| 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 | 44.9 | Very low | 37 | Very low | 235 Ų | 235 | 154.9 Ų | 154.9 | 100% | 1.158 | 86% | 0.859 | S | S | * | * | 0 | 113 | 0 | -64.7 | -55.6 | -174.1 | 0 | 0 | 107 | |||||
| 2 | P | 35.9 | Very low | 37.3 | Very low | 135 Ų | 135 | 161.8 Ų | 161.8 | 88% | 0.877 | 86% | 0.863 | S | S | * | * | -120.1 | -173.9 | 85.2 | 37.4 | -32.9 | 0 | 0 | 0 | 113.5 | |||||
| 3 | A | 34.6 | Very low | 37.6 | Very low | 98 Ų | 98 | 160.2 Ų | 160.2 | 81% | 0.81 | 85% | 0.854 | S | S | * | * | trans | -110.6 | 170 | -161.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 4 | I | 40.6 | Very low | 37.9 | Very low | 155 Ų | 155 | 165.3 Ų | 165.3 | 80% | 0.795 | 86% | 0.856 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 136.5 | -173.8 | -59.1 | 161.4 | 0 | 0 | 0 | 111.6 | ||
| 5 | P | 36.2 | Very low | 38.1 | Very low | 121 Ų | 121 | 164.1 Ų | 164.1 | 79% | 0.786 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 122.7 | 165.4 | 30.8 | -32.5 | 0 | 0 | 0 | 110.8 | ||
| 6 | S | 32.7 | Very low | 38.7 | Very low | 119 Ų | 119 | 159.9 Ų | 159.9 | 83% | 0.832 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -88.7 | 125.8 | -175.1 | 50.6 | 0 | 0 | 0 | 0 | 112.8 | ||
| 7 | S | 33.3 | Very low | 39.6 | Very low | 120 Ų | 120 | 156.4 Ų | 156.4 | 84% | 0.839 | 82% | 0.817 | S | S | * | * | trans | -101 | 115.6 | 174.7 | 54.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 8 | R | 34.5 | Very low | 40 | Very low | 241 Ų | 241 | 156.3 Ų | 156.3 | 91% | 0.909 | 82% | 0.817 | S | S | * | * | trans | -141.6 | 161.1 | 170.5 | -81.2 | -169.3 | 168.2 | 179.4 | -3.3 | 111 | ||||
| 9 | S | 32.9 | Very low | 40.2 | Very low | 109 Ų | 109 | 152.3 Ų | 152.3 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | 81 | 30.4 | 172.1 | 77.9 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 10 | R | 41.9 | Very low | 40.9 | Very low | 250 Ų | 250 | 151.8 Ų | 151.8 | 94% | 0.943 | 79% | 0.79 | S | S | * | * | trans | -97.4 | 60.1 | 152.6 | -90.4 | -169.6 | 173 | 177.5 | -0.9 | 112.3 | ||||
| 11 | T | 39.9 | Very low | 41.5 | Very low | 121 Ų | 121 | 149.6 Ų | 149.6 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | trans | -125.5 | 5.6 | -173 | 41.4 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 12 | R | 40.4 | Very low | 41.7 | Very low | 238 Ų | 238 | 144.4 Ų | 144.4 | 90% | 0.898 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -95.5 | -26.4 | -175.6 | -160.6 | 164.3 | -178.2 | 136.9 | 0.8 | 115.4 | R14 | R12-R14 PolarHBondContact O-N 3.19Š|
| 13 | D | 41.5 | Very low | 42.3 | Very low | 141 Ų | 141 | 143.8 Ų | 143.8 | 75% | 0.754 | 74% | 0.742 | S | S | * | * | G | 310 helix | trans | -81.4 | -7.7 | -174.5 | -63.3 | -64.5 | 0 | 0 | 0 | 115.8 | N15 N16 | D13-N15 PolarHBondContact O-N 3.38Å; D13-N16 PolarHBondContact O-N 3.29Å |
| 14 | R | 40.7 | Very low | 42.9 | Very low | 231 Ų | 231 | 146.4 Ų | 146.4 | 87% | 0.872 | 74% | 0.739 | S | S | * | * | G | 310 helix | trans | -72.2 | -3.2 | -165 | -155.9 | 163.5 | 70.1 | 179 | 3 | 115.7 | R12 | R12-R14 PolarHBondContact O-N 3.19Š|
| 15 | N | 41.7 | Very low | 43.3 | Very low | 147 Ų | 147 | 143.7 Ų | 143.7 | 79% | 0.786 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -113.2 | 1.2 | -175.9 | -77.7 | 15.7 | 0 | 0 | 0 | 115.1 | D13 V17 | D13-N15 PolarHBondContact O-N 3.38Å; N15-V17 PolarHBondContact O-N 3.01Å; N15-V17 VanDerWaalsContact O-N 3.08Å |
| 16 | N | 48.3 | Very low | 43.8 | Very low | 98 Ų | 98 | 144.9 Ų | 144.9 | 52% | 0.524 | 73% | 0.733 | S | S | . | * | trans | -79.6 | 95.1 | 176.5 | -168.4 | 0.6 | 0 | 0 | 0 | 111.3 | D13 L18 S19 | D13-N16 PolarHBondContact O-N 3.29Å; N16-L18 VanDerWaalsContact C-N 3.28Å; N16-L18 PolarHBondContact O-N 2.98Å; N16-L18 PolarHBondContact OD1-N 3.5Å; N16-S19 WeakPolarHBondContact CB-OG 3.27Å; N16-S19 PolarHBondContact O-N 3.08Å; N16-S19 PolarHBondContact O-OG 3.23Å | ||
| 17 | V | 52.7 | Low | 44.1 | Very low | 99 Ų | 99 | 146.8 Ų | 146.8 | 60% | 0.6 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -64.2 | -31.6 | -176.2 | -178.9 | 0 | 0 | 0 | 0 | 112.4 | N15 S19 R20 | N15-V17 PolarHBondContact O-N 3.01Å; N15-V17 VanDerWaalsContact O-N 3.08Å; V17-S19 PolarHBondContact O-N 3.27Å; V17-R20 PolarHBondContact O-N 3.44Å |
| 18 | L | 46.8 | Very low | 44.5 | Very low | 155 Ų | 155 | 148.9 Ų | 148.9 | 81% | 0.812 | 73% | 0.73 | S | S | * | * | G | 310 helix | trans | -65.7 | -24 | -177.4 | -65.3 | 168.4 | 0 | 0 | 0 | 113.2 | N16 | N16-L18 VanDerWaalsContact C-N 3.28Å; N16-L18 PolarHBondContact O-N 2.98Å; N16-L18 PolarHBondContact OD1-N 3.5Å |
| 19 | S | 44.1 | Very low | 44.5 | Very low | 81 Ų | 81 | 142.9 Ų | 142.9 | 57% | 0.566 | 72% | 0.722 | S | S | * | * | G | 310 helix | trans | -89.9 | 14.4 | -179 | 35.9 | 0 | 0 | 0 | 0 | 114.9 | N16 V17 | N16-S19 WeakPolarHBondContact CB-OG 3.27Å; N16-S19 PolarHBondContact O-N 3.08Å; N16-S19 PolarHBondContact O-OG 3.23Å; V17-S19 PolarHBondContact O-N 3.27Å |
| 20 | R | 54.9 | Low | 44.7 | Very low | 142 Ų | 142 | 146.3 Ų | 146.3 | 54% | 0.536 | 73% | 0.731 | S | S | . | * | trans | -76.4 | 132 | 170.6 | -88.5 | -170.7 | 175.5 | -113.8 | -0.7 | 111.1 | V17 E22 F23 | V17-R20 PolarHBondContact O-N 3.44Å; R20-E22 WeakPolarHBondContact CD-OE1 3.45Å; R20-E22 IonicContact CZ-OE1 3.7Å; R20-E22 IonicContact NE-OE1 3.99Å; R20-E22 IonicContact NH1-OE1 2.68Å; R20-E22 PolarHBondContact NH1-OE1 3.37Å; R20-E22 PolarHBondContact O-N 2.87Å; R20-E22 VanDerWaalsContact O-N 3.13Å; R20-F23 HydrophobicContact CB-CD2 3.99Å; R20-F23 PolarHBondContact O-N 3.31Å | ||
| 21 | P | 52.2 | Low | 44.2 | Very low | 105 Ų | 105 | 145.3 Ų | 145.3 | 68% | 0.682 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -60.8 | -26.8 | 178.5 | 25.3 | -34.3 | 0 | 0 | 0 | 112.8 | F23 M24 | P21-F23 PolarHBondContact O-N 3.11Å; P21-M24 PolarHBondContact O-N 2.92Å |
| 22 | E | 50.2 | Low | 43.7 | Very low | 126 Ų | 126 | 145.2 Ų | 145.2 | 59% | 0.589 | 73% | 0.73 | S | S | * | * | G | 310 helix | trans | -58.4 | -26.6 | 175.1 | -63.3 | 168.7 | -95.4 | 0 | 0 | 114.2 | R20 | R20-E22 WeakPolarHBondContact CD-OE1 3.45Å; R20-E22 IonicContact CZ-OE1 3.7Å; R20-E22 IonicContact NE-OE1 3.99Å; R20-E22 IonicContact NH1-OE1 2.68Å; R20-E22 PolarHBondContact NH1-OE1 3.37Å; R20-E22 PolarHBondContact O-N 2.87Å; R20-E22 VanDerWaalsContact O-N 3.13Å |
| 23 | F | 48.9 | Very low | 43.2 | Very low | 123 Ų | 123 | 139.9 Ų | 139.9 | 54% | 0.539 | 72% | 0.724 | S | S | . | * | G | 310 helix | trans | -100 | -13.3 | 179.9 | -72.2 | -90.2 | 0 | 0 | 0 | 113.2 | R20 P21 S25 | R20-F23 HydrophobicContact CB-CD2 3.99Å; R20-F23 PolarHBondContact O-N 3.31Å; P21-F23 PolarHBondContact O-N 3.11Å; F23-S25 VanDerWaalsContact C-N 3.26Å; F23-S25 PolarHBondContact O-N 3.44Å |
| 24 | M | 45.7 | Very low | 42.6 | Very low | 153 Ų | 153 | 140 Ų | 140 | 75% | 0.754 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -76.7 | -12.6 | -173.5 | -151.6 | 167.2 | -173.7 | 0 | 0 | 113.4 | P21 | P21-M24 PolarHBondContact O-N 2.92Š|
| 25 | S | 48.9 | Very low | 42.1 | Very low | 97 Ų | 97 | 134.2 Ų | 134.2 | 68% | 0.678 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -77.9 | -17.5 | -176.2 | -165 | 0 | 0 | 0 | 0 | 114.6 | F23 N27 | F23-S25 VanDerWaalsContact C-N 3.26Å; F23-S25 PolarHBondContact O-N 3.44Å; S25-N27 PolarHBondContact O-N 2.75Å |
| 26 | L | 47.2 | Very low | 41.5 | Very low | 146 Ų | 146 | 136.2 Ų | 136.2 | 76% | 0.764 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -76.6 | -16.7 | -168.3 | -89.7 | 161.5 | 0 | 0 | 0 | 115.8 | ||
| 27 | N | 39.7 | Very low | 40.6 | Very low | 160 Ų | 160 | 138 Ų | 138 | 86% | 0.856 | 74% | 0.739 | S | S | * | * | G | 310 helix | trans | -120.2 | 20.5 | -174.7 | -81 | 13.6 | 0 | 0 | 0 | 113.8 | S25 | S25-N27 PolarHBondContact O-N 2.75Š|
| 28 | Q | 40.4 | Very low | 39.5 | Very low | 164 Ų | 164 | 145.4 Ų | 145.4 | 77% | 0.766 | 76% | 0.756 | S | S | * | * | trans | -109.4 | 116.8 | -179.7 | -146.4 | 170 | 50.9 | 0 | 0 | 111.4 | ||||
| 29 | P | 36 | Very low | 38.6 | Very low | 115 Ų | 115 | 141.4 Ų | 141.4 | 75% | 0.747 | 75% | 0.752 | S | S | * | * | trans | -65.6 | 145 | 174.3 | 27.5 | -33.5 | 0 | 0 | 0 | 110.4 | R31 | P29-R31 PolarHBondContact O-N 3.02Š| ||
| 30 | L | 35.8 | Very low | 37.8 | Very low | 180 Ų | 180 | 144.4 Ų | 144.4 | 94% | 0.942 | 77% | 0.767 | S | S | * | * | trans | -63.2 | 95.7 | -175.5 | -76.4 | 167.9 | 0 | 0 | 0 | 111.7 | C32 | L30-C32 PolarHBondContact O-N 3.3Å; L30-C32 VanDerWaalsContact O-N 3.09Å | ||
| 31 | R | 32.1 | Very low | 36.6 | Very low | 230 Ų | 230 | 142.3 Ų | 142.3 | 87% | 0.868 | 78% | 0.78 | S | S | * | * | trans | -73.3 | 100.8 | 171.6 | -157.6 | 175.3 | -162.5 | 172.6 | 5.8 | 108.6 | P29 V33 | P29-R31 PolarHBondContact O-N 3.02Å; R31-V33 PolarHBondContact O-N 3.34Å | ||
| 32 | C | 28.6 | Very low | 35.5 | Very low | 119 Ų | 119 | 149.3 Ų | 149.3 | 80% | 0.804 | 79% | 0.793 | S | S | * | * | trans | -62.8 | 122.7 | 176.2 | -163.5 | 0 | 0 | 0 | 0 | 109.5 | L30 | L30-C32 PolarHBondContact O-N 3.3Å; L30-C32 VanDerWaalsContact O-N 3.09Å | ||
| 33 | V | 31.3 | Very low | 34.4 | Very low | 125 Ų | 125 | 154.4 Ų | 154.4 | 76% | 0.758 | 81% | 0.807 | S | S | * | * | trans | -115.5 | 116.2 | 177 | 177 | 0 | 0 | 0 | 0 | 107.6 | R31 | R31-V33 PolarHBondContact O-N 3.34Š| ||
| 34 | N | 29.1 | Very low | 33.7 | Very low | 143 Ų | 143 | 154.1 Ų | 154.1 | 77% | 0.765 | 82% | 0.817 | S | S | * | * | trans | -63.3 | 141.2 | 176.6 | -75 | -13.9 | 0 | 0 | 0 | 110.8 | E36 | N34-E36 PolarHBondContact O-N 3.02Š| ||
| 35 | S | 30.3 | Very low | 32.8 | Very low | 110 Ų | 110 | 150.8 Ų | 150.8 | 77% | 0.769 | 81% | 0.814 | S | S | * | * | trans | -78.4 | 101.3 | 178 | 54.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 36 | E | 28.9 | Very low | 32 | Very low | 190 Ų | 190 | 154.9 Ų | 154.9 | 89% | 0.888 | 82% | 0.822 | S | S | * | * | trans | -84.2 | 111.6 | 166.3 | -72.6 | -159.1 | 130.4 | 0 | 0 | 111.3 | N34 R38 | N34-E36 PolarHBondContact O-N 3.02Å; E36-R38 PolarHBondContact O-N 2.94Å | ||
| 37 | T | 29.9 | Very low | 31.5 | Very low | 135 Ų | 135 | 152.8 Ų | 152.8 | 83% | 0.828 | 82% | 0.818 | S | S | * | * | trans | -76.2 | 115.7 | -179.5 | -52.1 | 0 | 0 | 0 | 0 | 111 | G39 | T37-G39 PolarHBondContact O-N 3.46Š| ||
| 38 | R | 28.4 | Very low | 30.9 | Very low | 254 Ų | 254 | 153.5 Ų | 153.5 | 96% | 0.958 | 81% | 0.813 | S | S | * | * | trans | -67.2 | 100.4 | 172.1 | -95.8 | -175.7 | 170.1 | 177.5 | -2.1 | 111.4 | E36 | E36-R38 PolarHBondContact O-N 2.94Š| ||
| 39 | G | 27.8 | Very low | 30.4 | Very low | 71 Ų | 71 | 154 Ų | 154 | 73% | 0.732 | 82% | 0.815 | S | S | * | * | trans | -111.5 | 137.9 | 169 | 0 | 0 | 0 | 0 | 0 | 112.1 | T37 | T37-G39 PolarHBondContact O-N 3.46Š| ||
| 40 | T | 27.9 | Very low | 29.9 | Very low | 144 Ų | 144 | 155.4 Ų | 155.4 | 88% | 0.883 | 81% | 0.812 | S | S | * | * | trans | -107.2 | 116.8 | -175.8 | 50.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 41 | A | 28.9 | Very low | 29.6 | Very low | 98 Ų | 98 | 151 Ų | 151 | 81% | 0.81 | 80% | 0.802 | S | S | * | * | trans | -161.5 | 125.1 | 161 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 42 | R | 29.4 | Very low | 29.4 | Very low | 253 Ų | 253 | 145.1 Ų | 145.1 | 96% | 0.955 | 80% | 0.795 | S | S | * | * | trans | 40 | 140.2 | 140.3 | -64.9 | -179 | 173 | 170.7 | -2.4 | 124 | ||||
| 43 | R | 28 | Very low | 29.4 | Very low | 232 Ų | 232 | 148.3 Ų | 148.3 | 88% | 0.875 | 80% | 0.798 | S | S | * | * | trans | -76.8 | 162.6 | 166 | -118.4 | 178.9 | -173.2 | 174.5 | 1.9 | 112.1 | ||||
| 44 | P | 33.3 | Very low | 29.7 | Very low | 117 Ų | 117 | 147.3 Ų | 147.3 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | -128.5 | 165.2 | 71.5 | 17.1 | 7 | 0 | 0 | 0 | 113.2 | |||||
