| 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 | 47 | Very low | 52.2 | Low | 188 Ų | 188 | 151.7 Ų | 151.7 | 93% | 0.926 | 70% | 0.704 | S | S | * | * | 0 | -63.1 | 0 | -136.9 | -175.2 | -75.1 | 0 | 0 | 113 | E4 E5 | M1-E4 VanDerWaalsContact CA-OE2 3.31Å; M1-E4 WeakPolarHBondContact CA-OE2 3.47Å; M1-E4 PolarHBondContact N-OE2 3.46Å; M1-E4 WeakPolarHBondContact O-CB 3.45Å; M1-E4 PolarHBondContact O-N 3.01Å; M1-E5 PolarHBondContact O-N 3.41Å | |||
| 2 | R | 52.4 | Low | 51.9 | Low | 183 Ų | 183 | 148.2 Ų | 148.2 | 69% | 0.691 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -69.7 | -34 | -179.2 | -65.5 | -155.8 | -144.4 | 177.2 | 5.3 | 115.5 | E4 E5 L6 | R2-E4 VanDerWaalsContact C-N 3.31Å; R2-E5 PolarHBondContact O-N 3.28Å; R2-L6 PolarHBondContact O-N 3.11Å |
| 3 | L | 48 | Very low | 50.9 | Low | 148 Ų | 148 | 150.8 Ų | 150.8 | 78% | 0.775 | 72% | 0.723 | S | S | * | * | H | α-helix | trans | -68.3 | -31.2 | 173.2 | -84 | 161.4 | 0 | 0 | 0 | 111.9 | K7 | L3-K7 WeakPolarHBondContact O-CB 3.38Å; L3-K7 PolarHBondContact O-N 3.42Å |
| 4 | E | 55.7 | Low | 49.6 | Very low | 133 Ų | 133 | 152.2 Ų | 152.2 | 62% | 0.621 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -65.5 | -39.4 | 170.3 | -87.4 | 93.6 | -161.2 | 0 | 0 | 111.8 | M1 R2 K7 R8 | M1-E4 VanDerWaalsContact CA-OE2 3.31Å; M1-E4 WeakPolarHBondContact CA-OE2 3.47Å; M1-E4 PolarHBondContact N-OE2 3.46Å; M1-E4 WeakPolarHBondContact O-CB 3.45Å; M1-E4 PolarHBondContact O-N 3.01Å; R2-E4 VanDerWaalsContact C-N 3.31Å; E4-K7 PolarHBondContact O-N 3.43Å; E4-R8 WeakPolarHBondContact O-CB 3.47Å; E4-R8 PolarHBondContact O-N 2.79Å |
| 5 | E | 56.4 | Low | 48.7 | Very low | 128 Ų | 128 | 155.1 Ų | 155.1 | 60% | 0.598 | 74% | 0.741 | S | S | * | * | H | α-helix | trans | -67.5 | -44.6 | 179.8 | -71.6 | -162.1 | 149.1 | 0 | 0 | 112.8 | M1 R2 K7 R8 L9 | M1-E5 PolarHBondContact O-N 3.41Å; R2-E5 PolarHBondContact O-N 3.28Å; E5-K7 VanDerWaalsContact C-N 3.32Å; E5-K7 PolarHBondContact O-N 3.33Å; E5-R8 PolarHBondContact O-N 3.09Å; E5-L9 WeakPolarHBondContact O-CG 3Å; E5-L9 PolarHBondContact O-N 3.06Å |
| 6 | L | 49.4 | Very low | 48.1 | Very low | 120 Ų | 120 | 152.6 Ų | 152.6 | 63% | 0.628 | 74% | 0.738 | S | S | * | * | H | α-helix | trans | -62.4 | -39.9 | 173.7 | -87.1 | 171.6 | 0 | 0 | 0 | 112 | R2 L9 Q10 | R2-L6 PolarHBondContact O-N 3.11Å; L6-L9 PolarHBondContact O-N 3.34Å; L6-Q10 WeakPolarHBondContact O-CB 3Å; L6-Q10 PolarHBondContact O-N 3.36Å; L6-Q10 VanDerWaalsContact O-N 3.16Å |
| 7 | K | 59.9 | Low | 47.5 | Very low | 144 Ų | 144 | 152.6 Ų | 152.6 | 63% | 0.626 | 74% | 0.743 | S | S | * | * | H | α-helix | trans | -70.3 | -31.9 | 177.3 | -166 | 171.9 | -175.5 | 178 | 0 | 112.5 | L3 E4 E5 L9 Q10 N11 | L3-K7 WeakPolarHBondContact O-CB 3.38Å; L3-K7 PolarHBondContact O-N 3.42Å; E4-K7 PolarHBondContact O-N 3.43Å; E5-K7 VanDerWaalsContact C-N 3.32Å; E5-K7 PolarHBondContact O-N 3.33Å; K7-L9 VanDerWaalsContact C-N 3.33Å; K7-Q10 PolarHBondContact O-N 3.27Å; K7-Q10 VanDerWaalsContact O-N 3.16Å; K7-N11 PolarHBondContact O-N 3.29Å |
| 8 | R | 61.6 | Low | 47.4 | Very low | 218 Ų | 218 | 148.9 Ų | 148.9 | 82% | 0.823 | 73% | 0.727 | S | S | * | * | H | α-helix | trans | -70.6 | -30.8 | 175.5 | -164.7 | 179.4 | -178.9 | -174.5 | -0 | 111.9 | E4 E5 Q10 | E4-R8 WeakPolarHBondContact O-CB 3.47Å; E4-R8 PolarHBondContact O-N 2.79Å; E5-R8 PolarHBondContact O-N 3.09Å; R8-Q10 VanDerWaalsContact C-N 3.31Å |
| 9 | L | 49.3 | Very low | 46.8 | Very low | 129 Ų | 129 | 143.4 Ų | 143.4 | 68% | 0.675 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -76.9 | -17.5 | 170.4 | -68.3 | 169.8 | 0 | 0 | 0 | 112.9 | E5 L6 K7 | E5-L9 WeakPolarHBondContact O-CG 3Å; E5-L9 PolarHBondContact O-N 3.06Å; L6-L9 PolarHBondContact O-N 3.34Å; K7-L9 VanDerWaalsContact C-N 3.33Å |
| 10 | Q | 49.9 | Very low | 46.8 | Very low | 157 Ų | 157 | 145.7 Ų | 145.7 | 73% | 0.734 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -95.9 | -7.3 | -172.9 | -168.3 | 164.5 | 48.7 | 0 | 0 | 115.2 | L6 K7 R8 | L6-Q10 WeakPolarHBondContact O-CB 3Å; L6-Q10 PolarHBondContact O-N 3.36Å; L6-Q10 VanDerWaalsContact O-N 3.16Å; K7-Q10 PolarHBondContact O-N 3.27Å; K7-Q10 VanDerWaalsContact O-N 3.16Å; R8-Q10 VanDerWaalsContact C-N 3.31Å |
| 11 | N | 44.3 | Very low | 46.7 | Very low | 121 Ų | 121 | 146.3 Ų | 146.3 | 65% | 0.647 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -145.3 | 145.5 | -173.5 | -110.1 | -11.4 | 0 | 0 | 0 | 115.2 | K7 | K7-N11 PolarHBondContact O-N 3.29Š|
| 12 | P | 48.9 | Very low | 46.5 | Very low | 109 Ų | 109 | 142 Ų | 142 | 71% | 0.708 | 69% | 0.694 | S | S | * | * | cis | -98.9 | 147.2 | -23.9 | 34.7 | -23.1 | 0 | 0 | 0 | 111.5 | E14 | P12-E14 PolarHBondContact O-N 3.06Š| ||
| 13 | L | 38.9 | Very low | 45.7 | Very low | 182 Ų | 182 | 139.5 Ų | 139.5 | 95% | 0.953 | 69% | 0.694 | S | S | * | * | trans | -61.3 | 62.7 | 170.7 | -159.9 | 80.1 | 0 | 0 | 0 | 110.8 | Q15 | L13-Q15 PolarHBondContact O-N 3.48Š| ||
| 14 | E | 33.1 | Very low | 45.4 | Very low | 171 Ų | 171 | 138.8 Ų | 138.8 | 80% | 0.799 | 69% | 0.687 | S | S | * | * | trans | -76.8 | 124.6 | 172.6 | -154.4 | 176.1 | -155.4 | 0 | 0 | 107.9 | P12 V16 | P12-E14 PolarHBondContact O-N 3.06Å; E14-V16 VanDerWaalsContact C-N 3.35Å; E14-V16 PolarHBondContact O-N 3.16Å | ||
| 15 | Q | 36.4 | Very low | 44.4 | Very low | 195 Ų | 195 | 136.8 Ų | 136.8 | 91% | 0.911 | 68% | 0.68 | S | S | * | * | trans | -51.4 | 90.9 | -176.7 | -73.3 | 167.3 | -5.2 | 0 | 0 | 111.1 | L13 | L13-Q15 PolarHBondContact O-N 3.48Š| ||
| 16 | V | 38.8 | Very low | 43.3 | Very low | 115 Ų | 115 | 137 Ų | 137 | 70% | 0.697 | 68% | 0.681 | S | S | * | * | trans | -80.4 | 122.5 | 156.9 | -177.1 | 0 | 0 | 0 | 0 | 105.3 | E14 D18 | E14-V16 VanDerWaalsContact C-N 3.35Å; E14-V16 PolarHBondContact O-N 3.16Å; V16-D18 PolarHBondContact O-N 3.44Å | ||
| 17 | D | 37.2 | Very low | 42.8 | Very low | 153 Ų | 153 | 138.3 Ų | 138.3 | 82% | 0.818 | 68% | 0.684 | S | S | * | * | trans | -55.9 | 74.9 | 178.8 | -178.9 | 39.7 | 0 | 0 | 0 | 111.6 | G19 | D17-G19 PolarHBondContact O-N 3.5Š| ||
| 18 | D | 45.1 | Very low | 42 | Very low | 86 Ų | 86 | 138.4 Ų | 138.4 | 46% | 0.46 | 69% | 0.69 | S | S | . | * | trans | -88.7 | 25.4 | 173.8 | -78.8 | -30.2 | 0 | 0 | 0 | 110.8 | V16 K20 Y21 L22 | V16-D18 PolarHBondContact O-N 3.44Å; D18-K20 PolarHBondContact O-N 3.39Å; D18-Y21 PolarHBondContact O-N 2.77Å; D18-L22 PolarHBondContact O-N 2.79Å | ||
| 19 | G | 37.8 | Very low | 41 | Very low | 45 Ų | 45 | 131.1 Ų | 131.1 | 46% | 0.464 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -55.9 | -21.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | D17 | D17-G19 PolarHBondContact O-N 3.5Å |
| 20 | K | 45.4 | Very low | 40.6 | Very low | 189 Ų | 189 | 132.3 Ų | 132.3 | 82% | 0.822 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -85.6 | -28.3 | 177.6 | -139.9 | -178 | -177.7 | -169.9 | 0 | 114.5 | D18 | D18-K20 PolarHBondContact O-N 3.39Å |
| 21 | Y | 45.7 | Very low | 40.2 | Very low | 158 Ų | 158 | 132.7 Ų | 132.7 | 62% | 0.62 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -98.2 | -18 | -179.5 | -77.7 | -80.5 | 0 | 0 | 0 | 113.3 | D18 N25 | D18-Y21 PolarHBondContact O-N 2.77Å; Y21-N25 PolarHBondContact O-ND2 3.4Å |
| 22 | L | 42.6 | Very low | 40.4 | Very low | 97 Ų | 97 | 133.4 Ų | 133.4 | 51% | 0.508 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -71.3 | -34.2 | 175.5 | -155.3 | 154.7 | 0 | 0 | 0 | 111.3 | D18 E24 H26 | D18-L22 PolarHBondContact O-N 2.79Å; L22-E24 PolarHBondContact O-N 3.24Å; L22-H26 PolarHBondContact O-N 3.31Å |
| 23 | L | 36 | Very low | 40.3 | Very low | 131 Ų | 131 | 136.8 Ų | 136.8 | 69% | 0.686 | 70% | 0.703 | S | S | * | * | H | α-helix | trans | -65.4 | -36.4 | 179.8 | -131.3 | 79 | 0 | 0 | 0 | 112.8 | H26 Q27 | L23-H26 PolarHBondContact O-N 2.96Å; L23-Q27 PolarHBondContact O-N 3.31Å |
| 24 | E | 40.1 | Very low | 40.4 | Very low | 134 Ų | 134 | 135.3 Ų | 135.3 | 63% | 0.626 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -71.6 | -35.6 | -177.6 | -167.6 | 172 | -171.2 | 0 | 0 | 112.4 | L22 Q27 | L22-E24 PolarHBondContact O-N 3.24Å; E24-Q27 PolarHBondContact O-N 2.99Å |
| 25 | N | 35 | Very low | 40.8 | Very low | 90 Ų | 90 | 134.3 Ų | 134.3 | 48% | 0.481 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -74.6 | -30.2 | 177.1 | -80.7 | -66.6 | 0 | 0 | 0 | 113.1 | Y21 Q27 L28 | Y21-N25 PolarHBondContact O-ND2 3.4Å; N25-Q27 PolarHBondContact O-N 2.84Å; N25-L28 PolarHBondContact O-N 3.19Å |
| 26 | H | 33.4 | Very low | 41 | Very low | 134 Ų | 134 | 131.5 Ų | 131.5 | 62% | 0.62 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -68.9 | -24.8 | 175.7 | -123.3 | 84.2 | 0 | 0 | 0 | 112.3 | L22 L23 L28 A29 | L22-H26 PolarHBondContact O-N 3.31Å; L23-H26 PolarHBondContact O-N 2.96Å; H26-L28 PolarHBondContact O-N 3.06Å; H26-A29 WeakPolarHBondContact O-CB 3.18Å; H26-A29 PolarHBondContact O-N 2.9Å |
| 27 | Q | 39.2 | Very low | 41 | Very low | 146 Ų | 146 | 134.6 Ų | 134.6 | 68% | 0.682 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | -17.1 | 179.3 | -155.9 | 66.9 | 64.3 | 0 | 0 | 113 | L23 E24 N25 A29 | L23-Q27 PolarHBondContact O-N 3.31Å; E24-Q27 PolarHBondContact O-N 2.99Å; N25-Q27 PolarHBondContact O-N 2.84Å; Q27-A29 PolarHBondContact O-N 3.28Å |
| 28 | L | 43.1 | Very low | 40.9 | Very low | 146 Ų | 146 | 133.9 Ų | 133.9 | 76% | 0.764 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | 7.9 | 176.2 | -71.4 | 166.4 | 0 | 0 | 0 | 113.8 | N25 H26 M30 | N25-L28 PolarHBondContact O-N 3.19Å; H26-L28 PolarHBondContact O-N 3.06Å; L28-M30 VanDerWaalsContact C-N 3.32Å; L28-M30 PolarHBondContact O-N 3.44Å |
| 29 | A | 40.9 | Very low | 40.4 | Very low | 65 Ų | 65 | 138.9 Ų | 138.9 | 54% | 0.537 | 70% | 0.703 | S | S | . | * | trans | -91.7 | 35.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114 | H26 Q27 | H26-A29 WeakPolarHBondContact O-CB 3.18Å; H26-A29 PolarHBondContact O-N 2.9Å; Q27-A29 PolarHBondContact O-N 3.28Å | ||
| 30 | M | 41 | Very low | 40.1 | Very low | 154 Ų | 154 | 143.1 Ų | 143.1 | 76% | 0.759 | 72% | 0.722 | S | S | * | * | trans | -123.6 | 79.8 | 171.8 | -68.9 | -167.5 | 59.4 | 0 | 0 | 109.7 | L28 | L28-M30 VanDerWaalsContact C-N 3.32Å; L28-M30 PolarHBondContact O-N 3.44Å | ||
| 31 | D | 40.8 | Very low | 39.9 | Very low | 166 Ų | 166 | 140.3 Ų | 140.3 | 89% | 0.888 | 72% | 0.715 | S | S | * | * | trans | -171.4 | 55.6 | 156.4 | -89 | -23.7 | 0 | 0 | 0 | 107.7 | ||||
| 32 | V | 49.5 | Very low | 39.6 | Very low | 135 Ų | 135 | 136.5 Ų | 136.5 | 82% | 0.818 | 71% | 0.711 | S | S | * | * | trans | -109.5 | 58.8 | 174.7 | -174.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 33 | E | 45.6 | Very low | 39.8 | Very low | 180 Ų | 180 | 137.7 Ų | 137.7 | 84% | 0.841 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -147.2 | 4.9 | 171.6 | -149.9 | 142.3 | -144.5 | 0 | 0 | 116.9 | ||
| 34 | N | 42.6 | Very low | 40.5 | Very low | 152 Ų | 152 | 137.5 Ų | 137.5 | 81% | 0.813 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -140.1 | 108.9 | 172.6 | -98.2 | -50.4 | 0 | 0 | 0 | 112.9 | ||
| 35 | N | 40.9 | Very low | 41.7 | Very low | 149 Ų | 149 | 134 Ų | 134 | 80% | 0.797 | 70% | 0.702 | S | S | * | * | S | Bend | trans | 91.7 | 45.5 | 161.8 | -61.6 | -49.1 | 0 | 0 | 0 | 121.4 | ||
| 36 | I | 41.1 | Very low | 42.7 | Very low | 137 Ų | 137 | 135.2 Ų | 135.2 | 70% | 0.703 | 71% | 0.708 | S | S | * | * | trans | -136.4 | 79.5 | 151.4 | -49.7 | 177.1 | 0 | 0 | 0 | 110.5 | N38 | I36-N38 PolarHBondContact O-N 2.94Š| ||
| 37 | E | 37.7 | Very low | 44.4 | Very low | 180 Ų | 180 | 132.2 Ų | 132.2 | 84% | 0.841 | 70% | 0.695 | S | S | * | * | trans | -62.1 | 126.9 | 152.2 | -75.8 | -175.4 | 157.5 | 0 | 0 | 108.5 | ||||
| 38 | N | 35.8 | Very low | 46.1 | Very low | 138 Ų | 138 | 128.2 Ų | 128.2 | 74% | 0.738 | 68% | 0.682 | S | S | * | * | S | Bend | trans | 63.9 | 67.1 | 165 | -61.8 | -58.1 | 0 | 0 | 0 | 117.4 | I36 | I36-N38 PolarHBondContact O-N 2.94Š|
| 39 | Y | 33.4 | Very low | 48.1 | Very low | 191 Ų | 191 | 127.3 Ų | 127.3 | 75% | 0.749 | 67% | 0.672 | S | S | * | * | trans | -164.3 | 114.3 | 131.6 | -96.1 | -75.4 | 0 | 0 | 0 | 108.5 | L41 | Y39-L41 PolarHBondContact O-N 2.97Š| ||
| 40 | P | 33.3 | Very low | 50 | Low | 134 Ų | 134 | 127.3 Ų | 127.3 | 87% | 0.87 | 67% | 0.666 | S | S | * | * | trans | -71.4 | 80 | 169.8 | 28.2 | -30.4 | 0 | 0 | 0 | 108.7 | S42 | P40-S42 PolarHBondContact O-N 2.8Å; P40-S42 VanDerWaalsContact O-N 3.09Å | ||
| 41 | L | 39.8 | Very low | 52 | Low | 130 Ų | 130 | 125.6 Ų | 125.6 | 68% | 0.681 | 65% | 0.654 | S | S | * | * | trans | -69.7 | 101.5 | 168.4 | -66.5 | 171.4 | 0 | 0 | 0 | 106.3 | Y39 L43 | Y39-L41 PolarHBondContact O-N 2.97Å; L41-L43 PolarHBondContact O-N 3Å | ||
| 42 | S | 39 | Very low | 54.1 | Low | 77 Ų | 77 | 122.9 Ų | 122.9 | 54% | 0.538 | 64% | 0.638 | S | S | . | * | trans | -49.1 | 121.7 | 170.3 | 60.3 | 0 | 0 | 0 | 0 | 107.7 | P40 Q44 P45 | P40-S42 PolarHBondContact O-N 2.8Å; P40-S42 VanDerWaalsContact O-N 3.09Å; S42-Q44 PolarHBondContact O-N 3.5Å; S42-P45 WeakPolarHBondContact O-CD 3.48Å; S42-P45 WeakPolarHBondContact OG-CD 3.43Å; S42-P45 WeakPolarHBondContact OG-CG 3.25Å | ||
| 43 | L | 46.9 | Very low | 55.6 | Low | 123 Ų | 123 | 122.1 Ų | 122.1 | 64% | 0.644 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -64.7 | -25.6 | 176.2 | -94.8 | 97.6 | 0 | 0 | 0 | 111.9 | L41 L46 E47 | L41-L43 PolarHBondContact O-N 3Å; L43-L46 WeakPolarHBondContact O-CB 3.2Å; L43-L46 PolarHBondContact O-N 3.03Å; L43-E47 PolarHBondContact O-N 3.35Å |
| 44 | Q | 50.9 | Low | 57.4 | Low | 127 Ų | 127 | 117.5 Ų | 117.5 | 59% | 0.593 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -54.7 | -44.1 | -174.8 | -69.2 | -70.2 | -63.6 | 0 | 0 | 115.3 | S42 L46 E47 S48 | S42-Q44 PolarHBondContact O-N 3.5Å; Q44-L46 VanDerWaalsContact C-N 3.35Å; Q44-E47 PolarHBondContact NE2-OE2 3.1Å; Q44-S48 WeakPolarHBondContact O-CB 3.35Å; Q44-S48 PolarHBondContact O-N 3.27Å; Q44-S48 PolarHBondContact O-OG 3.37Å |
| 45 | P | 65.5 | Low | 59.4 | Low | 60 Ų | 60 | 118.6 Ų | 118.6 | 39% | 0.39 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -70.3 | -28.7 | 174.5 | -18.2 | 34.9 | 0 | 0 | 0 | 112.9 | S42 K49 | S42-P45 WeakPolarHBondContact O-CD 3.48Å; S42-P45 WeakPolarHBondContact OG-CD 3.43Å; S42-P45 WeakPolarHBondContact OG-CG 3.25Å; P45-K49 VanDerWaalsContact O-CG 3.25Å; P45-K49 WeakPolarHBondContact O-CG 3.48Å; P45-K49 PolarHBondContact O-N 3.18Å |
| 46 | L | 55.9 | Low | 61.5 | Low | 116 Ų | 116 | 114 Ų | 114 | 61% | 0.607 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -73.8 | -44.7 | 178 | -145.3 | 75.9 | 0 | 0 | 0 | 110.3 | L43 Q44 S48 K49 V50 | L43-L46 WeakPolarHBondContact O-CB 3.2Å; L43-L46 PolarHBondContact O-N 3.03Å; Q44-L46 VanDerWaalsContact C-N 3.35Å; L46-S48 VanDerWaalsContact C-N 3.26Å; L46-S48 PolarHBondContact O-N 2.73Å; L46-K49 PolarHBondContact O-N 3.01Å; L46-K49 VanDerWaalsContact O-N 3.1Å; L46-V50 WeakPolarHBondContact O-CG2 3.45Å; L46-V50 PolarHBondContact O-N 3.21Å |
| 47 | E | 68.7 | Low | 63.6 | Low | 71 Ų | 71 | 115.4 Ų | 115.4 | 33% | 0.332 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -55.9 | -42.7 | 170.4 | -72.5 | 175.1 | -151.4 | 0 | 0 | 111.5 | L43 Q44 K49 V50 K51 | L43-E47 PolarHBondContact O-N 3.35Å; Q44-E47 PolarHBondContact NE2-OE2 3.1Å; E47-K49 PolarHBondContact O-N 3.25Å; E47-V50 PolarHBondContact O-N 3.38Å; E47-K51 WeakPolarHBondContact O-CB 3.21Å; E47-K51 VanDerWaalsContact O-CG 3.31Å; E47-K51 WeakPolarHBondContact O-CG 3.47Å; E47-K51 PolarHBondContact O-N 3.34Å |
| 48 | S | 76.1 | Confident | 65.9 | Low | 61 Ų | 61 | 113.8 Ų | 113.8 | 43% | 0.427 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.8 | -43.6 | 176.2 | -61.4 | 0 | 0 | 0 | 0 | 111.6 | Q44 L46 K51 I52 | Q44-S48 WeakPolarHBondContact O-CB 3.35Å; Q44-S48 PolarHBondContact O-N 3.27Å; Q44-S48 PolarHBondContact O-OG 3.37Å; L46-S48 VanDerWaalsContact C-N 3.26Å; L46-S48 PolarHBondContact O-N 2.73Å; S48-K51 PolarHBondContact O-N 2.6Å; S48-I52 WeakPolarHBondContact O-CD1 3.31Å; S48-I52 WeakPolarHBondContact O-CG1 3.41Å; S48-I52 PolarHBondContact O-N 3.16Å |
| 49 | K | 84.1 | Confident | 68.1 | Low | 127 Ų | 127 | 111.3 Ų | 111.3 | 55% | 0.552 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.3 | -43.6 | 177.9 | -74.1 | 170.1 | -176.3 | -177.9 | 0 | 112.4 | P45 L46 E47 K51 I52 I53 | P45-K49 VanDerWaalsContact O-CG 3.25Å; P45-K49 WeakPolarHBondContact O-CG 3.48Å; P45-K49 PolarHBondContact O-N 3.18Å; L46-K49 PolarHBondContact O-N 3.01Å; L46-K49 VanDerWaalsContact O-N 3.1Å; E47-K49 PolarHBondContact O-N 3.25Å; K49-K51 VanDerWaalsContact C-N 3.35Å; K49-K51 PolarHBondContact O-N 3.27Å; K49-I52 PolarHBondContact O-N 2.79Å; K49-I53 WeakPolarHBondContact O-CG1 3.41Å; K49-I53 PolarHBondContact O-N 3.29Å |
| 50 | V | 81.1 | Confident | 70.6 | Confident | 66 Ų | 66 | 108.2 Ų | 108.2 | 40% | 0.4 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -61.1 | -45 | 176.8 | 173.8 | 0 | 0 | 0 | 0 | 110.4 | L46 E47 I52 I53 Q54 | L46-V50 WeakPolarHBondContact O-CG2 3.45Å; L46-V50 PolarHBondContact O-N 3.21Å; E47-V50 PolarHBondContact O-N 3.38Å; V50-I52 VanDerWaalsContact C-N 3.32Å; V50-I52 PolarHBondContact O-N 2.71Å; V50-I53 PolarHBondContact O-N 2.86Å; V50-Q54 HydrophobicContact CG1-CG 4.26Å; V50-Q54 WeakPolarHBondContact O-CB 3.47Å; V50-Q54 WeakPolarHBondContact O-CG 3.25Å; V50-Q54 PolarHBondContact O-N 3.44Å |
| 51 | K | 83 | Confident | 72.9 | Confident | 117 Ų | 117 | 105.6 Ų | 105.6 | 51% | 0.509 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.1 | -40.2 | 175.6 | -74.4 | 174.8 | 178.6 | 174.9 | 0 | 112.5 | E47 S48 K49 R55 | E47-K51 WeakPolarHBondContact O-CB 3.21Å; E47-K51 VanDerWaalsContact O-CG 3.31Å; E47-K51 WeakPolarHBondContact O-CG 3.47Å; E47-K51 PolarHBondContact O-N 3.34Å; S48-K51 PolarHBondContact O-N 2.6Å; K49-K51 VanDerWaalsContact C-N 3.35Å; K49-K51 PolarHBondContact O-N 3.27Å; K51-R55 WeakPolarHBondContact O-CB 3.26Å; K51-R55 PolarHBondContact O-N 3.41Å |
| 52 | I | 84.6 | Confident | 74.8 | Confident | 110 Ų | 110 | 106.9 Ų | 106.9 | 56% | 0.564 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.2 | -46.9 | 176.2 | -68.6 | 163.7 | 0 | 0 | 0 | 110.6 | S48 K49 V50 R55 A56 | S48-I52 WeakPolarHBondContact O-CD1 3.31Å; S48-I52 WeakPolarHBondContact O-CG1 3.41Å; S48-I52 PolarHBondContact O-N 3.16Å; K49-I52 PolarHBondContact O-N 2.79Å; V50-I52 VanDerWaalsContact C-N 3.32Å; V50-I52 PolarHBondContact O-N 2.71Å; I52-R55 PolarHBondContact O-N 3.01Å; I52-A56 WeakPolarHBondContact O-CB 3.42Å; I52-A56 PolarHBondContact O-N 3.09Å |
