Å; A116-R118 PolarHBondContact O-N 2.7Å; R118-Q122 PolarHBondContact O-N 3.32Å |
| 119 | R | 50 | Low | 57.2 | Low | 201 Ų | 201 | 107 Ų | 107 | 76% | 0.758 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -75.5 | -38 | 173.8 | -127 | 174.5 | -177.5 | -99.7 | 0.7 | 110.9 | K115 A116 K117 Q122 T123 | K115-R119 PolarHBondContact O-N 2.75Å; A116-R119 WeakPolarHBondContact O-CA 3.35Å; A116-R119 WeakPolarHBondContact O-CB 3.45Å; A116-R119 PolarHBondContact O-N 2.95Å; K117-R119 PolarHBondContact O-N 3.09Å; R119-Q122 PolarHBondContact O-N 3.14Å; R119-T123 PolarHBondContact O-N 2.87Å; R119-T123 PolarHBondContact O-OG1 2.91Å |
| 120 | E | 50.2 | Low | 56.3 | Low | 118 Ų | 118 | 111.8 Ų | 111.8 | 55% | 0.551 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -68.8 | -38.6 | 175.8 | -62 | 178.3 | 149.5 | 0 | 0 | 112.7 | A116 K117 Q122 T123 A124 | A116-E120 PolarHBondContact O-N 3.37Å; A116-E120 VanDerWaalsContact O-N 3.13Å; K117-E120 PolarHBondContact O-N 3.37Å; E120-Q122 VanDerWaalsContact C-N 3.34Å; E120-Q122 PolarHBondContact O-N 3.48Å; E120-T123 VanDerWaalsContact CA-OG1 3.29Å; E120-T123 WeakPolarHBondContact CA-OG1 2.88Å; E120-T123 PolarHBondContact O-N 3.45Å; E120-T123 PolarHBondContact O-OG1 3.3Å; E120-A124 WeakPolarHBondContact O-CB 2.74Å; E120-A124 PolarHBondContact O-N 2.92Å |
| 121 | S | 51.6 | Low | 55.8 | Low | 73 Ų | 73 | 112.5 Ų | 112.5 | 51% | 0.51 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -68.3 | -31.7 | 176.7 | -51.8 | 0 | 0 | 0 | 0 | 113 | K117 L125 | K117-S121 PolarHBondContact O-N 2.91Å; K117-S121 PolarHBondContact O-OG 2.86Å; S121-L125 WeakPolarHBondContact O-CB 3.41Å; S121-L125 PolarHBondContact O-N 3.47Å |
| 122 | Q | 48.2 | Very low | 54.9 | Low | 125 Ų | 125 | 115.2 Ų | 115.2 | 58% | 0.584 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -70.1 | -39.2 | 171.7 | -83.4 | -171 | 79.1 | 0 | 0 | 111.6 | R118 R119 E120 V126 | R118-Q122 PolarHBondContact O-N 3.32Å; R119-Q122 PolarHBondContact O-N 3.14Å; E120-Q122 VanDerWaalsContact C-N 3.34Å; E120-Q122 PolarHBondContact O-N 3.48Å; Q122-V126 WeakPolarHBondContact O-CB 3.24Å; Q122-V126 WeakPolarHBondContact O-CG2 3.47Å; Q122-V126 PolarHBondContact O-N 2.9Å |
| 123 | T | 52.2 | Low | 54.2 | Low | 97 Ų | 97 | 118.2 Ų | 118.2 | 60% | 0.595 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -68.7 | -34.4 | 175.2 | 43.2 | 0 | 0 | 0 | 0 | 113.1 | R119 E120 A127 | R119-T123 PolarHBondContact O-N 2.87Å; R119-T123 PolarHBondContact O-OG1 2.91Å; E120-T123 VanDerWaalsContact CA-OG1 3.29Å; E120-T123 WeakPolarHBondContact CA-OG1 2.88Å; E120-T123 PolarHBondContact O-N 3.45Å; E120-T123 PolarHBondContact O-OG1 3.3Å; T123-A127 WeakPolarHBondContact O-CB 3.31Å; T123-A127 PolarHBondContact O-N 2.86Å |
| 124 | A | 51.7 | Low | 53.1 | Low | 61 Ų | 61 | 119.3 Ų | 119.3 | 50% | 0.504 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -70.1 | -41 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | E120 A127 H128 | E120-A124 WeakPolarHBondContact O-CB 2.74Å; E120-A124 PolarHBondContact O-N 2.92Å; A124-A127 PolarHBondContact O-N 2.89Å; A124-H128 PolarHBondContact O-N 3.16Å; A124-H128 VanDerWaalsContact O-N 3.08Å |