| 45 | A | 27.5 | Very low | 29.5 | Very low | 83 Ų | 83 | 146.7 Ų | 146.7 | 69% | 0.686 | 80% | 0.8 | S | S | * | * | 57.5 | 132.3 | 62.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 46 | Q | 31 | Very low | 29.2 | Very low | 183 Ų | 183 | 148.6 Ų | 148.6 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | cis | -161.4 | -164.2 | 7.1 | -124.6 | -173.4 | -13.3 | 0 | 0 | 107.3 | ||||
| 47 | P | 37.5 | Very low | 29.9 | Very low | 103 Ų | 103 | 144.7 Ų | 144.7 | 67% | 0.669 | 79% | 0.793 | S | S | * | * | cis | -132.1 | 163.8 | -43.2 | 38.5 | -22 | 0 | 0 | 0 | 116.2 | ||||
| 48 | K | 26.3 | Very low | 29.8 | Very low | 174 Ų | 174 | 147.9 Ų | 147.9 | 76% | 0.757 | 80% | 0.798 | S | S | * | * | trans | 28.6 | 126.7 | 149.3 | -63 | -173.6 | 176.1 | -172.6 | 0 | 124.4 | ||||
| 49 | H | 29.9 | Very low | 29.9 | Very low | 176 Ų | 176 | 144.4 Ų | 144.4 | 82% | 0.815 | 79% | 0.793 | S | S | * | * | -168.5 | 152.6 | 118.1 | -117 | -87.9 | 0 | 0 | 0 | 110.2 | |||||
| 50 | Q | 26.9 | Very low | 30.5 | Very low | 144 Ų | 144 | 146.1 Ų | 146.1 | 67% | 0.673 | 79% | 0.791 | S | S | * | * | cis | 113.2 | 84.5 | -13.8 | -160.9 | 179.2 | -33.6 | 0 | 0 | 118.6 | ||||
| 51 | A | 28.2 | Very low | 30.6 | Very low | 88 Ų | 88 | 146.1 Ų | 146.1 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -169.3 | 112.8 | 158.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 52 | S | 27.7 | Very low | 30.5 | Very low | 105 Ų | 105 | 149 Ų | 149 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | 52.3 | 105.2 | 99.9 | 62.3 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 53 | Q | 29.7 | Very low | 30.6 | Very low | 186 Ų | 186 | 142.4 Ų | 142.4 | 87% | 0.869 | 79% | 0.786 | S | S | * | * | 70.1 | 151.9 | 75.8 | -86.3 | -160.9 | -22.2 | 0 | 0 | 115.6 | |||||
| 54 | P | 38 | Very low | 30.7 | Very low | 105 Ų | 105 | 136.4 Ų | 136.4 | 68% | 0.682 | 79% | 0.786 | S | S | * | * | cis | -139.5 | 174.7 | -40.9 | 39.5 | -23.1 | 0 | 0 | 0 | 113.2 | ||||
| 55 | C | 23.4 | Very low | 30.6 | Very low | 129 Ų | 129 | 138.3 Ų | 138.3 | 87% | 0.872 | 79% | 0.789 | S | S | * | * | trans | -164.6 | 133 | 152.1 | -129.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 56 | D | 24.7 | Very low | 30.8 | Very low | 151 Ų | 151 | 143.3 Ų | 143.3 | 81% | 0.807 | 80% | 0.796 | S | S | * | * | trans | -137.9 | 174.3 | 174.3 | -82.8 | -55.2 | 0 | 0 | 0 | 107.1 | ||||
| 57 | P | 43.3 | Very low | 30.9 | Very low | 108 Ų | 108 | 140.8 Ų | 140.8 | 70% | 0.701 | 79% | 0.788 | S | S | * | * | cis | -132.5 | 176.5 | -46.1 | 38.8 | -24.9 | 0 | 0 | 0 | 111.5 | ||||
| 58 | Q | 28.9 | Very low | 30.7 | Very low | 201 Ų | 201 | 147.7 Ų | 147.7 | 94% | 0.939 | 80% | 0.801 | S | S | * | * | trans | -155.5 | 145.3 | 150 | -120.4 | 164.4 | -1.1 | 0 | 0 | 112.8 | ||||
| 59 | E | 29.8 | Very low | 31.1 | Very low | 181 Ų | 181 | 148.4 Ų | 148.4 | 85% | 0.846 | 80% | 0.804 | S | S | * | * | trans | -102.7 | -156.3 | -167 | -59.1 | -178.1 | 113.6 | 0 | 0 | 112.3 | ||||
| 60 | P | 40.2 | Very low | 31.3 | Very low | 108 Ų | 108 | 148.6 Ų | 148.6 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | -124.6 | 177.7 | -86.1 | 38.4 | -22.9 | 0 | 0 | 0 | 112.9 | |||||
| 61 | T | 29.5 | Very low | 31.8 | Very low | 143 Ų | 143 | 147.7 Ų | 147.7 | 88% | 0.877 | 81% | 0.812 | S | S | * | * | trans | -144.4 | 147.5 | 157 | 36.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 62 | D | 28.3 | Very low | 32.2 | Very low | 159 Ų | 159 | 147.9 Ų | 147.9 | 85% | 0.85 | 81% | 0.814 | S | S | * | * | trans | -82.7 | 167.9 | -159.9 | -77.8 | -67.2 | 0 | 0 | 0 | 117.6 | ||||
| 63 | S | 29.9 | Very low | 32.6 | Very low | 115 Ų | 115 | 152.1 Ų | 152.1 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -60.9 | 144.6 | 174.8 | 60.2 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 64 | A | 29.8 | Very low | 33.1 | Very low | 106 Ų | 106 | 150 Ų | 150 | 88% | 0.876 | 81% | 0.813 | S | S | * | * | trans | -147.1 | 135.1 | 145.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 65 | N | 32.2 | Very low | 33.3 | Very low | 156 Ų | 156 | 149.9 Ų | 149.9 | 83% | 0.834 | 81% | 0.812 | S | S | * | * | trans | -116.5 | 120 | 179.2 | 170.5 | 21.1 | 0 | 0 | 0 | 109.6 | ||||
| 66 | K | 31.4 | Very low | 34.5 | Very low | 188 Ų | 188 | 150.6 Ų | 150.6 | 82% | 0.817 | 81% | 0.807 | S | S | * | * | trans | -158.7 | 136.1 | 156.4 | -135.4 | 164.2 | -173.2 | 173.3 | 0 | 117.1 | ||||
| 67 | D | 33.1 | Very low | 35.8 | Very low | 131 Ų | 131 | 150.8 Ų | 150.8 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | trans | -17.4 | 133.9 | 165.9 | -54.2 | -82 | 0 | 0 | 0 | 119.7 | ||||
| 68 | R | 33.8 | Very low | 36 | Very low | 248 Ų | 248 | 152.5 Ų | 152.5 | 94% | 0.936 | 81% | 0.806 | S | S | * | * | -154 | 139.4 | 101.2 | -149 | 163.3 | -176.8 | 150.1 | -1.1 | 112.5 | |||||
| 69 | K | 33.9 | Very low | 36.8 | Very low | 189 Ų | 189 | 148.7 Ų | 148.7 | 82% | 0.822 | 80% | 0.8 | S | S | * | * | trans | -79.1 | 134.3 | 175.9 | -66.1 | 175.5 | 178.4 | 175.8 | 0 | 111.4 | ||||
| 70 | E | 34.5 | Very low | 38.1 | Very low | 180 Ų | 180 | 145.7 Ų | 145.7 | 84% | 0.841 | 79% | 0.789 | S | S | * | * | trans | -89.2 | 144.9 | 143.1 | -64.4 | -167.3 | 138.4 | 0 | 0 | 109 | A72 | E70-A72 PolarHBondContact O-N 3.22Å; E70-A72 VanDerWaalsContact O-N 3.12Å | ||
| 71 | P | 37.6 | Very low | 38.6 | Very low | 124 Ų | 124 | 149.2 Ų | 149.2 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | trans | -74.5 | 100.8 | 170.9 | 30.4 | -31.2 | 0 | 0 | 0 | 109 | K73 | P71-K73 PolarHBondContact O-N 2.92Š| ||
| 72 | A | 36.6 | Very low | 39.9 | Very low | 93 Ų | 93 | 149.7 Ų | 149.7 | 77% | 0.769 | 79% | 0.792 | S | S | * | * | trans | -54.8 | 111.8 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109.1 | E70 L74 | E70-A72 PolarHBondContact O-N 3.22Å; E70-A72 VanDerWaalsContact O-N 3.12Å; A72-L74 PolarHBondContact O-N 2.97Å | ||
| 73 | K | 36.7 | Very low | 41.2 | Very low | 193 Ų | 193 | 148.6 Ų | 148.6 | 84% | 0.839 | 79% | 0.787 | S | S | * | * | trans | -70.1 | 102.2 | -176.5 | -164.5 | -179.6 | -175.8 | -172.3 | 0 | 108.4 | P71 | P71-K73 PolarHBondContact O-N 2.92Š| ||
| 74 | L | 38.7 | Very low | 42.9 | Very low | 142 Ų | 142 | 146.8 Ų | 146.8 | 74% | 0.743 | 77% | 0.772 | S | S | * | * | trans | -56.9 | 144.6 | 173.8 | -65.6 | 171.6 | 0 | 0 | 0 | 109.2 | A72 D76 | A72-L74 PolarHBondContact O-N 2.97Å; L74-D76 PolarHBondContact O-N 3.32Å | ||
| 75 | P | 42.3 | Very low | 45.4 | Very low | 102 Ų | 102 | 144.9 Ų | 144.9 | 66% | 0.662 | 75% | 0.752 | S | S | * | * | trans | -64.9 | 132 | 166 | 28.8 | -32.5 | 0 | 0 | 0 | 108.7 | E77 | P75-E77 HydrophobicContact CB-CG 4.29Å; P75-E77 PolarHBondContact O-N 3.15Å | ||
| 76 | D | 49.4 | Very low | 47.8 | Very low | 144 Ų | 144 | 146 Ų | 146 | 77% | 0.77 | 75% | 0.75 | S | S | * | * | trans | -75.3 | 46.1 | 175 | -67 | -68 | 0 | 0 | 0 | 111.8 | L74 | L74-D76 PolarHBondContact O-N 3.32Š| ||
| 77 | E | 51.7 | Low | 50.4 | Low | 155 Ų | 155 | 144.3 Ų | 144.3 | 72% | 0.724 | 74% | 0.743 | S | S | * | * | trans | -93.8 | 158.1 | 169.9 | -65.1 | -69.2 | 143.2 | 0 | 0 | 109.4 | P75 C79 | P75-E77 HydrophobicContact CB-CG 4.29Å; P75-E77 PolarHBondContact O-N 3.15Å; E77-C79 VanDerWaalsContact C-N 3.31Å; E77-C79 PolarHBondContact O-N 3.38Å | ||
| 78 | D | 47.9 | Very low | 53 | Low | 145 Ų | 145 | 139.4 Ų | 139.4 | 78% | 0.775 | 72% | 0.724 | S | S | * | * | trans | 60.3 | 26.4 | -179 | -69.2 | -25.7 | 0 | 0 | 0 | 117 | I80 | D78-I80 PolarHBondContact O-N 3.35Š| ||
| 79 | C | 44.7 | Very low | 55.6 | Low | 120 Ų | 120 | 131.8 Ų | 131.8 | 81% | 0.811 | 70% | 0.7 | S | S | * | * | trans | -67.2 | 69.8 | 144.5 | -89.8 | 0 | 0 | 0 | 0 | 110 | E77 Q81 | E77-C79 VanDerWaalsContact C-N 3.31Å; E77-C79 PolarHBondContact O-N 3.38Å; C79-Q81 PolarHBondContact O-N 2.85Å; C79-Q81 VanDerWaalsContact O-N 3.1Å | ||
| 80 | I | 58.7 | Low | 58.2 | Low | 119 Ų | 119 | 124.4 Ų | 124.4 | 61% | 0.61 | 68% | 0.675 | S | S | * | * | trans | -51.5 | 118.9 | 177.8 | -59.1 | 174.4 | 0 | 0 | 0 | 108.2 | D78 L82 | D78-I80 PolarHBondContact O-N 3.35Å; I80-L82 HydrophobicContact CB-CG 4.28Å; I80-L82 HydrophobicContact CG2-CD2 3.81Å; I80-L82 HydrophobicContact CG2-CG 3.92Å; I80-L82 WeakPolarHBondContact O-CG 3.41Å; I80-L82 PolarHBondContact O-N 2.93Å | ||
| 81 | Q | 50 | Low | 60.8 | Low | 182 Ų | 182 | 121.3 Ų | 121.3 | 85% | 0.85 | 66% | 0.662 | S | S | * | * | trans | -76.5 | 76.1 | -176.5 | -160.7 | 171.2 | 23.3 | 0 | 0 | 110.2 | C79 N83 | C79-Q81 PolarHBondContact O-N 2.85Å; C79-Q81 VanDerWaalsContact O-N 3.1Å; Q81-N83 PolarHBondContact O-N 3.39Å | ||
| 82 | L | 56.8 | Low | 63.2 | Low | 152 Ų | 152 | 119.4 Ų | 119.4 | 80% | 0.796 | 65% | 0.651 | S | S | * | * | trans | -67.6 | 28.9 | -172.9 | -72.9 | 171.1 | 0 | 0 | 0 | 115.1 | I80 P84 | I80-L82 HydrophobicContact CB-CG 4.28Å; I80-L82 HydrophobicContact CG2-CD2 3.81Å; I80-L82 HydrophobicContact CG2-CG 3.92Å; I80-L82 WeakPolarHBondContact O-CG 3.41Å; I80-L82 PolarHBondContact O-N 2.93Å; L82-P84 VanDerWaalsContact O-CD 3.26Å; L82-P84 WeakPolarHBondContact O-CD 3.35Å | ||
| 83 | N | 55.7 | Low | 65.8 | Low | 137 Ų | 137 | 117.7 Ų | 117.7 | 73% | 0.733 | 63% | 0.634 | S | S | * | * | trans | -113.8 | 65.1 | 166.1 | -167.6 | -0.2 | 0 | 0 | 0 | 110.7 | Q81 S85 | Q81-N83 PolarHBondContact O-N 3.39Å; N83-S85 PolarHBondContact O-N 3.34Å | ||
| 84 | P | 65 | Low | 68.3 | Low | 77 Ų | 77 | 113.6 Ų | 113.6 | 50% | 0.5 | 62% | 0.62 | S | S | . | * | trans | -62.3 | 110.9 | 165 | 28.4 | -31.4 | 0 | 0 | 0 | 107.2 | L82 I89 | L82-P84 VanDerWaalsContact O-CD 3.26Å; L82-P84 WeakPolarHBondContact O-CD 3.35Å; P84-I89 HydrophobicContact CB-CG1 4.15Å; P84-I89 HydrophobicContact CG-CD1 4.22Å; P84-I89 HydrophobicContact CG-CG1 4.14Å; P84-I89 WeakPolarHBondContact O-CD1 3.36Å | ||
| 85 | S | 83.3 | Confident | 70.7 | Confident | 66 Ų | 66 | 111.5 Ų | 111.5 | 46% | 0.462 | 61% | 0.609 | S | S | . | * | trans | -49.2 | 146.7 | -177.2 | 68.2 | 0 | 0 | 0 | 0 | 111.5 | N83 K87 G88 I89 | N83-S85 PolarHBondContact O-N 3.34Å; S85-K87 PolarHBondContact O-N 3.41Å; S85-G88 WeakPolarHBondContact O-CA 3.26Å; S85-G88 PolarHBondContact O-N 3.32Å; S85-G88 PolarHBondContact OG-N 2.86Å; S85-I89 PolarHBondContact O-N 3.5Å; S85-I89 VanDerWaalsContact O-N 3.08Å | ||
| 86 | F | 82.4 | Confident | 73 | Confident | 178 Ų | 178 | 109.4 Ų | 109.4 | 78% | 0.781 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -49.7 | -36.9 | 178.5 | 178.8 | -101.1 | 0 | 0 | 0 | 112.6 | I89 A90 | F86-I89 PolarHBondContact O-N 3.12Å; F86-A90 VanDerWaalsContact O-CB 3.29Å; F86-A90 WeakPolarHBondContact O-CB 3.47Å; F86-A90 PolarHBondContact O-N 3.26Å |
| 87 | K | 86.4 | Confident | 75 | Confident | 153 Ų | 153 | 107.4 Ų | 107.4 | 67% | 0.665 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -58.3 | -44.6 | 171.8 | -177 | 180 | 178.8 | -178.4 | 0 | 113 | S85 M91 | S85-K87 PolarHBondContact O-N 3.41Å; K87-M91 WeakPolarHBondContact O-CB 3.24Å; K87-M91 WeakPolarHBondContact O-CG 3.25Å; K87-M91 PolarHBondContact O-N 3.11Å |
| 88 | G | 86.4 | Confident | 77 | Confident | 29 Ų | 29 | 100.6 Ų | 100.6 | 30% | 0.299 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -63.8 | -48.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S85 A90 M91 S92 | S85-G88 WeakPolarHBondContact O-CA 3.26Å; S85-G88 PolarHBondContact O-N 3.32Å; S85-G88 PolarHBondContact OG-N 2.86Å; G88-A90 VanDerWaalsContact C-N 3.3Å; G88-A90 PolarHBondContact O-N 2.94Å; G88-M91 PolarHBondContact O-N 3.36Å; G88-S92 PolarHBondContact O-N 3.26Å; G88-S92 PolarHBondContact O-OG 2.56Å |