| 53 | I | 81.3 | Confident | 76.7 | Confident | 119 Ų | 119 | 111 Ų | 111 | 61% | 0.61 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64 | -46.1 | 178.7 | -66.3 | 170 | 0 | 0 | 0 | 110.7 | K49 V50 R55 A56 W57 | K49-I53 WeakPolarHBondContact O-CG1 3.41Å; K49-I53 PolarHBondContact O-N 3.29Å; V50-I53 PolarHBondContact O-N 2.86Å; I53-R55 VanDerWaalsContact C-N 3.31Å; I53-R55 PolarHBondContact O-N 3.16Å; I53-A56 PolarHBondContact O-N 3.26Å; I53-W57 WeakPolarHBondContact O-CB 3.41Å; I53-W57 PolarHBondContact O-N 2.96Å |
| 54 | Q | 83.8 | Confident | 77.4 | Confident | 82 Ų | 82 | 110.6 Ų | 110.6 | 38% | 0.383 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.8 | -36.9 | 177.3 | -73.8 | 176.6 | -18 | 0 | 0 | 112.6 | V50 R58 | V50-Q54 HydrophobicContact CG1-CG 4.26Å; V50-Q54 WeakPolarHBondContact O-CB 3.47Å; V50-Q54 WeakPolarHBondContact O-CG 3.25Å; V50-Q54 PolarHBondContact O-N 3.44Å; Q54-R58 WeakPolarHBondContact O-CB 3.14Å; Q54-R58 PolarHBondContact O-N 3.39Å |
| 55 | R | 84.9 | Confident | 77.3 | Confident | 175 Ų | 175 | 110.3 Ų | 110.3 | 66% | 0.66 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -69 | -45.6 | 174.4 | -176.1 | 173.5 | -176 | 134.4 | 0.7 | 111.5 | K51 I52 I53 W57 R58 E59 | K51-R55 WeakPolarHBondContact O-CB 3.26Å; K51-R55 PolarHBondContact O-N 3.41Å; I52-R55 PolarHBondContact O-N 3.01Å; I53-R55 VanDerWaalsContact C-N 3.31Å; I53-R55 PolarHBondContact O-N 3.16Å; R55-W57 VanDerWaalsContact C-N 3.29Å; R55-W57 PolarHBondContact O-N 3.06Å; R55-R58 PolarHBondContact O-N 3.45Å; R55-E59 WeakPolarHBondContact O-CB 3.35Å; R55-E59 PolarHBondContact O-N 3.03Å |
| 56 | A | 83.9 | Confident | 76.3 | Confident | 52 Ų | 52 | 112.9 Ų | 112.9 | 43% | 0.43 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.3 | -39.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | I52 I53 E59 Y60 | I52-A56 WeakPolarHBondContact O-CB 3.42Å; I52-A56 PolarHBondContact O-N 3.09Å; I53-A56 PolarHBondContact O-N 3.26Å; A56-E59 PolarHBondContact O-N 3.44Å; A56-Y60 WeakPolarHBondContact O-CB 3.48Å; A56-Y60 PolarHBondContact O-N 3.35Å |
| 57 | W | 85.4 | Confident | 75.5 | Confident | 167 Ų | 167 | 115.4 Ų | 115.4 | 63% | 0.633 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -67.9 | -42.2 | 176 | -172.6 | 60.2 | 0 | 0 | 0 | 112.5 | I53 R55 E59 Y60 L61 | I53-W57 WeakPolarHBondContact O-CB 3.41Å; I53-W57 PolarHBondContact O-N 2.96Å; R55-W57 VanDerWaalsContact C-N 3.29Å; R55-W57 PolarHBondContact O-N 3.06Å; W57-E59 VanDerWaalsContact C-N 3.31Å; W57-E59 PolarHBondContact O-N 2.98Å; W57-Y60 WeakPolarHBondContact O-CB 3.49Å; W57-Y60 PolarHBondContact O-N 3.26Å; W57-L61 HydrophobicContact CD2-CD1 4.01Å; W57-L61 HydrophobicContact CE3-CD1 4.21Å; W57-L61 HydrophobicContact CH2-CD1 4.11Å; W57-L61 HydrophobicContact CZ2-CD1 3.89Å; W57-L61 HydrophobicContact CZ3-CD1 4.26Å; W57-L61 WeakPolarHBondContact O-CG 3.41Å; W57-L61 PolarHBondContact O-N 2.81Å |
| 58 | R | 86.2 | Confident | 74 | Confident | 147 Ų | 147 | 119 Ų | 119 | 56% | 0.555 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -58.6 | -43 | 170.9 | -91.4 | -171.6 | -78.2 | -161.3 | -3.4 | 112.2 | Q54 R55 L61 Q62 | Q54-R58 WeakPolarHBondContact O-CB 3.14Å; Q54-R58 PolarHBondContact O-N 3.39Å; R55-R58 PolarHBondContact O-N 3.45Å; R58-L61 PolarHBondContact O-N 3.48Å; R58-Q62 WeakPolarHBondContact O-CB 3.47Å; R58-Q62 PolarHBondContact O-N 3.26Å |
| 59 | E | 83.4 | Confident | 72 | Confident | 85 Ų | 85 | 124 Ų | 124 | 40% | 0.397 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -68.9 | -37 | 178.8 | -157.7 | -170.5 | -168.8 | 0 | 0 | 111.8 | R55 A56 W57 Q62 R63 | R55-E59 WeakPolarHBondContact O-CB 3.35Å; R55-E59 PolarHBondContact O-N 3.03Å; A56-E59 PolarHBondContact O-N 3.44Å; W57-E59 VanDerWaalsContact C-N 3.31Å; W57-E59 PolarHBondContact O-N 2.98Å; E59-Q62 PolarHBondContact O-N 3.47Å; E59-R63 VanDerWaalsContact CG-NH1 3.27Å; E59-R63 WeakPolarHBondContact O-CG 3.49Å; E59-R63 PolarHBondContact O-N 3.06Å; E59-R63 IonicContact OE1-CZ 3.66Å; E59-R63 VanDerWaalsContact OE1-CZ 3.29Å; E59-R63 IonicContact OE1-NH1 2.91Å; E59-R63 PolarHBondContact OE1-NH1 3.42Å; E59-R63 IonicContact OE1-NH2 3.59Å; E59-R63 PolarHBondContact OE1-NH2 2.88Å; E59-R63 IonicContact OE2-CZ 2.6Å; E59-R63 IonicContact OE2-NH1 2.66Å; E59-R63 PolarHBondContact OE2-NH1 2.88Å; E59-R63 IonicContact OE2-NH2 3.29Å |
| 60 | Y | 85.6 | Confident | 69.3 | Low | 126 Ų | 126 | 129.7 Ų | 129.7 | 49% | 0.494 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -62.1 | -46.6 | 173 | 176.2 | -97.6 | 0 | 0 | 0 | 111.8 | A56 W57 Q62 R63 Q64 | A56-Y60 WeakPolarHBondContact O-CB 3.48Å; A56-Y60 PolarHBondContact O-N 3.35Å; W57-Y60 WeakPolarHBondContact O-CB 3.49Å; W57-Y60 PolarHBondContact O-N 3.26Å; Y60-Q62 VanDerWaalsContact C-N 3.33Å; Y60-Q62 PolarHBondContact O-N 3.15Å; Y60-R63 PolarHBondContact O-N 3.48Å; Y60-Q64 HydrophobicContact CE1-CG 4.13Å; Y60-Q64 PolarHBondContact O-N 3.35Å; Y60-Q64 PolarHBondContact OH-NE2 3.38Å |
| 61 | L | 80.6 | Confident | 67 | Low | 80 Ų | 80 | 131.9 Ų | 131.9 | 42% | 0.419 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -60.2 | -42.5 | 175.1 | -77 | 168.9 | 0 | 0 | 0 | 111.7 | W57 R58 R63 Q64 | W57-L61 HydrophobicContact CD2-CD1 4.01Å; W57-L61 HydrophobicContact CE3-CD1 4.21Å; W57-L61 HydrophobicContact CH2-CD1 4.11Å; W57-L61 HydrophobicContact CZ2-CD1 3.89Å; W57-L61 HydrophobicContact CZ3-CD1 4.26Å; W57-L61 WeakPolarHBondContact O-CG 3.41Å; W57-L61 PolarHBondContact O-N 2.81Å; R58-L61 PolarHBondContact O-N 3.48Å; L61-R63 VanDerWaalsContact C-N 3.28Å; L61-R63 PolarHBondContact O-N 3.46Å; L61-Q64 PolarHBondContact O-N 2.85Å; L61-Q64 VanDerWaalsContact O-N 3.16Å |
| 62 | Q | 81 | Confident | 64.9 | Low | 157 Ų | 157 | 132.3 Ų | 132.3 | 73% | 0.734 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -67.3 | -28.1 | 177.8 | -167.2 | 165.4 | 20.3 | 0 | 0 | 113.1 | R58 E59 Y60 | R58-Q62 WeakPolarHBondContact O-CB 3.47Å; R58-Q62 PolarHBondContact O-N 3.26Å; E59-Q62 PolarHBondContact O-N 3.47Å; Y60-Q62 VanDerWaalsContact C-N 3.33Å; Y60-Q62 PolarHBondContact O-N 3.15Å |
| 63 | R | 78.6 | Confident | 62.2 | Low | 163 Ų | 163 | 132.7 Ų | 132.7 | 62% | 0.615 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -79.1 | -23.1 | 172.9 | -74.4 | 179.2 | 177.7 | 114.7 | 5.2 | 113.4 | E59 Y60 L61 D65 | E59-R63 VanDerWaalsContact CG-NH1 3.27Å; E59-R63 WeakPolarHBondContact O-CG 3.49Å; E59-R63 PolarHBondContact O-N 3.06Å; E59-R63 IonicContact OE1-CZ 3.66Å; E59-R63 VanDerWaalsContact OE1-CZ 3.29Å; E59-R63 IonicContact OE1-NH1 2.91Å; E59-R63 PolarHBondContact OE1-NH1 3.42Å; E59-R63 IonicContact OE1-NH2 3.59Å; E59-R63 PolarHBondContact OE1-NH2 2.88Å; E59-R63 IonicContact OE2-CZ 2.6Å; E59-R63 IonicContact OE2-NH1 2.66Å; E59-R63 PolarHBondContact OE2-NH1 2.88Å; E59-R63 IonicContact OE2-NH2 3.29Å; Y60-R63 PolarHBondContact O-N 3.48Å; L61-R63 VanDerWaalsContact C-N 3.28Å; L61-R63 PolarHBondContact O-N 3.46Å; R63-D65 VanDerWaalsContact C-N 3.28Å |
| 64 | Q | 61.7 | Low | 60.1 | Low | 114 Ų | 114 | 132.4 Ų | 132.4 | 53% | 0.533 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -76 | -14.9 | 176.3 | -92.3 | -154.8 | 18.1 | 0 | 0 | 113.2 | Y60 L61 P66 | Y60-Q64 HydrophobicContact CE1-CG 4.13Å; Y60-Q64 PolarHBondContact O-N 3.35Å; Y60-Q64 PolarHBondContact OH-NE2 3.38Å; L61-Q64 PolarHBondContact O-N 2.85Å; L61-Q64 VanDerWaalsContact O-N 3.16Å; Q64-P66 VanDerWaalsContact O-CD 3.32Å; Q64-P66 WeakPolarHBondContact O-CD 3.23Å |
| 65 | D | 47.2 | Very low | 57.8 | Low | 121 Ų | 121 | 134.3 Ų | 134.3 | 65% | 0.647 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -62.1 | 120.1 | 174.7 | -118.9 | -32.4 | 0 | 0 | 0 | 109.7 | R63 L67 | R63-D65 VanDerWaalsContact C-N 3.28Å; D65-L67 PolarHBondContact O-N 2.9Å |
| 66 | P | 44.3 | Very low | 55.1 | Low | 114 Ų | 114 | 131.9 Ų | 131.9 | 74% | 0.74 | 68% | 0.678 | S | S | * | * | trans | -61.4 | 102.5 | -167.6 | -25.9 | 34.8 | 0 | 0 | 0 | 113.7 | Q64 E68 | Q64-P66 VanDerWaalsContact O-CD 3.32Å; Q64-P66 WeakPolarHBondContact O-CD 3.23Å; P66-E68 VanDerWaalsContact C-N 3.29Å; P66-E68 PolarHBondContact O-N 3.36Å | ||
| 67 | L | 39.8 | Very low | 52.8 | Low | 170 Ų | 170 | 136.1 Ų | 136.1 | 89% | 0.89 | 70% | 0.698 | S | S | * | * | trans | -74 | 79.9 | 169.2 | -78.5 | 168 | 0 | 0 | 0 | 110.7 | D65 K69 | D65-L67 PolarHBondContact O-N 2.9Å; L67-K69 PolarHBondContact O-N 3.25Å | ||
| 68 | E | 37.4 | Very low | 50.1 | Low | 145 Ų | 145 | 133.8 Ų | 133.8 | 68% | 0.678 | 71% | 0.707 | S | S | * | * | trans | -66.5 | 107.4 | 153.5 | -94.2 | -94.6 | 145.9 | 0 | 0 | 108.8 | P66 | P66-E68 VanDerWaalsContact C-N 3.29Å; P66-E68 PolarHBondContact O-N 3.36Å | ||
| 69 | K | 34.4 | Very low | 47.7 | Very low | 166 Ų | 166 | 131.5 Ų | 131.5 | 72% | 0.722 | 71% | 0.714 | S | S | * | * | trans | 56.3 | 86 | 146.9 | -57.6 | -177.5 | -175.6 | 112 | 0 | 117.4 | L67 | L67-K69 PolarHBondContact O-N 3.25Š| ||
| 70 | R | 27.9 | Very low | 45.3 | Very low | 247 Ų | 247 | 133.8 Ų | 133.8 | 93% | 0.932 | 73% | 0.729 | S | S | * | * | trans | -141.2 | 77.5 | 148.2 | -162.7 | 164.1 | -178.4 | 159.1 | -1.3 | 111.3 | ||||
| 71 | S | 32.3 | Very low | 42.8 | Very low | 112 Ų | 112 | 136.5 Ų | 136.5 | 78% | 0.783 | 74% | 0.743 | S | S | * | * | trans | -117.1 | 139.5 | 155.6 | -59.5 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 72 | P | 37.9 | Very low | 40.6 | Very low | 126 Ų | 126 | 140.1 Ų | 140.1 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -85.2 | 133.1 | -162 | 8 | 10.8 | 0 | 0 | 0 | 111 | ||
| 73 | S | 27.6 | Very low | 38.4 | Very low | 119 Ų | 119 | 138.5 Ų | 138.5 | 83% | 0.832 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -65 | 131.8 | -179.2 | -50.8 | 0 | 0 | 0 | 0 | 113.1 | ||
| 74 | P | 37.5 | Very low | 36 | Very low | 113 Ų | 113 | 135.9 Ų | 135.9 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 160.7 | 164.5 | 31.1 | -30.8 | 0 | 0 | 0 | 111.9 | ||
| 75 | P | 35.3 | Very low | 34.6 | Very low | 122 Ų | 122 | 135.6 Ų | 135.6 | 79% | 0.792 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 141.6 | -162.9 | 29.8 | -34.2 | 0 | 0 | 0 | 114.3 | ||
| 76 | S | 29.8 | Very low | 33.9 | Very low | 123 Ų | 123 | 135.5 Ų | 135.5 | 86% | 0.86 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -59 | 126.6 | 177.4 | -50.6 | 0 | 0 | 0 | 0 | 113.2 | ||
| 77 | V | 35.9 | Very low | 33.6 | Very low | 142 Ų | 142 | 135.7 Ų | 135.7 | 86% | 0.861 | 79% | 0.793 | S | S | * | * | trans | -123.3 | 121 | 157 | -70.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 78 | S | 27.9 | Very low | 33.4 | Very low | 117 Ų | 117 | 135.7 Ų | 135.7 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -68.3 | 141.4 | 175.7 | -63.5 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 79 | S | 35.8 | Very low | 33.2 | Very low | 100 Ų | 100 | 135.4 Ų | 135.4 | 70% | 0.699 | 79% | 0.794 | S | S | * | * | -177.3 | 125.4 | 119.8 | -107.5 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 80 | D | 32.8 | Very low | 33 | Very low | 132 Ų | 132 | 132.6 Ų | 132.6 | 71% | 0.706 | 79% | 0.791 | S | S | * | * | trans | 58.5 | 107.3 | 136.5 | -54.5 | -52.3 | 0 | 0 | 0 | 120.3 | ||||
| 81 | K | 33.4 | Very low | 33.4 | Very low | 183 Ų | 183 | 131.1 Ų | 131.1 | 80% | 0.796 | 79% | 0.792 | S | S | * | * | 89 | 119.4 | 74.1 | -106 | -176.4 | -179.9 | -178.6 | 0 | 114.6 | |||||
| 82 | L | 33.9 | Very low | 33.3 | Very low | 156 Ų | 156 | 131 Ų | 131 | 82% | 0.817 | 79% | 0.791 | S | S | * | * | trans | 82.3 | 104.4 | 157.3 | -49.5 | 177.8 | 0 | 0 | 0 | 118.1 | ||||
| 83 | S | 34.5 | Very low | 33.2 | Very low | 123 Ų | 123 | 132.1 Ų | 132.1 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | -173.1 | 145.3 | 99.7 | -79 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 84 | S | 29.7 | Very low | 33.4 | Very low | 109 Ų | 109 | 132 Ų | 132 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | -66.7 | 153.7 | 177.9 | 63.4 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 85 | S | 31.8 | Very low | 33.5 | Very low | 108 Ų | 108 | 130.2 Ų | 130.2 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | 170.9 | 145.6 | 114.7 | 51.1 | 0 | 0 | 0 | 0 | 114 | |||||
| 86 | V | 32.9 | Very low | 33.7 | Very low | 118 Ų | 118 | 129.1 Ų | 129.1 | 72% | 0.715 | 77% | 0.77 | S | S | * | * | trans | 61.3 | 97.3 | 159.9 | -152.5 | 0 | 0 | 0 | 0 | 118.3 | M88 | V86-M88 HydrophobicContact CG1-CG 4.02Š| ||
| 87 | S | 38.3 | Very low | 34.6 | Very low | 118 Ų | 118 | 128.3 Ų | 128.3 | 83% | 0.825 | 76% | 0.762 | S | S | * | * | trans | -114.7 | 120.4 | 146.8 | -67.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 88 | M | 35.4 | Very low | 35.3 | Very low | 171 Ų | 171 | 125.1 Ų | 125.1 | 84% | 0.842 | 75% | 0.751 | S | S | * | * | trans | -74.4 | 137.9 | -177.9 | -69.1 | -162.8 | 68.4 | 0 | 0 | 110.9 | V86 | V86-M88 HydrophobicContact CG1-CG 4.02Š| ||
| 89 | N | 33.3 | Very low | 36.6 | Very low | 138 Ų | 138 | 126.5 Ų | 126.5 | 74% | 0.738 | 74% | 0.744 | S | S | * | * | trans | -77.3 | 164.8 | 171 | -65.8 | 21.4 | 0 | 0 | 0 | 111.5 | ||||
| 90 | T | 29.8 | Very low | 37.6 | Very low | 107 Ų | 107 | 127.9 Ų | 127.9 | 66% | 0.656 | 74% | 0.738 | S | S | * | * | trans | 76.4 | 95.5 | 154.5 | 70.5 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 91 | F | 35.1 | Very low | 39.6 | Very low | 217 Ų | 217 | 127.2 Ų | 127.2 | 95% | 0.952 | 73% | 0.734 | S | S | * | * | -121.7 | 110.5 | 113 | -78.6 | -78.2 | 0 | 0 | 0 | 108.9 | |||||
| 92 | S | 31.2 | Very low | 42 | Very low | 109 Ų | 109 | 124.6 Ų | 124.6 | 76% | 0.762 | 73% | 0.725 | S | S | * | * | trans | -62.2 | 127.8 | 161.6 | -54.6 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 93 | D | 36.1 | Very low | 44.3 | Very low | 149 Ų | 149 | 126 Ų | 126 | 80% | 0.797 | 72% | 0.719 | S | S | * | * | trans | -136.9 | 119 | 141.5 | -152.6 | -3.6 | 0 | 0 | 0 | 109.7 | S95 | D93-S95 PolarHBondContact O-N 2.99Š| ||
| 94 | S | 31.8 | Very low | 46.5 | Very low | 118 Ų | 118 | 124.4 Ų | 124.4 | 83% | 0.825 | 70% | 0.698 | S | S | * | * | trans | -78.2 | 95 | -174.3 | 46.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 95 | S | 39.1 | Very low | 48.9 | Very low | 75 Ų | 75 | 122.5 Ų | 122.5 | 52% | 0.524 | 69% | 0.685 | S | S | . | * | trans | -120.1 | 117.6 | 157.9 | 72.3 | 0 | 0 | 0 | 0 | 107.8 | D93 | D93-S95 PolarHBondContact O-N 2.99Š| ||
| 96 | T | 38.4 | Very low | 51 | Low | 99 Ų | 99 | 121.6 Ų | 121.6 | 61% | 0.607 | 67% | 0.67 | S | S | * | * | trans | -32.2 | 132.4 | -174.5 | 40.7 | 0 | 0 | 0 | 0 | 115.7 | A98 | T96-A98 PolarHBondContact O-N 3.47Å; T96-A98 VanDerWaalsContact O-N 3.14Å | ||
| 97 | P | 49.5 | Very low | 53.4 | Low | 106 Ų | 106 | 123.2 Ų | 123.2 | 69% | 0.688 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -70.4 | -7.9 | -174.1 | 26.5 | -33.9 | 0 | 0 | 0 | 115.1 | ||
| 98 | A | 51.5 | Low | 55.4 | Low | 75 Ų | 75 | 122.5 Ų | 122.5 | 62% | 0.62 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -68.8 | -42 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | T96 | T96-A98 PolarHBondContact O-N 3.47Å; T96-A98 VanDerWaalsContact O-N 3.14Å |
| 99 | Q | 54 | Low | 57.4 | Low | 146 Ų | 146 | 121.5 Ų | 121.5 | 68% | 0.682 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -76.7 | -27.2 | -175 | -75.1 | -171.9 | -27 | 0 | 0 | 114 | E102 R103 | Q99-E102 PolarHBondContact O-N 3.06Å; Q99-R103 PolarHBondContact O-N 3.16Å |
| 100 | K | 57.6 | Low | 59.6 | Low | 129 Ų | 129 | 121.7 Ų | 121.7 | 56% | 0.561 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -68.4 | -36 | 179.3 | -72.1 | 178.6 | 178.7 | 171.8 | 0 | 111.9 | E104 | K100-E104 WeakPolarHBondContact O-CB 3.45Å; K100-E104 PolarHBondContact O-N 2.81Å |
| 101 | N | 73.4 | Confident | 61.7 | Low | 118 Ų | 118 | 120.6 Ų | 120.6 | 63% | 0.631 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -67.6 | -37.1 | 176.2 | -78.4 | -18.9 | 0 | 0 | 0 | 112.5 | S105 | N101-S105 VanDerWaalsContact O-CB 3.25Å; N101-S105 WeakPolarHBondContact O-CB 3.39Å; N101-S105 PolarHBondContact O-N 3.35Å; N101-S105 PolarHBondContact O-OG 2.97Å; N101-S105 VanDerWaalsContact O-OG 3.04Å |
| 102 | E | 84.6 | Confident | 63.2 | Low | 128 Ų | 128 | 116.9 Ų | 116.9 | 60% | 0.598 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -71.1 | -44.2 | 177.9 | -169 | 157.1 | -145.5 | 0 | 0 | 111.2 | Q99 E104 S105 I106 | Q99-E102 PolarHBondContact O-N 3.06Å; E102-E104 VanDerWaalsContact C-N 3.35Å; E102-E104 PolarHBondContact O-N 3.36Å; E102-S105 PolarHBondContact O-N 3.34Å; E102-I106 HydrophobicContact CG-CD1 4.02Å; E102-I106 WeakPolarHBondContact O-CB 3.35Å; E102-I106 WeakPolarHBondContact O-CD1 3.43Å; E102-I106 WeakPolarHBondContact O-CG1 3.44Å; E102-I106 PolarHBondContact O-N 3.4Å |
| 103 | R | 83 | Confident | 64.5 | Low | 184 Ų | 184 | 113.3 Ų | 113.3 | 69% | 0.694 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -60.4 | -42.3 | 175.7 | -176.1 | 174.9 | 166.3 | 151.6 | -2.1 | 112.3 | Q99 R107 | Q99-R103 PolarHBondContact O-N 3.16Å; R103-R107 WeakPolarHBondContact O-CG 3.29Å; R103-R107 PolarHBondContact O-N 3.44Å |
| 104 | E | 80 | Confident | 64.9 | Low | 90 Ų | 90 | 110.4 Ų | 110.4 | 42% | 0.421 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -72.7 | -38 | 177.6 | -172.2 | 56.4 | -153.2 | 0 | 0 | 112.1 | K100 E102 I106 R107 Q108 | K100-E104 WeakPolarHBondContact O-CB 3.45Å; K100-E104 PolarHBondContact O-N 2.81Å; E102-E104 VanDerWaalsContact C-N 3.35Å; E102-E104 PolarHBondContact O-N 3.36Å; E104-I106 VanDerWaalsContact C-N 3.34Å; E104-I106 PolarHBondContact O-N 3.41Å; E104-R107 PolarHBondContact O-N 3.45Å; E104-Q108 WeakPolarHBondContact O-CG 3.47Å; E104-Q108 PolarHBondContact O-N 2.92Å; E104-Q108 PolarHBondContact OE1-NE2 3.36Å |
| 105 | S | 79.7 | Confident | 65.9 | Low | 69 Ų | 69 | 113.7 Ų | 113.7 | 48% | 0.483 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -62 | -39.4 | 173.5 | -76.2 | 0 | 0 | 0 | 0 | 112.9 | N101 E102 Q108 K109 | N101-S105 VanDerWaalsContact O-CB 3.25Å; N101-S105 WeakPolarHBondContact O-CB 3.39Å; N101-S105 PolarHBondContact O-N 3.35Å; N101-S105 PolarHBondContact O-OG 2.97Å; N101-S105 VanDerWaalsContact O-OG 3.04Å; E102-S105 PolarHBondContact O-N 3.34Å; S105-Q108 PolarHBondContact O-N 3.23Å; S105-K109 WeakPolarHBondContact O-CB 3.48Å; S105-K109 PolarHBondContact O-N 2.96Å |