| 125 | L | 51.9 | Low | 52.6 | Low | 132 Ų | 132 | 121.2 Ų | 121.2 | 69% | 0.691 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -67.1 | -37.2 | 176.6 | -155.6 | 99.3 | 0 | 0 | 0 | 111.8 | S121 Q129 | S121-L125 WeakPolarHBondContact O-CB 3.41Å; S121-L125 PolarHBondContact O-N 3.47Å; L125-Q129 PolarHBondContact O-N 3.17Å |
| 126 | V | 54.1 | Low | 52.2 | Low | 68 Ų | 68 | 120.5 Ų | 120.5 | 41% | 0.412 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -73.1 | -31.1 | 177.4 | 179.8 | 0 | 0 | 0 | 0 | 111.6 | Q122 R130 | Q122-V126 WeakPolarHBondContact O-CB 3.24Å; Q122-V126 WeakPolarHBondContact O-CG2 3.47Å; Q122-V126 PolarHBondContact O-N 2.9Å; V126-R130 WeakPolarHBondContact O-CG 3.35Å |
| 127 | A | 53.8 | Low | 51.7 | Low | 57 Ų | 57 | 124.5 Ų | 124.5 | 47% | 0.471 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -69.8 | -42.5 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | T123 A124 Q129 R130 | T123-A127 WeakPolarHBondContact O-CB 3.31Å; T123-A127 PolarHBondContact O-N 2.86Å; A124-A127 PolarHBondContact O-N 2.89Å; A127-Q129 VanDerWaalsContact C-N 3.32Å; A127-Q129 PolarHBondContact O-N 3.1Å; A127-R130 PolarHBondContact O-N 3.48Å |
| 128 | H | 49.8 | Very low | 51.5 | Low | 129 Ų | 129 | 123.9 Ų | 123.9 | 60% | 0.597 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -68.4 | -28.9 | 179.3 | -162.4 | -57.6 | 0 | 0 | 0 | 113.1 | A124 T131 | A124-H128 PolarHBondContact O-N 3.16Å; A124-H128 VanDerWaalsContact O-N 3.08Å; H128-T131 PolarHBondContact O-OG1 3.13Å; H128-T131 VanDerWaalsContact O-OG1 3.14Å |
| 129 | Q | 54 | Low | 51.4 | Low | 132 Ų | 132 | 119.7 Ų | 119.7 | 62% | 0.617 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -71.1 | -29.8 | 175.1 | -111.4 | -143.8 | -36.2 | 0 | 0 | 113.2 | L125 A127 | L125-Q129 PolarHBondContact O-N 3.17Å; A127-Q129 VanDerWaalsContact C-N 3.32Å; A127-Q129 PolarHBondContact O-N 3.1Å |
| 130 | R | 53.6 | Low | 51.5 | Low | 193 Ų | 193 | 114.3 Ų | 114.3 | 73% | 0.728 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -77.7 | -26.3 | -177.8 | -68.1 | 179.9 | -168.3 | 170.6 | 2.8 | 113.3 | V126 A127 | V126-R130 WeakPolarHBondContact O-CG 3.35Å; A127-R130 PolarHBondContact O-N 3.48Å |
| 131 | T | 54.4 | Low | 51.6 | Low | 107 Ų | 107 | 114 Ų | 114 | 66% | 0.656 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -83.4 | -11.5 | 177.6 | 47 | 0 | 0 | 0 | 0 | 113.7 | H128 | H128-T131 PolarHBondContact O-OG1 3.13Å; H128-T131 VanDerWaalsContact O-OG1 3.14Å |
| 132 | L | 52.2 | Low | 51.6 | Low | 123 Ų | 123 | 117.2 Ų | 117.2 | 64% | 0.644 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -93.4 | -7.1 | -179.1 | -153.1 | 105.9 | 0 | 0 | 0 | 113.3 | ||
| 133 | F | 53.2 | Low | 51.9 | Low | 171 Ų | 171 | 116.5 Ų | 116.5 | 75% | 0.75 | 67% | 0.665 | S | S | * | * | trans | -122.6 | 11.7 | -176.8 | -79.1 | -77.7 | 0 | 0 | 0 | 113.8 | ||||
| 134 | G | 42 | Very low | 51.9 | Low | 128 Ų | 128 | 118.3 Ų | 118.3 | 100% | 1.32 | 67% | 0.672 | S | S | * | * | trans | -117.2 | 0 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.3 |
Retrieved 134 of 134 residues in 249.2 ms
(Link to these results)