| 89 | I | 88.4 | Confident | 79 | Confident | 88 Ų | 88 | 96.4 Ų | 96.4 | 45% | 0.451 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -57.5 | -45.9 | 176.4 | -55.5 | 173.5 | 0 | 0 | 0 | 110.2 | P84 S85 F86 S93 | P84-I89 HydrophobicContact CB-CG1 4.15Å; P84-I89 HydrophobicContact CG-CD1 4.22Å; P84-I89 HydrophobicContact CG-CG1 4.14Å; P84-I89 WeakPolarHBondContact O-CD1 3.36Å; S85-I89 PolarHBondContact O-N 3.5Å; S85-I89 VanDerWaalsContact O-N 3.08Å; F86-I89 PolarHBondContact O-N 3.12Å; I89-S93 VanDerWaalsContact O-CB 3.3Å; I89-S93 WeakPolarHBondContact O-CB 3.26Å; I89-S93 PolarHBondContact O-N 3.44Å; I89-S93 PolarHBondContact O-OG 3.04Å |
| 90 | A | 89.3 | Confident | 81.3 | Confident | 34 Ų | 34 | 93.5 Ų | 93.5 | 28% | 0.281 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -44.6 | 179 | 0 | 0 | 0 | 0 | 0 | 112.3 | F86 G88 S93 L94 | F86-A90 VanDerWaalsContact O-CB 3.29Å; F86-A90 WeakPolarHBondContact O-CB 3.47Å; F86-A90 PolarHBondContact O-N 3.26Å; G88-A90 VanDerWaalsContact C-N 3.3Å; G88-A90 PolarHBondContact O-N 2.94Å; A90-S93 PolarHBondContact O-N 2.88Å; A90-L94 WeakPolarHBondContact O-CB 3.42Å; A90-L94 WeakPolarHBondContact O-CG 3.42Å; A90-L94 PolarHBondContact O-N 2.9Å |
| 91 | M | 88.6 | Confident | 82.8 | Confident | 115 Ų | 115 | 91.6 Ų | 91.6 | 57% | 0.567 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.7 | -45.3 | 178.5 | -72.4 | -67.6 | 174.9 | 0 | 0 | 112.6 | K87 G88 S93 L94 L95 | K87-M91 WeakPolarHBondContact O-CB 3.24Å; K87-M91 WeakPolarHBondContact O-CG 3.25Å; K87-M91 PolarHBondContact O-N 3.11Å; G88-M91 PolarHBondContact O-N 3.36Å; M91-S93 VanDerWaalsContact C-N 3.27Å; M91-S93 PolarHBondContact O-N 2.86Å; M91-L94 PolarHBondContact O-N 2.8Å; M91-L95 WeakPolarHBondContact O-CB 3.47Å; M91-L95 PolarHBondContact O-N 2.84Å |
| 92 | S | 88.8 | Confident | 84.9 | Confident | 84 Ų | 84 | 82.9 Ų | 82.9 | 59% | 0.587 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -60.7 | -38.2 | 173.8 | -63.5 | 0 | 0 | 0 | 0 | 111.9 | G88 A96 | G88-S92 PolarHBondContact O-N 3.26Å; G88-S92 PolarHBondContact O-OG 2.56Å; S92-A96 WeakPolarHBondContact O-CB 3.49Å; S92-A96 PolarHBondContact O-N 2.83Å |
| 93 | S | 90.4 | Very high | 86.4 | Confident | 57 Ų | 57 | 80.3 Ų | 80.3 | 40% | 0.399 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -67.6 | -44.6 | 177.5 | -56.5 | 0 | 0 | 0 | 0 | 112.1 | I89 A90 M91 A96 I97 | I89-S93 VanDerWaalsContact O-CB 3.3Å; I89-S93 WeakPolarHBondContact O-CB 3.26Å; I89-S93 PolarHBondContact O-N 3.44Å; I89-S93 PolarHBondContact O-OG 3.04Å; A90-S93 PolarHBondContact O-N 2.88Å; M91-S93 VanDerWaalsContact C-N 3.27Å; M91-S93 PolarHBondContact O-N 2.86Å; S93-A96 PolarHBondContact O-N 3.09Å; S93-I97 WeakPolarHBondContact O-CD1 3.43Å; S93-I97 VanDerWaalsContact O-CG1 3.27Å; S93-I97 WeakPolarHBondContact O-CG1 3.28Å; S93-I97 PolarHBondContact O-N 3.37Å |
| 94 | L | 89.1 | Confident | 88.1 | Confident | 107 Ų | 107 | 82.8 Ų | 82.8 | 56% | 0.56 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -62.3 | -41.5 | 175.6 | -73.3 | 169.8 | 0 | 0 | 0 | 111.9 | A90 M91 I97 D98 | A90-L94 WeakPolarHBondContact O-CB 3.42Å; A90-L94 WeakPolarHBondContact O-CG 3.42Å; A90-L94 PolarHBondContact O-N 2.9Å; M91-L94 PolarHBondContact O-N 2.8Å; L94-I97 PolarHBondContact O-N 2.65Å; L94-D98 PolarHBondContact O-N 2.97Å |
| 95 | L | 89.6 | Confident | 89.3 | Confident | 98 Ų | 98 | 81.6 Ų | 81.6 | 51% | 0.513 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -66.9 | -38 | 176.4 | -177.3 | 145.2 | 0 | 0 | 0 | 112 | M91 I97 D98 I99 | M91-L95 WeakPolarHBondContact O-CB 3.47Å; M91-L95 PolarHBondContact O-N 2.84Å; L95-I97 VanDerWaalsContact C-N 3.34Å; L95-D98 PolarHBondContact O-N 3.29Å; L95-I99 HydrophobicContact CD2-CD1 3.61Å; L95-I99 HydrophobicContact CG-CD1 4.34Å; L95-I99 WeakPolarHBondContact O-CG1 3.46Å; L95-I99 PolarHBondContact O-N 3.44Å |
| 96 | A | 90.9 | Very high | 89.5 | Confident | 57 Ų | 57 | 78.6 Ų | 78.6 | 47% | 0.471 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -64.8 | -37.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S92 S93 C100 | S92-A96 WeakPolarHBondContact O-CB 3.49Å; S92-A96 PolarHBondContact O-N 2.83Å; S93-A96 PolarHBondContact O-N 3.09Å; A96-C100 WeakPolarHBondContact O-CB 3.38Å; A96-C100 PolarHBondContact O-N 3.49Å |
| 97 | I | 91.6 | Very high | 89.9 | Confident | 103 Ų | 103 | 72 Ų | 72 | 53% | 0.528 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66.3 | -46.1 | 174.4 | -69.2 | 162.2 | 0 | 0 | 0 | 110.9 | S93 L94 L95 I99 C100 L101 | S93-I97 WeakPolarHBondContact O-CD1 3.43Å; S93-I97 VanDerWaalsContact O-CG1 3.27Å; S93-I97 WeakPolarHBondContact O-CG1 3.28Å; S93-I97 PolarHBondContact O-N 3.37Å; L94-I97 PolarHBondContact O-N 2.65Å; L95-I97 VanDerWaalsContact C-N 3.34Å; I97-I99 PolarHBondContact O-N 3.3Å; I97-C100 PolarHBondContact O-N 3.46Å; I97-L101 VanDerWaalsContact O-CB 3.28Å; I97-L101 WeakPolarHBondContact O-CB 3.31Å; I97-L101 PolarHBondContact O-N 3.12Å |
| 98 | D | 93.3 | Very high | 90 | Very high | 12 Ų | 12 | 64.7 Ų | 64.7 | 6% | 0.064 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -56 | -49.1 | 175.4 | 174.6 | 49.4 | 0 | 0 | 0 | 111.7 | L94 L95 S102 R177 H245 L246 T247 | L94-D98 PolarHBondContact O-N 2.97Å; L95-D98 PolarHBondContact O-N 3.29Å; D98-S102 WeakPolarHBondContact O-CB 3.42Å; D98-S102 PolarHBondContact O-N 3.03Å; D98-S102 PolarHBondContact O-OG 2.84Å; D98-S102 PolarHBondContact OD1-OG 2.95Å; D98-R177 IonicContact OD2-CZ 2.72Å; D98-R177 IonicContact OD2-NH1 3.5Å; D98-R177 IonicContact OD2-NH2 2.79Å; D98-R177 PolarHBondContact OD2-NH2 3.16Å; D98-H245 WeakPolarHBondContact OD2-CB 3.33Å; D98-L246 PolarHBondContact OD1-N 3.47Å; D98-T247 HydrophobicContact CB-CG2 4Å; D98-T247 VanDerWaalsContact CG-CG2 3.44Å; D98-T247 VanDerWaalsContact CG-OG1 3.28Å; D98-T247 PolarHBondContact OD1-N 3.04Å; D98-T247 PolarHBondContact OD1-OG1 2.89Å; D98-T247 WeakPolarHBondContact OD2-CG2 3.49Å; D98-T247 PolarHBondContact OD2-OG1 2.96Å |
| 99 | I | 90.6 | Very high | 90 | Very high | 56 Ų | 56 | 63.3 Ų | 63.3 | 29% | 0.287 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64.3 | -44 | 177.9 | -67.4 | 171.8 | 0 | 0 | 0 | 111.3 | L95 I97 K103 | L95-I99 HydrophobicContact CD2-CD1 3.61Å; L95-I99 HydrophobicContact CG-CD1 4.34Å; L95-I99 WeakPolarHBondContact O-CG1 3.46Å; L95-I99 PolarHBondContact O-N 3.44Å; I97-I99 PolarHBondContact O-N 3.3Å; I99-K103 HydrophobicContact CG2-CD 4.29Å; I99-K103 WeakPolarHBondContact O-CB 3.43Å; I99-K103 WeakPolarHBondContact O-CG 3.26Å; I99-K103 PolarHBondContact O-N 3.41Å |
| 100 | C | 91.9 | Very high | 89.7 | Confident | 60 Ų | 60 | 63.6 Ų | 63.6 | 41% | 0.405 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -62.6 | -46.4 | 179.3 | -176.4 | 0 | 0 | 0 | 0 | 111.7 | A96 I97 R104 | A96-C100 WeakPolarHBondContact O-CB 3.38Å; A96-C100 PolarHBondContact O-N 3.49Å; I97-C100 PolarHBondContact O-N 3.46Å; C100-R104 VanDerWaalsContact O-CG 3.27Å; C100-R104 WeakPolarHBondContact O-CG 3.32Å; C100-R104 PolarHBondContact O-N 3.34Å |
| 101 | L | 91.3 | Very high | 89.2 | Confident | 78 Ų | 78 | 67.9 Ų | 67.9 | 41% | 0.408 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -70.6 | -41.6 | -179.6 | -173.1 | 56.2 | 0 | 0 | 0 | 111.4 | I97 K103 R104 L105 L246 | I97-L101 VanDerWaalsContact O-CB 3.28Å; I97-L101 WeakPolarHBondContact O-CB 3.31Å; I97-L101 PolarHBondContact O-N 3.12Å; L101-K103 PolarHBondContact O-N 3.28Å; L101-R104 PolarHBondContact O-N 2.89Å; L101-L105 HydrophobicContact CD1-CD1 4.39Å; L101-L105 HydrophobicContact CD1-CG 4.35Å; L101-L105 HydrophobicContact CG-CD1 4.17Å; L101-L105 WeakPolarHBondContact O-CB 3.29Å; L101-L105 WeakPolarHBondContact O-CG 3.49Å; L101-L105 PolarHBondContact O-N 2.91Å; L101-L246 HydrophobicContact CB-CD1 4.21Å; L101-L246 HydrophobicContact CD2-CD1 3.43Å; L101-L246 VanDerWaalsContact CD2-CD1 3.43Å; L101-L246 HydrophobicContact CG-CD1 3.57Å |
| 102 | S | 92.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 67.7 Ų | 67.7 | 0% | 0 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -63.4 | -40.5 | 176 | -57.4 | 0 | 0 | 0 | 0 | 112.2 | D98 L105 G106 H245 L246 | D98-S102 WeakPolarHBondContact O-CB 3.42Å; D98-S102 PolarHBondContact O-N 3.03Å; D98-S102 PolarHBondContact O-OG 2.84Å; D98-S102 PolarHBondContact OD1-OG 2.95Å; S102-L105 PolarHBondContact O-N 3.26Å; S102-G106 PolarHBondContact O-N 3.5Å; S102-G106 VanDerWaalsContact O-N 3.15Å; S102-H245 WeakPolarHBondContact OG-CA 3.49Å; S102-L246 PolarHBondContact OG-N 3.34Å |
| 103 | K | 89.4 | Confident | 88.4 | Confident | 98 Ų | 98 | 65.1 Ų | 65.1 | 43% | 0.426 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -64.2 | -40.3 | 172.5 | -78.1 | -175.1 | 172.1 | -174.2 | 0 | 112.3 | I99 L101 G106 P180 | I99-K103 HydrophobicContact CG2-CD 4.29Å; I99-K103 WeakPolarHBondContact O-CB 3.43Å; I99-K103 WeakPolarHBondContact O-CG 3.26Å; I99-K103 PolarHBondContact O-N 3.41Å; L101-K103 PolarHBondContact O-N 3.28Å; K103-G106 PolarHBondContact O-N 2.78Å; K103-P180 WeakPolarHBondContact CE-O 3.31Å; K103-P180 HydrophobicContact CG-CB 4.12Å |
| 104 | R | 90.1 | Very high | 88 | Confident | 188 Ų | 188 | 67.2 Ų | 67.2 | 71% | 0.709 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -65.9 | -35.5 | 175.5 | -74.5 | 172.2 | -178.9 | -135.3 | 0.6 | 113.3 | C100 L101 G106 | C100-R104 VanDerWaalsContact O-CG 3.27Å; C100-R104 WeakPolarHBondContact O-CG 3.32Å; C100-R104 PolarHBondContact O-N 3.34Å; L101-R104 PolarHBondContact O-N 2.89Å; R104-G106 VanDerWaalsContact C-N 3.34Å |
| 105 | L | 90.8 | Very high | 87.9 | Confident | 53 Ų | 53 | 69.6 Ų | 69.6 | 28% | 0.277 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -78.1 | -15.9 | 178.3 | -71.1 | 175 | 0 | 0 | 0 | 113.6 | L101 S102 V107 V239 L240 L246 | L101-L105 HydrophobicContact CD1-CD1 4.39Å; L101-L105 HydrophobicContact CD1-CG 4.35Å; L101-L105 HydrophobicContact CG-CD1 4.17Å; L101-L105 WeakPolarHBondContact O-CB 3.29Å; L101-L105 WeakPolarHBondContact O-CG 3.49Å; L101-L105 PolarHBondContact O-N 2.91Å; S102-L105 PolarHBondContact O-N 3.26Å; L105-V107 PolarHBondContact O-N 3.07Å; L105-V239 HydrophobicContact CB-CG1 4.02Å; L105-V239 HydrophobicContact CD1-CG1 4.26Å; L105-L240 WeakPolarHBondContact O-CA 3.46Å; L105-L240 WeakPolarHBondContact O-CD2 3.45Å; L105-L246 HydrophobicContact CD1-CD1 3.74Å; L105-L246 HydrophobicContact CD1-CD2 3.91Å; L105-L246 HydrophobicContact CD1-CG 4.04Å |
| 106 | G | 88.6 | Confident | 87.7 | Confident | 3 Ų | 3 | 65.4 Ų | 65.4 | 3% | 0.031 | 35% | 0.35 | C | S | . | . | trans | -67.6 | 38.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | S102 K103 R104 C108 A109 L240 | S102-G106 PolarHBondContact O-N 3.5Å; S102-G106 VanDerWaalsContact O-N 3.15Å; K103-G106 PolarHBondContact O-N 2.78Å; R104-G106 VanDerWaalsContact C-N 3.34Å; G106-C108 PolarHBondContact O-N 3.15Å; G106-C108 VanDerWaalsContact O-N 3.14Å; G106-A109 WeakPolarHBondContact O-CB 3.45Å; G106-A109 PolarHBondContact O-N 3.44Å; G106-L240 CarbonylContact C-O 3.32Å; G106-L240 VanDerWaalsContact C-O 3.32Å; G106-L240 WeakPolarHBondContact CA-O 3.41Å | ||
| 107 | V | 91.1 | Very high | 87.6 | Confident | 39 Ų | 39 | 67.8 Ų | 67.8 | 24% | 0.236 | 36% | 0.364 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.3 | -12.8 | -174.5 | -62.4 | 0 | 0 | 0 | 0 | 114.4 | L105 S113 W115 L240 | L105-V107 PolarHBondContact O-N 3.07Å; V107-S113 WeakPolarHBondContact O-CB 3.28Å; V107-W115 HydrophobicContact CB-CB 4.12Å; V107-W115 HydrophobicContact CB-CG 4.34Å; V107-W115 HydrophobicContact CG2-CB 3.92Å; V107-W115 HydrophobicContact CG2-CD2 4.16Å; V107-W115 HydrophobicContact CG2-CE3 4.21Å; V107-W115 HydrophobicContact CG2-CG 4.05Å; V107-W115 PolarHBondContact O-N 3.5Å; V107-W115 VanDerWaalsContact O-N 3.1Å; V107-L240 HydrophobicContact CG2-CD2 4.2Å |