| 106 | I | 76 | Confident | 66.3 | Low | 89 Ų | 89 | 119.3 Ų | 119.3 | 46% | 0.456 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -64.4 | -45 | 176.3 | -68.4 | 163.8 | 0 | 0 | 0 | 110 | E102 E104 Q108 K109 L110 | E102-I106 HydrophobicContact CG-CD1 4.02Å; E102-I106 WeakPolarHBondContact O-CB 3.35Å; E102-I106 WeakPolarHBondContact O-CD1 3.43Å; E102-I106 WeakPolarHBondContact O-CG1 3.44Å; E102-I106 PolarHBondContact O-N 3.4Å; E104-I106 VanDerWaalsContact C-N 3.34Å; E104-I106 PolarHBondContact O-N 3.41Å; I106-Q108 PolarHBondContact O-N 3Å; I106-K109 PolarHBondContact O-N 3.49Å; I106-L110 HydrophobicContact CG2-CD1 3.79Å; I106-L110 HydrophobicContact CG2-CG 4.4Å; I106-L110 WeakPolarHBondContact O-CB 3.35Å; I106-L110 VanDerWaalsContact O-CG 3.28Å; I106-L110 WeakPolarHBondContact O-CG 3.47Å; I106-L110 PolarHBondContact O-N 2.86Å |
| 107 | R | 82.7 | Confident | 66.7 | Low | 153 Ų | 153 | 121.7 Ų | 121.7 | 58% | 0.577 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -61.8 | -43.1 | 177.2 | -70.9 | 178.4 | 110.5 | -110.5 | -2.7 | 111.8 | R103 E104 L110 A111 | R103-R107 WeakPolarHBondContact O-CG 3.29Å; R103-R107 PolarHBondContact O-N 3.44Å; E104-R107 PolarHBondContact O-N 3.45Å; R107-L110 PolarHBondContact O-N 3.39Å; R107-A111 VanDerWaalsContact O-CB 3.23Å; R107-A111 WeakPolarHBondContact O-CB 3.32Å; R107-A111 PolarHBondContact O-N 3.02Å |
| 108 | Q | 80.5 | Confident | 66.5 | Low | 102 Ų | 102 | 124.6 Ų | 124.6 | 48% | 0.477 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -66 | -43.5 | 177.1 | -72.4 | -177.6 | 5.8 | 0 | 0 | 112.3 | E104 S105 I106 L110 A111 L112 | E104-Q108 WeakPolarHBondContact O-CG 3.47Å; E104-Q108 PolarHBondContact O-N 2.92Å; E104-Q108 PolarHBondContact OE1-NE2 3.36Å; S105-Q108 PolarHBondContact O-N 3.23Å; I106-Q108 PolarHBondContact O-N 3Å; Q108-L110 VanDerWaalsContact C-N 3.35Å; Q108-L110 PolarHBondContact O-N 3.22Å; Q108-A111 PolarHBondContact O-N 3.42Å; Q108-L112 VanDerWaalsContact O-CB 3.29Å; Q108-L112 WeakPolarHBondContact O-CB 3.43Å; Q108-L112 PolarHBondContact O-N 3.44Å |
| 109 | K | 78.7 | Confident | 65.9 | Low | 151 Ų | 151 | 123.5 Ų | 123.5 | 66% | 0.657 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -62.5 | -39.6 | 176.7 | -88.2 | -167.8 | 172.8 | -159.5 | 0 | 113.1 | S105 I106 G113 | S105-K109 WeakPolarHBondContact O-CB 3.48Å; S105-K109 PolarHBondContact O-N 2.96Å; I106-K109 PolarHBondContact O-N 3.49Å; K109-G113 PolarHBondContact O-N 3.33Å |
| 110 | L | 78.8 | Confident | 65.3 | Low | 141 Ų | 141 | 123.1 Ų | 123.1 | 74% | 0.738 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -71 | -40.6 | 178.2 | -70.7 | 171.5 | 0 | 0 | 0 | 112 | I106 R107 Q108 | I106-L110 HydrophobicContact CG2-CD1 3.79Å; I106-L110 HydrophobicContact CG2-CG 4.4Å; I106-L110 WeakPolarHBondContact O-CB 3.35Å; I106-L110 VanDerWaalsContact O-CG 3.28Å; I106-L110 WeakPolarHBondContact O-CG 3.47Å; I106-L110 PolarHBondContact O-N 2.86Å; R107-L110 PolarHBondContact O-N 3.39Å; Q108-L110 VanDerWaalsContact C-N 3.35Å; Q108-L110 PolarHBondContact O-N 3.22Å |
| 111 | A | 74.8 | Confident | 64.6 | Low | 85 Ų | 85 | 120.5 Ų | 120.5 | 70% | 0.702 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -79.1 | -36.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | R107 Q108 | R107-A111 VanDerWaalsContact O-CB 3.23Å; R107-A111 WeakPolarHBondContact O-CB 3.32Å; R107-A111 PolarHBondContact O-N 3.02Å; Q108-A111 PolarHBondContact O-N 3.42Å |
| 112 | L | 64.9 | Low | 62.7 | Low | 139 Ų | 139 | 122.6 Ų | 122.6 | 73% | 0.728 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -97.5 | 0.4 | -176.1 | -68.6 | 165.7 | 0 | 0 | 0 | 113.5 | Q108 S114 | Q108-L112 VanDerWaalsContact O-CB 3.29Å; Q108-L112 WeakPolarHBondContact O-CB 3.43Å; Q108-L112 PolarHBondContact O-N 3.44Å; L112-S114 PolarHBondContact O-N 3.49Å |
| 113 | G | 59.1 | Low | 60.4 | Low | 34 Ų | 34 | 126.2 Ų | 126.2 | 35% | 0.351 | 67% | 0.671 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 43.4 | 74.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112 | K109 F115 | K109-G113 PolarHBondContact O-N 3.33Å; G113-F115 PolarHBondContact O-N 3.46Å |
| 114 | S | 45.3 | Very low | 57.8 | Low | 88 Ų | 88 | 122.4 Ų | 122.4 | 62% | 0.615 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -65.7 | 63.9 | 175.3 | 177.3 | 0 | 0 | 0 | 0 | 110.9 | L112 | L112-S114 PolarHBondContact O-N 3.49Š|
| 115 | F | 52.4 | Low | 55.6 | Low | 186 Ų | 186 | 123 Ų | 123 | 82% | 0.816 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -110.5 | -3.3 | 169.5 | -86 | -80.6 | 0 | 0 | 0 | 111.1 | G113 | G113-F115 PolarHBondContact O-N 3.46Š|
| 116 | F | 47.3 | Very low | 53.2 | Low | 194 Ų | 194 | 125.8 Ų | 125.8 | 85% | 0.851 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -140.2 | 68.3 | 177.9 | -59.8 | -74.9 | 0 | 0 | 0 | 110.5 | ||
| 117 | D | 47.5 | Very low | 51.4 | Low | 148 Ų | 148 | 126.7 Ų | 126.7 | 79% | 0.791 | 72% | 0.715 | S | S | * | * | trans | -154.5 | 76.2 | 154.3 | -163.1 | 51.6 | 0 | 0 | 0 | 109.7 | ||||
| 118 | D | 44.4 | Very low | 49.2 | Very low | 168 Ų | 168 | 129.8 Ų | 129.8 | 90% | 0.898 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -141.1 | 102.8 | 146.2 | -149.6 | -6.7 | 0 | 0 | 0 | 108.7 | ||
| 119 | G | 39.7 | Very low | 47.4 | Very low | 52 Ų | 52 | 130.4 Ų | 130.4 | 54% | 0.536 | 75% | 0.748 | S | S | . | * | trans | 88 | 120.9 | 145.6 | 0 | 0 | 0 | 0 | 0 | 117.7 | G121 | G119-G121 PolarHBondContact O-N 3.43Å; G119-G121 VanDerWaalsContact O-N 3.11Å | ||
| 120 | P | 41.3 | Very low | 45.6 | Very low | 137 Ų | 137 | 126.6 Ų | 126.6 | 89% | 0.89 | 75% | 0.751 | S | S | * | * | trans | -75.8 | 99.9 | 173.5 | 30.2 | -30.1 | 0 | 0 | 0 | 110.9 | ||||
| 121 | G | 43 | Very low | 43.9 | Very low | 75 Ų | 75 | 129.7 Ų | 129.7 | 77% | 0.773 | 76% | 0.758 | S | S | * | * | trans | -113.3 | 95.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | G119 Y123 | G119-G121 PolarHBondContact O-N 3.43Å; G119-G121 VanDerWaalsContact O-N 3.11Å; G121-Y123 PolarHBondContact O-N 3.34Å; G121-Y123 VanDerWaalsContact O-N 3.15Å | ||
| 122 | I | 33.6 | Very low | 42.8 | Very low | 162 Ų | 162 | 130.4 Ų | 130.4 | 83% | 0.831 | 76% | 0.756 | S | S | * | * | trans | -60.6 | 103.7 | 170.7 | -55.1 | -78 | 0 | 0 | 0 | 109.5 | ||||
| 123 | Y | 35 | Very low | 42.6 | Very low | 203 Ų | 203 | 127.5 Ų | 127.5 | 80% | 0.796 | 75% | 0.747 | S | S | * | * | trans | -163.9 | 122.2 | 136.7 | -136.3 | -108.9 | 0 | 0 | 0 | 112.7 | G121 | G121-Y123 PolarHBondContact O-N 3.34Å; G121-Y123 VanDerWaalsContact O-N 3.15Å | ||
| 124 | T | 29.1 | Very low | 42.6 | Very low | 104 Ų | 104 | 132.5 Ų | 132.5 | 64% | 0.638 | 77% | 0.765 | S | S | * | * | trans | -33 | 133.4 | 153.4 | 48.1 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 125 | S | 33.1 | Very low | 43.6 | Very low | 103 Ų | 103 | 132.2 Ų | 132.2 | 72% | 0.72 | 76% | 0.763 | S | S | * | * | 176.5 | 124.6 | 119.5 | -75.4 | 0 | 0 | 0 | 0 | 110.5 | S127 | S125-S127 PolarHBondContact O-N 2.89Š| |||
| 126 | C | 30.9 | Very low | 43.9 | Very low | 128 Ų | 128 | 125.8 Ų | 125.8 | 87% | 0.865 | 75% | 0.745 | S | S | * | * | trans | -52.8 | 124 | 161.2 | 47.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 127 | S | 37.5 | Very low | 44.5 | Very low | 108 Ų | 108 | 126.1 Ų | 126.1 | 76% | 0.755 | 74% | 0.74 | S | S | * | * | trans | -140.1 | 118.4 | 161.2 | -74.3 | 0 | 0 | 0 | 0 | 109 | S125 S129 | S125-S127 PolarHBondContact O-N 2.89Å; S127-S129 PolarHBondContact O-N 2.95Å | ||
| 128 | K | 36.2 | Very low | 45.2 | Very low | 218 Ų | 218 | 126.3 Ų | 126.3 | 95% | 0.948 | 74% | 0.74 | S | S | * | * | trans | -62.1 | 109.2 | 172.6 | -65.8 | 171.6 | 173.7 | 177.8 | 0 | 109.3 | ||||
| 129 | S | 43.8 | Very low | 46 | Very low | 115 Ų | 115 | 126.5 Ų | 126.5 | 80% | 0.804 | 74% | 0.736 | S | S | * | * | trans | -172.5 | 104.4 | 150.2 | 47.6 | 0 | 0 | 0 | 0 | 107 | S127 | S127-S129 PolarHBondContact O-N 2.95Š| ||
| 130 | G | 39.4 | Very low | 46.8 | Very low | 70 Ų | 70 | 129.2 Ų | 129.2 | 72% | 0.722 | 75% | 0.747 | S | S | * | * | 104.5 | 74.2 | 97.4 | 0 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 131 | K | 44.4 | Very low | 47.2 | Very low | 206 Ų | 206 | 125.1 Ų | 125.1 | 90% | 0.896 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 123.9 | 166 | -66.7 | 174 | 173 | 178.1 | 0 | 107 | S133 | K131-S133 PolarHBondContact O-N 3.01Š|
| 132 | P | 50.1 | Low | 47.6 | Very low | 101 Ų | 101 | 130.2 Ų | 130.2 | 66% | 0.656 | 74% | 0.735 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 128 | 177.6 | 26.4 | -31.2 | 0 | 0 | 0 | 107.9 | A136 | P132-A136 HydrophobicContact CB-CB 4.27Š|
| 133 | S | 61.8 | Low | 48.1 | Very low | 78 Ų | 78 | 129 Ų | 129 | 55% | 0.545 | 73% | 0.73 | S | S | . | * | P | Polyproline II helix | trans | -64.8 | 157.3 | -179.8 | 86.1 | 0 | 0 | 0 | 0 | 110.2 | K131 S135 A136 | K131-S133 PolarHBondContact O-N 3.01Å; S133-S135 PolarHBondContact O-N 2.96Å; S133-A136 WeakPolarHBondContact O-CB 3.31Å; S133-A136 PolarHBondContact O-N 3.01Å |
| 134 | L | 59.2 | Low | 49.3 | Very low | 138 Ų | 138 | 127.1 Ų | 127.1 | 72% | 0.723 | 73% | 0.733 | S | S | * | * | H | α-helix | trans | -50.9 | -30.1 | -178 | -66.6 | 170.5 | 0 | 0 | 0 | 113.2 | A136 R137 L138 | L134-A136 VanDerWaalsContact C-N 3.28Å; L134-A136 PolarHBondContact O-N 3.15Å; L134-R137 PolarHBondContact O-N 3Å; L134-L138 PolarHBondContact O-N 3.01Å |
| 135 | S | 65.5 | Low | 51 | Low | 82 Ų | 82 | 129.2 Ų | 129.2 | 57% | 0.573 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -59.3 | -35.9 | 176.6 | -53.9 | 0 | 0 | 0 | 0 | 113.2 | S133 L138 | S133-S135 PolarHBondContact O-N 2.96Å; S135-L138 PolarHBondContact O-N 3.33Å |
| 136 | A | 60.1 | Low | 52.8 | Low | 52 Ų | 52 | 130.2 Ų | 130.2 | 43% | 0.43 | 73% | 0.732 | S | S | . | * | H | α-helix | trans | -72.6 | -30.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | P132 S133 L134 L138 | P132-A136 HydrophobicContact CB-CB 4.27Å; S133-A136 WeakPolarHBondContact O-CB 3.31Å; S133-A136 PolarHBondContact O-N 3.01Å; L134-A136 VanDerWaalsContact C-N 3.28Å; L134-A136 PolarHBondContact O-N 3.15Å; A136-L138 VanDerWaalsContact C-N 3.32Å |
| 137 | R | 59.1 | Low | 54.6 | Low | 201 Ų | 201 | 129 Ų | 129 | 76% | 0.758 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -70.4 | -27.1 | 174.7 | -96.8 | -176.6 | -171.8 | 167.6 | 2.1 | 113.3 | L134 Q139 | L134-R137 PolarHBondContact O-N 3Å; R137-Q139 VanDerWaalsContact C-N 3.34Å |
| 138 | L | 61.6 | Low | 55.9 | Low | 151 Ų | 151 | 132.7 Ų | 132.7 | 79% | 0.791 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.4 | -13.9 | -178.6 | -67.6 | 170.4 | 0 | 0 | 0 | 113.4 | L134 S135 A136 | L134-L138 PolarHBondContact O-N 3.01Å; S135-L138 PolarHBondContact O-N 3.33Å; A136-L138 VanDerWaalsContact C-N 3.32Å |
| 139 | Q | 60.8 | Low | 57.7 | Low | 172 Ų | 172 | 128.5 Ų | 128.5 | 80% | 0.804 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -88 | -18.5 | -178.9 | -70.5 | -177 | -1.5 | 0 | 0 | 114.3 | R137 | R137-Q139 VanDerWaalsContact C-N 3.34Š|
| 140 | S | 57.9 | Low | 58.7 | Low | 110 Ų | 110 | 129.3 Ų | 129.3 | 77% | 0.769 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -105.6 | 21.1 | -167.4 | 97.6 | 0 | 0 | 0 | 0 | 116.7 | ||
| 141 | G | 48.7 | Very low | 59.7 | Low | 50 Ų | 50 | 133.2 Ų | 133.2 | 52% | 0.515 | 72% | 0.718 | S | S | . | * | S | Bend | trans | 178.8 | 99.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | N143 | G141-N143 PolarHBondContact O-N 3.42Š|
| 142 | M | 51.6 | Low | 60.2 | Low | 182 Ų | 182 | 127.1 Ų | 127.1 | 90% | 0.897 | 70% | 0.702 | S | S | * | * | trans | 44.1 | 67.6 | 146.1 | 51.5 | -178 | 66.5 | 0 | 0 | 116.4 | L144 | M142-L144 PolarHBondContact O-N 3.32Å; M142-L144 VanDerWaalsContact O-N 3.07Å | ||
| 143 | N | 45.5 | Very low | 60.6 | Low | 136 Ų | 136 | 125.9 Ų | 125.9 | 73% | 0.727 | 71% | 0.707 | S | S | * | * | trans | 19.7 | 72.5 | 141.2 | -163.4 | 41.6 | 0 | 0 | 0 | 117.6 | G141 Q145 | G141-N143 PolarHBondContact O-N 3.42Å; N143-Q145 VanDerWaalsContact C-N 3.31Å; N143-Q145 PolarHBondContact O-N 3.12Å | ||
| 144 | L | 59.8 | Low | 60 | Low | 165 Ų | 165 | 127.3 Ų | 127.3 | 86% | 0.864 | 72% | 0.717 | S | S | * | * | trans | -69.7 | 93.7 | 159.4 | -131.2 | 79.1 | 0 | 0 | 0 | 107.6 | M142 I146 | M142-L144 PolarHBondContact O-N 3.32Å; M142-L144 VanDerWaalsContact O-N 3.07Å; L144-I146 PolarHBondContact O-N 2.92Å | ||
| 145 | Q | 65.1 | Low | 59.6 | Low | 148 Ų | 148 | 128.2 Ų | 128.2 | 69% | 0.692 | 72% | 0.723 | S | S | * | * | trans | -77.6 | 102.9 | 176.9 | -172.3 | 170.8 | 4.6 | 0 | 0 | 108.4 | N143 C147 | N143-Q145 VanDerWaalsContact C-N 3.31Å; N143-Q145 PolarHBondContact O-N 3.12Å; Q145-C147 PolarHBondContact O-N 3.25Å | ||
| 146 | I | 69.2 | Low | 59.1 | Low | 124 Ų | 124 | 133.2 Ų | 133.2 | 64% | 0.636 | 73% | 0.734 | S | S | * | * | trans | -76 | 107.1 | 170.6 | -58.6 | 178.1 | 0 | 0 | 0 | 106.6 | L144 F148 | L144-I146 PolarHBondContact O-N 2.92Å; I146-F148 HydrophobicContact CB-CE2 4.26Å; I146-F148 HydrophobicContact CG2-CD2 4.23Å; I146-F148 HydrophobicContact CG2-CE2 3.8Å; I146-F148 HydrophobicContact CG2-CZ 4.15Å; I146-F148 PolarHBondContact O-N 2.83Å | ||
| 147 | C | 70.5 | Confident | 58.2 | Low | 103 Ų | 103 | 137.1 Ų | 137.1 | 70% | 0.696 | 75% | 0.748 | S | S | * | * | trans | -71.9 | 108.2 | 173.8 | -66.6 | 0 | 0 | 0 | 0 | 109.1 | Q145 V149 | Q145-C147 PolarHBondContact O-N 3.25Å; C147-V149 PolarHBondContact O-N 3.4Å | ||
| 148 | F | 64 | Low | 57.9 | Low | 185 Ų | 185 | 133.1 Ų | 133.1 | 81% | 0.811 | 75% | 0.751 | S | S | * | * | trans | -83.4 | 108.4 | 163.8 | -72.7 | -88.5 | 0 | 0 | 0 | 107.7 | I146 N150 | I146-F148 HydrophobicContact CB-CE2 4.26Å; I146-F148 HydrophobicContact CG2-CD2 4.23Å; I146-F148 HydrophobicContact CG2-CE2 3.8Å; I146-F148 HydrophobicContact CG2-CZ 4.15Å; I146-F148 PolarHBondContact O-N 2.83Å; F148-N150 PolarHBondContact O-N 2.98Å | ||
| 149 | V | 72.9 | Confident | 57.2 | Low | 129 Ų | 129 | 133.7 Ų | 133.7 | 78% | 0.782 | 76% | 0.755 | S | S | * | * | trans | -73.1 | 104.8 | 169.9 | -145.9 | 0 | 0 | 0 | 0 | 106.2 | C147 D151 | C147-V149 PolarHBondContact O-N 3.4Å; V149-D151 PolarHBondContact O-N 3.13Å | ||
| 150 | N | 66.1 | Low | 57 | Low | 133 Ų | 133 | 130.2 Ų | 130.2 | 71% | 0.711 | 76% | 0.755 | S | S | * | * | trans | -86.4 | 93.1 | 166.2 | -173.5 | 60.4 | 0 | 0 | 0 | 106.5 | F148 S152 | F148-N150 PolarHBondContact O-N 2.98Å; N150-S152 WeakPolarHBondContact ND2-CB 3.46Å; N150-S152 PolarHBondContact ND2-OG 2.7Å; N150-S152 PolarHBondContact O-N 2.74Å | ||
| 151 | D | 60.4 | Low | 56.4 | Low | 151 Ų | 151 | 132.2 Ų | 132.2 | 81% | 0.807 | 76% | 0.757 | S | S | * | * | trans | -69.5 | 71 | 166.9 | -103 | -39.3 | 0 | 0 | 0 | 108.7 | V149 G153 | V149-D151 PolarHBondContact O-N 3.13Å; D151-G153 VanDerWaalsContact C-N 3.33Å | ||
| 152 | S | 53.4 | Low | 56 | Low | 79 Ų | 79 | 136.1 Ų | 136.1 | 55% | 0.552 | 77% | 0.767 | S | S | * | * | trans | -99.7 | 72.5 | 155.3 | -60.8 | 0 | 0 | 0 | 0 | 106.5 | N150 S154 | N150-S152 WeakPolarHBondContact ND2-CB 3.46Å; N150-S152 PolarHBondContact ND2-OG 2.7Å; N150-S152 PolarHBondContact O-N 2.74Å; S152-S154 PolarHBondContact O-N 3.37Å | ||
| 153 | G | 59.3 | Low | 55.7 | Low | 75 Ų | 75 | 132.2 Ų | 132.2 | 77% | 0.773 | 76% | 0.757 | S | S | * | * | trans | -59.6 | 94.7 | 161.3 | 0 | 0 | 0 | 0 | 0 | 107.6 | D151 | D151-G153 VanDerWaalsContact C-N 3.33Š| ||
| 154 | S | 49.3 | Very low | 55.4 | Low | 108 Ų | 108 | 135.2 Ų | 135.2 | 76% | 0.755 | 76% | 0.763 | S | S | * | * | trans | -89.3 | 129.5 | 172.7 | 40.5 | 0 | 0 | 0 | 0 | 108.8 | S152 | S152-S154 PolarHBondContact O-N 3.37Š| ||
| 155 | D | 51.4 | Low | 54.4 | Low | 156 Ų | 156 | 133 Ų | 133 | 83% | 0.834 | 76% | 0.757 | S | S | * | * | trans | -35.7 | 131.3 | 172 | -80.1 | -54.3 | 0 | 0 | 0 | 114.8 | ||||
| 156 | K | 53.8 | Low | 53.2 | Low | 188 Ų | 188 | 134.7 Ų | 134.7 | 82% | 0.817 | 77% | 0.765 | S | S | * | * | trans | -136 | 89.4 | 153.2 | -91.5 | -87.4 | 176.9 | 167.6 | 0 | 106.9 | ||||
| 157 | D | 42.1 | Very low | 52 | Low | 133 Ų | 133 | 134.9 Ų | 134.9 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | trans | 14.9 | 108.9 | 149.2 | -51 | -44.4 | 0 | 0 | 0 | 116.4 | ||||
| 158 | S | 51.7 | Low | 50.6 | Low | 118 Ų | 118 | 135.1 Ų | 135.1 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | trans | -130.8 | 90 | 148.5 | -70.8 | 0 | 0 | 0 | 0 | 107.2 | A160 | S158-A160 VanDerWaalsContact C-N 3.29Å; S158-A160 PolarHBondContact O-N 3.16Å | ||
| 159 | D | 47.4 | Very low | 49.2 | Very low | 163 Ų | 163 | 134 Ų | 134 | 87% | 0.872 | 78% | 0.777 | S | S | * | * | trans | -53.5 | 93.4 | 162 | -73 | -49.6 | 0 | 0 | 0 | 109 | ||||
| 160 | A | 56.4 | Low | 47.6 | Very low | 98 Ų | 98 | 134.6 Ų | 134.6 | 81% | 0.81 | 78% | 0.775 | S | S | * | * | trans | -110.9 | 80.4 | 158.5 | 0 | 0 | 0 | 0 | 0 | 106.6 | S158 | S158-A160 VanDerWaalsContact C-N 3.29Å; S158-A160 PolarHBondContact O-N 3.16Å | ||
| 161 | D | 46.7 | Very low | 46 | Very low | 152 Ų | 152 | 133.8 Ų | 133.8 | 81% | 0.813 | 78% | 0.775 | S | S | * | * | trans | -60.7 | 151.8 | 166.3 | -155.1 | -13.7 | 0 | 0 | 0 | 110.2 | ||||
| 162 | D | 40.3 | Very low | 45.3 | Very low | 133 Ų | 133 | 132 Ų | 132 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | trans | 81 | 100.1 | 156.5 | -131.6 | -3.6 | 0 | 0 | 0 | 120.1 | ||||
| 163 | S | 44 | Very low | 44.3 | Very low | 99 Ų | 99 | 136.2 Ų | 136.2 | 69% | 0.692 | 79% | 0.787 | S | S | * | * | -176.8 | 97.3 | 106 | -75.5 | 0 | 0 | 0 | 0 | 110.4 | T165 | S163-T165 PolarHBondContact O-N 3.46Å; S163-T165 VanDerWaalsContact O-N 3.15Å | |||
| 164 | K | 39.8 | Very low | 43.1 | Very low | 199 Ų | 199 | 138.3 Ų | 138.3 | 87% | 0.865 | 79% | 0.79 | S | S | * | * | trans | -67.6 | 98.8 | 158.1 | -71.9 | 174 | 170.3 | 174.6 | 0 | 108.4 | ||||
| 165 | T | 38.1 | Very low | 43 | Very low | 119 Ų | 119 | 138.5 Ų | 138.5 | 73% | 0.73 | 79% | 0.789 | S | S | * | * | trans | -99.3 | 77.8 | 160.7 | 49.9 | 0 | 0 | 0 | 0 | 109.2 | S163 T167 | S163-T165 PolarHBondContact O-N 3.46Å; S163-T165 VanDerWaalsContact O-N 3.15Å; T165-T167 VanDerWaalsContact C-N 3.33Å; T165-T167 PolarHBondContact O-N 2.83Å | ||