| 108 | C | 88.3 | Confident | 87.5 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 35% | 0.351 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -107.1 | 13 | 173.8 | -56.3 | 0 | 0 | 0 | 0 | 112.6 | G106 Y110 R119 L240 L241 | G106-C108 PolarHBondContact O-N 3.15Å; G106-C108 VanDerWaalsContact O-N 3.14Å; C108-Y110 PolarHBondContact O-N 3.34Å; C108-R119 HydrophobicContact CB-CB 4.29Å; C108-R119 WeakPolarHBondContact O-CD 3.43Å; C108-R119 PolarHBondContact O-NH1 3.35Å; C108-L240 CarbonylContact C-O 3.59Å; C108-L240 WeakPolarHBondContact CA-O 3.48Å; C108-L240 WeakPolarHBondContact CB-O 3.49Å; C108-L240 PolarHBondContact N-O 3.22Å; C108-L241 HydrophobicContact CB-CD2 4.21Å |
| 109 | A | 84.7 | Confident | 87.4 | Confident | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 36% | 0.36 | C | S | . | . | S | Bend | trans | -62.3 | -37.9 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | G106 R119 W181 M183 | G106-A109 WeakPolarHBondContact O-CB 3.45Å; G106-A109 PolarHBondContact O-N 3.44Å; A109-R119 VanDerWaalsContact C-NH1 3.33Å; A109-R119 PolarHBondContact O-NH1 3.33Å; A109-W181 HydrophobicContact CB-CD2 4.28Å; A109-W181 HydrophobicContact CB-CG 4.26Å; A109-M183 HydrophobicContact CB-CE 3.64Å; A109-M183 WeakPolarHBondContact O-CE 3.29Å |
| 110 | Y | 83.2 | Confident | 87.5 | Confident | 93 Ų | 93 | 68.5 Ų | 68.5 | 37% | 0.365 | 37% | 0.373 | S | S | . | . | S | Bend | trans | -131.5 | 164 | 175.9 | -56.6 | -79.4 | 0 | 0 | 0 | 110.9 | C108 S112 S113 G116 W181 E182 | C108-Y110 PolarHBondContact O-N 3.34Å; Y110-S112 PolarHBondContact O-N 2.96Å; Y110-S113 PolarHBondContact N-OG 3.05Å; Y110-S113 VanDerWaalsContact O-CB 3.27Å; Y110-S113 WeakPolarHBondContact O-CB 3.37Å; Y110-S113 PolarHBondContact O-N 3.42Å; Y110-S113 VanDerWaalsContact O-N 3.08Å; Y110-S113 PolarHBondContact O-OG 3.11Å; Y110-G116 WeakPolarHBondContact O-CA 3.31Å; Y110-W181 HydrophobicContact CE2-CD2 4.29Å; Y110-W181 AromaticContact CE2-CE3 3.66Å; Y110-W181 HydrophobicContact CE2-CE3 3.66Å; Y110-W181 AromaticContact CE2-CZ3 3.99Å; Y110-W181 HydrophobicContact CE2-CZ3 3.99Å; Y110-E182 PolarHBondContact OH-O 2.86Å |
| 111 | T | 78.1 | Confident | 87.6 | Confident | 125 Ų | 125 | 71.8 Ų | 71.8 | 77% | 0.767 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -24.2 | 174.2 | 45.3 | 0 | 0 | 0 | 0 | 112.8 | ||
| 112 | S | 78.8 | Confident | 87.8 | Confident | 111 Ų | 111 | 69.4 Ų | 69.4 | 78% | 0.776 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.9 | -2.3 | 172.9 | 53.2 | 0 | 0 | 0 | 0 | 114.4 | Y110 | Y110-S112 PolarHBondContact O-N 2.96Š|
| 113 | S | 83.2 | Confident | 87.8 | Confident | 30 Ų | 30 | 72.2 Ų | 72.2 | 21% | 0.21 | 39% | 0.388 | C | S | . | . | S | Bend | trans | -72.4 | 158.9 | 173.4 | -56.2 | 0 | 0 | 0 | 0 | 111 | V107 Y110 W115 G116 | V107-S113 WeakPolarHBondContact O-CB 3.28Å; Y110-S113 PolarHBondContact N-OG 3.05Å; Y110-S113 VanDerWaalsContact O-CB 3.27Å; Y110-S113 WeakPolarHBondContact O-CB 3.37Å; Y110-S113 PolarHBondContact O-N 3.42Å; Y110-S113 VanDerWaalsContact O-N 3.08Å; Y110-S113 PolarHBondContact O-OG 3.11Å; S113-W115 PolarHBondContact O-N 2.88Å; S113-W115 VanDerWaalsContact O-N 3.08Å; S113-G116 PolarHBondContact O-N 3.48Å |
| 114 | S | 81 | Confident | 88 | Confident | 100 Ų | 100 | 72.5 Ų | 72.5 | 70% | 0.699 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.1 | -32.3 | -174.3 | 51.5 | 0 | 0 | 0 | 0 | 114.3 | ||
| 115 | W | 87.4 | Confident | 88.3 | Confident | 157 Ų | 157 | 65.6 Ų | 65.6 | 60% | 0.595 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.5 | 27.2 | 177.3 | -76.6 | 27 | 0 | 0 | 0 | 111.6 | V107 S113 S117 V118 R119 | V107-W115 HydrophobicContact CB-CB 4.12Å; V107-W115 HydrophobicContact CB-CG 4.34Å; V107-W115 HydrophobicContact CG2-CB 3.92Å; V107-W115 HydrophobicContact CG2-CD2 4.16Å; V107-W115 HydrophobicContact CG2-CE3 4.21Å; V107-W115 HydrophobicContact CG2-CG 4.05Å; V107-W115 PolarHBondContact O-N 3.5Å; V107-W115 VanDerWaalsContact O-N 3.1Å; S113-W115 PolarHBondContact O-N 2.88Å; S113-W115 VanDerWaalsContact O-N 3.08Å; W115-S117 PolarHBondContact O-N 3.11Å; W115-S117 VanDerWaalsContact O-N 3.16Å; W115-V118 HydrophobicContact CB-CG2 3.85Å; W115-V118 HydrophobicContact CD2-CG2 4.44Å; W115-V118 HydrophobicContact CE3-CG2 4.03Å; W115-V118 HydrophobicContact CG-CG2 4.43Å; W115-V118 WeakPolarHBondContact O-CG2 3.46Å; W115-V118 PolarHBondContact O-N 3.04Å; W115-R119 PolarHBondContact O-N 3.31Å |
| 116 | G | 84.2 | Confident | 88.4 | Confident | 10 Ų | 10 | 63.3 Ų | 63.3 | 10% | 0.103 | 36% | 0.359 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59 | -25.8 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | Y110 S113 R119 | Y110-G116 WeakPolarHBondContact O-CA 3.31Å; S113-G116 PolarHBondContact O-N 3.48Å; G116-R119 WeakPolarHBondContact O-CB 3.32Å; G116-R119 PolarHBondContact O-N 3.33Å |
| 117 | S | 89.3 | Confident | 88.7 | Confident | 107 Ų | 107 | 66.5 Ų | 66.5 | 75% | 0.748 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67.1 | -43 | 175.6 | 53.3 | 0 | 0 | 0 | 0 | 113 | W115 R119 | W115-S117 PolarHBondContact O-N 3.11Å; W115-S117 VanDerWaalsContact O-N 3.16Å; S117-R119 VanDerWaalsContact C-N 3.25Å; S117-R119 PolarHBondContact O-N 2.93Å |
| 118 | V | 90.9 | Very high | 88.9 | Confident | 45 Ų | 45 | 67.2 Ų | 67.2 | 27% | 0.273 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | -5.1 | 179.2 | -62.5 | 0 | 0 | 0 | 0 | 113.2 | W115 S120 M121 I122 | W115-V118 HydrophobicContact CB-CG2 3.85Å; W115-V118 HydrophobicContact CD2-CG2 4.44Å; W115-V118 HydrophobicContact CE3-CG2 4.03Å; W115-V118 HydrophobicContact CG-CG2 4.43Å; W115-V118 WeakPolarHBondContact O-CG2 3.46Å; W115-V118 PolarHBondContact O-N 3.04Å; V118-S120 PolarHBondContact O-N 2.94Å; V118-S120 VanDerWaalsContact O-N 3.07Å; V118-M121 WeakPolarHBondContact O-CB 3.33Å; V118-M121 PolarHBondContact O-N 3.18Å; V118-I122 WeakPolarHBondContact O-CG1 3.36Å; V118-I122 PolarHBondContact O-N 2.8Å |
| 119 | R | 91.3 | Very high | 89.2 | Confident | 62 Ų | 62 | 67.2 Ų | 67.2 | 23% | 0.234 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -48.8 | -37.4 | 175.8 | -179.1 | -180 | 170.1 | 89.1 | -11.5 | 112.9 | C108 A109 W115 G116 S117 T123 L241 | C108-R119 HydrophobicContact CB-CB 4.29Å; C108-R119 WeakPolarHBondContact O-CD 3.43Å; C108-R119 PolarHBondContact O-NH1 3.35Å; A109-R119 VanDerWaalsContact C-NH1 3.33Å; A109-R119 PolarHBondContact O-NH1 3.33Å; W115-R119 PolarHBondContact O-N 3.31Å; G116-R119 WeakPolarHBondContact O-CB 3.32Å; G116-R119 PolarHBondContact O-N 3.33Å; S117-R119 VanDerWaalsContact C-N 3.25Å; S117-R119 PolarHBondContact O-N 2.93Å; R119-T123 WeakPolarHBondContact O-CB 3.34Å; R119-T123 PolarHBondContact O-N 2.85Å; R119-T123 PolarHBondContact O-OG1 2.89Å; R119-L241 HydrophobicContact CG-CD2 3.77Å |
| 120 | S | 91.4 | Very high | 89.6 | Confident | 80 Ų | 80 | 67.5 Ų | 67.5 | 56% | 0.559 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -62.7 | -49.9 | 176.3 | -171.8 | 0 | 0 | 0 | 0 | 111.7 | V118 I122 T123 L124 | V118-S120 PolarHBondContact O-N 2.94Å; V118-S120 VanDerWaalsContact O-N 3.07Å; S120-I122 PolarHBondContact O-N 2.96Å; S120-T123 WeakPolarHBondContact O-CB 3.19Å; S120-T123 PolarHBondContact O-N 2.93Å; S120-T123 VanDerWaalsContact O-N 3.1Å; S120-L124 WeakPolarHBondContact O-CG 3.19Å; S120-L124 PolarHBondContact O-N 3.42Å |
| 121 | M | 94.3 | Very high | 90 | Very high | 129 Ų | 129 | 63.2 Ų | 63.2 | 64% | 0.635 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -61.5 | -42.3 | 177 | -62.2 | 175.3 | 69.7 | 0 | 0 | 112.1 | V118 T123 L124 L125 | V118-M121 WeakPolarHBondContact O-CB 3.33Å; V118-M121 PolarHBondContact O-N 3.18Å; M121-T123 VanDerWaalsContact C-N 3.28Å; M121-T123 PolarHBondContact O-N 3.36Å; M121-L124 PolarHBondContact O-N 2.97Å; M121-L125 WeakPolarHBondContact O-CB 3.37Å; M121-L125 PolarHBondContact O-N 3.35Å |
| 122 | I | 94.8 | Very high | 90.7 | Very high | 27 Ų | 27 | 60.9 Ų | 60.9 | 14% | 0.138 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -66.7 | -30.9 | 176.3 | -55.7 | -57.5 | 0 | 0 | 0 | 111.4 | V118 S120 A126 L240 L241 | V118-I122 WeakPolarHBondContact O-CG1 3.36Å; V118-I122 PolarHBondContact O-N 2.8Å; S120-I122 PolarHBondContact O-N 2.96Å; I122-A126 WeakPolarHBondContact O-CB 3.27Å; I122-A126 PolarHBondContact O-N 3.4Å; I122-L240 HydrophobicContact CD1-CD1 4.21Å; I122-L240 HydrophobicContact CG2-CB 4.18Å; I122-L240 HydrophobicContact CG2-CD1 4.42Å; I122-L241 HydrophobicContact CB-CD2 4.49Å; I122-L241 HydrophobicContact CG2-CD1 4.05Å; I122-L241 HydrophobicContact CG2-CD2 4.26Å; I122-L241 HydrophobicContact CG2-CG 3.78Å |
| 123 | T | 92.6 | Very high | 91.4 | Very high | 59 Ų | 59 | 58.7 Ų | 58.7 | 36% | 0.362 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -73.5 | -38.1 | 174.5 | -56.1 | 0 | 0 | 0 | 0 | 112 | R119 S120 M121 A126 L127 | R119-T123 WeakPolarHBondContact O-CB 3.34Å; R119-T123 PolarHBondContact O-N 2.85Å; R119-T123 PolarHBondContact O-OG1 2.89Å; S120-T123 WeakPolarHBondContact O-CB 3.19Å; S120-T123 PolarHBondContact O-N 2.93Å; S120-T123 VanDerWaalsContact O-N 3.1Å; M121-T123 VanDerWaalsContact C-N 3.28Å; M121-T123 PolarHBondContact O-N 3.36Å; T123-A126 WeakPolarHBondContact O-CB 3.35Å; T123-A126 PolarHBondContact O-N 3.04Å; T123-L127 PolarHBondContact O-N 3.05Å |
| 124 | L | 94.1 | Very high | 92 | Very high | 105 Ų | 105 | 60.1 Ų | 60.1 | 55% | 0.55 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -64.9 | -41.2 | 172 | -69.7 | 171.3 | 0 | 0 | 0 | 111.6 | S120 M121 L127 T128 | S120-L124 WeakPolarHBondContact O-CG 3.19Å; S120-L124 PolarHBondContact O-N 3.42Å; M121-L124 PolarHBondContact O-N 2.97Å; L124-L127 WeakPolarHBondContact O-CB 3.38Å; L124-L127 PolarHBondContact O-N 2.97Å; L124-T128 PolarHBondContact O-N 2.74Å |
| 125 | L | 96.2 | Very high | 92.7 | Very high | 43 Ų | 43 | 56.9 Ų | 56.9 | 23% | 0.225 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -58.2 | -47.9 | 170.9 | 172.3 | 62.3 | 0 | 0 | 0 | 111.2 | M121 L127 T128 L233 V234 | M121-L125 WeakPolarHBondContact O-CB 3.37Å; M121-L125 PolarHBondContact O-N 3.35Å; L125-L127 VanDerWaalsContact C-N 3.29Å; L125-L127 PolarHBondContact O-N 3.24Å; L125-T128 PolarHBondContact O-N 2.92Å; L125-T128 VanDerWaalsContact O-N 3.12Å; L125-T128 PolarHBondContact O-OG1 3.32Å; L125-L233 HydrophobicContact CD1-CB 4.26Å; L125-L233 HydrophobicContact CD2-CB 4.06Å; L125-V234 HydrophobicContact CD1-CG2 3.95Å |
| 126 | A | 94 | Very high | 93.1 | Very high | 4 Ų | 4 | 56.1 Ų | 56.1 | 3% | 0.033 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -58.4 | -39.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I122 T123 T128 G129 H130 H202 S237 L241 | I122-A126 WeakPolarHBondContact O-CB 3.27Å; I122-A126 PolarHBondContact O-N 3.4Å; T123-A126 WeakPolarHBondContact O-CB 3.35Å; T123-A126 PolarHBondContact O-N 3.04Å; A126-T128 PolarHBondContact O-N 2.97Å; A126-G129 WeakPolarHBondContact O-CA 3.3Å; A126-G129 PolarHBondContact O-N 3.06Å; A126-H130 PolarHBondContact O-N 2.94Å; A126-H202 PolarHBondContact O-CD2 3.49Å; A126-H202 VanDerWaalsContact O-CD2 3.24Å; A126-S237 WeakPolarHBondContact CB-OG 3.35Å; A126-L241 HydrophobicContact CB-CD1 4.2Å |
| 127 | L | 94 | Very high | 93.7 | Very high | 70 Ų | 70 | 57 Ų | 57 | 37% | 0.366 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.6 | -28.3 | 177.5 | -175.9 | 62.4 | 0 | 0 | 0 | 113.1 | T123 L124 L125 G129 H130 T133 L188 | T123-L127 PolarHBondContact O-N 3.05Å; L124-L127 WeakPolarHBondContact O-CB 3.38Å; L124-L127 PolarHBondContact O-N 2.97Å; L125-L127 VanDerWaalsContact C-N 3.29Å; L125-L127 PolarHBondContact O-N 3.24Å; L127-G129 VanDerWaalsContact C-N 3.27Å; L127-G129 PolarHBondContact O-N 3.44Å; L127-H130 HydrophobicContact CD1-CB 4.14Å; L127-H130 WeakPolarHBondContact O-CB 3.29Å; L127-H130 PolarHBondContact O-N 3.49Å; L127-T133 PolarHBondContact O-OG1 2.84Å; L127-L188 HydrophobicContact CD1-CD1 3.91Å |
| 128 | T | 95.6 | Very high | 94.1 | Very high | 55 Ų | 55 | 52.1 Ų | 52.1 | 34% | 0.337 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -68.2 | -24.9 | 172.7 | 72 | 0 | 0 | 0 | 0 | 113 | L124 L125 A126 W134 W230 | L124-T128 PolarHBondContact O-N 2.74Å; L125-T128 PolarHBondContact O-N 2.92Å; L125-T128 VanDerWaalsContact O-N 3.12Å; L125-T128 PolarHBondContact O-OG1 3.32Å; A126-T128 PolarHBondContact O-N 2.97Å; T128-W134 PolarHBondContact O-NE1 2.91Å; T128-W230 PolarHBondContact OG1-NE1 2.96Å |
| 129 | G | 93.4 | Very high | 94.3 | Very high | 0 Ų | 0 | 53.7 Ų | 53.7 | 0% | 0 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.5 | 5.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | A126 L127 R205 | A126-G129 WeakPolarHBondContact O-CA 3.3Å; A126-G129 PolarHBondContact O-N 3.06Å; L127-G129 VanDerWaalsContact C-N 3.27Å; L127-G129 PolarHBondContact O-N 3.44Å; G129-R205 PolarHBondContact O-NE 3.38Å; G129-R205 VanDerWaalsContact O-NE 3.09Å |
| 130 | H | 94.1 | Very high | 94.5 | Very high | 6 Ų | 6 | 53.7 Ų | 53.7 | 3% | 0.028 | 29% | 0.294 | C | S | . | . | trans | -79.2 | 137.1 | -171.9 | -159.2 | -104 | 0 | 0 | 0 | 111.5 | A126 L127 I132 T133 W134 L188 A192 H202 | A126-H130 PolarHBondContact O-N 2.94Å; L127-H130 HydrophobicContact CD1-CB 4.14Å; L127-H130 WeakPolarHBondContact O-CB 3.29Å; L127-H130 PolarHBondContact O-N 3.49Å; H130-I132 VanDerWaalsContact C-N 3.34Å; H130-I132 PolarHBondContact O-N 3.18Å; H130-T133 WeakPolarHBondContact O-CB 3.31Å; H130-T133 PolarHBondContact O-N 3.34Å; H130-T133 VanDerWaalsContact O-N 3.15Å; H130-W134 PolarHBondContact O-N 3.39Å; H130-L188 PolarHBondContact CE1-O 2.93Å; H130-L188 PolarHBondContact NE2-O 3.26Å; H130-L188 VanDerWaalsContact NE2-O 3.13Å; H130-A192 VanDerWaalsContact CE1-CB 3.49Å; H130-A192 WeakPolarHBondContact CE1-CB 3.41Å; H130-A192 WeakPolarHBondContact NE2-CB 3.09Å; H130-H202 AromaticContact CD2-CE1 3.95Å; H130-H202 AromaticContact CD2-NE2 3.54Å | ||
| 131 | G | 92.3 | Very high | 94.7 | Very high | 2 Ų | 2 | 53.1 Ų | 53.1 | 2% | 0.021 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60 | -42 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | T133 W134 I135 | G131-T133 VanDerWaalsContact C-N 3.3Å; G131-T133 PolarHBondContact O-N 2.85Å; G131-W134 PolarHBondContact O-N 3.18Å; G131-I135 WeakPolarHBondContact O-CG1 3.45Å; G131-I135 PolarHBondContact O-N 2.97Å |
| 132 | I | 92.4 | Very high | 94.7 | Very high | 77 Ų | 77 | 48.5 Ų | 48.5 | 40% | 0.395 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -58.9 | -41.3 | 178.2 | -54.7 | 179.1 | 0 | 0 | 0 | 111.3 | H130 W134 F136 C191 | H130-I132 VanDerWaalsContact C-N 3.34Å; H130-I132 PolarHBondContact O-N 3.18Å; I132-W134 VanDerWaalsContact C-N 3.35Å; I132-W134 PolarHBondContact O-N 3.18Å; I132-F136 VanDerWaalsContact O-CB 3.23Å; I132-F136 WeakPolarHBondContact O-CB 3.47Å; I132-F136 PolarHBondContact O-N 3.17Å; I132-C191 HydrophobicContact CD1-CB 3.76Å |
| 133 | T | 93.4 | Very high | 94.5 | Very high | 65 Ų | 65 | 52.4 Ų | 52.4 | 40% | 0.399 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -59.9 | -45.2 | 179.7 | -46.5 | 0 | 0 | 0 | 0 | 111.2 | L127 H130 G131 G137 | L127-T133 PolarHBondContact O-OG1 2.84Å; H130-T133 WeakPolarHBondContact O-CB 3.31Å; H130-T133 PolarHBondContact O-N 3.34Å; H130-T133 VanDerWaalsContact O-N 3.15Å; G131-T133 VanDerWaalsContact C-N 3.3Å; G131-T133 PolarHBondContact O-N 2.85Å; T133-G137 PolarHBondContact O-N 3.2Å |
| 134 | W | 95.8 | Very high | 94.6 | Very high | 59 Ų | 59 | 59.3 Ų | 59.3 | 22% | 0.223 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -76.6 | -39.1 | -179.3 | -78.1 | 95.5 | 0 | 0 | 0 | 113.7 | T128 H130 G131 I132 T138 L161 V209 L213 W230 | T128-W134 PolarHBondContact O-NE1 2.91Å; H130-W134 PolarHBondContact O-N 3.39Å; G131-W134 PolarHBondContact O-N 3.18Å; I132-W134 VanDerWaalsContact C-N 3.35Å; I132-W134 PolarHBondContact O-N 3.18Å; W134-T138 VanDerWaalsContact O-CB 3.28Å; W134-T138 WeakPolarHBondContact O-CB 3.46Å; W134-T138 PolarHBondContact O-N 3.41Å; W134-T138 PolarHBondContact O-OG1 3.41Å; W134-L161 HydrophobicContact CB-CD1 3.83Å; W134-L161 HydrophobicContact CB-CD2 3.58Å; W134-L161 HydrophobicContact CB-CG 4.38Å; W134-L161 HydrophobicContact CG-CD2 4.27Å; W134-V209 HydrophobicContact CD2-CG1 4.08Å; W134-V209 HydrophobicContact CD2-CG2 4.34Å; W134-V209 HydrophobicContact CE3-CG1 3.84Å; W134-V209 HydrophobicContact CE3-CG2 4.48Å; W134-V209 HydrophobicContact CH2-CG1 3.51Å; W134-V209 HydrophobicContact CZ2-CG1 3.76Å; W134-V209 HydrophobicContact CZ3-CG1 3.55Å; W134-L213 HydrophobicContact CH2-CD1 4.03Å; W134-L213 HydrophobicContact CZ3-CD1 4.24Å; W134-W230 AromaticContact CE2-CH2 3.92Å; W134-W230 AromaticContact CZ2-CH2 3.61Å; W134-W230 HydrophobicContact CZ2-CH2 3.61Å; W134-W230 AromaticContact CZ2-CZ2 3.83Å; W134-W230 HydrophobicContact CZ2-CZ2 3.83Å; W134-W230 HydrophobicContact CZ2-CZ3 4.43Å; W134-W230 AromaticContact NE1-CH2 3.84Å; W134-W230 AromaticContact NE1-CZ2 3.85Å |
| 135 | I | 96 | Very high | 94.4 | Very high | 32 Ų | 32 | 55.2 Ų | 55.2 | 16% | 0.164 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.9 | -50.9 | 173.9 | -68.9 | -69.6 | 0 | 0 | 0 | 110.1 | G131 T138 I139 L158 L161 L162 I165 | G131-I135 WeakPolarHBondContact O-CG1 3.45Å; G131-I135 PolarHBondContact O-N 2.97Å; I135-T138 PolarHBondContact O-N 3.35Å; I135-I139 HydrophobicContact CG2-CD1 3.76Å; I135-I139 VanDerWaalsContact O-CG1 3.31Å; I135-I139 WeakPolarHBondContact O-CG1 3.44Å; I135-I139 PolarHBondContact O-N 3.34Å; I135-L158 HydrophobicContact CD1-CD1 3.7Å; I135-L161 HydrophobicContact CD1-CB 3.55Å; I135-L161 HydrophobicContact CD1-CD1 4.31Å; I135-L161 HydrophobicContact CG1-CB 4.39Å; I135-L162 HydrophobicContact CD1-CD2 4.03Å; I135-L162 HydrophobicContact CD1-CG 4.22Å; I135-I165 HydrophobicContact CD1-CD1 4.19Å; I135-I165 HydrophobicContact CG1-CD1 3.84Å |
| 136 | F | 95.7 | Very high | 94.1 | Very high | 141 Ų | 141 | 60.6 Ų | 60.6 | 62% | 0.618 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -61.5 | -47.7 | 178.9 | -179.5 | -100.1 | 0 | 0 | 0 | 111.8 | I132 T138 I139 V140 | I132-F136 VanDerWaalsContact O-CB 3.23Å; I132-F136 WeakPolarHBondContact O-CB 3.47Å; I132-F136 PolarHBondContact O-N 3.17Å; F136-T138 VanDerWaalsContact C-N 3.35Å; F136-T138 PolarHBondContact O-N 3.47Å; F136-I139 PolarHBondContact O-N 3.1Å; F136-V140 HydrophobicContact CD1-CG2 4.25Å; F136-V140 HydrophobicContact CD2-CG2 4.47Å; F136-V140 HydrophobicContact CE1-CG2 3.86Å; F136-V140 HydrophobicContact CE2-CG2 4.1Å; F136-V140 HydrophobicContact CZ-CG2 3.78Å; F136-V140 WeakPolarHBondContact O-CG2 3.41Å; F136-V140 PolarHBondContact O-N 3.35Å |
| 137 | G | 96.4 | Very high | 94.1 | Very high | 30 Ų | 30 | 64.7 Ų | 64.7 | 31% | 0.309 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -57.9 | -44.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | T133 I139 V140 C141 | T133-G137 PolarHBondContact O-N 3.2Å; G137-I139 PolarHBondContact O-N 2.88Å; G137-V140 PolarHBondContact O-N 2.67Å; G137-C141 WeakPolarHBondContact O-CB 3.3Å; G137-C141 PolarHBondContact O-N 2.95Å; G137-C141 PolarHBondContact O-SG 3.06Å; G137-C141 VanDerWaalsContact O-SG 3.36Å |
| 138 | T | 96.8 | Very high | 94 | Very high | 4 Ų | 4 | 66 Ų | 66 | 3% | 0.025 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 179.6 | -53.9 | 0 | 0 | 0 | 0 | 111.8 | W134 I135 F136 C141 L142 L154 L157 L158 L161 | W134-T138 VanDerWaalsContact O-CB 3.28Å; W134-T138 WeakPolarHBondContact O-CB 3.46Å; W134-T138 PolarHBondContact O-N 3.41Å; W134-T138 PolarHBondContact O-OG1 3.41Å; I135-T138 PolarHBondContact O-N 3.35Å; F136-T138 VanDerWaalsContact C-N 3.35Å; F136-T138 PolarHBondContact O-N 3.47Å; T138-C141 PolarHBondContact O-N 3.38Å; T138-L142 VanDerWaalsContact O-CB 3.31Å; T138-L142 WeakPolarHBondContact O-CB 3.33Å; T138-L142 PolarHBondContact O-N 3.06Å; T138-L154 HydrophobicContact CG2-CB 4.46Å; T138-L154 HydrophobicContact CG2-CD2 4.09Å; T138-L154 VanDerWaalsContact CG2-O 3.28Å; T138-L154 WeakPolarHBondContact CG2-O 3.43Å; T138-L157 HydrophobicContact CG2-CB 4.29Å; T138-L157 HydrophobicContact CG2-CD2 4.2Å; T138-L157 HydrophobicContact CG2-CG 4.21Å; T138-L158 HydrophobicContact CG2-CB 3.94Å; T138-L161 WeakPolarHBondContact OG1-CD1 3.29Å |
| 139 | I | 95.6 | Very high | 93.9 | Very high | 77 Ų | 77 | 66.7 Ų | 66.7 | 40% | 0.395 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -66 | -42.6 | 176.1 | -67.9 | 166.6 | 0 | 0 | 0 | 111.4 | I135 F136 G137 L142 T143 L158 | I135-I139 HydrophobicContact CG2-CD1 3.76Å; I135-I139 VanDerWaalsContact O-CG1 3.31Å; I135-I139 WeakPolarHBondContact O-CG1 3.44Å; I135-I139 PolarHBondContact O-N 3.34Å; F136-I139 PolarHBondContact O-N 3.1Å; G137-I139 PolarHBondContact O-N 2.88Å; I139-L142 PolarHBondContact O-N 3.47Å; I139-T143 WeakPolarHBondContact O-CG2 3.4Å; I139-T143 PolarHBondContact O-N 3.09Å; I139-T143 PolarHBondContact O-OG1 3.46Å; I139-T143 VanDerWaalsContact O-OG1 3.06Å; I139-L158 HydrophobicContact CG1-CD1 4.35Å; I139-L158 HydrophobicContact CG1-CD2 4.41Å |
| 140 | V | 95.9 | Very high | 93.9 | Very high | 63 Ų | 63 | 67.7 Ų | 67.7 | 38% | 0.382 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.3 | -40.2 | 175.6 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | F136 G137 T143 R144 | F136-V140 HydrophobicContact CD1-CG2 4.25Å; F136-V140 HydrophobicContact CD2-CG2 4.47Å; F136-V140 HydrophobicContact CE1-CG2 3.86Å; F136-V140 HydrophobicContact CE2-CG2 4.1Å; F136-V140 HydrophobicContact CZ-CG2 3.78Å; F136-V140 WeakPolarHBondContact O-CG2 3.41Å; F136-V140 PolarHBondContact O-N 3.35Å; G137-V140 PolarHBondContact O-N 2.67Å; V140-T143 PolarHBondContact O-OG1 3.34Å; V140-T143 VanDerWaalsContact O-OG1 3.05Å; V140-R144 WeakPolarHBondContact O-CB 3.32Å; V140-R144 VanDerWaalsContact O-CG 3.28Å; V140-R144 WeakPolarHBondContact O-CG 3.24Å; V140-R144 PolarHBondContact O-N 3.49Å |
| 141 | C | 95.5 | Very high | 94 | Very high | 67 Ų | 67 | 68.7 Ų | 68.7 | 45% | 0.453 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -65.1 | -40.2 | 172.9 | -72.7 | 0 | 0 | 0 | 0 | 112.1 | G137 T138 R144 S145 L154 | G137-C141 WeakPolarHBondContact O-CB 3.3Å; G137-C141 PolarHBondContact O-N 2.95Å; G137-C141 PolarHBondContact O-SG 3.06Å; G137-C141 VanDerWaalsContact O-SG 3.36Å; T138-C141 PolarHBondContact O-N 3.38Å; C141-R144 CarbonylContact O-C 3.51Å; C141-R144 PolarHBondContact O-N 2.92Å; C141-S145 WeakPolarHBondContact O-CB 3.43Å; C141-S145 PolarHBondContact O-N 3.35Å; C141-L154 HydrophobicContact CB-CD1 3.82Å; C141-L154 HydrophobicContact CB-CD2 3.66Å; C141-L154 HydrophobicContact CB-CG 4.43Å |
| 142 | L | 94.3 | Very high | 94.2 | Very high | 33 Ų | 33 | 70.6 Ų | 70.6 | 17% | 0.173 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -65.2 | -45.7 | -179.1 | -175 | 62.9 | 0 | 0 | 0 | 111.5 | T138 I139 R144 S145 Q151 L154 V155 I277 | T138-L142 VanDerWaalsContact O-CB 3.31Å; T138-L142 WeakPolarHBondContact O-CB 3.33Å; T138-L142 PolarHBondContact O-N 3.06Å; I139-L142 PolarHBondContact O-N 3.47Å; L142-R144 PolarHBondContact O-N 3.03Å; L142-S145 PolarHBondContact O-N 2.94Å; L142-Q151 HydrophobicContact CD1-CB 4.13Å; L142-Q151 HydrophobicContact CD1-CG 4.11Å; L142-L154 HydrophobicContact CB-CB 4.42Å; L142-L154 HydrophobicContact CD1-CB 3.98Å; L142-V155 HydrophobicContact CD1-CG2 3.95Å; L142-V155 HydrophobicContact CD2-CG2 4.12Å; L142-I277 HydrophobicContact CD1-CD1 4.1Å |
| 143 | T | 90.7 | Very high | 94.4 | Very high | 108 Ų | 108 | 68.3 Ų | 68.3 | 66% | 0.663 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -66.3 | -11.9 | 174.8 | 54.3 | 0 | 0 | 0 | 0 | 114.3 | I139 V140 | I139-T143 WeakPolarHBondContact O-CG2 3.4Å; I139-T143 PolarHBondContact O-N 3.09Å; I139-T143 PolarHBondContact O-OG1 3.46Å; I139-T143 VanDerWaalsContact O-OG1 3.06Å; V140-T143 PolarHBondContact O-OG1 3.34Å; V140-T143 VanDerWaalsContact O-OG1 3.05Å |