| 166 | E | 39.7 | Very low | 42.3 | Very low | 184 Ų | 184 | 139.8 Ų | 139.8 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -58.4 | 95.4 | 155.6 | -73.2 | -89.8 | 127.1 | 0 | 0 | 107.8 | S168 | E166-S168 PolarHBondContact O-N 3.48Š| ||
| 167 | T | 44.2 | Very low | 42 | Very low | 127 Ų | 127 | 136.6 Ų | 136.6 | 78% | 0.779 | 79% | 0.794 | S | S | * | * | trans | -87.1 | 98.7 | 168.6 | 96.3 | 0 | 0 | 0 | 0 | 107 | T165 L169 | T165-T167 VanDerWaalsContact C-N 3.33Å; T165-T167 PolarHBondContact O-N 2.83Å; T167-L169 PolarHBondContact O-N 3.49Å | ||
| 168 | S | 41.9 | Very low | 41.6 | Very low | 109 Ų | 109 | 138.8 Ų | 138.8 | 76% | 0.762 | 80% | 0.797 | S | S | * | * | trans | -41.5 | 131.1 | 175.9 | -168.9 | 0 | 0 | 0 | 0 | 112.8 | E166 D170 | E166-S168 PolarHBondContact O-N 3.48Å; S168-D170 PolarHBondContact O-N 3.28Å | ||
| 169 | L | 35 | Very low | 41 | Very low | 161 Ų | 161 | 142.2 Ų | 142.2 | 84% | 0.843 | 80% | 0.8 | S | S | * | * | trans | -48.9 | 119.1 | 150.5 | -69.1 | 158.4 | 0 | 0 | 0 | 109.3 | T167 | T167-L169 PolarHBondContact O-N 3.49Š| ||
| 170 | D | 38.7 | Very low | 40.8 | Very low | 142 Ų | 142 | 139.5 Ų | 139.5 | 76% | 0.759 | 79% | 0.794 | S | S | * | * | trans | 178.5 | 105.4 | 137.6 | -116.6 | -54.2 | 0 | 0 | 0 | 111.1 | S168 | S168-D170 PolarHBondContact O-N 3.28Š| ||
| 171 | T | 32.6 | Very low | 40.7 | Very low | 116 Ų | 116 | 139.3 Ų | 139.3 | 71% | 0.712 | 79% | 0.787 | S | S | * | * | trans | 70.8 | 142.1 | 130.4 | -58.4 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 172 | P | 46 | Very low | 41.4 | Very low | 114 Ų | 114 | 137.4 Ų | 137.4 | 74% | 0.74 | 79% | 0.785 | S | S | * | * | cis | -128.3 | 170.4 | -29.9 | 34.2 | -15.4 | 0 | 0 | 0 | 114.6 | ||||
| 173 | L | 31 | Very low | 41.9 | Very low | 166 Ų | 166 | 140.1 Ų | 140.1 | 87% | 0.869 | 79% | 0.787 | S | S | * | * | trans | -57.5 | 133.9 | 169 | -65.9 | 98.5 | 0 | 0 | 0 | 113.2 | ||||
| 174 | S | 35 | Very low | 42.3 | Very low | 120 Ų | 120 | 140.3 Ų | 140.3 | 84% | 0.839 | 79% | 0.788 | S | S | * | * | trans | -179.8 | 157 | 149.5 | -87.8 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 175 | P | 46.9 | Very low | 42.9 | Very low | 112 Ų | 112 | 137.9 Ų | 137.9 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | -118.8 | 163 | -116.8 | 40.9 | -33.7 | 0 | 0 | 0 | 116.3 | S177 | P175-S177 PolarHBondContact O-N 3.29Š| |||
| 176 | M | 37.8 | Very low | 43.6 | Very low | 182 Ų | 182 | 143.1 Ų | 143.1 | 90% | 0.897 | 79% | 0.791 | S | S | * | * | trans | 24.1 | 85 | 152.7 | -97.2 | 142.2 | 72.2 | 0 | 0 | 117.1 | ||||
| 177 | S | 47 | Very low | 43.7 | Very low | 122 Ų | 122 | 141 Ų | 141 | 85% | 0.853 | 79% | 0.786 | S | S | * | * | trans | -95.4 | 102.7 | 155.6 | -79.3 | 0 | 0 | 0 | 0 | 109.6 | P175 | P175-S177 PolarHBondContact O-N 3.29Š| ||
| 178 | K | 33.5 | Very low | 43.7 | Very low | 179 Ų | 179 | 140.8 Ų | 140.8 | 78% | 0.778 | 78% | 0.784 | S | S | * | * | trans | -68.1 | 155 | 151.6 | -66.7 | 176.8 | 175.9 | 175.7 | 0 | 108.1 | ||||
| 179 | Q | 38.7 | Very low | 44 | Very low | 189 Ų | 189 | 140 Ų | 140 | 88% | 0.883 | 78% | 0.775 | S | S | * | * | trans | 82.6 | 123.5 | 176.7 | -49.6 | 174.5 | -34.2 | 0 | 0 | 111.7 | ||||
| 180 | S | 44.5 | Very low | 44.6 | Very low | 107 Ų | 107 | 140.7 Ų | 140.7 | 75% | 0.748 | 77% | 0.774 | S | S | * | * | cis | -157.4 | 157.1 | 23.8 | 50 | 0 | 0 | 0 | 0 | 110.9 | S182 | S180-S182 PolarHBondContact O-N 2.91Š| ||
| 181 | S | 53.5 | Low | 44.7 | Very low | 94 Ų | 94 | 141.4 Ų | 141.4 | 66% | 0.657 | 77% | 0.772 | S | S | * | * | trans | -32.4 | 121.1 | 160.8 | 55.3 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 182 | S | 60.3 | Low | 45.5 | Very low | 111 Ų | 111 | 143.8 Ų | 143.8 | 78% | 0.776 | 78% | 0.775 | S | S | * | * | trans | -111.6 | 105.6 | 154.9 | -171.2 | 0 | 0 | 0 | 0 | 106.9 | S180 S184 | S180-S182 PolarHBondContact O-N 2.91Å; S182-S184 PolarHBondContact O-N 2.97Å | ||
| 183 | Y | 52.7 | Low | 45.6 | Very low | 190 Ų | 190 | 144.2 Ų | 144.2 | 75% | 0.745 | 78% | 0.781 | S | S | * | * | trans | -52.5 | 113.4 | 164.2 | -68.7 | -99.6 | 0 | 0 | 0 | 108.3 | ||||
| 184 | S | 51 | Low | 46.7 | Very low | 103 Ų | 103 | 143 Ų | 143 | 72% | 0.72 | 77% | 0.771 | S | S | * | * | trans | -117.2 | 85.9 | 150.7 | 51.2 | 0 | 0 | 0 | 0 | 106.8 | S182 R186 | S182-S184 PolarHBondContact O-N 2.97Å; S184-R186 VanDerWaalsContact C-N 3.3Å; S184-R186 PolarHBondContact O-N 3.27Å; S184-R186 VanDerWaalsContact O-N 3.12Å | ||
| 185 | D | 52.4 | Low | 47.6 | Very low | 148 Ų | 148 | 139.6 Ų | 139.6 | 79% | 0.791 | 75% | 0.747 | S | S | * | * | trans | -52.4 | 99.7 | 142.9 | -75.3 | -60.6 | 0 | 0 | 0 | 107.3 | ||||
| 186 | R | 52.3 | Low | 48.2 | Very low | 229 Ų | 229 | 139.3 Ų | 139.3 | 86% | 0.864 | 74% | 0.739 | S | S | * | * | trans | -137.5 | 104.5 | 158 | -78.8 | -152.3 | 166.7 | 174 | -2 | 108.6 | S184 | S184-R186 VanDerWaalsContact C-N 3.3Å; S184-R186 PolarHBondContact O-N 3.27Å; S184-R186 VanDerWaalsContact O-N 3.12Å | ||
| 187 | D | 42.4 | Very low | 49.6 | Very low | 141 Ų | 141 | 136.7 Ų | 136.7 | 75% | 0.754 | 73% | 0.729 | S | S | * | * | trans | 36.9 | 91.4 | 160.8 | -84.1 | -36.3 | 0 | 0 | 0 | 115.8 | T189 | D187-T189 HydrophobicContact CB-CG2 4.28Å; D187-T189 PolarHBondContact O-N 2.95Å | ||
| 188 | T | 44.6 | Very low | 50.9 | Low | 122 Ų | 122 | 137.3 Ų | 137.3 | 75% | 0.748 | 72% | 0.722 | S | S | * | * | trans | -58 | 72.5 | 137 | -23.8 | 0 | 0 | 0 | 0 | 108.3 | E190 | T188-E190 HydrophobicContact CG2-CG 3.68Å; T188-E190 PolarHBondContact O-N 3.37Å | ||
| 189 | T | 48 | Very low | 53 | Low | 92 Ų | 92 | 131.1 Ų | 131.1 | 56% | 0.564 | 70% | 0.697 | S | S | * | * | trans | -67.9 | 86.7 | 152.6 | 41.5 | 0 | 0 | 0 | 0 | 105.3 | D187 E191 | D187-T189 HydrophobicContact CB-CG2 4.28Å; D187-T189 PolarHBondContact O-N 2.95Å; T189-E191 HydrophobicContact CG2-CG 4.12Å; T189-E191 PolarHBondContact O-N 3.24Å | ||
| 190 | E | 47 | Very low | 55.1 | Low | 176 Ų | 176 | 128.2 Ų | 128.2 | 82% | 0.822 | 69% | 0.687 | S | S | * | * | trans | -65.3 | 48.7 | 151.5 | -57.8 | -167.2 | 164.6 | 0 | 0 | 108.5 | T188 E192 | T188-E190 HydrophobicContact CG2-CG 3.68Å; T188-E190 PolarHBondContact O-N 3.37Å; E190-E192 VanDerWaalsContact C-N 3.34Å; E190-E192 PolarHBondContact O-N 3.38Å; E190-E192 VanDerWaalsContact O-N 3.15Å | ||
| 191 | E | 42.1 | Very low | 57.1 | Low | 156 Ų | 156 | 128.3 Ų | 128.3 | 73% | 0.729 | 68% | 0.675 | S | S | * | * | trans | -84.4 | 96.1 | 170.1 | -68.2 | -149.8 | 178.8 | 0 | 0 | 105.1 | T189 S193 | T189-E191 HydrophobicContact CG2-CG 4.12Å; T189-E191 PolarHBondContact O-N 3.24Å; E191-S193 PolarHBondContact O-N 2.82Å | ||
| 192 | E | 48.3 | Very low | 58.6 | Low | 166 Ų | 166 | 127.1 Ų | 127.1 | 78% | 0.776 | 66% | 0.66 | S | S | * | * | trans | 48.1 | 80.6 | 149.9 | -58.6 | -177.4 | 165.6 | 0 | 0 | 110.8 | E190 E194 | E190-E192 VanDerWaalsContact C-N 3.34Å; E190-E192 PolarHBondContact O-N 3.38Å; E190-E192 VanDerWaalsContact O-N 3.15Å; E192-E194 PolarHBondContact O-N 2.98Å | ||
| 193 | S | 48.7 | Very low | 60 | Low | 123 Ų | 123 | 125 Ų | 125 | 86% | 0.86 | 64% | 0.643 | S | S | * | * | trans | -53.3 | 89.1 | 150.8 | -66.9 | 0 | 0 | 0 | 0 | 105.6 | E191 S195 | E191-S193 PolarHBondContact O-N 2.82Å; S193-S195 PolarHBondContact O-N 3.26Å | ||
| 194 | E | 53.8 | Low | 61.7 | Low | 142 Ų | 142 | 120.6 Ų | 120.6 | 66% | 0.664 | 63% | 0.625 | S | S | * | * | trans | -48.1 | 111 | 175.4 | -58.5 | 176.6 | 132.2 | 0 | 0 | 103.6 | E192 L196 M199 | E192-E194 PolarHBondContact O-N 2.98Å; E194-L196 PolarHBondContact O-N 3.44Å; E194-M199 HydrophobicContact CB-CE 3.34Å; E194-M199 HydrophobicContact CG-CE 3.88Å; E194-M199 WeakPolarHBondContact OE2-CE 3.18Å | ||
| 195 | S | 53.4 | Low | 63.6 | Low | 48 Ų | 48 | 118.1 Ų | 118.1 | 34% | 0.336 | 60% | 0.602 | S | S | . | * | trans | -57 | 129.3 | -170.1 | 93 | 0 | 0 | 0 | 0 | 105 | S193 D197 D198 | S193-S195 PolarHBondContact O-N 3.26Å; S195-D197 PolarHBondContact O-N 2.84Å; S195-D198 WeakPolarHBondContact CB-OD2 3.34Å; S195-D198 PolarHBondContact O-N 3.36Å; S195-D198 PolarHBondContact OG-N 2.91Å; S195-D198 PolarHBondContact OG-OD2 2.66Å | ||
| 196 | L | 60.2 | Low | 65.4 | Low | 106 Ų | 106 | 117.1 Ų | 117.1 | 56% | 0.555 | 59% | 0.59 | S | S | * | * | G | 310 helix | trans | -52 | -27.6 | -173.1 | -172.8 | 119.1 | 0 | 0 | 0 | 110.5 | E194 R204 | E194-L196 PolarHBondContact O-N 3.44Å; L196-R204 VanDerWaalsContact CD2-NH2 3.27Å; L196-R204 PolarHBondContact O-NE 3.32Å; L196-R204 PolarHBondContact O-NH2 2.9Å |
| 197 | D | 67.4 | Low | 67.4 | Low | 127 Ų | 127 | 112.2 Ų | 112.2 | 68% | 0.679 | 58% | 0.576 | S | S | * | * | G | 310 helix | trans | -80.9 | -15.4 | -179 | -60.1 | -39.5 | 0 | 0 | 0 | 115.6 | S195 R204 | S195-D197 PolarHBondContact O-N 2.84Å; D197-R204 IonicContact OD1-CZ 3.91Å; D197-R204 IonicContact OD1-NH2 2.92Å; D197-R204 PolarHBondContact OD1-NH2 3.01Å |
| 198 | D | 74.4 | Confident | 69.9 | Low | 134 Ų | 134 | 110.9 Ų | 110.9 | 72% | 0.717 | 57% | 0.568 | S | S | * | * | G | 310 helix | trans | -89 | -1.5 | 176.6 | -67.4 | -37.6 | 0 | 0 | 0 | 113.5 | S195 | S195-D198 WeakPolarHBondContact CB-OD2 3.34Å; S195-D198 PolarHBondContact O-N 3.36Å; S195-D198 PolarHBondContact OG-N 2.91Å; S195-D198 PolarHBondContact OG-OD2 2.66Å |
| 199 | M | 76.6 | Confident | 72.3 | Confident | 49 Ų | 49 | 110 Ų | 110 | 24% | 0.241 | 56% | 0.555 | C | S | . | * | S | Bend | trans | -79.4 | 135.3 | -179.5 | -71.7 | -76.9 | 150.8 | 0 | 0 | 112.8 | E194 T203 R204 | E194-M199 HydrophobicContact CB-CE 3.34Å; E194-M199 HydrophobicContact CG-CE 3.88Å; E194-M199 WeakPolarHBondContact OE2-CE 3.18Å; M199-T203 HydrophobicContact SD-CG2 3.53Å; M199-T203 VanDerWaalsContact SD-CG2 3.53Å; M199-R204 HydrophobicContact CB-CB 4.48Å |
| 200 | D | 84.6 | Confident | 74.5 | Confident | 128 Ų | 128 | 108 Ų | 108 | 68% | 0.684 | 55% | 0.548 | S | S | * | . | trans | -55.2 | 144.1 | 166.7 | -75.4 | -37.4 | 0 | 0 | 0 | 111.3 | L202 T203 R204 | D200-L202 PolarHBondContact O-N 2.91Å; D200-L202 VanDerWaalsContact O-N 3.1Å; D200-T203 WeakPolarHBondContact O-CA 3.39Å; D200-T203 WeakPolarHBondContact O-CB 3.33Å; D200-T203 PolarHBondContact O-N 3.35Å; D200-R204 PolarHBondContact O-N 2.87Å | ||
| 201 | F | 85.2 | Confident | 76.9 | Confident | 110 Ų | 110 | 105.7 Ų | 105.7 | 48% | 0.482 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -50.1 | -42.4 | -178.6 | 176.5 | -93.6 | 0 | 0 | 0 | 112.7 | T203 R204 Q205 A317 | F201-T203 PolarHBondContact O-N 3Å; F201-R204 PolarHBondContact O-N 3.46Å; F201-Q205 HydrophobicContact CE1-CB 4.35Å; F201-Q205 WeakPolarHBondContact O-CB 3.44Å; F201-Q205 PolarHBondContact O-N 3.5Å; F201-A317 HydrophobicContact CE1-CB 3.66Å; F201-A317 HydrophobicContact CE2-CB 4.31Å; F201-A317 HydrophobicContact CZ-CB 3.4Å; F201-A317 VanDerWaalsContact CZ-CB 3.4Å |
| 202 | L | 85.3 | Confident | 79.4 | Confident | 68 Ų | 68 | 100.5 Ų | 100.5 | 36% | 0.356 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.1 | -37.2 | -179.4 | -172.9 | 63.8 | 0 | 0 | 0 | 112.4 | D200 K206 | D200-L202 PolarHBondContact O-N 2.91Å; D200-L202 VanDerWaalsContact O-N 3.1Å; L202-K206 HydrophobicContact CG-CD 4.47Å; L202-K206 WeakPolarHBondContact O-CB 3.38Å; L202-K206 VanDerWaalsContact O-CG 3.26Å; L202-K206 WeakPolarHBondContact O-CG 3.35Å; L202-K206 PolarHBondContact O-N 3.42Å |
| 203 | T | 89.7 | Confident | 81.7 | Confident | 67 Ų | 67 | 98.7 Ų | 98.7 | 41% | 0.411 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68.4 | -42.8 | 175.9 | -54.6 | 0 | 0 | 0 | 0 | 110.1 | M199 D200 F201 K206 K207 | M199-T203 HydrophobicContact SD-CG2 3.53Å; M199-T203 VanDerWaalsContact SD-CG2 3.53Å; D200-T203 WeakPolarHBondContact O-CA 3.39Å; D200-T203 WeakPolarHBondContact O-CB 3.33Å; D200-T203 PolarHBondContact O-N 3.35Å; F201-T203 PolarHBondContact O-N 3Å; T203-K206 PolarHBondContact O-N 2.96Å; T203-K207 WeakPolarHBondContact O-CB 3.33Å; T203-K207 PolarHBondContact O-N 3.14Å |
| 204 | R | 89.4 | Confident | 84.1 | Confident | 98 Ų | 98 | 99.2 Ų | 99.2 | 37% | 0.37 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62 | -45.1 | 173.9 | -174.2 | 179 | -88.2 | -156.9 | 0.6 | 111.9 | L196 D197 M199 D200 F201 K207 L208 | L196-R204 VanDerWaalsContact CD2-NH2 3.27Å; L196-R204 PolarHBondContact O-NE 3.32Å; L196-R204 PolarHBondContact O-NH2 2.9Å; D197-R204 IonicContact OD1-CZ 3.91Å; D197-R204 IonicContact OD1-NH2 2.92Å; D197-R204 PolarHBondContact OD1-NH2 3.01Å; M199-R204 HydrophobicContact CB-CB 4.48Å; D200-R204 PolarHBondContact O-N 2.87Å; F201-R204 PolarHBondContact O-N 3.46Å; R204-K207 PolarHBondContact O-N 2.82Å; R204-L208 WeakPolarHBondContact O-CB 3.38Å; R204-L208 PolarHBondContact O-N 2.89Å |
| 205 | Q | 89.7 | Confident | 86.1 | Confident | 50 Ų | 50 | 95 Ų | 95 | 23% | 0.234 | 49% | 0.49 | C | S | . | . | H | α-helix | trans | -60.6 | -47.3 | 177.1 | -174.7 | -174.1 | 11.7 | 0 | 0 | 111.3 | F201 K207 L208 Q209 | F201-Q205 HydrophobicContact CE1-CB 4.35Å; F201-Q205 WeakPolarHBondContact O-CB 3.44Å; F201-Q205 PolarHBondContact O-N 3.5Å; Q205-K207 VanDerWaalsContact C-N 3.35Å; Q205-K207 PolarHBondContact O-N 2.96Å; Q205-L208 PolarHBondContact O-N 3.18Å; Q205-Q209 VanDerWaalsContact O-CB 3.31Å; Q205-Q209 WeakPolarHBondContact O-CB 3.37Å; Q205-Q209 PolarHBondContact O-N 2.9Å |
| 206 | K | 91.3 | Very high | 88.1 | Confident | 127 Ų | 127 | 98.7 Ų | 98.7 | 55% | 0.552 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.7 | -42.7 | 177 | -76.3 | 174 | -179.3 | 176.9 | 0 | 112.1 | L202 T203 Q209 A210 | L202-K206 HydrophobicContact CG-CD 4.47Å; L202-K206 WeakPolarHBondContact O-CB 3.38Å; L202-K206 VanDerWaalsContact O-CG 3.26Å; L202-K206 WeakPolarHBondContact O-CG 3.35Å; L202-K206 PolarHBondContact O-N 3.42Å; T203-K206 PolarHBondContact O-N 2.96Å; K206-Q209 PolarHBondContact O-N 3.2Å; K206-A210 WeakPolarHBondContact O-CB 3.27Å; K206-A210 PolarHBondContact O-N 2.8Å |
| 207 | K | 93.9 | Very high | 89.9 | Confident | 127 Ų | 127 | 97 Ų | 97 | 55% | 0.552 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.4 | -48.6 | 177.6 | -174.1 | 176.1 | 179.8 | 175.4 | 0 | 111.4 | T203 R204 Q205 Q209 A210 E211 | T203-K207 WeakPolarHBondContact O-CB 3.33Å; T203-K207 PolarHBondContact O-N 3.14Å; R204-K207 PolarHBondContact O-N 2.82Å; Q205-K207 VanDerWaalsContact C-N 3.35Å; Q205-K207 PolarHBondContact O-N 2.96Å; K207-Q209 VanDerWaalsContact C-N 3.33Å; K207-Q209 PolarHBondContact O-N 2.95Å; K207-A210 WeakPolarHBondContact O-CB 3.37Å; K207-A210 PolarHBondContact O-N 3.49Å; K207-E211 PolarHBondContact O-N 2.92Å |
| 208 | L | 93.9 | Very high | 91.3 | Very high | 112 Ų | 112 | 96.5 Ų | 96.5 | 59% | 0.586 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.9 | -40.1 | 178.1 | -173.6 | 65.3 | 0 | 0 | 0 | 111.8 | R204 Q205 A210 E211 A212 | R204-L208 WeakPolarHBondContact O-CB 3.38Å; R204-L208 PolarHBondContact O-N 2.89Å; Q205-L208 PolarHBondContact O-N 3.18Å; L208-A210 VanDerWaalsContact C-N 3.34Å; L208-A210 PolarHBondContact O-N 2.87Å; L208-E211 PolarHBondContact O-N 3.28Å; L208-A212 WeakPolarHBondContact O-CB 3.46Å; L208-A212 PolarHBondContact O-N 3.44Å |
| 209 | Q | 94.6 | Very high | 92.3 | Very high | 103 Ų | 103 | 92.2 Ų | 92.2 | 48% | 0.481 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -65 | -37.6 | 175.8 | -168 | -175.8 | 16.8 | 0 | 0 | 111.9 | Q205 K206 K207 K213 | Q205-Q209 VanDerWaalsContact O-CB 3.31Å; Q205-Q209 WeakPolarHBondContact O-CB 3.37Å; Q205-Q209 PolarHBondContact O-N 2.9Å; K206-Q209 PolarHBondContact O-N 3.2Å; K207-Q209 VanDerWaalsContact C-N 3.33Å; K207-Q209 PolarHBondContact O-N 2.95Å; Q209-K213 HydrophobicContact CG-CD 4.47Å; Q209-K213 WeakPolarHBondContact O-CB 3.21Å; Q209-K213 VanDerWaalsContact O-CG 3.23Å; Q209-K213 WeakPolarHBondContact O-CG 3.49Å; Q209-K213 PolarHBondContact O-N 3.39Å |
| 210 | A | 95.9 | Very high | 93.1 | Very high | 51 Ų | 51 | 97.1 Ų | 97.1 | 42% | 0.421 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.7 | -43.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | K206 K207 L208 K213 M214 | K206-A210 WeakPolarHBondContact O-CB 3.27Å; K206-A210 PolarHBondContact O-N 2.8Å; K207-A210 WeakPolarHBondContact O-CB 3.37Å; K207-A210 PolarHBondContact O-N 3.49Å; L208-A210 VanDerWaalsContact C-N 3.34Å; L208-A210 PolarHBondContact O-N 2.87Å; A210-K213 PolarHBondContact O-N 3.38Å; A210-M214 WeakPolarHBondContact O-CG 3.46Å; A210-M214 PolarHBondContact O-N 3.45Å |
| 211 | E | 95.8 | Very high | 93.8 | Very high | 128 Ų | 128 | 94.8 Ų | 94.8 | 60% | 0.598 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -60.9 | -48.2 | 175.3 | -175.5 | 178.5 | 167.7 | 0 | 0 | 111.8 | K207 L208 K213 M214 A215 | K207-E211 PolarHBondContact O-N 2.92Å; L208-E211 PolarHBondContact O-N 3.28Å; E211-K213 VanDerWaalsContact C-N 3.32Å; E211-K213 PolarHBondContact O-N 3.43Å; E211-M214 PolarHBondContact O-N 2.99Å; E211-A215 WeakPolarHBondContact O-CB 3.47Å; E211-A215 PolarHBondContact O-N 2.99Å |
| 212 | A | 95.7 | Very high | 94.4 | Very high | 47 Ų | 47 | 95.2 Ų | 95.2 | 39% | 0.388 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.4 | -40.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L208 A215 L216 | L208-A212 WeakPolarHBondContact O-CB 3.46Å; L208-A212 PolarHBondContact O-N 3.44Å; A212-A215 PolarHBondContact O-N 3.38Å; A212-L216 WeakPolarHBondContact O-CB 3.34Å; A212-L216 VanDerWaalsContact O-CG 3.29Å; A212-L216 WeakPolarHBondContact O-CG 3.43Å; A212-L216 PolarHBondContact O-N 3.26Å |
| 213 | K | 97.2 | Very high | 94.9 | Very high | 128 Ų | 128 | 94.7 Ų | 94.7 | 56% | 0.557 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.8 | -44.2 | 175.5 | -78.3 | 172.3 | 179.1 | 175.4 | 0 | 112.1 | Q209 A210 E211 A217 | Q209-K213 HydrophobicContact CG-CD 4.47Å; Q209-K213 WeakPolarHBondContact O-CB 3.21Å; Q209-K213 VanDerWaalsContact O-CG 3.23Å; Q209-K213 WeakPolarHBondContact O-CG 3.49Å; Q209-K213 PolarHBondContact O-N 3.39Å; A210-K213 PolarHBondContact O-N 3.38Å; E211-K213 VanDerWaalsContact C-N 3.32Å; E211-K213 PolarHBondContact O-N 3.43Å; K213-A217 PolarHBondContact O-N 3Å |