| 144 | R | 93.5 | Very high | 94.6 | Very high | 205 Ų | 205 | 66.7 Ų | 66.7 | 77% | 0.774 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -105.2 | -11.1 | 175 | -69.3 | -62.7 | -160.2 | 141.2 | 4.1 | 114 | V140 C141 L142 | V140-R144 WeakPolarHBondContact O-CB 3.32Å; V140-R144 VanDerWaalsContact O-CG 3.28Å; V140-R144 WeakPolarHBondContact O-CG 3.24Å; V140-R144 PolarHBondContact O-N 3.49Å; C141-R144 CarbonylContact O-C 3.51Å; C141-R144 PolarHBondContact O-N 2.92Å; L142-R144 PolarHBondContact O-N 3.03Å |
| 145 | S | 91.8 | Very high | 94.6 | Very high | 19 Ų | 19 | 64.6 Ų | 64.6 | 13% | 0.133 | 36% | 0.358 | C | S | . | . | trans | -86.6 | 120.3 | -178.2 | -174.7 | 0 | 0 | 0 | 0 | 110.7 | C141 L142 Q151 | C141-S145 WeakPolarHBondContact O-CB 3.43Å; C141-S145 PolarHBondContact O-N 3.35Å; L142-S145 PolarHBondContact O-N 2.94Å; S145-Q151 PolarHBondContact O-NE2 3Å; S145-Q151 PolarHBondContact OG-N 2.82Å | ||
| 146 | N | 88.6 | Confident | 94.7 | Very high | 156 Ų | 156 | 63 Ų | 63 | 83% | 0.834 | 35% | 0.35 | S | S | * | . | trans | -102 | 3 | 173.5 | -64.8 | -45.3 | 0 | 0 | 0 | 113 | ||||
| 147 | T | 94.2 | Very high | 94.8 | Very high | 89 Ų | 89 | 56.7 Ų | 56.7 | 55% | 0.546 | 32% | 0.323 | S | S | . | . | S | Bend | trans | -103.7 | 134.1 | -178.8 | 62.8 | 0 | 0 | 0 | 0 | 110.7 | A149 G150 Q151 | T147-A149 VanDerWaalsContact C-N 3.35Å; T147-A149 PolarHBondContact O-N 3.44Å; T147-G150 PolarHBondContact O-N 2.76Å; T147-G150 VanDerWaalsContact O-N 3.11Å; T147-G150 PolarHBondContact OG1-N 3.4Å; T147-Q151 WeakPolarHBondContact O-CG 3.35Å; T147-Q151 PolarHBondContact O-N 3.41Å |
| 148 | L | 93.1 | Very high | 94.9 | Very high | 99 Ų | 99 | 57 Ų | 57 | 52% | 0.518 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -56.3 | -47.5 | -178.7 | -61.6 | 176.5 | 0 | 0 | 0 | 111.7 | G150 Q151 E152 Q274 | L148-G150 PolarHBondContact O-N 3.27Å; L148-Q151 PolarHBondContact O-N 2.94Å; L148-E152 WeakPolarHBondContact O-CB 3.31Å; L148-E152 PolarHBondContact O-N 3.15Å; L148-Q274 HydrophobicContact CD2-CG 3.98Å |
| 149 | A | 93.3 | Very high | 94.9 | Very high | 68 Ų | 68 | 59.7 Ų | 59.7 | 56% | 0.562 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -63.7 | -37.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | T147 E152 V153 | T147-A149 VanDerWaalsContact C-N 3.35Å; T147-A149 PolarHBondContact O-N 3.44Å; A149-E152 PolarHBondContact O-N 3.46Å; A149-V153 WeakPolarHBondContact O-CG2 3.39Å; A149-V153 PolarHBondContact O-N 3.2Å; A149-V153 VanDerWaalsContact O-N 3.11Å |
| 150 | G | 93.6 | Very high | 95.1 | Very high | 22 Ų | 22 | 56 Ų | 56 | 23% | 0.227 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -67.4 | -42.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | T147 L148 L154 | T147-G150 PolarHBondContact O-N 2.76Å; T147-G150 VanDerWaalsContact O-N 3.11Å; T147-G150 PolarHBondContact OG1-N 3.4Å; L148-G150 PolarHBondContact O-N 3.27Å; G150-L154 WeakPolarHBondContact O-CB 3.5Å; G150-L154 WeakPolarHBondContact O-CD1 3.28Å; G150-L154 WeakPolarHBondContact O-CG 3.28Å; G150-L154 PolarHBondContact O-N 2.98Å |
| 151 | Q | 95.1 | Very high | 95.2 | Very high | 26 Ų | 26 | 53 Ų | 53 | 12% | 0.121 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -65 | -41.5 | 174.4 | -70.1 | 176.5 | -12.1 | 0 | 0 | 112 | L142 S145 T147 L148 L154 V155 I277 | L142-Q151 HydrophobicContact CD1-CB 4.13Å; L142-Q151 HydrophobicContact CD1-CG 4.11Å; S145-Q151 PolarHBondContact O-NE2 3Å; S145-Q151 PolarHBondContact OG-N 2.82Å; T147-Q151 WeakPolarHBondContact O-CG 3.35Å; T147-Q151 PolarHBondContact O-N 3.41Å; L148-Q151 PolarHBondContact O-N 2.94Å; Q151-L154 PolarHBondContact O-N 3.24Å; Q151-V155 WeakPolarHBondContact O-CB 3.24Å; Q151-V155 WeakPolarHBondContact O-CG2 3.31Å; Q151-V155 PolarHBondContact O-N 3.46Å; Q151-I277 HydrophobicContact CB-CD1 3.91Å; Q151-I277 HydrophobicContact CG-CD1 4.21Å |
| 152 | E | 96.3 | Very high | 95.2 | Very high | 42 Ų | 42 | 53.8 Ų | 53.8 | 20% | 0.196 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -58.8 | -50 | 176.4 | -171 | -173.7 | 118.3 | 0 | 0 | 111.6 | L148 A149 L154 V155 N156 W267 L268 S270 | L148-E152 WeakPolarHBondContact O-CB 3.31Å; L148-E152 PolarHBondContact O-N 3.15Å; A149-E152 PolarHBondContact O-N 3.46Å; E152-L154 VanDerWaalsContact C-N 3.32Å; E152-L154 PolarHBondContact O-N 2.91Å; E152-V155 PolarHBondContact O-N 2.83Å; E152-N156 PolarHBondContact O-N 3.35Å; E152-N156 PolarHBondContact O-ND2 3.24Å; E152-W267 PolarHBondContact OE1-NE1 3.05Å; E152-L268 VanDerWaalsContact CG-O 3.31Å; E152-L268 WeakPolarHBondContact CG-O 3.33Å; E152-S270 VanDerWaalsContact OE2-CA 3.26Å; E152-S270 WeakPolarHBondContact OE2-CA 3.47Å; E152-S270 VanDerWaalsContact OE2-CB 3.25Å; E152-S270 WeakPolarHBondContact OE2-CB 3.48Å; E152-S270 PolarHBondContact OE2-N 2.69Å; E152-S270 PolarHBondContact OE2-OG 3.1Å |
| 153 | V | 96.8 | Very high | 95.4 | Very high | 30 Ų | 30 | 54.2 Ų | 54.2 | 18% | 0.182 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.4 | -38.1 | 177.7 | 174 | 0 | 0 | 0 | 0 | 111.4 | A149 L157 F212 H216 W267 | A149-V153 WeakPolarHBondContact O-CG2 3.39Å; A149-V153 PolarHBondContact O-N 3.2Å; A149-V153 VanDerWaalsContact O-N 3.11Å; V153-L157 WeakPolarHBondContact O-CB 3.47Å; V153-L157 PolarHBondContact O-N 2.92Å; V153-F212 HydrophobicContact CG1-CE1 3.77Å; V153-F212 HydrophobicContact CG1-CZ 4.28Å; V153-F212 WeakPolarHBondContact O-CZ 3.43Å; V153-H216 HydrophobicContact CG1-CB 4.21Å; V153-H216 HydrophobicContact CG2-CB 4.42Å; V153-W267 HydrophobicContact CG2-CZ2 4.35Å |
| 154 | L | 97.2 | Very high | 95.7 | Very high | 30 Ų | 30 | 49.1 Ų | 49.1 | 16% | 0.157 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -73.6 | -35.1 | 179.1 | -72.4 | 166.1 | 0 | 0 | 0 | 113.4 | T138 C141 L142 G150 Q151 E152 L157 L158 | T138-L154 HydrophobicContact CG2-CB 4.46Å; T138-L154 HydrophobicContact CG2-CD2 4.09Å; T138-L154 VanDerWaalsContact CG2-O 3.28Å; T138-L154 WeakPolarHBondContact CG2-O 3.43Å; C141-L154 HydrophobicContact CB-CD1 3.82Å; C141-L154 HydrophobicContact CB-CD2 3.66Å; C141-L154 HydrophobicContact CB-CG 4.43Å; L142-L154 HydrophobicContact CB-CB 4.42Å; L142-L154 HydrophobicContact CD1-CB 3.98Å; G150-L154 WeakPolarHBondContact O-CB 3.5Å; G150-L154 WeakPolarHBondContact O-CD1 3.28Å; G150-L154 WeakPolarHBondContact O-CG 3.28Å; G150-L154 PolarHBondContact O-N 2.98Å; Q151-L154 PolarHBondContact O-N 3.24Å; E152-L154 VanDerWaalsContact C-N 3.32Å; E152-L154 PolarHBondContact O-N 2.91Å; L154-L157 PolarHBondContact O-N 2.87Å; L154-L158 WeakPolarHBondContact O-CB 3.37Å; L154-L158 PolarHBondContact O-N 2.94Å |
| 155 | V | 97.1 | Very high | 95.8 | Very high | 15 Ų | 15 | 41.3 Ų | 41.3 | 9% | 0.091 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -68.8 | -43 | 174.3 | 169.2 | 0 | 0 | 0 | 0 | 110.7 | L142 Q151 E152 L157 L158 L159 L268 C273 L276 I277 | L142-V155 HydrophobicContact CD1-CG2 3.95Å; L142-V155 HydrophobicContact CD2-CG2 4.12Å; Q151-V155 WeakPolarHBondContact O-CB 3.24Å; Q151-V155 WeakPolarHBondContact O-CG2 3.31Å; Q151-V155 PolarHBondContact O-N 3.46Å; E152-V155 PolarHBondContact O-N 2.83Å; V155-L157 PolarHBondContact O-N 3.37Å; V155-L158 PolarHBondContact O-N 3Å; V155-L159 WeakPolarHBondContact O-CB 3.31Å; V155-L159 PolarHBondContact O-N 3.35Å; V155-L268 HydrophobicContact CG1-CD1 4.2Å; V155-C273 HydrophobicContact CB-CB 4.27Å; V155-C273 HydrophobicContact CG1-CB 4.32Å; V155-C273 HydrophobicContact CG2-CB 4.3Å; V155-L276 HydrophobicContact CG1-CD1 4.26Å; V155-I277 HydrophobicContact CG2-CD1 4.02Å; V155-I277 HydrophobicContact CG2-CG1 4.12Å |
| 156 | N | 97.9 | Very high | 96 | Very high | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.4 | -35.1 | 174.8 | -75.7 | -76.9 | 0 | 0 | 0 | 112.3 | E152 L159 A160 F212 V263 W267 L268 | E152-N156 PolarHBondContact O-N 3.35Å; E152-N156 PolarHBondContact O-ND2 3.24Å; N156-L159 PolarHBondContact O-N 3.02Å; N156-A160 WeakPolarHBondContact O-CB 3.27Å; N156-A160 PolarHBondContact O-N 3.35Å; N156-F212 HydrophobicContact CB-CE2 4.15Å; N156-F212 HydrophobicContact CB-CZ 4.05Å; N156-V263 HydrophobicContact CB-CG1 4.43Å; N156-W267 HydrophobicContact CB-CD2 4.19Å; N156-W267 HydrophobicContact CB-CE3 3.88Å; N156-W267 HydrophobicContact CB-CH2 3.6Å; N156-W267 HydrophobicContact CB-CZ2 3.91Å; N156-W267 HydrophobicContact CB-CZ3 3.59Å; N156-L268 PolarHBondContact ND2-O 2.77Å; N156-L268 PolarHBondContact OD1-N 2.77Å |
| 157 | L | 98.1 | Very high | 96.4 | Very high | 8 Ų | 8 | 42.1 Ų | 42.1 | 4% | 0.042 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.7 | -41.7 | 171.7 | -179.4 | 58.4 | 0 | 0 | 0 | 111.9 | T138 V153 L154 V155 A160 L161 V209 F212 | T138-L157 HydrophobicContact CG2-CB 4.29Å; T138-L157 HydrophobicContact CG2-CD2 4.2Å; T138-L157 HydrophobicContact CG2-CG 4.21Å; V153-L157 WeakPolarHBondContact O-CB 3.47Å; V153-L157 PolarHBondContact O-N 2.92Å; L154-L157 PolarHBondContact O-N 2.87Å; V155-L157 PolarHBondContact O-N 3.37Å; L157-A160 PolarHBondContact O-N 3.32Å; L157-L161 HydrophobicContact CD1-CD1 4.32Å; L157-L161 HydrophobicContact CD1-CG 4.43Å; L157-L161 HydrophobicContact CG-CD1 4.09Å; L157-L161 WeakPolarHBondContact O-CG 3.32Å; L157-L161 PolarHBondContact O-N 3.42Å; L157-V209 HydrophobicContact CD1-CG2 4.36Å; L157-F212 HydrophobicContact CB-CD1 4.33Å; L157-F212 HydrophobicContact CB-CE1 3.69Å; L157-F212 HydrophobicContact CB-CE2 4.41Å; L157-F212 HydrophobicContact CB-CZ 3.75Å; L157-F212 HydrophobicContact CD1-CD1 3.88Å; L157-F212 HydrophobicContact CD1-CE1 4.13Å; L157-F212 HydrophobicContact CD1-CG 4.13Å; L157-F212 HydrophobicContact CG-CE1 4.35Å |
| 158 | L | 97.7 | Very high | 96.5 | Very high | 35 Ų | 35 | 38 Ų | 38 | 18% | 0.183 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -64.1 | -43.3 | 176.6 | -176.2 | 59.2 | 0 | 0 | 0 | 111.2 | I135 T138 I139 L154 V155 A160 L161 L162 | I135-L158 HydrophobicContact CD1-CD1 3.7Å; T138-L158 HydrophobicContact CG2-CB 3.94Å; I139-L158 HydrophobicContact CG1-CD1 4.35Å; I139-L158 HydrophobicContact CG1-CD2 4.41Å; L154-L158 WeakPolarHBondContact O-CB 3.37Å; L154-L158 PolarHBondContact O-N 2.94Å; V155-L158 PolarHBondContact O-N 3Å; L158-A160 VanDerWaalsContact C-N 3.34Å; L158-A160 PolarHBondContact O-N 3.5Å; L158-L161 PolarHBondContact O-N 3.49Å; L158-L162 HydrophobicContact CD1-CD1 4.46Å; L158-L162 HydrophobicContact CD1-CG 4.48Å; L158-L162 HydrophobicContact CG-CD1 4.2Å; L158-L162 VanDerWaalsContact O-CG 3.29Å; L158-L162 WeakPolarHBondContact O-CG 3.44Å; L158-L162 PolarHBondContact O-N 2.56Å |
| 159 | L | 97.5 | Very high | 96.5 | Very high | 61 Ų | 61 | 34.4 Ų | 34.4 | 32% | 0.319 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -57.7 | -45.6 | 172.8 | 178.3 | 62.8 | 0 | 0 | 0 | 111.4 | V155 N156 L161 L162 L163 L268 | V155-L159 WeakPolarHBondContact O-CB 3.31Å; V155-L159 PolarHBondContact O-N 3.35Å; N156-L159 PolarHBondContact O-N 3.02Å; L159-L161 PolarHBondContact O-N 2.94Å; L159-L162 PolarHBondContact O-N 2.68Å; L159-L163 VanDerWaalsContact O-CB 3.29Å; L159-L163 WeakPolarHBondContact O-CB 3.37Å; L159-L163 PolarHBondContact O-N 3.36Å; L159-L268 HydrophobicContact CD2-CD1 3.95Å; L159-L268 HydrophobicContact CD2-CG 4.16Å |
| 160 | A | 98.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.6 | -41.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | N156 L157 L158 D164 M208 V263 | N156-A160 WeakPolarHBondContact O-CB 3.27Å; N156-A160 PolarHBondContact O-N 3.35Å; L157-A160 PolarHBondContact O-N 3.32Å; L158-A160 VanDerWaalsContact C-N 3.34Å; L158-A160 PolarHBondContact O-N 3.5Å; A160-D164 WeakPolarHBondContact O-CB 2.94Å; A160-D164 PolarHBondContact O-N 2.88Å; A160-M208 HydrophobicContact CB-CE 3.99Å; A160-M208 HydrophobicContact CB-CG 4.46Å; A160-M208 HydrophobicContact CB-SD 3.51Å; A160-M208 VanDerWaalsContact CB-SD 3.51Å; A160-M208 WeakPolarHBondContact O-CE 3.45Å; A160-V263 HydrophobicContact CB-CB 4.4Å; A160-V263 HydrophobicContact CB-CG1 4.29Å; A160-V263 HydrophobicContact CB-CG2 3.76Å |