| 214 | M | 97.2 | Very high | 95.2 | Very high | 134 Ų | 134 | 98.2 Ų | 98.2 | 66% | 0.66 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.3 | -42.4 | 176.6 | -67.6 | -66 | -176.2 | 0 | 0 | 111.3 | A210 E211 A217 M218 | A210-M214 WeakPolarHBondContact O-CG 3.46Å; A210-M214 PolarHBondContact O-N 3.45Å; E211-M214 PolarHBondContact O-N 2.99Å; M214-A217 PolarHBondContact O-N 3.17Å; M214-M218 WeakPolarHBondContact O-CG 3.41Å; M214-M218 PolarHBondContact O-N 3.35Å; M214-M218 VanDerWaalsContact O-N 3.16Å |
| 215 | A | 96.4 | Very high | 95.6 | Very high | 52 Ų | 52 | 99.3 Ų | 99.3 | 43% | 0.43 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.7 | -45.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | E211 A212 A217 M218 A219 | E211-A215 WeakPolarHBondContact O-CB 3.47Å; E211-A215 PolarHBondContact O-N 2.99Å; A212-A215 PolarHBondContact O-N 3.38Å; A215-A217 VanDerWaalsContact C-N 3.32Å; A215-A217 PolarHBondContact O-N 3.25Å; A215-M218 PolarHBondContact O-N 3.35Å; A215-M218 VanDerWaalsContact O-N 3.15Å; A215-A219 PolarHBondContact O-N 2.98Å |
| 216 | L | 96.4 | Very high | 96 | Very high | 127 Ų | 127 | 101.5 Ų | 101.5 | 67% | 0.665 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.4 | -38 | 175.6 | -73.5 | 171.5 | 0 | 0 | 0 | 112.1 | A212 M218 A219 | A212-L216 WeakPolarHBondContact O-CB 3.34Å; A212-L216 VanDerWaalsContact O-CG 3.29Å; A212-L216 WeakPolarHBondContact O-CG 3.43Å; A212-L216 PolarHBondContact O-N 3.26Å; L216-M218 VanDerWaalsContact C-N 3.27Å; L216-M218 PolarHBondContact O-N 3.21Å; L216-A219 WeakPolarHBondContact O-CB 3.35Å; L216-A219 PolarHBondContact O-N 3.21Å |
| 217 | A | 96.7 | Very high | 96.2 | Very high | 70 Ų | 70 | 99.8 Ų | 99.8 | 58% | 0.579 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.7 | -32.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | K213 M214 A215 P221 | K213-A217 PolarHBondContact O-N 3Å; M214-A217 PolarHBondContact O-N 3.17Å; A215-A217 VanDerWaalsContact C-N 3.32Å; A215-A217 PolarHBondContact O-N 3.25Å; A217-P221 WeakPolarHBondContact O-CD 3.47Å |
| 218 | M | 96.7 | Very high | 96.3 | Very high | 117 Ų | 117 | 97.8 Ų | 97.8 | 58% | 0.576 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -77.5 | -17.3 | 176.5 | -66.7 | -173.8 | -67.4 | 0 | 0 | 113.8 | M214 A215 L216 K220 P221 M222 | M214-M218 WeakPolarHBondContact O-CG 3.41Å; M214-M218 PolarHBondContact O-N 3.35Å; M214-M218 VanDerWaalsContact O-N 3.16Å; A215-M218 PolarHBondContact O-N 3.35Å; A215-M218 VanDerWaalsContact O-N 3.15Å; L216-M218 VanDerWaalsContact C-N 3.27Å; L216-M218 PolarHBondContact O-N 3.21Å; M218-K220 PolarHBondContact O-N 3.46Å; M218-P221 VanDerWaalsContact O-CD 3.23Å; M218-P221 WeakPolarHBondContact O-CD 3.27Å; M218-P221 VanDerWaalsContact O-CG 3.28Å; M218-P221 WeakPolarHBondContact O-CG 3.42Å; M218-M222 VanDerWaalsContact O-CB 3.23Å; M218-M222 WeakPolarHBondContact O-CB 3.48Å; M218-M222 PolarHBondContact O-N 3.5Å |
| 219 | A | 95.2 | Very high | 96.4 | Very high | 44 Ų | 44 | 95.3 Ų | 95.3 | 36% | 0.364 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61 | -44.3 | -175 | 0 | 0 | 0 | 0 | 0 | 112.9 | A215 L216 M222 A223 | A215-A219 PolarHBondContact O-N 2.98Å; L216-A219 WeakPolarHBondContact O-CB 3.35Å; L216-A219 PolarHBondContact O-N 3.21Å; A219-M222 PolarHBondContact O-N 3.21Å; A219-A223 WeakPolarHBondContact O-CB 3.36Å; A219-A223 PolarHBondContact O-N 3.41Å |
| 220 | K | 95.3 | Very high | 96.3 | Very high | 152 Ų | 152 | 95 Ų | 95 | 66% | 0.661 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.4 | -51.2 | -179.5 | -174.2 | 175.5 | -175.6 | 174.6 | 0 | 113.7 | M218 M222 A223 K224 | M218-K220 PolarHBondContact O-N 3.46Å; K220-M222 VanDerWaalsContact C-N 3.33Å; K220-A223 PolarHBondContact O-N 3.34Å; K220-K224 PolarHBondContact O-N 3.08Å; K220-K224 VanDerWaalsContact O-N 3.12Å |
| 221 | P | 97.8 | Very high | 96 | Very high | 79 Ų | 79 | 98 Ų | 98 | 51% | 0.513 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.4 | -36.1 | 175.8 | 23.1 | -31.9 | 0 | 0 | 0 | 112.4 | A217 M218 K224 M225 | A217-P221 WeakPolarHBondContact O-CD 3.47Å; M218-P221 VanDerWaalsContact O-CD 3.23Å; M218-P221 WeakPolarHBondContact O-CD 3.27Å; M218-P221 VanDerWaalsContact O-CG 3.28Å; M218-P221 WeakPolarHBondContact O-CG 3.42Å; P221-K224 PolarHBondContact O-N 3.02Å; P221-M225 WeakPolarHBondContact O-CB 3.27Å; P221-M225 PolarHBondContact O-N 3.14Å |
| 222 | M | 97.5 | Very high | 95.7 | Very high | 119 Ų | 119 | 98.9 Ų | 98.9 | 59% | 0.586 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.2 | -41.6 | 175.7 | -172.2 | 171 | 68.8 | 0 | 0 | 112 | M218 A219 K220 M225 Q226 | M218-M222 VanDerWaalsContact O-CB 3.23Å; M218-M222 WeakPolarHBondContact O-CB 3.48Å; M218-M222 PolarHBondContact O-N 3.5Å; A219-M222 PolarHBondContact O-N 3.21Å; K220-M222 VanDerWaalsContact C-N 3.33Å; M222-M225 HydrophobicContact CG-CE 4.35Å; M222-M225 WeakPolarHBondContact O-CB 3.25Å; M222-M225 PolarHBondContact O-N 3.32Å; M222-Q226 WeakPolarHBondContact O-CB 3.46Å; M222-Q226 PolarHBondContact O-N 3.17Å |
| 223 | A | 96 | Very high | 95.3 | Very high | 56 Ų | 56 | 102.4 Ų | 102.4 | 46% | 0.463 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.1 | -42.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | A219 K220 M225 Q226 V227 | A219-A223 WeakPolarHBondContact O-CB 3.36Å; A219-A223 PolarHBondContact O-N 3.41Å; K220-A223 PolarHBondContact O-N 3.34Å; A223-M225 VanDerWaalsContact C-N 3.34Å; A223-M225 PolarHBondContact O-N 3.42Å; A223-Q226 WeakPolarHBondContact O-CB 3.42Å; A223-Q226 PolarHBondContact O-N 3.12Å; A223-V227 WeakPolarHBondContact O-CG2 3.18Å; A223-V227 PolarHBondContact O-N 3.46Å |
| 224 | K | 97.6 | Very high | 94.7 | Very high | 141 Ų | 141 | 102.4 Ų | 102.4 | 61% | 0.613 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -61.8 | -42.5 | 174.5 | -73.3 | -176.9 | 176.6 | -173.6 | 0 | 112 | K220 P221 Q226 V227 E228 | K220-K224 PolarHBondContact O-N 3.08Å; K220-K224 VanDerWaalsContact O-N 3.12Å; P221-K224 PolarHBondContact O-N 3.02Å; K224-Q226 VanDerWaalsContact C-N 3.33Å; K224-V227 PolarHBondContact O-N 3.35Å; K224-E228 PolarHBondContact O-N 2.93Å |
| 225 | M | 97.8 | Very high | 94 | Very high | 121 Ų | 121 | 105.6 Ų | 105.6 | 60% | 0.596 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -61 | -44.2 | 175.9 | -177.5 | 179.6 | 69 | 0 | 0 | 110.9 | P221 M222 A223 V227 E228 V229 | P221-M225 WeakPolarHBondContact O-CB 3.27Å; P221-M225 PolarHBondContact O-N 3.14Å; M222-M225 HydrophobicContact CG-CE 4.35Å; M222-M225 WeakPolarHBondContact O-CB 3.25Å; M222-M225 PolarHBondContact O-N 3.32Å; A223-M225 VanDerWaalsContact C-N 3.34Å; A223-M225 PolarHBondContact O-N 3.42Å; M225-V227 PolarHBondContact O-N 3.12Å; M225-E228 PolarHBondContact O-N 3.48Å; M225-V229 WeakPolarHBondContact O-CG2 3.32Å; M225-V229 PolarHBondContact O-N 3.3Å |
| 226 | Q | 97.4 | Very high | 93.3 | Very high | 96 Ų | 96 | 111.4 Ų | 111.4 | 45% | 0.449 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -59.4 | -44.4 | 176.8 | -178.1 | 60.8 | 26.1 | 0 | 0 | 112.2 | M222 A223 K224 E228 V229 E230 | M222-Q226 WeakPolarHBondContact O-CB 3.46Å; M222-Q226 PolarHBondContact O-N 3.17Å; A223-Q226 WeakPolarHBondContact O-CB 3.42Å; A223-Q226 PolarHBondContact O-N 3.12Å; K224-Q226 VanDerWaalsContact C-N 3.33Å; Q226-E228 VanDerWaalsContact C-N 3.32Å; Q226-E228 PolarHBondContact O-N 3.28Å; Q226-V229 WeakPolarHBondContact O-CB 3.49Å; Q226-V229 PolarHBondContact O-N 2.9Å; Q226-E230 PolarHBondContact NE2-OE1 2.88Å; Q226-E230 WeakPolarHBondContact O-CG 3.43Å; Q226-E230 PolarHBondContact O-N 3.13Å |
| 227 | V | 95.5 | Very high | 92.9 | Very high | 92 Ų | 92 | 105.7 Ų | 105.7 | 56% | 0.558 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.5 | -38.4 | 176.8 | 171.9 | 0 | 0 | 0 | 0 | 112 | A223 K224 M225 E230 K231 | A223-V227 WeakPolarHBondContact O-CG2 3.18Å; A223-V227 PolarHBondContact O-N 3.46Å; K224-V227 PolarHBondContact O-N 3.35Å; M225-V227 PolarHBondContact O-N 3.12Å; V227-E230 PolarHBondContact O-N 3.49Å; V227-K231 WeakPolarHBondContact O-CB 3.33Å; V227-K231 PolarHBondContact O-N 3.37Å |
| 228 | E | 95.6 | Very high | 92.4 | Very high | 84 Ų | 84 | 105.8 Ų | 105.8 | 39% | 0.393 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -71.1 | -36.6 | 176.8 | -167.8 | 62 | -143.8 | 0 | 0 | 111.8 | K224 M225 Q226 K231 Q232 | K224-E228 PolarHBondContact O-N 2.93Å; M225-E228 PolarHBondContact O-N 3.48Å; Q226-E228 VanDerWaalsContact C-N 3.32Å; Q226-E228 PolarHBondContact O-N 3.28Å; E228-K231 WeakPolarHBondContact O-CB 3.41Å; E228-K231 PolarHBondContact O-N 3.02Å; E228-K231 IonicContact OE1-NZ 3Å; E228-K231 PolarHBondContact OE1-NZ 3.24Å; E228-K231 IonicContact OE2-NZ 3.35Å; E228-K231 PolarHBondContact OE2-NZ 3.42Å; E228-Q232 WeakPolarHBondContact O-CG 3.47Å; E228-Q232 PolarHBondContact O-N 3.48Å; E228-Q232 VanDerWaalsContact O-N 3.08Å |
| 229 | V | 96.2 | Very high | 92.2 | Very high | 60 Ų | 60 | 100.3 Ų | 100.3 | 36% | 0.364 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 172.3 | 170.5 | 0 | 0 | 0 | 0 | 110.8 | M225 Q226 K231 Q232 N233 | M225-V229 WeakPolarHBondContact O-CG2 3.32Å; M225-V229 PolarHBondContact O-N 3.3Å; Q226-V229 WeakPolarHBondContact O-CB 3.49Å; Q226-V229 PolarHBondContact O-N 2.9Å; V229-K231 VanDerWaalsContact C-N 3.33Å; V229-K231 PolarHBondContact O-N 3.38Å; V229-Q232 PolarHBondContact O-N 2.92Å; V229-N233 WeakPolarHBondContact CG1-ND2 3.49Å; V229-N233 PolarHBondContact O-N 3.03Å; V229-N233 PolarHBondContact O-ND2 2.96Å; V229-N233 VanDerWaalsContact O-ND2 3.12Å |
| 230 | E | 92.9 | Very high | 92 | Very high | 96 Ų | 96 | 99.7 Ų | 99.7 | 45% | 0.449 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.2 | -38.3 | 177 | -75 | 169.9 | -171.6 | 0 | 0 | 112.2 | Q226 V227 Q232 N233 R234 | Q226-E230 PolarHBondContact NE2-OE1 2.88Å; Q226-E230 WeakPolarHBondContact O-CG 3.43Å; Q226-E230 PolarHBondContact O-N 3.13Å; V227-E230 PolarHBondContact O-N 3.49Å; E230-Q232 VanDerWaalsContact C-N 3.29Å; E230-Q232 PolarHBondContact O-N 3.4Å; E230-N233 CarbonylContact O-C 3.54Å; E230-N233 PolarHBondContact O-N 2.92Å; E230-N233 VanDerWaalsContact O-N 3.14Å; E230-R234 WeakPolarHBondContact O-CG 3.38Å; E230-R234 PolarHBondContact O-N 3.42Å; E230-R234 VanDerWaalsContact O-N 3.13Å |
| 231 | K | 89.9 | Confident | 91.8 | Very high | 116 Ų | 116 | 99 Ų | 99 | 50% | 0.504 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.6 | -36.6 | 174.6 | -178.5 | 175.7 | 151.8 | -134.8 | 0 | 112.3 | V227 E228 V229 | V227-K231 WeakPolarHBondContact O-CB 3.33Å; V227-K231 PolarHBondContact O-N 3.37Å; E228-K231 WeakPolarHBondContact O-CB 3.41Å; E228-K231 PolarHBondContact O-N 3.02Å; E228-K231 IonicContact OE1-NZ 3Å; E228-K231 PolarHBondContact OE1-NZ 3.24Å; E228-K231 IonicContact OE2-NZ 3.35Å; E228-K231 PolarHBondContact OE2-NZ 3.42Å; V229-K231 VanDerWaalsContact C-N 3.33Å; V229-K231 PolarHBondContact O-N 3.38Å |
| 232 | Q | 88.7 | Confident | 91.6 | Very high | 145 Ų | 145 | 100.7 Ų | 100.7 | 68% | 0.678 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -72 | -32.7 | 173.6 | -68.2 | 177.6 | 19.7 | 0 | 0 | 112.7 | E228 V229 E230 R234 | E228-Q232 WeakPolarHBondContact O-CG 3.47Å; E228-Q232 PolarHBondContact O-N 3.48Å; E228-Q232 VanDerWaalsContact O-N 3.08Å; V229-Q232 PolarHBondContact O-N 2.92Å; E230-Q232 VanDerWaalsContact C-N 3.29Å; E230-Q232 PolarHBondContact O-N 3.4Å; Q232-R234 VanDerWaalsContact C-N 3.33Å; Q232-R234 PolarHBondContact O-N 3.28Å |
| 233 | N | 88.4 | Confident | 91.3 | Very high | 121 Ų | 121 | 95.8 Ų | 95.8 | 65% | 0.647 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.3 | 3.3 | 179.9 | -74.1 | -45 | 0 | 0 | 0 | 114.6 | V229 E230 K235 | V229-N233 WeakPolarHBondContact CG1-ND2 3.49Å; V229-N233 PolarHBondContact O-N 3.03Å; V229-N233 PolarHBondContact O-ND2 2.96Å; V229-N233 VanDerWaalsContact O-ND2 3.12Å; E230-N233 CarbonylContact O-C 3.54Å; E230-N233 PolarHBondContact O-N 2.92Å; E230-N233 VanDerWaalsContact O-N 3.14Å; N233-K235 PolarHBondContact O-N 3.38Å |
| 234 | R | 83.3 | Confident | 90.9 | Very high | 128 Ų | 128 | 97 Ų | 97 | 48% | 0.483 | 48% | 0.48 | S | S | . | . | P | Polyproline II helix | trans | -57.6 | 134.2 | 178.8 | -73.2 | -176 | 178.5 | -96.3 | -7.4 | 110.8 | E230 Q232 K236 | E230-R234 WeakPolarHBondContact O-CG 3.38Å; E230-R234 PolarHBondContact O-N 3.42Å; E230-R234 VanDerWaalsContact O-N 3.13Å; Q232-R234 VanDerWaalsContact C-N 3.33Å; Q232-R234 PolarHBondContact O-N 3.28Å; R234-K236 PolarHBondContact O-N 3.49Å |
| 235 | K | 83.3 | Confident | 90.6 | Very high | 201 Ų | 201 | 98.6 Ų | 98.6 | 87% | 0.874 | 49% | 0.49 | S | S | * | . | P | Polyproline II helix | trans | -56.8 | 136.8 | 177.4 | -65 | 174.8 | -176.2 | 168.7 | 0 | 109.8 | N233 | N233-K235 PolarHBondContact O-N 3.38Š|
| 236 | K | 82.2 | Confident | 90.2 | Very high | 175 Ų | 175 | 96.1 Ų | 96.1 | 76% | 0.761 | 48% | 0.478 | S | S | * | . | P | Polyproline II helix | trans | -64 | 138.3 | 172.7 | -65.5 | 179.8 | -178.7 | 177.9 | 0 | 108.9 | R234 P238 | R234-K236 PolarHBondContact O-N 3.49Å; K236-P238 WeakPolarHBondContact O-CD 3.5Å |
| 237 | S | 86.9 | Confident | 89.9 | Confident | 7 Ų | 7 | 95.2 Ų | 95.2 | 5% | 0.049 | 48% | 0.48 | C | S | . | . | P | Polyproline II helix | trans | -61.2 | 130.1 | 176 | 164.2 | 0 | 0 | 0 | 0 | 109.6 | V239 A240 D277 | S237-V239 PolarHBondContact O-N 3.01Å; S237-V239 VanDerWaalsContact OG-CB 3.27Å; S237-V239 WeakPolarHBondContact OG-CB 3.48Å; S237-V239 WeakPolarHBondContact OG-CG2 3.43Å; S237-V239 PolarHBondContact OG-N 3.18Å; S237-V239 VanDerWaalsContact OG-N 3.16Å; S237-A240 WeakPolarHBondContact O-CB 3.34Å; S237-A240 PolarHBondContact O-N 3.16Å; S237-D277 VanDerWaalsContact OG-CG 3.3Å; S237-D277 PolarHBondContact OG-OD1 3.49Å; S237-D277 PolarHBondContact OG-OD2 2.97Å |
| 238 | P | 86.9 | Confident | 89.7 | Confident | 72 Ų | 72 | 97.6 Ų | 97.6 | 47% | 0.468 | 49% | 0.485 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -49.6 | -21.9 | 170.2 | -29.5 | 32.9 | 0 | 0 | 0 | 114.6 | K236 A240 D241 L242 D277 | K236-P238 WeakPolarHBondContact O-CD 3.5Å; P238-A240 PolarHBondContact O-N 2.92Å; P238-D241 PolarHBondContact O-N 3.23Å; P238-D241 VanDerWaalsContact O-N 3.12Å; P238-L242 PolarHBondContact O-N 3.33Å; P238-L242 VanDerWaalsContact O-N 3.13Å; P238-D277 VanDerWaalsContact CD-OD1 3.27Å; P238-D277 WeakPolarHBondContact CD-OD1 3.44Å |
| 239 | V | 92.1 | Very high | 89.5 | Confident | 1 Ų | 1 | 93.9 Ų | 93.9 | 1% | 0.006 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -58.1 | -30.9 | 173.5 | 177.3 | 0 | 0 | 0 | 0 | 111.8 | S237 D241 L242 L243 L253 V273 I274 D277 | S237-V239 PolarHBondContact O-N 3.01Å; S237-V239 VanDerWaalsContact OG-CB 3.27Å; S237-V239 WeakPolarHBondContact OG-CB 3.48Å; S237-V239 WeakPolarHBondContact OG-CG2 3.43Å; S237-V239 PolarHBondContact OG-N 3.18Å; S237-V239 VanDerWaalsContact OG-N 3.16Å; V239-D241 PolarHBondContact O-N 3.18Å; V239-L242 PolarHBondContact O-N 2.82Å; V239-L243 HydrophobicContact CG1-CB 4.18Å; V239-L243 HydrophobicContact CG1-CD1 3.85Å; V239-L243 HydrophobicContact CG1-CG 4.17Å; V239-L243 WeakPolarHBondContact O-CA 3.47Å; V239-L243 WeakPolarHBondContact O-CB 3.35Å; V239-L243 PolarHBondContact O-N 3.22Å; V239-L253 HydrophobicContact CB-CD1 4.06Å; V239-L253 HydrophobicContact CG1-CD1 3.85Å; V239-L253 HydrophobicContact CG2-CD1 3.99Å; V239-V273 HydrophobicContact CG2-CG1 4.4Å; V239-I274 HydrophobicContact CG1-CG1 4.36Å; V239-D277 HydrophobicContact CG2-CB 3.39Å; V239-D277 WeakPolarHBondContact CG2-OD2 3.41Å |
| 240 | A | 90.6 | Very high | 89.3 | Confident | 31 Ų | 31 | 91.9 Ų | 91.9 | 26% | 0.256 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.4 | -34.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | S237 P238 | S237-A240 WeakPolarHBondContact O-CB 3.34Å; S237-A240 PolarHBondContact O-N 3.16Å; P238-A240 PolarHBondContact O-N 2.92Å |
| 241 | D | 91.7 | Very high | 89.2 | Confident | 139 Ų | 139 | 91.8 Ų | 91.8 | 74% | 0.743 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -87.8 | -34.3 | -179.9 | -61.1 | -34.3 | 0 | 0 | 0 | 112.1 | P238 V239 P244 | P238-D241 PolarHBondContact O-N 3.23Å; P238-D241 VanDerWaalsContact O-N 3.12Å; V239-D241 PolarHBondContact O-N 3.18Å; D241-P244 WeakPolarHBondContact O-CD 3.22Å |
| 242 | L | 92.1 | Very high | 89.3 | Confident | 114 Ų | 114 | 87.6 Ų | 87.6 | 60% | 0.597 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -79.8 | -30 | -179.5 | -67.2 | 175.4 | 0 | 0 | 0 | 113.2 | P238 V239 P244 V273 | P238-L242 PolarHBondContact O-N 3.33Å; P238-L242 VanDerWaalsContact O-N 3.13Å; V239-L242 PolarHBondContact O-N 2.82Å; L242-P244 WeakPolarHBondContact O-CD 3.44Å; L242-V273 HydrophobicContact CB-CG1 3.88Å; L242-V273 HydrophobicContact CD1-CG1 3.74Å; L242-V273 HydrophobicContact CG-CG1 4.49Å |
| 243 | L | 91.8 | Very high | 89.4 | Confident | 15 Ų | 15 | 81.2 Ų | 81.2 | 8% | 0.079 | 41% | 0.411 | C | S | . | . | trans | -120.4 | 60 | 177.6 | -59.6 | -175.8 | 0 | 0 | 0 | 111.3 | V239 H245 M246 M266 Q270 V273 I274 | V239-L243 HydrophobicContact CG1-CB 4.18Å; V239-L243 HydrophobicContact CG1-CD1 3.85Å; V239-L243 HydrophobicContact CG1-CG 4.17Å; V239-L243 WeakPolarHBondContact O-CA 3.47Å; V239-L243 WeakPolarHBondContact O-CB 3.35Å; V239-L243 PolarHBondContact O-N 3.22Å; L243-H245 PolarHBondContact O-N 2.92Å; L243-H245 VanDerWaalsContact O-N 3.09Å; L243-M246 PolarHBondContact O-N 3.42Å; L243-M266 HydrophobicContact CD1-CE 3.85Å; L243-Q270 HydrophobicContact CD1-CB 4.27Å; L243-Q270 HydrophobicContact CD2-CB 3.97Å; L243-Q270 HydrophobicContact CD2-CG 3.7Å; L243-V273 HydrophobicContact CD1-CG1 4.46Å; L243-V273 HydrophobicContact CG-CG1 4.28Å; L243-I274 HydrophobicContact CD1-CD1 4.22Å; L243-I274 HydrophobicContact CD1-CG1 4Å | ||
| 244 | P | 89 | Confident | 89.4 | Confident | 81 Ų | 81 | 80.3 Ų | 80.3 | 53% | 0.526 | 41% | 0.405 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -21.4 | -173.9 | 27.9 | -35.8 | 0 | 0 | 0 | 113 | D241 L242 M246 | D241-P244 WeakPolarHBondContact O-CD 3.22Å; L242-P244 WeakPolarHBondContact O-CD 3.44Å; P244-M246 PolarHBondContact O-N 2.99Å |
| 245 | H | 89.9 | Confident | 89.7 | Confident | 175 Ų | 175 | 80.6 Ų | 80.6 | 81% | 0.81 | 41% | 0.409 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.2 | -5 | 177.7 | -57.2 | -24.8 | 0 | 0 | 0 | 113.6 | L243 | L243-H245 PolarHBondContact O-N 2.92Å; L243-H245 VanDerWaalsContact O-N 3.09Å |