| 161 | L | 98 | Very high | 96.7 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -66.4 | -39.9 | 176.6 | -72.7 | 163.5 | 0 | 0 | 0 | 112.3 | W134 I135 T138 L157 L158 L159 I165 M208 V209 | W134-L161 HydrophobicContact CB-CD1 3.83Å; W134-L161 HydrophobicContact CB-CD2 3.58Å; W134-L161 HydrophobicContact CB-CG 4.38Å; W134-L161 HydrophobicContact CG-CD2 4.27Å; I135-L161 HydrophobicContact CD1-CB 3.55Å; I135-L161 HydrophobicContact CD1-CD1 4.31Å; I135-L161 HydrophobicContact CG1-CB 4.39Å; T138-L161 WeakPolarHBondContact OG1-CD1 3.29Å; L157-L161 HydrophobicContact CD1-CD1 4.32Å; L157-L161 HydrophobicContact CD1-CG 4.43Å; L157-L161 HydrophobicContact CG-CD1 4.09Å; L157-L161 WeakPolarHBondContact O-CG 3.32Å; L157-L161 PolarHBondContact O-N 3.42Å; L158-L161 PolarHBondContact O-N 3.49Å; L159-L161 PolarHBondContact O-N 2.94Å; L161-I165 WeakPolarHBondContact O-CB 3.4Å; L161-I165 WeakPolarHBondContact O-CD1 3.45Å; L161-I165 VanDerWaalsContact O-CG1 3.23Å; L161-I165 WeakPolarHBondContact O-CG1 3.28Å; L161-I165 PolarHBondContact O-N 3.03Å; L161-M208 HydrophobicContact CD2-CE 3.81Å; L161-M208 HydrophobicContact CG-CE 4.06Å; L161-V209 HydrophobicContact CD2-CG2 3.86Å |
| 162 | L | 97.1 | Very high | 96.7 | Very high | 83 Ų | 83 | 32.5 Ų | 32.5 | 44% | 0.435 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -67.7 | -46 | 176.2 | -69.6 | 171.2 | 0 | 0 | 0 | 111.4 | I135 L158 L159 D164 I165 M166 | I135-L162 HydrophobicContact CD1-CD2 4.03Å; I135-L162 HydrophobicContact CD1-CG 4.22Å; L158-L162 HydrophobicContact CD1-CD1 4.46Å; L158-L162 HydrophobicContact CD1-CG 4.48Å; L158-L162 HydrophobicContact CG-CD1 4.2Å; L158-L162 VanDerWaalsContact O-CG 3.29Å; L158-L162 WeakPolarHBondContact O-CG 3.44Å; L158-L162 PolarHBondContact O-N 2.56Å; L159-L162 PolarHBondContact O-N 2.68Å; L162-D164 VanDerWaalsContact C-N 3.33Å; L162-D164 PolarHBondContact O-N 2.91Å; L162-I165 PolarHBondContact O-N 3.33Å; L162-M166 WeakPolarHBondContact O-CB 3.4Å; L162-M166 VanDerWaalsContact O-CG 3.3Å; L162-M166 WeakPolarHBondContact O-CG 3.23Å; L162-M166 PolarHBondContact O-N 3.41Å |
| 163 | L | 97.4 | Very high | 96.6 | Very high | 43 Ų | 43 | 37.5 Ų | 37.5 | 23% | 0.225 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -54.4 | -47.5 | 173.5 | 172.6 | 66.9 | 0 | 0 | 0 | 111.5 | L159 T167 H259 L262 V263 | L159-L163 VanDerWaalsContact O-CB 3.29Å; L159-L163 WeakPolarHBondContact O-CB 3.37Å; L159-L163 PolarHBondContact O-N 3.36Å; L163-T167 VanDerWaalsContact O-CB 3.24Å; L163-T167 WeakPolarHBondContact O-CB 3.47Å; L163-T167 PolarHBondContact O-N 3.27Å; L163-T167 PolarHBondContact O-OG1 2.93Å; L163-H259 HydrophobicContact CD2-CB 4.33Å; L163-L262 HydrophobicContact CD1-CD2 4.35Å; L163-L262 HydrophobicContact CD2-CB 4.48Å; L163-L262 HydrophobicContact CD2-CD2 4.06Å; L163-L262 HydrophobicContact CD2-CG 4.36Å; L163-V263 HydrophobicContact CD2-CG2 3.78Å |
| 164 | D | 97.6 | Very high | 96.5 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.5 | -51.3 | 178.7 | 179.7 | 96.9 | 0 | 0 | 0 | 112.1 | A160 L162 M166 T167 V168 S204 R205 M208 H259 | A160-D164 WeakPolarHBondContact O-CB 2.94Å; A160-D164 PolarHBondContact O-N 2.88Å; L162-D164 VanDerWaalsContact C-N 3.33Å; L162-D164 PolarHBondContact O-N 2.91Å; D164-M166 VanDerWaalsContact C-N 3.34Å; D164-M166 PolarHBondContact O-N 2.86Å; D164-T167 PolarHBondContact O-N 3.49Å; D164-V168 WeakPolarHBondContact O-CB 3.43Å; D164-V168 VanDerWaalsContact O-CG2 3.3Å; D164-V168 WeakPolarHBondContact O-CG2 3.19Å; D164-V168 PolarHBondContact O-N 3.33Å; D164-S204 VanDerWaalsContact OD1-CB 3.25Å; D164-S204 WeakPolarHBondContact OD1-CB 3.12Å; D164-S204 PolarHBondContact OD1-OG 2.99Å; D164-R205 HydrophobicContact CB-CG 4.5Å; D164-R205 WeakPolarHBondContact OD2-CG 3.22Å; D164-R205 IonicContact OD2-NH1 3.49Å; D164-R205 PolarHBondContact OD2-NH1 3.25Å; D164-M208 HydrophobicContact CB-CE 4.1Å; D164-H259 IonicContact OD1-CE1 3.44Å; D164-H259 PolarHBondContact OD1-CE1 3.37Å; D164-H259 IonicContact OD1-ND1 2.92Å; D164-H259 PolarHBondContact OD1-ND1 2.86Å |
| 165 | I | 95.6 | Very high | 96.3 | Very high | 42 Ų | 42 | 46 Ų | 46 | 22% | 0.215 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.3 | -45.1 | -178.8 | -69.8 | 165.7 | 0 | 0 | 0 | 110.6 | I135 L161 L162 A169 | I135-I165 HydrophobicContact CD1-CD1 4.19Å; I135-I165 HydrophobicContact CG1-CD1 3.84Å; L161-I165 WeakPolarHBondContact O-CB 3.4Å; L161-I165 WeakPolarHBondContact O-CD1 3.45Å; L161-I165 VanDerWaalsContact O-CG1 3.23Å; L161-I165 WeakPolarHBondContact O-CG1 3.28Å; L161-I165 PolarHBondContact O-N 3.03Å; L162-I165 PolarHBondContact O-N 3.33Å; I165-A169 WeakPolarHBondContact O-CB 3.34Å; I165-A169 PolarHBondContact O-N 3.36Å |
| 166 | M | 95.9 | Very high | 96.1 | Very high | 143 Ų | 143 | 50.8 Ų | 50.8 | 70% | 0.704 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -64.7 | -46.3 | 178.6 | -71.7 | 178.6 | 66.6 | 0 | 0 | 112.1 | L162 D164 G170 | L162-M166 WeakPolarHBondContact O-CB 3.4Å; L162-M166 VanDerWaalsContact O-CG 3.3Å; L162-M166 WeakPolarHBondContact O-CG 3.23Å; L162-M166 PolarHBondContact O-N 3.41Å; D164-M166 VanDerWaalsContact C-N 3.34Å; D164-M166 PolarHBondContact O-N 2.86Å; M166-G170 PolarHBondContact O-N 3.46Å |
| 167 | T | 96.6 | Very high | 95.8 | Very high | 49 Ų | 49 | 53.3 Ų | 53.3 | 30% | 0.301 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -68.9 | -46.3 | -177 | -54.9 | 0 | 0 | 0 | 0 | 111.1 | L163 D164 G170 V171 L255 H259 | L163-T167 VanDerWaalsContact O-CB 3.24Å; L163-T167 WeakPolarHBondContact O-CB 3.47Å; L163-T167 PolarHBondContact O-N 3.27Å; L163-T167 PolarHBondContact O-OG1 2.93Å; D164-T167 PolarHBondContact O-N 3.49Å; T167-G170 PolarHBondContact O-N 2.9Å; T167-V171 WeakPolarHBondContact O-CG2 3.36Å; T167-V171 PolarHBondContact O-N 3.36Å; T167-L255 HydrophobicContact CG2-CD1 4.46Å; T167-H259 WeakPolarHBondContact CB-NE2 3.41Å; T167-H259 WeakPolarHBondContact CG2-NE2 3.37Å |
| 168 | V | 96 | Very high | 95.4 | Very high | 3 Ų | 3 | 59.7 Ų | 59.7 | 2% | 0.018 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 178.2 | 174.6 | 0 | 0 | 0 | 0 | 111.3 | D164 G170 V171 Q172 P199 A201 L255 | D164-V168 WeakPolarHBondContact O-CB 3.43Å; D164-V168 VanDerWaalsContact O-CG2 3.3Å; D164-V168 WeakPolarHBondContact O-CG2 3.19Å; D164-V168 PolarHBondContact O-N 3.33Å; V168-G170 VanDerWaalsContact C-N 3.27Å; V168-G170 PolarHBondContact O-N 2.98Å; V168-V171 PolarHBondContact O-N 3.36Å; V168-Q172 HydrophobicContact CG1-CG 4.14Å; V168-Q172 VanDerWaalsContact O-CB 3.28Å; V168-Q172 WeakPolarHBondContact O-CB 3.25Å; V168-Q172 WeakPolarHBondContact O-CG 3.42Å; V168-Q172 PolarHBondContact O-N 3.42Å; V168-P199 HydrophobicContact CG1-CG 4.07Å; V168-P199 HydrophobicContact CG2-CG 4.27Å; V168-A201 HydrophobicContact CB-CB 4.48Å; V168-A201 HydrophobicContact CG1-CB 3.53Å; V168-L255 HydrophobicContact CG2-CD2 3.87Å |
| 169 | A | 94.4 | Very high | 94.9 | Very high | 22 Ų | 22 | 59.1 Ų | 59.1 | 18% | 0.182 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -62.7 | -36.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | I165 K173 M193 | I165-A169 WeakPolarHBondContact O-CB 3.34Å; I165-A169 PolarHBondContact O-N 3.36Å; A169-K173 WeakPolarHBondContact O-CB 3.45Å; A169-K173 PolarHBondContact O-N 2.83Å; A169-M193 HydrophobicContact CB-CB 3.82Å; A169-M193 HydrophobicContact CB-CG 4.46Å |
| 170 | G | 95.3 | Very high | 94.3 | Very high | 34 Ų | 34 | 56.7 Ų | 56.7 | 35% | 0.351 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.6 | -55.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | M166 T167 V168 Q172 K173 L174 | M166-G170 PolarHBondContact O-N 3.46Å; T167-G170 PolarHBondContact O-N 2.9Å; V168-G170 VanDerWaalsContact C-N 3.27Å; V168-G170 PolarHBondContact O-N 2.98Å; G170-Q172 PolarHBondContact O-N 3.12Å; G170-K173 PolarHBondContact O-N 2.75Å; G170-L174 WeakPolarHBondContact O-CG 3.39Å; G170-L174 PolarHBondContact O-N 3.03Å |
| 171 | V | 96.1 | Very high | 93.6 | Very high | 42 Ų | 42 | 60.9 Ų | 60.9 | 26% | 0.255 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.7 | -41.1 | -179.3 | 178.9 | 0 | 0 | 0 | 0 | 111.6 | T167 V168 K173 L174 I175 F198 P199 | T167-V171 WeakPolarHBondContact O-CG2 3.36Å; T167-V171 PolarHBondContact O-N 3.36Å; V168-V171 PolarHBondContact O-N 3.36Å; V171-K173 PolarHBondContact O-N 2.96Å; V171-L174 PolarHBondContact O-N 3.02Å; V171-I175 HydrophobicContact CG1-CD1 3.69Å; V171-I175 HydrophobicContact CG1-CG1 4.37Å; V171-I175 PolarHBondContact O-N 3.17Å; V171-F198 HydrophobicContact CG1-CD1 4.28Å; V171-F198 HydrophobicContact CG1-CE1 4.17Å; V171-P199 HydrophobicContact CG1-CG 4.43Å |
| 172 | Q | 94.5 | Very high | 92.6 | Very high | 1 Ų | 1 | 67.6 Ų | 67.6 | 1% | 0.005 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -58.2 | -45.9 | 173.2 | -82.3 | -169.2 | 17.1 | 0 | 0 | 111.8 | V168 G170 L174 K176 M193 D194 Y196 F198 P199 | V168-Q172 HydrophobicContact CG1-CG 4.14Å; V168-Q172 VanDerWaalsContact O-CB 3.28Å; V168-Q172 WeakPolarHBondContact O-CB 3.25Å; V168-Q172 WeakPolarHBondContact O-CG 3.42Å; V168-Q172 PolarHBondContact O-N 3.42Å; G170-Q172 PolarHBondContact O-N 3.12Å; Q172-L174 VanDerWaalsContact C-N 3.29Å; Q172-L174 PolarHBondContact O-N 2.93Å; Q172-K176 WeakPolarHBondContact O-CA 3.44Å; Q172-K176 PolarHBondContact O-N 3.42Å; Q172-M193 PolarHBondContact OE1-O 3.15Å; Q172-M193 VanDerWaalsContact OE1-O 3.12Å; Q172-D194 PolarHBondContact NE2-OD1 3.1Å; Q172-Y196 HydrophobicContact CB-CD2 4.23Å; Q172-Y196 PolarHBondContact NE2-O 3.45Å; Q172-Y196 VanDerWaalsContact NE2-O 3.11Å; Q172-Y196 VanDerWaalsContact O-CD2 3.22Å; Q172-Y196 WeakPolarHBondContact O-CD2 3.2Å; Q172-Y196 PolarHBondContact OE1-O 3.07Å; Q172-F198 WeakPolarHBondContact CA-O 3.01Å; Q172-F198 VanDerWaalsContact CG-O 3.28Å; Q172-F198 WeakPolarHBondContact CG-O 3.47Å; Q172-P199 PolarHBondContact NE2-O 3Å |
| 173 | K | 93.3 | Very high | 91.6 | Very high | 146 Ų | 146 | 66.1 Ų | 66.1 | 64% | 0.635 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -69.3 | -24.2 | 179.4 | -171 | 173.8 | -179 | -179.7 | 0 | 113.4 | A169 G170 V171 K176 | A169-K173 WeakPolarHBondContact O-CB 3.45Å; A169-K173 PolarHBondContact O-N 2.83Å; G170-K173 PolarHBondContact O-N 2.75Å; V171-K173 PolarHBondContact O-N 2.96Å; K173-K176 WeakPolarHBondContact O-CE 3.44Å; K173-K176 WeakPolarHBondContact O-CG 3.28Å |
| 174 | L | 94.8 | Very high | 90.7 | Very high | 144 Ų | 144 | 70.3 Ų | 70.3 | 75% | 0.754 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -78.7 | -51.6 | 172.7 | -70.7 | 168.3 | 0 | 0 | 0 | 112 | G170 V171 Q172 | G170-L174 WeakPolarHBondContact O-CG 3.39Å; G170-L174 PolarHBondContact O-N 3.03Å; V171-L174 PolarHBondContact O-N 3.02Å; Q172-L174 VanDerWaalsContact C-N 3.29Å; Q172-L174 PolarHBondContact O-N 2.93Å |
| 175 | I | 94 | Very high | 89.7 | Confident | 94 Ų | 94 | 72 Ų | 72 | 48% | 0.482 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -86.3 | -32.1 | -169.5 | -67.5 | 178.1 | 0 | 0 | 0 | 112.8 | V171 R177 F198 | V171-I175 HydrophobicContact CG1-CD1 3.69Å; V171-I175 HydrophobicContact CG1-CG1 4.37Å; V171-I175 PolarHBondContact O-N 3.17Å; I175-R177 HydrophobicContact CG2-CB 4.29Å; I175-R177 PolarHBondContact O-N 2.92Å; I175-F198 HydrophobicContact CB-CD1 4.45Å; I175-F198 HydrophobicContact CD1-CD1 3.6Å; I175-F198 HydrophobicContact CD1-CE1 3.57Å; I175-F198 HydrophobicContact CG2-CB 4.41Å; I175-F198 HydrophobicContact CG2-CD1 4.09Å |
| 176 | K | 92.3 | Very high | 88.9 | Confident | 117 Ų | 117 | 71.3 Ų | 71.3 | 51% | 0.509 | 38% | 0.375 | S | S | . | . | trans | 53.7 | 26.6 | 173.5 | -53.8 | -176 | -175.4 | 174.5 | 0 | 116 | Q172 K173 K178 Y196 | Q172-K176 WeakPolarHBondContact O-CA 3.44Å; Q172-K176 PolarHBondContact O-N 3.42Å; K173-K176 WeakPolarHBondContact O-CE 3.44Å; K173-K176 WeakPolarHBondContact O-CG 3.28Å; K176-K178 PolarHBondContact O-N 2.76Å; K176-Y196 VanDerWaalsContact CA-CD1 3.48Å; K176-Y196 HydrophobicContact CB-CD1 3.91Å; K176-Y196 HydrophobicContact CB-CE1 3.68Å; K176-Y196 HydrophobicContact CB-CE2 4.41Å; K176-Y196 HydrophobicContact CB-CG 4.36Å; K176-Y196 HydrophobicContact CG-CD1 4.49Å; K176-Y196 HydrophobicContact CG-CD2 4.43Å; K176-Y196 HydrophobicContact CG-CE1 4.03Å; K176-Y196 HydrophobicContact CG-CE2 3.95Å | ||