| 246 | M | 90.7 | Very high | 90 | Very high | 70 Ų | 70 | 80.2 Ų | 80.2 | 35% | 0.345 | 40% | 0.403 | S | S | . | . | trans | -130.9 | 62.5 | -174.5 | -61.9 | -67.5 | -83.5 | 0 | 0 | 112 | L243 P244 H248 I249 | L243-M246 PolarHBondContact O-N 3.42Å; P244-M246 PolarHBondContact O-N 2.99Å; M246-H248 VanDerWaalsContact C-N 3.27Å; M246-H248 PolarHBondContact O-N 3.06Å; M246-I249 HydrophobicContact CB-CB 4.22Å; M246-I249 HydrophobicContact CB-CG1 3.8Å; M246-I249 HydrophobicContact CE-CD1 4.47Å; M246-I249 HydrophobicContact CE-CG1 4.04Å; M246-I249 WeakPolarHBondContact O-CB 3.36Å; M246-I249 PolarHBondContact O-N 3.42Å | ||
| 247 | P | 89.5 | Confident | 90.4 | Very high | 77 Ų | 77 | 74.3 Ų | 74.3 | 50% | 0.5 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.9 | -27.8 | -176.4 | 26.5 | -35.3 | 0 | 0 | 0 | 113.7 | I249 S250 E251 | P247-I249 PolarHBondContact O-N 3.23Å; P247-S250 PolarHBondContact O-N 3.2Å; P247-S250 PolarHBondContact O-OG 3.38Å; P247-E251 PolarHBondContact O-N 2.87Å; P247-E251 VanDerWaalsContact O-N 3.16Å |
| 248 | H | 91.1 | Very high | 90.6 | Very high | 142 Ų | 142 | 76.2 Ų | 76.2 | 66% | 0.657 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -64.2 | -31 | 175.3 | -74.4 | 42.2 | 0 | 0 | 0 | 111.5 | M246 C252 | M246-H248 VanDerWaalsContact C-N 3.27Å; M246-H248 PolarHBondContact O-N 3.06Å; H248-C252 VanDerWaalsContact O-CB 3.25Å; H248-C252 WeakPolarHBondContact O-CB 3.32Å; H248-C252 PolarHBondContact O-N 3.37Å; H248-C252 PolarHBondContact O-SG 3.38Å |
| 249 | I | 92.7 | Very high | 90.9 | Very high | 6 Ų | 6 | 79 Ų | 79 | 3% | 0.031 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -70.1 | -45.9 | 179.8 | -59.9 | -63.1 | 0 | 0 | 0 | 110.7 | M246 P247 E251 C252 L253 L258 D262 M266 I274 | M246-I249 HydrophobicContact CB-CB 4.22Å; M246-I249 HydrophobicContact CB-CG1 3.8Å; M246-I249 HydrophobicContact CE-CD1 4.47Å; M246-I249 HydrophobicContact CE-CG1 4.04Å; M246-I249 WeakPolarHBondContact O-CB 3.36Å; M246-I249 PolarHBondContact O-N 3.42Å; P247-I249 PolarHBondContact O-N 3.23Å; I249-E251 VanDerWaalsContact C-N 3.32Å; I249-E251 PolarHBondContact O-N 2.88Å; I249-C252 PolarHBondContact O-N 2.9Å; I249-L253 HydrophobicContact CG2-CD1 3.98Å; I249-L253 HydrophobicContact CG2-CG 4.38Å; I249-L253 WeakPolarHBondContact O-CB 3.49Å; I249-L253 VanDerWaalsContact O-CG 3.23Å; I249-L253 WeakPolarHBondContact O-CG 3.47Å; I249-L253 PolarHBondContact O-N 2.97Å; I249-L258 HydrophobicContact CD1-CD1 3.94Å; I249-L258 HydrophobicContact CG2-CD1 4.08Å; I249-D262 HydrophobicContact CD1-CB 3.65Å; I249-M266 HydrophobicContact CD1-SD 4.47Å; I249-I274 HydrophobicContact CG2-CD1 3.7Å; I249-I274 HydrophobicContact CG2-CG1 4.34Å |
| 250 | S | 90.8 | Very high | 90.9 | Very high | 18 Ų | 18 | 84.2 Ų | 84.2 | 13% | 0.126 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -63.6 | -38.6 | 177.3 | 58.4 | 0 | 0 | 0 | 0 | 111.7 | P247 L253 M254 | P247-S250 PolarHBondContact O-N 3.2Å; P247-S250 PolarHBondContact O-OG 3.38Å; S250-L253 PolarHBondContact O-N 3.4Å; S250-M254 WeakPolarHBondContact O-CG 3.45Å; S250-M254 PolarHBondContact O-N 2.9Å |
| 251 | E | 91.2 | Very high | 91 | Very high | 93 Ų | 93 | 86.4 Ų | 86.4 | 44% | 0.435 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -64.2 | -46.4 | 172.6 | -174 | 179 | 179.9 | 0 | 0 | 112.4 | P247 I249 L253 M254 K255 | P247-E251 PolarHBondContact O-N 2.87Å; P247-E251 VanDerWaalsContact O-N 3.16Å; I249-E251 VanDerWaalsContact C-N 3.32Å; I249-E251 PolarHBondContact O-N 2.88Å; E251-L253 VanDerWaalsContact C-N 3.28Å; E251-L253 PolarHBondContact O-N 3.25Å; E251-M254 PolarHBondContact O-N 3.01Å; E251-K255 HydrophobicContact CG-CD 4.28Å; E251-K255 WeakPolarHBondContact O-CG 3.48Å; E251-K255 PolarHBondContact O-N 3.45Å; E251-K255 VanDerWaalsContact OE1-CE 3.26Å; E251-K255 WeakPolarHBondContact OE1-CE 3.37Å; E251-K255 IonicContact OE1-NZ 3.81Å; E251-K255 PolarHBondContact OE1-NZ 3.12Å |
| 252 | C | 92.2 | Very high | 91 | Very high | 29 Ų | 29 | 82.3 Ų | 82.3 | 20% | 0.196 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -60.7 | -37.7 | 176.4 | -79 | 0 | 0 | 0 | 0 | 112.1 | H248 I249 K255 R256 S257 L258 | H248-C252 VanDerWaalsContact O-CB 3.25Å; H248-C252 WeakPolarHBondContact O-CB 3.32Å; H248-C252 PolarHBondContact O-N 3.37Å; H248-C252 PolarHBondContact O-SG 3.38Å; I249-C252 PolarHBondContact O-N 2.9Å; C252-K255 CarbonylContact O-C 3.59Å; C252-K255 PolarHBondContact O-N 3.27Å; C252-R256 PolarHBondContact O-N 3.3Å; C252-S257 PolarHBondContact O-N 2.99Å; C252-S257 PolarHBondContact O-OG 2.94Å; C252-L258 HydrophobicContact CB-CB 4.43Å; C252-L258 HydrophobicContact CB-CD1 3.88Å |
| 253 | L | 90.9 | Very high | 91.1 | Very high | 10 Ų | 10 | 79.1 Ų | 79.1 | 5% | 0.052 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -64.5 | -47.7 | 174.4 | -75.3 | 168.7 | 0 | 0 | 0 | 111.6 | V239 I249 S250 E251 K255 R256 L258 I274 L278 | V239-L253 HydrophobicContact CB-CD1 4.06Å; V239-L253 HydrophobicContact CG1-CD1 3.85Å; V239-L253 HydrophobicContact CG2-CD1 3.99Å; I249-L253 HydrophobicContact CG2-CD1 3.98Å; I249-L253 HydrophobicContact CG2-CG 4.38Å; I249-L253 WeakPolarHBondContact O-CB 3.49Å; I249-L253 VanDerWaalsContact O-CG 3.23Å; I249-L253 WeakPolarHBondContact O-CG 3.47Å; I249-L253 PolarHBondContact O-N 2.97Å; S250-L253 PolarHBondContact O-N 3.4Å; E251-L253 VanDerWaalsContact C-N 3.28Å; E251-L253 PolarHBondContact O-N 3.25Å; L253-K255 VanDerWaalsContact C-N 3.28Å; L253-K255 PolarHBondContact O-N 3Å; L253-R256 PolarHBondContact O-N 3.25Å; L253-L258 HydrophobicContact CD2-CD2 3.8Å; L253-L258 HydrophobicContact CG-CD2 4.43Å; L253-I274 HydrophobicContact CD1-CG1 4.47Å; L253-I274 HydrophobicContact CD1-CG2 4.27Å; L253-I274 HydrophobicContact CD2-CG2 3.98Å; L253-L278 HydrophobicContact CD2-CD1 4.21Å; L253-L278 HydrophobicContact CD2-CD2 3.78Å; L253-L278 HydrophobicContact CD2-CG 4.08Å |
| 254 | M | 88.8 | Confident | 91.1 | Very high | 103 Ų | 103 | 87.1 Ų | 87.1 | 51% | 0.507 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -61.1 | -37.2 | 177.2 | -70.8 | -177.4 | 80.5 | 0 | 0 | 112.2 | S250 E251 R256 | S250-M254 WeakPolarHBondContact O-CG 3.45Å; S250-M254 PolarHBondContact O-N 2.9Å; E251-M254 PolarHBondContact O-N 3.01Å; M254-R256 VanDerWaalsContact C-N 3.29Å; M254-R256 PolarHBondContact O-N 3.24Å |
| 255 | K | 89.3 | Confident | 91.3 | Very high | 133 Ų | 133 | 90.5 Ų | 90.5 | 58% | 0.578 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.7 | -0.1 | 176.3 | -66.5 | -178.1 | -171.8 | 174.3 | 0 | 114.1 | E251 C252 L253 S257 | E251-K255 HydrophobicContact CG-CD 4.28Å; E251-K255 WeakPolarHBondContact O-CG 3.48Å; E251-K255 PolarHBondContact O-N 3.45Å; E251-K255 VanDerWaalsContact OE1-CE 3.26Å; E251-K255 WeakPolarHBondContact OE1-CE 3.37Å; E251-K255 IonicContact OE1-NZ 3.81Å; E251-K255 PolarHBondContact OE1-NZ 3.12Å; C252-K255 CarbonylContact O-C 3.59Å; C252-K255 PolarHBondContact O-N 3.27Å; L253-K255 VanDerWaalsContact C-N 3.28Å; L253-K255 PolarHBondContact O-N 3Å; K255-S257 WeakPolarHBondContact CB-OG 3.49Å; K255-S257 PolarHBondContact O-N 3.43Å |
| 256 | R | 89.5 | Confident | 91.5 | Very high | 194 Ų | 194 | 83 Ų | 83 | 73% | 0.732 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.9 | 40.4 | -174.4 | -57.3 | -179.3 | 172 | 126.3 | -3.7 | 112.9 | C252 L253 M254 | C252-R256 PolarHBondContact O-N 3.3Å; L253-R256 PolarHBondContact O-N 3.25Å; M254-R256 VanDerWaalsContact C-N 3.29Å; M254-R256 PolarHBondContact O-N 3.24Å |
| 257 | S | 90.5 | Very high | 91.7 | Very high | 51 Ų | 51 | 83.6 Ų | 83.6 | 36% | 0.357 | 42% | 0.419 | S | S | . | . | trans | -125 | 17.5 | -169.9 | 64.2 | 0 | 0 | 0 | 0 | 113.9 | C252 K255 K259 | C252-S257 PolarHBondContact O-N 2.99Å; C252-S257 PolarHBondContact O-OG 2.94Å; K255-S257 WeakPolarHBondContact CB-OG 3.49Å; K255-S257 PolarHBondContact O-N 3.43Å; S257-K259 PolarHBondContact O-N 3.15Å | ||
| 258 | L | 91.2 | Very high | 92 | Very high | 47 Ų | 47 | 86.8 Ų | 86.8 | 25% | 0.246 | 43% | 0.43 | C | S | . | . | trans | -64.7 | 125.1 | -178.5 | -165.8 | 70.5 | 0 | 0 | 0 | 111.4 | I249 C252 L253 D262 L263 I274 | I249-L258 HydrophobicContact CD1-CD1 3.94Å; I249-L258 HydrophobicContact CG2-CD1 4.08Å; C252-L258 HydrophobicContact CB-CB 4.43Å; C252-L258 HydrophobicContact CB-CD1 3.88Å; L253-L258 HydrophobicContact CD2-CD2 3.8Å; L253-L258 HydrophobicContact CG-CD2 4.43Å; L258-D262 HydrophobicContact CD1-CB 4.23Å; L258-L263 HydrophobicContact CD1-CD2 4.24Å; L258-L263 HydrophobicContact CD2-CD1 3.94Å; L258-L263 HydrophobicContact CD2-CD2 3.99Å; L258-L263 HydrophobicContact CD2-CG 4.25Å; L258-L263 HydrophobicContact CG-CD1 4.35Å; L258-L263 HydrophobicContact CG-CD2 4.26Å; L258-L263 HydrophobicContact CG-CG 4.31Å; L258-I274 HydrophobicContact CD2-CG2 4.29Å | ||
| 259 | K | 92.8 | Very high | 92.3 | Very high | 130 Ų | 130 | 82.2 Ų | 82.2 | 57% | 0.565 | 42% | 0.422 | S | S | * | . | trans | -102.3 | 153 | -178.6 | -61.3 | 174.9 | -175.9 | 173.1 | 0 | 110.7 | S257 T261 D262 | S257-K259 PolarHBondContact O-N 3.15Å; K259-T261 WeakPolarHBondContact CB-OG1 3.23Å; K259-T261 PolarHBondContact O-N 3.2Å; K259-T261 VanDerWaalsContact O-N 3.11Å; K259-D262 WeakPolarHBondContact CB-OD2 3.43Å; K259-D262 PolarHBondContact N-OD2 3.15Å; K259-D262 WeakPolarHBondContact O-CB 3.28Å; K259-D262 PolarHBondContact O-N 3.16Å | ||
| 260 | P | 93.3 | Very high | 92.4 | Very high | 111 Ų | 111 | 84.6 Ų | 84.6 | 72% | 0.721 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.6 | -27 | 174.8 | -25.5 | 34.7 | 0 | 0 | 0 | 113.9 | D262 L263 R264 | P260-D262 VanDerWaalsContact C-N 3.32Å; P260-L263 PolarHBondContact O-N 3.38Å; P260-R264 PolarHBondContact O-N 3.33Å |
| 261 | T | 93 | Very high | 92.7 | Very high | 77 Ų | 77 | 86.4 Ų | 86.4 | 47% | 0.472 | 44% | 0.44 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -35.7 | 175.7 | 46.4 | 0 | 0 | 0 | 0 | 112.6 | K259 L263 R264 | K259-T261 WeakPolarHBondContact CB-OG1 3.23Å; K259-T261 PolarHBondContact O-N 3.2Å; K259-T261 VanDerWaalsContact O-N 3.11Å; T261-L263 PolarHBondContact O-N 3.35Å; T261-R264 PolarHBondContact O-N 3.05Å |
| 262 | D | 91.4 | Very high | 92.9 | Very high | 53 Ų | 53 | 86.5 Ų | 86.5 | 28% | 0.283 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71 | -20.5 | -176.5 | -47.9 | -29.5 | 0 | 0 | 0 | 111.2 | I249 L258 K259 P260 | I249-D262 HydrophobicContact CD1-CB 3.65Å; L258-D262 HydrophobicContact CD1-CB 4.23Å; K259-D262 WeakPolarHBondContact CB-OD2 3.43Å; K259-D262 PolarHBondContact N-OD2 3.15Å; K259-D262 WeakPolarHBondContact O-CB 3.28Å; K259-D262 PolarHBondContact O-N 3.16Å; P260-D262 VanDerWaalsContact C-N 3.32Å |
| 263 | L | 93.9 | Very high | 93.1 | Very high | 47 Ų | 47 | 87 Ų | 87 | 25% | 0.246 | 44% | 0.443 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -100 | -9.7 | -176.1 | -60.8 | -175.7 | 0 | 0 | 0 | 113.9 | L258 P260 T261 D265 M266 L271 I274 | L258-L263 HydrophobicContact CD1-CD2 4.24Å; L258-L263 HydrophobicContact CD2-CD1 3.94Å; L258-L263 HydrophobicContact CD2-CD2 3.99Å; L258-L263 HydrophobicContact CD2-CG 4.25Å; L258-L263 HydrophobicContact CG-CD1 4.35Å; L258-L263 HydrophobicContact CG-CD2 4.26Å; L258-L263 HydrophobicContact CG-CG 4.31Å; P260-L263 PolarHBondContact O-N 3.38Å; T261-L263 PolarHBondContact O-N 3.35Å; L263-D265 VanDerWaalsContact C-N 3.33Å; L263-D265 PolarHBondContact O-N 3.27Å; L263-M266 HydrophobicContact CD2-SD 3.43Å; L263-M266 WeakPolarHBondContact CD2-SD 3.47Å; L263-M266 WeakPolarHBondContact O-CB 3.23Å; L263-M266 PolarHBondContact O-N 2.89Å; L263-L271 HydrophobicContact CB-CD2 3.92Å; L263-L271 HydrophobicContact CD1-CD2 4.4Å; L263-L271 HydrophobicContact CD2-CD2 3.92Å; L263-L271 HydrophobicContact CG-CD2 4.3Å; L263-I274 HydrophobicContact CD2-CD1 3.78Å |
| 264 | R | 92.5 | Very high | 93.3 | Very high | 182 Ų | 182 | 86.8 Ų | 86.8 | 69% | 0.687 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.5 | -39.6 | -168.6 | -176.9 | 175.6 | -65.3 | 162.7 | 1.2 | 113.3 | P260 T261 M266 | P260-R264 PolarHBondContact O-N 3.33Å; T261-R264 PolarHBondContact O-N 3.05Å; R264-M266 VanDerWaalsContact C-N 3.35Å |
| 265 | D | 91.3 | Very high | 93.6 | Very high | 152 Ų | 152 | 84.7 Ų | 84.7 | 81% | 0.813 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.7 | 16.2 | -174 | -57 | -39.8 | 0 | 0 | 0 | 112.2 | L263 | L263-D265 VanDerWaalsContact C-N 3.33Å; L263-D265 PolarHBondContact O-N 3.27Å |
| 266 | M | 94.2 | Very high | 93.9 | Very high | 18 Ų | 18 | 82.3 Ų | 82.3 | 9% | 0.089 | 43% | 0.428 | C | S | . | . | trans | -89.5 | 143.1 | -179.5 | -62.8 | -169.4 | 67.4 | 0 | 0 | 112 | L243 I249 L263 R264 Q270 L271 I274 | L243-M266 HydrophobicContact CD1-CE 3.85Å; I249-M266 HydrophobicContact CD1-SD 4.47Å; L263-M266 HydrophobicContact CD2-SD 3.43Å; L263-M266 WeakPolarHBondContact CD2-SD 3.47Å; L263-M266 WeakPolarHBondContact O-CB 3.23Å; L263-M266 PolarHBondContact O-N 2.89Å; R264-M266 VanDerWaalsContact C-N 3.35Å; M266-Q270 HydrophobicContact CB-CB 4.48Å; M266-Q270 HydrophobicContact CE-CB 3.4Å; M266-Q270 HydrophobicContact CE-CG 4.4Å; M266-L271 HydrophobicContact CB-CD2 3.78Å; M266-L271 HydrophobicContact CB-CG 3.87Å; M266-L271 HydrophobicContact CG-CD2 4.43Å; M266-L271 HydrophobicContact SD-CD2 4.1Å; M266-I274 HydrophobicContact CE-CD1 3.45Å; M266-I274 VanDerWaalsContact CE-CD1 3.45Å; M266-I274 HydrophobicContact CE-CG1 4.49Å; M266-I274 HydrophobicContact SD-CD1 3.76Å | ||
| 267 | T | 95.8 | Very high | 94.1 | Very high | 82 Ų | 82 | 73.8 Ų | 73.8 | 50% | 0.503 | 40% | 0.397 | S | S | . | . | trans | -69.4 | 155.2 | 172 | 66.7 | 0 | 0 | 0 | 0 | 110.9 | G269 Q270 L271 | T267-G269 PolarHBondContact O-N 3.05Å; T267-Q270 PolarHBondContact O-N 2.89Å; T267-Q270 VanDerWaalsContact OG1-CD 3.32Å; T267-Q270 WeakPolarHBondContact OG1-CG 3.47Å; T267-Q270 PolarHBondContact OG1-N 3.45Å; T267-Q270 PolarHBondContact OG1-OE1 2.91Å; T267-L271 WeakPolarHBondContact O-CG 3.33Å; T267-L271 PolarHBondContact O-N 3.43Å | ||
| 268 | I | 96.6 | Very high | 94.3 | Very high | 144 Ų | 144 | 74.4 Ų | 74.4 | 74% | 0.738 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -53.7 | -39.8 | 175.9 | -61.4 | 171.3 | 0 | 0 | 0 | 111.1 | L271 Q272 | I268-L271 PolarHBondContact O-N 3.18Å; I268-Q272 WeakPolarHBondContact O-CB 3.35Å; I268-Q272 PolarHBondContact O-N 2.88Å |
| 269 | G | 96.4 | Very high | 94.5 | Very high | 46 Ų | 46 | 76.1 Ų | 76.1 | 47% | 0.474 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.6 | -44.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | T267 Q272 V273 | T267-G269 PolarHBondContact O-N 3.05Å; G269-Q272 WeakPolarHBondContact O-CB 3.37Å; G269-Q272 PolarHBondContact O-N 3.38Å; G269-V273 WeakPolarHBondContact O-CG2 3.29Å; G269-V273 PolarHBondContact O-N 2.8Å |
| 270 | Q | 95 | Very high | 94.6 | Very high | 56 Ų | 56 | 73.1 Ų | 73.1 | 26% | 0.262 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -68.9 | -39 | 178.4 | -62.6 | 164.2 | -49.3 | 0 | 0 | 111.9 | L243 M266 T267 Q272 V273 I274 | L243-Q270 HydrophobicContact CD1-CB 4.27Å; L243-Q270 HydrophobicContact CD2-CB 3.97Å; L243-Q270 HydrophobicContact CD2-CG 3.7Å; M266-Q270 HydrophobicContact CB-CB 4.48Å; M266-Q270 HydrophobicContact CE-CB 3.4Å; M266-Q270 HydrophobicContact CE-CG 4.4Å; T267-Q270 PolarHBondContact O-N 2.89Å; T267-Q270 VanDerWaalsContact OG1-CD 3.32Å; T267-Q270 WeakPolarHBondContact OG1-CG 3.47Å; T267-Q270 PolarHBondContact OG1-N 3.45Å; T267-Q270 PolarHBondContact OG1-OE1 2.91Å; Q270-Q272 VanDerWaalsContact C-N 3.3Å; Q270-Q272 PolarHBondContact O-N 2.86Å; Q270-V273 WeakPolarHBondContact O-CB 3.23Å; Q270-V273 PolarHBondContact O-N 3.45Å; Q270-I274 PolarHBondContact O-N 2.85Å; Q270-I274 VanDerWaalsContact O-N 3.15Å |
| 271 | L | 96.1 | Very high | 94.6 | Very high | 56 Ų | 56 | 70.6 Ų | 70.6 | 29% | 0.293 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -61.4 | -40.1 | 172.6 | -66.7 | 175.3 | 0 | 0 | 0 | 111.3 | L263 M266 T267 I268 V273 I274 V275 | L263-L271 HydrophobicContact CB-CD2 3.92Å; L263-L271 HydrophobicContact CD1-CD2 4.4Å; L263-L271 HydrophobicContact CD2-CD2 3.92Å; L263-L271 HydrophobicContact CG-CD2 4.3Å; M266-L271 HydrophobicContact CB-CD2 3.78Å; M266-L271 HydrophobicContact CB-CG 3.87Å; M266-L271 HydrophobicContact CG-CD2 4.43Å; M266-L271 HydrophobicContact SD-CD2 4.1Å; T267-L271 WeakPolarHBondContact O-CG 3.33Å; T267-L271 PolarHBondContact O-N 3.43Å; I268-L271 PolarHBondContact O-N 3.18Å; L271-V273 VanDerWaalsContact C-N 3.34Å; L271-V273 PolarHBondContact O-N 3.37Å; L271-I274 PolarHBondContact O-N 2.92Å; L271-V275 WeakPolarHBondContact O-CB 3.33Å; L271-V275 VanDerWaalsContact O-CG2 3.29Å; L271-V275 WeakPolarHBondContact O-CG2 3.38Å; L271-V275 PolarHBondContact O-N 3.22Å |
| 272 | Q | 97.1 | Very high | 94.7 | Very high | 96 Ų | 96 | 71.4 Ų | 71.4 | 45% | 0.449 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.5 | -38.5 | 176.2 | -171.7 | 64.8 | 51.7 | 0 | 0 | 112.2 | I268 G269 Q270 V275 N276 | I268-Q272 WeakPolarHBondContact O-CB 3.35Å; I268-Q272 PolarHBondContact O-N 2.88Å; G269-Q272 WeakPolarHBondContact O-CB 3.37Å; G269-Q272 PolarHBondContact O-N 3.38Å; Q270-Q272 VanDerWaalsContact C-N 3.3Å; Q270-Q272 PolarHBondContact O-N 2.86Å; Q272-V275 PolarHBondContact O-N 3.45Å; Q272-N276 PolarHBondContact NE2-OD1 2.92Å; Q272-N276 WeakPolarHBondContact O-CB 3.45Å; Q272-N276 PolarHBondContact O-N 2.66Å |
| 273 | V | 95.6 | Very high | 94.9 | Very high | 40 Ų | 40 | 74.5 Ų | 74.5 | 24% | 0.242 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -59.2 | -47.5 | 173.6 | 170.2 | 0 | 0 | 0 | 0 | 110.5 | V239 L242 L243 G269 Q270 L271 N276 D277 | V239-V273 HydrophobicContact CG2-CG1 4.4Å; L242-V273 HydrophobicContact CB-CG1 3.88Å; L242-V273 HydrophobicContact CD1-CG1 3.74Å; L242-V273 HydrophobicContact CG-CG1 4.49Å; L243-V273 HydrophobicContact CD1-CG1 4.46Å; L243-V273 HydrophobicContact CG-CG1 4.28Å; G269-V273 WeakPolarHBondContact O-CG2 3.29Å; G269-V273 PolarHBondContact O-N 2.8Å; Q270-V273 WeakPolarHBondContact O-CB 3.23Å; Q270-V273 PolarHBondContact O-N 3.45Å; L271-V273 VanDerWaalsContact C-N 3.34Å; L271-V273 PolarHBondContact O-N 3.37Å; V273-N276 PolarHBondContact O-N 3.11Å; V273-D277 WeakPolarHBondContact O-CB 3.42Å; V273-D277 PolarHBondContact O-N 3Å |
| 274 | I | 94.7 | Very high | 95 | Very high | 5 Ų | 5 | 75 Ų | 75 | 3% | 0.026 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.6 | -45.7 | 177.3 | -65.4 | 170 | 0 | 0 | 0 | 111.3 | V239 L243 I249 L253 L258 L263 M266 Q270 L271 N276 D277 L278 | V239-I274 HydrophobicContact CG1-CG1 4.36Å; L243-I274 HydrophobicContact CD1-CD1 4.22Å; L243-I274 HydrophobicContact CD1-CG1 4Å; I249-I274 HydrophobicContact CG2-CD1 3.7Å; I249-I274 HydrophobicContact CG2-CG1 4.34Å; L253-I274 HydrophobicContact CD1-CG1 4.47Å; L253-I274 HydrophobicContact CD1-CG2 4.27Å; L253-I274 HydrophobicContact CD2-CG2 3.98Å; L258-I274 HydrophobicContact CD2-CG2 4.29Å; L263-I274 HydrophobicContact CD2-CD1 3.78Å; M266-I274 HydrophobicContact CE-CD1 3.45Å; M266-I274 VanDerWaalsContact CE-CD1 3.45Å; M266-I274 HydrophobicContact CE-CG1 4.49Å; M266-I274 HydrophobicContact SD-CD1 3.76Å; Q270-I274 PolarHBondContact O-N 2.85Å; Q270-I274 VanDerWaalsContact O-N 3.15Å; L271-I274 PolarHBondContact O-N 2.92Å; I274-N276 VanDerWaalsContact C-N 3.34Å; I274-N276 PolarHBondContact O-N 3.18Å; I274-D277 PolarHBondContact O-N 3.07Å; I274-L278 HydrophobicContact CG2-CD1 3.94Å; I274-L278 HydrophobicContact CG2-CG 4.34Å; I274-L278 WeakPolarHBondContact O-CB 3.26Å; I274-L278 WeakPolarHBondContact O-CG 3.32Å; I274-L278 PolarHBondContact O-N 3.32Å |
| 275 | V | 95.7 | Very high | 95 | Very high | 59 Ų | 59 | 68.7 Ų | 68.7 | 36% | 0.358 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.4 | -42.5 | -179.9 | 167.4 | 0 | 0 | 0 | 0 | 111.3 | L271 Q272 L278 H279 | L271-V275 WeakPolarHBondContact O-CB 3.33Å; L271-V275 VanDerWaalsContact O-CG2 3.29Å; L271-V275 WeakPolarHBondContact O-CG2 3.38Å; L271-V275 PolarHBondContact O-N 3.22Å; Q272-V275 PolarHBondContact O-N 3.45Å; V275-L278 PolarHBondContact O-N 3.02Å; V275-H279 WeakPolarHBondContact CG1-CE1 3.47Å; V275-H279 VanDerWaalsContact O-CG 3.3Å; V275-H279 PolarHBondContact O-N 2.86Å; V275-H279 PolarHBondContact O-ND1 3.21Å; V275-H279 VanDerWaalsContact O-ND1 3.16Å |
| 276 | N | 95.9 | Very high | 95.3 | Very high | 82 Ų | 82 | 65.8 Ų | 65.8 | 44% | 0.439 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64.8 | -45.9 | 177.3 | -73.5 | -9.1 | 0 | 0 | 0 | 111.4 | Q272 V273 I274 L278 H279 S280 | Q272-N276 PolarHBondContact NE2-OD1 2.92Å; Q272-N276 WeakPolarHBondContact O-CB 3.45Å; Q272-N276 PolarHBondContact O-N 2.66Å; V273-N276 PolarHBondContact O-N 3.11Å; I274-N276 VanDerWaalsContact C-N 3.34Å; I274-N276 PolarHBondContact O-N 3.18Å; N276-L278 PolarHBondContact O-N 2.9Å; N276-H279 PolarHBondContact O-N 3.34Å; N276-S280 PolarHBondContact O-N 2.91Å; N276-S280 PolarHBondContact O-OG 3.38Å |
| 277 | D | 93 | Very high | 95.5 | Very high | 15 Ų | 15 | 70.1 Ų | 70.1 | 8% | 0.08 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -59.4 | -45.2 | 176.4 | -177 | 71.7 | 0 | 0 | 0 | 112 | S237 P238 V239 V273 I274 H279 S280 Q281 | S237-D277 VanDerWaalsContact OG-CG 3.3Å; S237-D277 PolarHBondContact OG-OD1 3.49Å; S237-D277 PolarHBondContact OG-OD2 2.97Å; P238-D277 VanDerWaalsContact CD-OD1 3.27Å; P238-D277 WeakPolarHBondContact CD-OD1 3.44Å; V239-D277 HydrophobicContact CG2-CB 3.39Å; V239-D277 WeakPolarHBondContact CG2-OD2 3.41Å; V273-D277 WeakPolarHBondContact O-CB 3.42Å; V273-D277 PolarHBondContact O-N 3Å; I274-D277 PolarHBondContact O-N 3.07Å; D277-H279 PolarHBondContact O-N 2.97Å; D277-S280 PolarHBondContact O-N 3.34Å; D277-Q281 WeakPolarHBondContact O-CB 3.38Å; D277-Q281 WeakPolarHBondContact O-CG 3.45Å; D277-Q281 PolarHBondContact O-N 3.36Å; D277-Q281 PolarHBondContact OD2-NE2 3.48Å |
| 278 | L | 94.2 | Very high | 95.5 | Very high | 65 Ų | 65 | 70.5 Ų | 70.5 | 34% | 0.34 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.2 | -43 | 176.3 | -75.5 | 175.4 | 0 | 0 | 0 | 112.3 | L253 I274 V275 N276 Q281 I282 | L253-L278 HydrophobicContact CD2-CD1 4.21Å; L253-L278 HydrophobicContact CD2-CD2 3.78Å; L253-L278 HydrophobicContact CD2-CG 4.08Å; I274-L278 HydrophobicContact CG2-CD1 3.94Å; I274-L278 HydrophobicContact CG2-CG 4.34Å; I274-L278 WeakPolarHBondContact O-CB 3.26Å; I274-L278 WeakPolarHBondContact O-CG 3.32Å; I274-L278 PolarHBondContact O-N 3.32Å; V275-L278 PolarHBondContact O-N 3.02Å; N276-L278 PolarHBondContact O-N 2.9Å; L278-Q281 PolarHBondContact O-N 3.44Å; L278-I282 WeakPolarHBondContact O-CB 3.41Å; L278-I282 WeakPolarHBondContact O-CD1 3.29Å; L278-I282 WeakPolarHBondContact O-CG1 3.23Å; L278-I282 PolarHBondContact O-N 3.49Å |
| 279 | H | 96.2 | Very high | 95.6 | Very high | 82 Ų | 82 | 68 Ų | 68 | 38% | 0.38 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 175.3 | -71.2 | 143.2 | 0 | 0 | 0 | 111.6 | V275 N276 D277 I282 E283 | V275-H279 WeakPolarHBondContact CG1-CE1 3.47Å; V275-H279 VanDerWaalsContact O-CG 3.3Å; V275-H279 PolarHBondContact O-N 2.86Å; V275-H279 PolarHBondContact O-ND1 3.21Å; V275-H279 VanDerWaalsContact O-ND1 3.16Å; N276-H279 PolarHBondContact O-N 3.34Å; D277-H279 PolarHBondContact O-N 2.97Å; H279-I282 PolarHBondContact O-N 3.45Å; H279-E283 PolarHBondContact O-N 2.88Å |
| 280 | S | 94.3 | Very high | 95.7 | Very high | 68 Ų | 68 | 69.9 Ų | 69.9 | 48% | 0.476 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -66 | -37.2 | 176.6 | -64.3 | 0 | 0 | 0 | 0 | 113 | N276 D277 E283 S284 | N276-S280 PolarHBondContact O-N 2.91Å; N276-S280 PolarHBondContact O-OG 3.38Å; D277-S280 PolarHBondContact O-N 3.34Å; S280-E283 PolarHBondContact O-N 3.38Å; S280-S284 WeakPolarHBondContact O-CB 3.34Å; S280-S284 PolarHBondContact O-N 2.97Å; S280-S284 PolarHBondContact O-OG 2.77Å |
| 281 | Q | 93.7 | Very high | 95.9 | Very high | 58 Ų | 58 | 72.7 Ų | 72.7 | 27% | 0.271 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.8 | -40.9 | 172.8 | -76.1 | -172 | 69.4 | 0 | 0 | 111.8 | D277 L278 S284 L285 | D277-Q281 WeakPolarHBondContact O-CB 3.38Å; D277-Q281 WeakPolarHBondContact O-CG 3.45Å; D277-Q281 PolarHBondContact O-N 3.36Å; D277-Q281 PolarHBondContact OD2-NE2 3.48Å; L278-Q281 PolarHBondContact O-N 3.44Å; Q281-S284 WeakPolarHBondContact CA-OG 3.4Å; Q281-S284 PolarHBondContact O-OG 3.26Å; Q281-L285 VanDerWaalsContact O-CB 3.25Å; Q281-L285 WeakPolarHBondContact O-CB 3.47Å; Q281-L285 WeakPolarHBondContact O-CD1 3.35Å; Q281-L285 WeakPolarHBondContact O-CG 3.41Å; Q281-L285 PolarHBondContact O-N 3.12Å |
| 282 | I | 94.9 | Very high | 95.9 | Very high | 93 Ų | 93 | 74.7 Ų | 74.7 | 48% | 0.477 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.8 | -47.1 | 176.3 | -70.9 | 163.5 | 0 | 0 | 0 | 110.4 | L278 H279 N286 | L278-I282 WeakPolarHBondContact O-CB 3.41Å; L278-I282 WeakPolarHBondContact O-CD1 3.29Å; L278-I282 WeakPolarHBondContact O-CG1 3.23Å; L278-I282 PolarHBondContact O-N 3.49Å; H279-I282 PolarHBondContact O-N 3.45Å; I282-N286 WeakPolarHBondContact O-CB 3.49Å; I282-N286 PolarHBondContact O-N 3.45Å; I282-N286 PolarHBondContact O-ND2 3.27Å |
| 283 | E | 96.6 | Very high | 96 | Very high | 119 Ų | 119 | 73.3 Ų | 73.3 | 56% | 0.556 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -59.6 | -53.9 | 178.6 | -175.7 | 171.4 | -154.2 | 0 | 0 | 111.2 | H279 S280 L285 N286 E287 | H279-E283 PolarHBondContact O-N 2.88Å; S280-E283 PolarHBondContact O-N 3.38Å; E283-L285 PolarHBondContact O-N 2.98Å; E283-N286 PolarHBondContact O-N 3Å; E283-E287 WeakPolarHBondContact O-CG 3.45Å; E283-E287 PolarHBondContact O-N 3.47Å |
| 284 | S | 94.7 | Very high | 96.1 | Very high | 58 Ų | 58 | 76 Ų | 76 | 41% | 0.406 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62 | -41 | 179.9 | 53.5 | 0 | 0 | 0 | 0 | 113.8 | S280 Q281 N286 E287 E288 | S280-S284 WeakPolarHBondContact O-CB 3.34Å; S280-S284 PolarHBondContact O-N 2.97Å; S280-S284 PolarHBondContact O-OG 2.77Å; Q281-S284 WeakPolarHBondContact CA-OG 3.4Å; Q281-S284 PolarHBondContact O-OG 3.26Å; S284-N286 VanDerWaalsContact C-N 3.33Å; S284-N286 PolarHBondContact O-N 3.44Å; S284-E287 PolarHBondContact O-N 2.92Å; S284-E288 WeakPolarHBondContact O-CB 3.39Å; S284-E288 PolarHBondContact O-N 3.37Å |
| 285 | L | 94 | Very high | 96.3 | Very high | 49 Ų | 49 | 79.7 Ų | 79.7 | 26% | 0.257 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -67.4 | -34.4 | 176.6 | -73.6 | 171 | 0 | 0 | 0 | 112.3 | Q281 E283 L289 | Q281-L285 VanDerWaalsContact O-CB 3.25Å; Q281-L285 WeakPolarHBondContact O-CB 3.47Å; Q281-L285 WeakPolarHBondContact O-CD1 3.35Å; Q281-L285 WeakPolarHBondContact O-CG 3.41Å; Q281-L285 PolarHBondContact O-N 3.12Å; E283-L285 PolarHBondContact O-N 2.98Å; L285-L289 VanDerWaalsContact O-CB 3.27Å; L285-L289 WeakPolarHBondContact O-CB 3.47Å; L285-L289 PolarHBondContact O-N 3.05Å |
| 286 | N | 97.6 | Very high | 96.4 | Very high | 91 Ų | 91 | 82.3 Ų | 82.3 | 49% | 0.487 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -70.5 | -40.1 | 176.1 | -73.2 | -20.2 | 0 | 0 | 0 | 111.3 | I282 E283 S284 L289 V290 | I282-N286 WeakPolarHBondContact O-CB 3.49Å; I282-N286 PolarHBondContact O-N 3.45Å; I282-N286 PolarHBondContact O-ND2 3.27Å; E283-N286 PolarHBondContact O-N 3Å; S284-N286 VanDerWaalsContact C-N 3.33Å; S284-N286 PolarHBondContact O-N 3.44Å; N286-L289 PolarHBondContact O-N 2.92Å; N286-V290 WeakPolarHBondContact O-CG2 3.45Å; N286-V290 PolarHBondContact O-N 3.18Å |
| 287 | E | 97.7 | Very high | 96.5 | Very high | 108 Ų | 108 | 81.9 Ų | 81.9 | 51% | 0.505 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.1 | -46.7 | 173.3 | -72.1 | 178.6 | 177 | 0 | 0 | 111.7 | E283 S284 L289 V290 Q291 | E283-E287 WeakPolarHBondContact O-CG 3.45Å; E283-E287 PolarHBondContact O-N 3.47Å; S284-E287 PolarHBondContact O-N 2.92Å; E287-L289 VanDerWaalsContact C-N 3.35Å; E287-L289 PolarHBondContact O-N 3.45Å; E287-V290 PolarHBondContact O-N 3.46Å; E287-Q291 WeakPolarHBondContact O-CG 3.4Å; E287-Q291 PolarHBondContact O-N 3.49Å |
| 288 | E | 96.1 | Very high | 96.7 | Very high | 91 Ų | 91 | 87.4 Ų | 87.4 | 43% | 0.425 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -59.6 | -44.9 | 175.6 | -175.7 | -178.1 | 176.6 | 0 | 0 | 111.2 | S284 V290 Q291 L292 | S284-E288 WeakPolarHBondContact O-CB 3.39Å; S284-E288 PolarHBondContact O-N 3.37Å; E288-V290 VanDerWaalsContact C-N 3.35Å; E288-V290 PolarHBondContact O-N 3.47Å; E288-Q291 PolarHBondContact O-N 2.96Å; E288-L292 HydrophobicContact CG-CD1 4.02Å; E288-L292 HydrophobicContact CG-CG 4.43Å; E288-L292 WeakPolarHBondContact O-CB 3.41Å; E288-L292 WeakPolarHBondContact O-CG 3.28Å; E288-L292 PolarHBondContact O-N 3.39Å |
| 289 | L | 98 | Very high | 96.9 | Very high | 92 Ų | 92 | 89 Ų | 89 | 48% | 0.482 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -58.6 | -45.9 | 176.6 | 176.4 | 62.6 | 0 | 0 | 0 | 111.6 | L285 N286 E287 Q291 L292 L293 | L285-L289 VanDerWaalsContact O-CB 3.27Å; L285-L289 WeakPolarHBondContact O-CB 3.47Å; L285-L289 PolarHBondContact O-N 3.05Å; N286-L289 PolarHBondContact O-N 2.92Å; E287-L289 VanDerWaalsContact C-N 3.35Å; E287-L289 PolarHBondContact O-N 3.45Å; L289-Q291 VanDerWaalsContact C-N 3.35Å; L289-Q291 PolarHBondContact O-N 2.91Å; L289-L292 PolarHBondContact O-N 3.12Å; L289-L293 HydrophobicContact CD1-CD1 4.08Å; L289-L293 HydrophobicContact CD1-CG 4.11Å; L289-L293 HydrophobicContact CG-CD1 3.99Å; L289-L293 HydrophobicContact CG-CG 4.43Å; L289-L293 WeakPolarHBondContact O-CB 3.44Å; L289-L293 VanDerWaalsContact O-CG 3.22Å; L289-L293 WeakPolarHBondContact O-CG 3.26Å; L289-L293 PolarHBondContact O-N 3.44Å |
| 290 | V | 98.6 | Very high | 97 | Very high | 84 Ų | 84 | 89.6 Ų | 89.6 | 51% | 0.509 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.4 | -45 | 177.9 | 170.3 | 0 | 0 | 0 | 0 | 110.8 | N286 E287 E288 L293 L294 | N286-V290 WeakPolarHBondContact O-CG2 3.45Å; N286-V290 PolarHBondContact O-N 3.18Å; E287-V290 PolarHBondContact O-N 3.46Å; E288-V290 VanDerWaalsContact C-N 3.35Å; E288-V290 PolarHBondContact O-N 3.47Å; V290-L293 PolarHBondContact O-N 3.33Å; V290-L294 HydrophobicContact CG1-CD1 4.22Å; V290-L294 WeakPolarHBondContact O-CG 3.45Å; V290-L294 PolarHBondContact O-N 3.47Å |
| 291 | Q | 98.4 | Very high | 97.2 | Very high | 116 Ų | 116 | 91 Ų | 91 | 54% | 0.542 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.1 | -45.9 | 177.5 | -69.7 | 172.2 | 33.5 | 0 | 0 | 111.9 | E287 E288 L289 L293 L294 I295 | E287-Q291 WeakPolarHBondContact O-CG 3.4Å; E287-Q291 PolarHBondContact O-N 3.49Å; E288-Q291 PolarHBondContact O-N 2.96Å; L289-Q291 VanDerWaalsContact C-N 3.35Å; L289-Q291 PolarHBondContact O-N 2.91Å; Q291-L293 VanDerWaalsContact C-N 3.32Å; Q291-L293 PolarHBondContact O-N 2.98Å; Q291-L294 PolarHBondContact O-N 3.42Å; Q291-I295 WeakPolarHBondContact O-CG1 3.31Å; Q291-I295 PolarHBondContact O-N 2.96Å |
| 292 | L | 97.4 | Very high | 97.4 | Very high | 98 Ų | 98 | 93.9 Ų | 93.9 | 51% | 0.513 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.1 | -36 | 177.9 | -71.1 | 173.3 | 0 | 0 | 0 | 112.4 | E288 L289 R296 | E288-L292 HydrophobicContact CG-CD1 4.02Å; E288-L292 HydrophobicContact CG-CG 4.43Å; E288-L292 WeakPolarHBondContact O-CB 3.41Å; E288-L292 WeakPolarHBondContact O-CG 3.28Å; E288-L292 PolarHBondContact O-N 3.39Å; L289-L292 PolarHBondContact O-N 3.12Å; L292-R296 WeakPolarHBondContact O-CB 3.41Å; L292-R296 PolarHBondContact O-N 2.88Å |
| 293 | L | 98.5 | Very high | 97.5 | Very high | 67 Ų | 67 | 94.4 Ų | 94.4 | 35% | 0.351 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -67.3 | -40.5 | 175.1 | -72.2 | 172.2 | 0 | 0 | 0 | 112.1 | L289 V290 Q291 R296 D297 | L289-L293 HydrophobicContact CD1-CD1 4.08Å; L289-L293 HydrophobicContact CD1-CG 4.11Å; L289-L293 HydrophobicContact CG-CD1 3.99Å; L289-L293 HydrophobicContact CG-CG 4.43Å; L289-L293 WeakPolarHBondContact O-CB 3.44Å; L289-L293 VanDerWaalsContact O-CG 3.22Å; L289-L293 WeakPolarHBondContact O-CG 3.26Å; L289-L293 PolarHBondContact O-N 3.44Å; V290-L293 PolarHBondContact O-N 3.33Å; Q291-L293 VanDerWaalsContact C-N 3.32Å; Q291-L293 PolarHBondContact O-N 2.98Å; L293-R296 WeakPolarHBondContact O-CB 3.43Å; L293-R296 PolarHBondContact O-N 3.4Å; L293-D297 VanDerWaalsContact O-CG 3.23Å; L293-D297 PolarHBondContact O-N 2.9Å |
| 294 | L | 98.5 | Very high | 97.6 | Very high | 97 Ų | 97 | 93.5 Ų | 93.5 | 51% | 0.508 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63 | -47.7 | 174.9 | -70.3 | 172 | 0 | 0 | 0 | 111.3 | V290 Q291 R296 D297 E298 | V290-L294 HydrophobicContact CG1-CD1 4.22Å; V290-L294 WeakPolarHBondContact O-CG 3.45Å; V290-L294 PolarHBondContact O-N 3.47Å; Q291-L294 PolarHBondContact O-N 3.42Å; L294-R296 VanDerWaalsContact C-N 3.29Å; L294-R296 PolarHBondContact O-N 2.92Å; L294-D297 PolarHBondContact O-N 2.92Å; L294-D297 VanDerWaalsContact O-N 3.12Å; L294-E298 WeakPolarHBondContact O-CG 3.25Å; L294-E298 PolarHBondContact O-N 3.45Å |
| 295 | I | 98.2 | Very high | 97.7 | Very high | 81 Ų | 81 | 93.3 Ų | 93.3 | 42% | 0.415 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.3 | -41.5 | 176.7 | -67.6 | 165.2 | 0 | 0 | 0 | 110.7 | Q291 D297 E298 L299 | Q291-I295 WeakPolarHBondContact O-CG1 3.31Å; Q291-I295 PolarHBondContact O-N 2.96Å; I295-D297 VanDerWaalsContact C-N 3.33Å; I295-D297 PolarHBondContact O-N 3.42Å; I295-E298 PolarHBondContact O-N 2.9Å; I295-L299 HydrophobicContact CG2-CD1 3.76Å; I295-L299 HydrophobicContact CG2-CG 4.19Å; I295-L299 WeakPolarHBondContact O-CB 3.21Å; I295-L299 VanDerWaalsContact O-CG 3.26Å; I295-L299 WeakPolarHBondContact O-CG 3.34Å; I295-L299 PolarHBondContact O-N 3.34Å |
| 296 | R | 97.6 | Very high | 97.9 | Very high | 115 Ų | 115 | 95.9 Ų | 95.9 | 43% | 0.434 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.9 | -46.9 | 174.9 | 179 | -155.8 | 65.9 | -179.1 | -4 | 111 | L292 L293 L294 L299 H300 | L292-R296 WeakPolarHBondContact O-CB 3.41Å; L292-R296 PolarHBondContact O-N 2.88Å; L293-R296 WeakPolarHBondContact O-CB 3.43Å; L293-R296 PolarHBondContact O-N 3.4Å; L294-R296 VanDerWaalsContact C-N 3.29Å; L294-R296 PolarHBondContact O-N 2.92Å; R296-L299 PolarHBondContact O-N 2.68Å; R296-H300 WeakPolarHBondContact O-CB 3.36Å; R296-H300 PolarHBondContact O-CD2 3.49Å; R296-H300 VanDerWaalsContact O-CD2 3.25Å; R296-H300 VanDerWaalsContact O-CG 3.25Å; R296-H300 PolarHBondContact O-N 3.16Å |
| 297 | D | 97.9 | Very high | 97.9 | Very high | 73 Ų | 73 | 96.1 Ų | 96.1 | 39% | 0.39 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.8 | -37 | -178 | -66.1 | -9 | 0 | 0 | 0 | 111.8 | L293 L294 I295 T301 | L293-D297 VanDerWaalsContact O-CG 3.23Å; L293-D297 PolarHBondContact O-N 2.9Å; L294-D297 PolarHBondContact O-N 2.92Å; L294-D297 VanDerWaalsContact O-N 3.12Å; I295-D297 VanDerWaalsContact C-N 3.33Å; I295-D297 PolarHBondContact O-N 3.42Å; D297-T301 WeakPolarHBondContact O-CB 3.41Å; D297-T301 PolarHBondContact O-N 3.27Å; D297-T301 PolarHBondContact O-OG1 3.19Å |
| 298 | E | 98.2 | Very high | 97.9 | Very high | 130 Ų | 130 | 94.5 Ų | 94.5 | 61% | 0.607 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -62.4 | -49.1 | 171.8 | -72.5 | 171.8 | -170.9 | 0 | 0 | 111.5 | L294 I295 H300 T301 E302 | L294-E298 WeakPolarHBondContact O-CG 3.25Å; L294-E298 PolarHBondContact O-N 3.45Å; I295-E298 PolarHBondContact O-N 2.9Å; E298-H300 VanDerWaalsContact C-N 3.34Å; E298-H300 PolarHBondContact O-N 3.03Å; E298-T301 WeakPolarHBondContact O-CB 3.22Å; E298-T301 PolarHBondContact O-N 3.39Å; E298-E302 PolarHBondContact O-N 3.45Å |
| 299 | L | 98.1 | Very high | 98 | Very high | 98 Ų | 98 | 94.8 Ų | 94.8 | 51% | 0.513 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.2 | -35.6 | 178.3 | -71.5 | 172.9 | 0 | 0 | 0 | 112.6 | I295 R296 E302 Q303 | I295-L299 HydrophobicContact CG2-CD1 3.76Å; I295-L299 HydrophobicContact CG2-CG 4.19Å; I295-L299 WeakPolarHBondContact O-CB 3.21Å; I295-L299 VanDerWaalsContact O-CG 3.26Å; I295-L299 WeakPolarHBondContact O-CG 3.34Å; I295-L299 PolarHBondContact O-N 3.34Å; R296-L299 PolarHBondContact O-N 2.68Å; L299-E302 PolarHBondContact O-N 2.9Å; L299-Q303 WeakPolarHBondContact O-CB 3.47Å; L299-Q303 PolarHBondContact O-N 2.89Å |
| 300 | H | 98.1 | Very high | 97.8 | Very high | 96 Ų | 96 | 94.6 Ų | 94.6 | 44% | 0.444 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65 | -42.4 | 172.9 | -76.6 | -165.1 | 0 | 0 | 0 | 111.1 | R296 E298 E302 Q303 D304 | R296-H300 WeakPolarHBondContact O-CB 3.36Å; R296-H300 PolarHBondContact O-CD2 3.49Å; R296-H300 VanDerWaalsContact O-CD2 3.25Å; R296-H300 VanDerWaalsContact O-CG 3.25Å; R296-H300 PolarHBondContact O-N 3.16Å; E298-H300 VanDerWaalsContact C-N 3.34Å; E298-H300 PolarHBondContact O-N 3.03Å; H300-E302 VanDerWaalsContact C-N 3.33Å; H300-E302 PolarHBondContact O-N 3.43Å; H300-Q303 WeakPolarHBondContact O-CB 3.34Å; H300-Q303 PolarHBondContact O-N 3.29Å; H300-D304 PolarHBondContact O-N 2.66Å |
| 301 | T | 98.3 | Very high | 97.6 | Very high | 98 Ų | 98 | 95.5 Ų | 95.5 | 60% | 0.601 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.5 | -40.9 | 176.2 | -55.1 | 0 | 0 | 0 | 0 | 111.3 | D297 E298 D304 A305 | D297-T301 WeakPolarHBondContact O-CB 3.41Å; D297-T301 PolarHBondContact O-N 3.27Å; D297-T301 PolarHBondContact O-OG1 3.19Å; E298-T301 WeakPolarHBondContact O-CB 3.22Å; E298-T301 PolarHBondContact O-N 3.39Å; T301-D304 PolarHBondContact O-N 3.41Å; T301-A305 PolarHBondContact O-N 3.04Å |
| 302 | E | 98.2 | Very high | 97.5 | Very high | 118 Ų | 118 | 93.7 Ų | 93.7 | 55% | 0.551 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -65.4 | -40.8 | 174.8 | -175.5 | 175.3 | -170.4 | 0 | 0 | 111.9 | E298 L299 H300 A305 M306 | E298-E302 PolarHBondContact O-N 3.45Å; L299-E302 PolarHBondContact O-N 2.9Å; H300-E302 VanDerWaalsContact C-N 3.33Å; H300-E302 PolarHBondContact O-N 3.43Å; E302-A305 PolarHBondContact O-N 2.89Å; E302-M306 WeakPolarHBondContact O-CB 3.49Å; E302-M306 PolarHBondContact O-N 3.33Å |
| 303 | Q | 97.4 | Very high | 97.3 | Very high | 104 Ų | 104 | 94.8 Ų | 94.8 | 49% | 0.486 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.7 | -47.7 | 174 | 177.2 | 179.6 | 47.3 | 0 | 0 | 111.3 | L299 H300 A305 M306 L307 | L299-Q303 WeakPolarHBondContact O-CB 3.47Å; L299-Q303 PolarHBondContact O-N 2.89Å; H300-Q303 WeakPolarHBondContact O-CB 3.34Å; H300-Q303 PolarHBondContact O-N 3.29Å; Q303-A305 VanDerWaalsContact C-N 3.33Å; Q303-A305 PolarHBondContact O-N 2.92Å; Q303-M306 PolarHBondContact O-N 2.85Å; Q303-L307 HydrophobicContact CG-CD1 4.2Å; Q303-L307 HydrophobicContact CG-CG 4.43Å; Q303-L307 WeakPolarHBondContact O-CG 3.5Å; Q303-L307 PolarHBondContact O-N 2.94Å |
| 304 | D | 97.8 | Very high | 97 | Very high | 99 Ų | 99 | 93.7 Ų | 93.7 | 53% | 0.529 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.1 | -43.2 | 179 | -74.5 | -18.4 | 0 | 0 | 0 | 111.2 | H300 T301 M306 L307 V308 | H300-D304 PolarHBondContact O-N 2.66Å; T301-D304 PolarHBondContact O-N 3.41Å; D304-M306 PolarHBondContact O-N 2.87Å; D304-L307 PolarHBondContact O-N 3.49Å; D304-V308 WeakPolarHBondContact O-CG2 3.4Å; D304-V308 PolarHBondContact O-N 2.95Å; D304-V308 VanDerWaalsContact O-N 3.12Å |
| 305 | A | 98.2 | Very high | 96.7 | Very high | 54 Ų | 54 | 93.9 Ų | 93.9 | 45% | 0.446 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.6 | -45 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | T301 E302 Q303 L307 V308 D309 | T301-A305 PolarHBondContact O-N 3.04Å; E302-A305 PolarHBondContact O-N 2.89Å; Q303-A305 VanDerWaalsContact C-N 3.33Å; Q303-A305 PolarHBondContact O-N 2.92Å; A305-L307 VanDerWaalsContact C-N 3.35Å; A305-L307 PolarHBondContact O-N 2.78Å; A305-V308 PolarHBondContact O-N 2.94Å; A305-D309 PolarHBondContact O-N 3.25Å |
| 306 | M | 97.9 | Very high | 96.4 | Very high | 103 Ų | 103 | 95.4 Ų | 95.4 | 51% | 0.507 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.1 | -38 | 178.2 | -172.6 | -175.4 | -59.2 | 0 | 0 | 112.3 | E302 Q303 D304 V308 D309 I310 | E302-M306 WeakPolarHBondContact O-CB 3.49Å; E302-M306 PolarHBondContact O-N 3.33Å; Q303-M306 PolarHBondContact O-N 2.85Å; D304-M306 PolarHBondContact O-N 2.87Å; M306-V308 VanDerWaalsContact C-N 3.34Å; M306-D309 PolarHBondContact O-N 2.88Å; M306-I310 HydrophobicContact CG-CD1 4.04Å; M306-I310 VanDerWaalsContact O-CG1 3.25Å; M306-I310 WeakPolarHBondContact O-CG1 3.47Å; M306-I310 PolarHBondContact O-N 3.39Å |
| 307 | L | 97.2 | Very high | 96 | Very high | 96 Ų | 96 | 90.8 Ų | 90.8 | 50% | 0.503 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.9 | -38.8 | 176.4 | -72.7 | 176.2 | 0 | 0 | 0 | 111.7 | Q303 D304 A305 I310 E311 | Q303-L307 HydrophobicContact CG-CD1 4.2Å; Q303-L307 HydrophobicContact CG-CG 4.43Å; Q303-L307 WeakPolarHBondContact O-CG 3.5Å; Q303-L307 PolarHBondContact O-N 2.94Å; D304-L307 PolarHBondContact O-N 3.49Å; A305-L307 VanDerWaalsContact C-N 3.35Å; A305-L307 PolarHBondContact O-N 2.78Å; L307-I310 PolarHBondContact O-N 3.42Å; L307-E311 WeakPolarHBondContact O-CB 3.21Å; L307-E311 PolarHBondContact O-N 3.32Å |
| 308 | V | 98.2 | Very high | 95.6 | Very high | 74 Ų | 74 | 92.5 Ų | 92.5 | 45% | 0.448 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.3 | -47 | 173.2 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | D304 A305 M306 I310 E311 D312 | D304-V308 WeakPolarHBondContact O-CG2 3.4Å; D304-V308 PolarHBondContact O-N 2.95Å; D304-V308 VanDerWaalsContact O-N 3.12Å; A305-V308 PolarHBondContact O-N 2.94Å; M306-V308 VanDerWaalsContact C-N 3.34Å; V308-I310 VanDerWaalsContact C-N 3.35Å; V308-I310 PolarHBondContact O-N 2.94Å; V308-E311 WeakPolarHBondContact O-CB 3.49Å; V308-E311 PolarHBondContact O-N 3Å; V308-E311 VanDerWaalsContact O-N 3.16Å; V308-D312 PolarHBondContact O-N 3.42Å |
| 309 | D | 97.2 | Very high | 95.2 | Very high | 98 Ų | 98 | 90 Ų | 90 | 52% | 0.524 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.2 | -43.8 | 177.7 | -73.1 | -21.2 | 0 | 0 | 0 | 111.9 | A305 M306 E311 D312 L313 | A305-D309 PolarHBondContact O-N 3.25Å; M306-D309 PolarHBondContact O-N 2.88Å; D309-E311 VanDerWaalsContact C-N 3.31Å; D309-E311 PolarHBondContact O-N 2.92Å; D309-D312 PolarHBondContact O-N 3.37Å; D309-L313 WeakPolarHBondContact O-CB 3.46Å; D309-L313 WeakPolarHBondContact O-CG 2.87Å; D309-L313 PolarHBondContact O-N 3.48Å |
| 310 | I | 94 | Very high | 94.7 | Very high | 88 Ų | 88 | 89.8 Ų | 89.8 | 45% | 0.451 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -61.1 | -43.1 | 176.4 | -70.5 | 165.7 | 0 | 0 | 0 | 110.5 | M306 L307 V308 T314 | M306-I310 HydrophobicContact CG-CD1 4.04Å; M306-I310 VanDerWaalsContact O-CG1 3.25Å; M306-I310 WeakPolarHBondContact O-CG1 3.47Å; M306-I310 PolarHBondContact O-N 3.39Å; L307-I310 PolarHBondContact O-N 3.42Å; V308-I310 VanDerWaalsContact C-N 3.35Å; V308-I310 PolarHBondContact O-N 2.94Å; I310-T314 VanDerWaalsContact O-CB 3.22Å; I310-T314 WeakPolarHBondContact O-CB 3.33Å; I310-T314 PolarHBondContact O-N 2.81Å; I310-T314 PolarHBondContact O-OG1 2.64Å |
| 311 | E | 94.9 | Very high | 94 | Very high | 102 Ų | 102 | 89.4 Ų | 89.4 | 48% | 0.477 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.5 | -45 | 179.4 | -158.4 | -165.8 | -173.6 | 0 | 0 | 111.4 | L307 V308 D309 T314 R315 | L307-E311 WeakPolarHBondContact O-CB 3.21Å; L307-E311 PolarHBondContact O-N 3.32Å; V308-E311 WeakPolarHBondContact O-CB 3.49Å; V308-E311 PolarHBondContact O-N 3Å; V308-E311 VanDerWaalsContact O-N 3.16Å; D309-E311 VanDerWaalsContact C-N 3.31Å; D309-E311 PolarHBondContact O-N 2.92Å; E311-T314 PolarHBondContact O-N 3.15Å; E311-R315 VanDerWaalsContact CD-CZ 3.49Å; E311-R315 VanDerWaalsContact CG-NH1 3.3Å; E311-R315 WeakPolarHBondContact O-CB 3.32Å; E311-R315 WeakPolarHBondContact O-CG 3.36Å; E311-R315 PolarHBondContact O-N 3.38Å; E311-R315 IonicContact OE1-CZ 3.49Å; E311-R315 IonicContact OE1-NH1 2.8Å; E311-R315 PolarHBondContact OE1-NH1 2.88Å; E311-R315 IonicContact OE2-CZ 2.77Å; E311-R315 IonicContact OE2-NH1 2.66Å; E311-R315 PolarHBondContact OE2-NH1 3.43Å; E311-R315 IonicContact OE2-NH2 3.44Å; E311-R315 PolarHBondContact OE2-NH2 3.04Å |
| 312 | D | 95.9 | Very high | 93.4 | Very high | 78 Ų | 78 | 91.2 Ų | 91.2 | 42% | 0.417 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.9 | -46.8 | 176.9 | -83.5 | -21.5 | 0 | 0 | 0 | 112.4 | V308 D309 T314 R315 H316 | V308-D312 PolarHBondContact O-N 3.42Å; D309-D312 PolarHBondContact O-N 3.37Å; D312-T314 VanDerWaalsContact C-N 3.33Å; D312-T314 PolarHBondContact O-N 2.82Å; D312-R315 PolarHBondContact O-N 3.06Å; D312-R315 IonicContact OD1-CZ 2.87Å; D312-R315 IonicContact OD1-NE 2.97Å; D312-R315 PolarHBondContact OD1-NE 2.88Å; D312-R315 IonicContact OD1-NH2 3.37Å; D312-R315 PolarHBondContact OD1-NH2 2.88Å; D312-H316 VanDerWaalsContact O-CB 3.27Å; D312-H316 WeakPolarHBondContact O-CB 3.36Å; D312-H316 PolarHBondContact O-N 2.69Å |
| 313 | L | 93.7 | Very high | 92.7 | Very high | 121 Ų | 121 | 90.4 Ų | 90.4 | 63% | 0.634 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -63.6 | -40.6 | 177.1 | -71 | 173.3 | 0 | 0 | 0 | 111.5 | D309 H316 A317 | D309-L313 WeakPolarHBondContact O-CB 3.46Å; D309-L313 WeakPolarHBondContact O-CG 2.87Å; D309-L313 PolarHBondContact O-N 3.48Å; L313-H316 PolarHBondContact O-N 3.04Å; L313-A317 WeakPolarHBondContact O-CB 3.27Å; L313-A317 PolarHBondContact O-N 2.8Å |
| 314 | T | 90.8 | Very high | 91.9 | Very high | 45 Ų | 45 | 91.4 Ų | 91.4 | 28% | 0.276 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.6 | -49 | 177.5 | -58.5 | 0 | 0 | 0 | 0 | 110.7 | I310 E311 D312 H316 A317 E318 | I310-T314 VanDerWaalsContact O-CB 3.22Å; I310-T314 WeakPolarHBondContact O-CB 3.33Å; I310-T314 PolarHBondContact O-N 2.81Å; I310-T314 PolarHBondContact O-OG1 2.64Å; E311-T314 PolarHBondContact O-N 3.15Å; D312-T314 VanDerWaalsContact C-N 3.33Å; D312-T314 PolarHBondContact O-N 2.82Å; T314-H316 VanDerWaalsContact C-N 3.31Å; T314-H316 PolarHBondContact O-N 3.45Å; T314-A317 PolarHBondContact O-N 3.38Å; T314-E318 WeakPolarHBondContact O-CG 3.46Å; T314-E318 PolarHBondContact O-N 3.47Å |
| 315 | R | 92.9 | Very high | 91 | Very high | 101 Ų | 101 | 89.9 Ų | 89.9 | 38% | 0.381 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -57.3 | -43.7 | 174.9 | -79.7 | -170.6 | -75.3 | -104.7 | -3.3 | 112.5 | E311 D312 S319 | E311-R315 VanDerWaalsContact CD-CZ 3.49Å; E311-R315 VanDerWaalsContact CG-NH1 3.3Å; E311-R315 WeakPolarHBondContact O-CB 3.32Å; E311-R315 WeakPolarHBondContact O-CG 3.36Å; E311-R315 PolarHBondContact O-N 3.38Å; E311-R315 IonicContact OE1-CZ 3.49Å; E311-R315 IonicContact OE1-NH1 2.8Å; E311-R315 PolarHBondContact OE1-NH1 2.88Å; E311-R315 IonicContact OE2-CZ 2.77Å; E311-R315 IonicContact OE2-NH1 2.66Å; E311-R315 PolarHBondContact OE2-NH1 3.43Å; E311-R315 IonicContact OE2-NH2 3.44Å; E311-R315 PolarHBondContact OE2-NH2 3.04Å; D312-R315 PolarHBondContact O-N 3.06Å; D312-R315 IonicContact OD1-CZ 2.87Å; D312-R315 IonicContact OD1-NE 2.97Å; D312-R315 PolarHBondContact OD1-NE 2.88Å; D312-R315 IonicContact OD1-NH2 3.37Å; D312-R315 PolarHBondContact OD1-NH2 2.88Å; R315-S319 WeakPolarHBondContact O-CB 3.49Å; R315-S319 PolarHBondContact O-N 3.36Å; R315-S319 PolarHBondContact O-OG 2.89Å |
| 316 | H | 92.8 | Very high | 90 | Very high | 113 Ų | 113 | 93.5 Ų | 93.5 | 52% | 0.523 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.9 | -43.6 | -180 | -175 | 60.6 | 0 | 0 | 0 | 111.3 | D312 L313 T314 S319 Q320 | D312-H316 VanDerWaalsContact O-CB 3.27Å; D312-H316 WeakPolarHBondContact O-CB 3.36Å; D312-H316 PolarHBondContact O-N 2.69Å; L313-H316 PolarHBondContact O-N 3.04Å; T314-H316 VanDerWaalsContact C-N 3.31Å; T314-H316 PolarHBondContact O-N 3.45Å; H316-S319 PolarHBondContact O-N 2.91Å; H316-Q320 PolarHBondContact CD2-NE2 2.94Å; H316-Q320 VanDerWaalsContact CD2-NE2 3.32Å; H316-Q320 PolarHBondContact NE2-NE2 3.43Å; H316-Q320 WeakPolarHBondContact O-CG 3.42Å; H316-Q320 PolarHBondContact O-N 3.28Å |
| 317 | A | 88.7 | Confident | 89 | Confident | 17 Ų | 17 | 95.6 Ų | 95.6 | 14% | 0.14 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -64 | -45.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F201 L313 T314 S319 Q320 Q321 | F201-A317 HydrophobicContact CE1-CB 3.66Å; F201-A317 HydrophobicContact CE2-CB 4.31Å; F201-A317 HydrophobicContact CZ-CB 3.4Å; F201-A317 VanDerWaalsContact CZ-CB 3.4Å; L313-A317 WeakPolarHBondContact O-CB 3.27Å; L313-A317 PolarHBondContact O-N 2.8Å; T314-A317 PolarHBondContact O-N 3.38Å; A317-S319 VanDerWaalsContact C-N 3.3Å; A317-S319 PolarHBondContact O-N 3.1Å; A317-Q320 PolarHBondContact O-N 3.27Å; A317-Q321 WeakPolarHBondContact O-CB 3.4Å; A317-Q321 PolarHBondContact O-N 3.05Å |
| 318 | E | 88.3 | Confident | 87.4 | Confident | 110 Ų | 110 | 98 Ų | 98 | 51% | 0.514 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.9 | -42 | 175.7 | -73 | 176.3 | 178.2 | 0 | 0 | 111.7 | T314 Q321 K322 | T314-E318 WeakPolarHBondContact O-CG 3.46Å; T314-E318 PolarHBondContact O-N 3.47Å; E318-Q321 PolarHBondContact O-N 3.49Å; E318-K322 WeakPolarHBondContact O-CB 3.25Å; E318-K322 PolarHBondContact O-N 2.9Å |
| 319 | S | 90.9 | Very high | 85.3 | Confident | 76 Ų | 76 | 100 Ų | 100 | 53% | 0.531 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.2 | -43.4 | 176.8 | -60.6 | 0 | 0 | 0 | 0 | 112 | R315 H316 A317 K322 H323 | R315-S319 WeakPolarHBondContact O-CB 3.49Å; R315-S319 PolarHBondContact O-N 3.36Å; R315-S319 PolarHBondContact O-OG 2.89Å; H316-S319 PolarHBondContact O-N 2.91Å; A317-S319 VanDerWaalsContact C-N 3.3Å; A317-S319 PolarHBondContact O-N 3.1Å; S319-K322 PolarHBondContact O-N 3.33Å; S319-H323 WeakPolarHBondContact O-CB 3.49Å; S319-H323 PolarHBondContact O-N 3.2Å |
| 320 | Q | 87.5 | Confident | 83.4 | Confident | 95 Ų | 95 | 100.2 Ų | 100.2 | 44% | 0.444 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.3 | -43.6 | 175.2 | -76.7 | -163.2 | 50.1 | 0 | 0 | 111.6 | H316 A317 H323 M324 | H316-Q320 PolarHBondContact CD2-NE2 2.94Å; H316-Q320 VanDerWaalsContact CD2-NE2 3.32Å; H316-Q320 PolarHBondContact NE2-NE2 3.43Å; H316-Q320 WeakPolarHBondContact O-CG 3.42Å; H316-Q320 PolarHBondContact O-N 3.28Å; A317-Q320 PolarHBondContact O-N 3.27Å; Q320-H323 PolarHBondContact O-N 3.25Å; Q320-M324 WeakPolarHBondContact O-CG 3.37Å; Q320-M324 PolarHBondContact O-N 3.41Å |
| 321 | Q | 83.9 | Confident | 80.9 | Confident | 87 Ų | 87 | 109.1 Ų | 109.1 | 41% | 0.407 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65 | -42.3 | 179.9 | -168.2 | 175.6 | 17.3 | 0 | 0 | 111.9 | A317 E318 H323 M324 A325 | A317-Q321 WeakPolarHBondContact O-CB 3.4Å; A317-Q321 PolarHBondContact O-N 3.05Å; E318-Q321 PolarHBondContact O-N 3.49Å; Q321-H323 VanDerWaalsContact C-N 3.33Å; Q321-H323 PolarHBondContact O-N 2.95Å; Q321-M324 PolarHBondContact O-N 3.14Å; Q321-A325 WeakPolarHBondContact O-CB 3.41Å; Q321-A325 PolarHBondContact O-N 2.58Å |
| 322 | K | 84.9 | Confident | 80.2 | Confident | 136 Ų | 136 | 109.5 Ų | 109.5 | 59% | 0.591 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -59.2 | -45.5 | 173.6 | -177.6 | 177.3 | 175.2 | -178.9 | 0 | 111.5 | E318 S319 M324 A325 E326 | E318-K322 WeakPolarHBondContact O-CB 3.25Å; E318-K322 PolarHBondContact O-N 2.9Å; S319-K322 PolarHBondContact O-N 3.33Å; K322-M324 VanDerWaalsContact C-N 3.32Å; K322-M324 PolarHBondContact O-N 3.25Å; K322-A325 PolarHBondContact O-N 3.25Å; K322-E326 WeakPolarHBondContact CE-OE1 3.25Å; K322-E326 WeakPolarHBondContact O-CG 3.33Å; K322-E326 PolarHBondContact O-N 3.48Å |
| 323 | H | 84.1 | Confident | 79.3 | Confident | 102 Ų | 102 | 111.2 Ų | 111.2 | 47% | 0.472 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -67.9 | -31.2 | 179.7 | -164.7 | -108.7 | 0 | 0 | 0 | 112.7 | S319 Q320 Q321 K327 | S319-H323 WeakPolarHBondContact O-CB 3.49Å; S319-H323 PolarHBondContact O-N 3.2Å; Q320-H323 PolarHBondContact O-N 3.25Å; Q321-H323 VanDerWaalsContact C-N 3.33Å; Q321-H323 PolarHBondContact O-N 2.95Å; H323-K327 WeakPolarHBondContact CE1-CE 3.05Å; H323-K327 PolarHBondContact CE1-NZ 3.48Å; H323-K327 VanDerWaalsContact CE1-NZ 3.3Å; H323-K327 WeakPolarHBondContact O-CG 3.46Å; H323-K327 PolarHBondContact O-N 3.32Å |
| 324 | M | 80.2 | Confident | 78.6 | Confident | 125 Ų | 125 | 110.6 Ų | 110.6 | 62% | 0.616 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -69.4 | -42.3 | 170.6 | -73.5 | -175.3 | 171.1 | 0 | 0 | 112 | Q320 Q321 K322 K327 M328 | Q320-M324 WeakPolarHBondContact O-CG 3.37Å; Q320-M324 PolarHBondContact O-N 3.41Å; Q321-M324 PolarHBondContact O-N 3.14Å; K322-M324 VanDerWaalsContact C-N 3.32Å; K322-M324 PolarHBondContact O-N 3.25Å; M324-K327 PolarHBondContact O-N 3.23Å; M324-M328 WeakPolarHBondContact O-CG 3.36Å; M324-M328 PolarHBondContact O-N 3.3Å |
| 325 | A | 78.5 | Confident | 77.8 | Confident | 67 Ų | 67 | 114.5 Ų | 114.5 | 55% | 0.554 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -64 | -39 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q321 K322 K327 M328 | Q321-A325 WeakPolarHBondContact O-CB 3.41Å; Q321-A325 PolarHBondContact O-N 2.58Å; K322-A325 PolarHBondContact O-N 3.25Å; A325-K327 VanDerWaalsContact C-N 3.32Å; A325-K327 PolarHBondContact O-N 2.84Å; A325-M328 PolarHBondContact O-N 3.3Å |
| 326 | E | 78.6 | Confident | 76.9 | Confident | 130 Ų | 130 | 115.3 Ų | 115.3 | 61% | 0.607 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -68.4 | -28.3 | 175.7 | -73.3 | 175 | -177 | 0 | 0 | 113.1 | K322 | K322-E326 WeakPolarHBondContact CE-OE1 3.25Å; K322-E326 WeakPolarHBondContact O-CG 3.33Å; K322-E326 PolarHBondContact O-N 3.48Å |
| 327 | K | 75.7 | Confident | 75.8 | Confident | 147 Ų | 147 | 115.5 Ų | 115.5 | 64% | 0.639 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -85.2 | -14.8 | 178.8 | -77.8 | -177.5 | 175.1 | -174.4 | 0 | 114.3 | H323 M324 A325 P329 | H323-K327 WeakPolarHBondContact CE1-CE 3.05Å; H323-K327 PolarHBondContact CE1-NZ 3.48Å; H323-K327 VanDerWaalsContact CE1-NZ 3.3Å; H323-K327 WeakPolarHBondContact O-CG 3.46Å; H323-K327 PolarHBondContact O-N 3.32Å; M324-K327 PolarHBondContact O-N 3.23Å; A325-K327 VanDerWaalsContact C-N 3.32Å; A325-K327 PolarHBondContact O-N 2.84Å; K327-P329 VanDerWaalsContact O-CD 3.29Å; K327-P329 WeakPolarHBondContact O-CD 3.29Å |
| 328 | M | 62.9 | Low | 74.9 | Confident | 146 Ų | 146 | 122.5 Ų | 122.5 | 72% | 0.719 | 64% | 0.635 | S | S | * | * | S | Bend | trans | -79.6 | 112.7 | 175.5 | -68.4 | -129.8 | -71.4 | 0 | 0 | 109.2 | M324 A325 A330 | M324-M328 WeakPolarHBondContact O-CG 3.36Å; M324-M328 PolarHBondContact O-N 3.3Å; A325-M328 PolarHBondContact O-N 3.3Å; M328-A330 PolarHBondContact O-N 3.22Å |
| 329 | P | 55.2 | Low | 73.9 | Confident | 115 Ų | 115 | 123.5 Ų | 123.5 | 75% | 0.747 | 65% | 0.645 | S | S | * | * | trans | -63.9 | 126.2 | 179.6 | 25.8 | -31.6 | 0 | 0 | 0 | 109.3 | K327 K331 | K327-P329 VanDerWaalsContact O-CD 3.29Å; K327-P329 WeakPolarHBondContact O-CD 3.29Å; P329-K331 PolarHBondContact O-N 3.07Å | ||
| 330 | A | 56.3 | Low | 72.5 | Confident | 104 Ų | 104 | 127.4 Ų | 127.4 | 86% | 0.86 | 65% | 0.654 | S | S | * | * | trans | -54.3 | 114.9 | 166 | 0 | 0 | 0 | 0 | 0 | 107.9 | M328 | M328-A330 PolarHBondContact O-N 3.22Š| ||
| 331 | K | 42 | Very low | 71.1 | Confident | 275 Ų | 275 | 130.4 Ų | 130.4 | 100% | 1.196 | 67% | 0.673 | S | S | * | * | trans | -72.3 | 0 | 173.4 | -92.6 | -174.8 | 176.1 | 177.7 | 0 | 111.2 | P329 | P329-K331 PolarHBondContact O-N 3.07Š|
Retrieved 331 of 331 residues in 299.9 ms
(Link to these results)