| 177 | R | 90.7 | Very high | 88.1 | Confident | 53 Ų | 53 | 72.4 Ų | 72.4 | 20% | 0.2 | 38% | 0.376 | C | S | . | . | P | Polyproline II helix | trans | -57 | 130.9 | 178.6 | -170.1 | -175.9 | 178.7 | 172.3 | 1.3 | 110.2 | D98 I175 S197 F198 H245 T247 D248 | D98-R177 IonicContact OD2-CZ 2.72Å; D98-R177 IonicContact OD2-NH1 3.5Å; D98-R177 IonicContact OD2-NH2 2.79Å; D98-R177 PolarHBondContact OD2-NH2 3.16Å; I175-R177 HydrophobicContact CG2-CB 4.29Å; I175-R177 PolarHBondContact O-N 2.92Å; R177-S197 WeakPolarHBondContact CD-OG 3.48Å; R177-S197 WeakPolarHBondContact CG-OG 3.16Å; R177-S197 PolarHBondContact O-N 2.8Å; R177-S197 PolarHBondContact O-OG 2.95Å; R177-F198 HydrophobicContact CB-CB 3.78Å; R177-F198 HydrophobicContact CG-CB 4.44Å; R177-H245 VanDerWaalsContact CZ-CD2 3.42Å; R177-H245 PolarHBondContact NE-CD2 2.93Å; R177-H245 PolarHBondContact NH2-CD2 3.29Å; R177-H245 PolarHBondContact NH2-ND1 2.63Å; R177-T247 PolarHBondContact NH1-OG1 3.12Å; R177-D248 VanDerWaalsContact CD-OD1 3.28Å; R177-D248 WeakPolarHBondContact CD-OD1 3.48Å; R177-D248 IonicContact CZ-OD1 2.8Å; R177-D248 IonicContact NE-OD1 3.7Å; R177-D248 IonicContact NH1-OD1 3.78Å; R177-D248 PolarHBondContact NH1-OD1 3.27Å |
| 178 | K | 90.3 | Very high | 87.1 | Confident | 142 Ų | 142 | 73.8 Ų | 73.8 | 62% | 0.617 | 38% | 0.381 | S | S | * | . | P | Polyproline II helix | trans | -78 | 143.4 | 170.4 | -75.2 | -171.9 | 171.7 | -172 | 0 | 111 | K176 E182 S197 H245 | K176-K178 PolarHBondContact O-N 2.76Å; K178-E182 IonicContact NZ-OE1 2.72Å; K178-E182 PolarHBondContact NZ-OE1 2.99Å; K178-S197 PolarHBondContact O-OG 2.98Å; K178-H245 PolarHBondContact O-NE2 2.98Å |
| 179 | G | 87.1 | Confident | 86.3 | Confident | 23 Ų | 23 | 74 Ų | 74 | 24% | 0.237 | 38% | 0.382 | C | S | . | . | P | Polyproline II helix | trans | -63.9 | 169.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114 | W181 R243 | G179-W181 PolarHBondContact O-N 3.47Å; G179-R243 WeakPolarHBondContact CA-O 3.35Å |
| 180 | P | 86.3 | Confident | 85.6 | Confident | 9 Ų | 9 | 79.1 Ų | 79.1 | 6% | 0.058 | 40% | 0.398 | C | S | . | . | S | Bend | trans | -61.2 | -29.6 | 178.8 | -17 | 24.5 | 0 | 0 | 0 | 114 | K103 G242 H244 H245 | K103-P180 WeakPolarHBondContact CE-O 3.31Å; K103-P180 HydrophobicContact CG-CB 4.12Å; P180-G242 WeakPolarHBondContact CD-O 3.4Å; P180-H244 VanDerWaalsContact CD-C 3.48Å; P180-H244 WeakPolarHBondContact CG-O 3.25Å; P180-H245 HydrophobicContact CG-CB 4.42Å |
| 181 | W | 82 | Confident | 84.5 | Confident | 89 Ų | 89 | 80.7 Ų | 80.7 | 34% | 0.337 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -123.4 | 141.1 | 176.9 | -61.4 | 87 | 0 | 0 | 0 | 109.8 | A109 Y110 G179 M183 G242 | A109-W181 HydrophobicContact CB-CD2 4.28Å; A109-W181 HydrophobicContact CB-CG 4.26Å; Y110-W181 HydrophobicContact CE2-CD2 4.29Å; Y110-W181 AromaticContact CE2-CE3 3.66Å; Y110-W181 HydrophobicContact CE2-CE3 3.66Å; Y110-W181 AromaticContact CE2-CZ3 3.99Å; Y110-W181 HydrophobicContact CE2-CZ3 3.99Å; G179-W181 PolarHBondContact O-N 3.47Å; W181-M183 HydrophobicContact CB-CE 4.08Å; W181-M183 PolarHBondContact O-N 3.12Å; W181-G242 VanDerWaalsContact CD1-CA 3.48Å; W181-G242 PolarHBondContact N-O 3Å |
| 182 | E | 77.8 | Confident | 83.3 | Confident | 140 Ų | 140 | 79.2 Ų | 79.2 | 65% | 0.654 | 40% | 0.395 | S | S | * | . | trans | -78.3 | 116.1 | 173.4 | -60.1 | -156.6 | 130.4 | 0 | 0 | 109.7 | Y110 K178 | Y110-E182 PolarHBondContact OH-O 2.86Å; K178-E182 IonicContact NZ-OE1 2.72Å; K178-E182 PolarHBondContact NZ-OE1 2.99Å | ||
| 183 | M | 76.1 | Confident | 82.5 | Confident | 53 Ų | 53 | 84.1 Ų | 84.1 | 26% | 0.261 | 42% | 0.419 | S | S | . | . | trans | -132.7 | 147.2 | 174.5 | -62.6 | -165.9 | -166.8 | 0 | 0 | 109.8 | A109 W181 L241 | A109-M183 HydrophobicContact CB-CE 3.64Å; A109-M183 WeakPolarHBondContact O-CE 3.29Å; W181-M183 HydrophobicContact CB-CE 4.08Å; W181-M183 PolarHBondContact O-N 3.12Å; M183-L241 WeakPolarHBondContact CE-O 3.2Å | ||
| 184 | T | 77.9 | Confident | 81.9 | Confident | 130 Ų | 130 | 77.5 Ų | 77.5 | 80% | 0.798 | 39% | 0.39 | S | S | * | . | P | Polyproline II helix | trans | -66.6 | 130.3 | 163.9 | 41.3 | 0 | 0 | 0 | 0 | 109.4 | ||
| 185 | P | 76.4 | Confident | 81.4 | Confident | 36 Ų | 36 | 73.2 Ų | 73.2 | 23% | 0.234 | 37% | 0.37 | C | S | . | . | P | Polyproline II helix | trans | -64.2 | 141.5 | 173.9 | -16.2 | 28.6 | 0 | 0 | 0 | 110.4 | D189 Y190 V195 | P185-D189 HydrophobicContact CB-CB 4.05Å; P185-Y190 HydrophobicContact CB-CD2 3.89Å; P185-Y190 HydrophobicContact CB-CE1 4.49Å; P185-Y190 HydrophobicContact CB-CE2 3.65Å; P185-Y190 HydrophobicContact CB-CG 4.42Å; P185-Y190 HydrophobicContact CG-CE1 4.36Å; P185-Y190 HydrophobicContact CG-CE2 3.96Å; P185-Y190 WeakPolarHBondContact O-CE2 3.25Å; P185-V195 HydrophobicContact CG-CG1 4.25Å |
| 186 | G | 78.5 | Confident | 81.2 | Confident | 28 Ų | 28 | 72.7 Ų | 72.7 | 29% | 0.289 | 36% | 0.363 | S | S | . | . | P | Polyproline II helix | trans | -73.7 | 163.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L188 D189 Y190 | G186-L188 PolarHBondContact O-N 3.17Å; G186-D189 PolarHBondContact N-OD2 2.98Å; G186-D189 WeakPolarHBondContact O-CB 3.2Å; G186-D189 PolarHBondContact O-N 2.95Å; G186-Y190 WeakPolarHBondContact O-CD2 3.4Å; G186-Y190 PolarHBondContact O-N 3.37Å |
| 187 | F | 80.3 | Confident | 81.1 | Confident | 166 Ų | 166 | 67.2 Ų | 67.2 | 73% | 0.728 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -49.7 | -45 | 175 | 174.7 | -102.6 | 0 | 0 | 0 | 112.4 | Y190 C191 | F187-Y190 PolarHBondContact O-N 2.87Å; F187-C191 PolarHBondContact O-N 3.11Å; F187-C191 PolarHBondContact O-SG 3.29Å |
| 188 | L | 75.5 | Confident | 81.2 | Confident | 77 Ų | 77 | 67 Ų | 67 | 40% | 0.403 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -66.9 | -40 | 177 | -66 | 179.8 | 0 | 0 | 0 | 113.2 | L127 H130 G186 Y190 C191 A192 | L127-L188 HydrophobicContact CD1-CD1 3.91Å; H130-L188 PolarHBondContact CE1-O 2.93Å; H130-L188 PolarHBondContact NE2-O 3.26Å; H130-L188 VanDerWaalsContact NE2-O 3.13Å; G186-L188 PolarHBondContact O-N 3.17Å; L188-Y190 VanDerWaalsContact C-N 3.29Å; L188-Y190 PolarHBondContact O-N 3.22Å; L188-C191 PolarHBondContact O-N 2.8Å; L188-A192 WeakPolarHBondContact O-CB 3.37Å; L188-A192 PolarHBondContact O-N 3.5Å |
| 189 | D | 78.7 | Confident | 81.5 | Confident | 7 Ų | 7 | 60.4 Ų | 60.4 | 4% | 0.037 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60.4 | -41.5 | 175.7 | -59.8 | -60.6 | 0 | 0 | 0 | 110.2 | P185 G186 M193 D194 R238 R243 | P185-D189 HydrophobicContact CB-CB 4.05Å; G186-D189 PolarHBondContact N-OD2 2.98Å; G186-D189 WeakPolarHBondContact O-CB 3.2Å; G186-D189 PolarHBondContact O-N 2.95Å; D189-M193 PolarHBondContact O-N 2.96Å; D189-M193 VanDerWaalsContact O-N 3.17Å; D189-D194 PolarHBondContact O-N 3.32Å; D189-R238 IonicContact OD1-CZ 3.42Å; D189-R238 VanDerWaalsContact OD1-CZ 3.28Å; D189-R238 IonicContact OD1-NH1 3.09Å; D189-R238 PolarHBondContact OD1-NH1 3.07Å; D189-R238 IonicContact OD1-NH2 3.34Å; D189-R238 PolarHBondContact OD1-NH2 3.24Å; D189-R243 IonicContact OD1-CZ 3.87Å; D189-R243 IonicContact OD1-NE 2.79Å; D189-R243 IonicContact OD1-NH2 3.69Å; D189-R243 IonicContact OD2-CZ 3.6Å; D189-R243 IonicContact OD2-NE 2.81Å; D189-R243 PolarHBondContact OD2-NE 3.01Å; D189-R243 IonicContact OD2-NH2 3.24Å; D189-R243 PolarHBondContact OD2-NH2 3.41Å |
| 190 | Y | 79.9 | Confident | 81.9 | Confident | 131 Ų | 131 | 59.4 Ų | 59.4 | 51% | 0.514 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -63.2 | -49.3 | 172.7 | -82.8 | -67.9 | 0 | 0 | 0 | 112.7 | P185 G186 F187 L188 A192 M193 V195 | P185-Y190 HydrophobicContact CB-CD2 3.89Å; P185-Y190 HydrophobicContact CB-CE1 4.49Å; P185-Y190 HydrophobicContact CB-CE2 3.65Å; P185-Y190 HydrophobicContact CB-CG 4.42Å; P185-Y190 HydrophobicContact CG-CE1 4.36Å; P185-Y190 HydrophobicContact CG-CE2 3.96Å; P185-Y190 WeakPolarHBondContact O-CE2 3.25Å; G186-Y190 WeakPolarHBondContact O-CD2 3.4Å; G186-Y190 PolarHBondContact O-N 3.37Å; F187-Y190 PolarHBondContact O-N 2.87Å; L188-Y190 VanDerWaalsContact C-N 3.29Å; L188-Y190 PolarHBondContact O-N 3.22Å; Y190-A192 PolarHBondContact O-N 3.11Å; Y190-M193 PolarHBondContact O-N 3.33Å; Y190-V195 HydrophobicContact CD1-CG2 3.78Å; Y190-V195 HydrophobicContact CE1-CG2 4.06Å |
| 191 | C | 72.8 | Confident | 82.3 | Confident | 66 Ų | 66 | 59 Ų | 59 | 45% | 0.446 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -64.8 | -26.3 | -179.5 | -67.5 | 0 | 0 | 0 | 0 | 113.5 | I132 F187 L188 | I132-C191 HydrophobicContact CD1-CB 3.76Å; F187-C191 PolarHBondContact O-N 3.11Å; F187-C191 PolarHBondContact O-SG 3.29Å; L188-C191 PolarHBondContact O-N 2.8Å |
| 192 | A | 71 | Confident | 83 | Confident | 11 Ų | 11 | 54.9 Ų | 54.9 | 9% | 0.091 | 28% | 0.283 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.4 | 8.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | H130 L188 Y190 D194 | H130-A192 VanDerWaalsContact CE1-CB 3.49Å; H130-A192 WeakPolarHBondContact CE1-CB 3.41Å; H130-A192 WeakPolarHBondContact NE2-CB 3.09Å; L188-A192 WeakPolarHBondContact O-CB 3.37Å; L188-A192 PolarHBondContact O-N 3.5Å; Y190-A192 PolarHBondContact O-N 3.11Å; A192-D194 PolarHBondContact O-N 2.78Å; A192-D194 VanDerWaalsContact O-N 3.11Å |
| 193 | M | 77.6 | Confident | 84 | Confident | 104 Ų | 104 | 48.2 Ų | 48.2 | 51% | 0.512 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58.5 | 14.8 | -179 | -58.9 | -67.6 | -69.7 | 0 | 0 | 115.4 | A169 Q172 D189 Y190 V195 | A169-M193 HydrophobicContact CB-CB 3.82Å; A169-M193 HydrophobicContact CB-CG 4.46Å; Q172-M193 PolarHBondContact OE1-O 3.15Å; Q172-M193 VanDerWaalsContact OE1-O 3.12Å; D189-M193 PolarHBondContact O-N 2.96Å; D189-M193 VanDerWaalsContact O-N 3.17Å; Y190-M193 PolarHBondContact O-N 3.33Å; M193-V195 PolarHBondContact O-N 3.44Å |
| 194 | D | 80.8 | Confident | 85 | Confident | 7 Ų | 7 | 45.7 Ų | 45.7 | 4% | 0.037 | 24% | 0.24 | C | C | . | . | trans | -85.3 | 57.1 | -176 | -163.6 | 32.7 | 0 | 0 | 0 | 111 | Q172 D189 A192 A201 H202 R238 H244 | Q172-D194 PolarHBondContact NE2-OD1 3.1Å; D189-D194 PolarHBondContact O-N 3.32Å; A192-D194 PolarHBondContact O-N 2.78Å; A192-D194 VanDerWaalsContact O-N 3.11Å; D194-A201 HydrophobicContact CB-CB 4.32Å; D194-A201 WeakPolarHBondContact OD1-CB 3.26Å; D194-H202 IonicContact OD2-CE1 3.35Å; D194-H202 PolarHBondContact OD2-CE1 2.82Å; D194-H202 IonicContact OD2-ND1 3.44Å; D194-H202 PolarHBondContact OD2-ND1 2.68Å; D194-R238 IonicContact OD2-CZ 2.65Å; D194-R238 IonicContact OD2-NE 3.28Å; D194-R238 IonicContact OD2-NH2 2.68Å; D194-R238 PolarHBondContact OD2-NH2 3.24Å; D194-H244 IonicContact OD1-CE1 3.8Å; D194-H244 PolarHBondContact OD1-CE1 2.78Å; D194-H244 IonicContact OD2-CE1 3.67Å; D194-H244 IonicContact OD2-NE2 3.91Å | ||
| 195 | V | 83.4 | Confident | 86 | Confident | 55 Ų | 55 | 39.7 Ų | 39.7 | 33% | 0.333 | 20% | 0.202 | S | C | . | . | trans | -92.2 | -25.3 | -172.4 | 176.9 | 0 | 0 | 0 | 0 | 112.5 | P185 Y190 M193 | P185-V195 HydrophobicContact CG-CG1 4.25Å; Y190-V195 HydrophobicContact CD1-CG2 3.78Å; Y190-V195 HydrophobicContact CE1-CG2 4.06Å; M193-V195 PolarHBondContact O-N 3.44Å | ||
| 196 | Y | 89.7 | Confident | 87 | Confident | 82 Ų | 82 | 38 Ų | 38 | 32% | 0.322 | 19% | 0.191 | S | C | . | . | S | Bend | trans | -114.6 | 157.6 | 179.6 | -59.9 | -71.9 | 0 | 0 | 0 | 110.9 | Q172 K176 | Q172-Y196 HydrophobicContact CB-CD2 4.23Å; Q172-Y196 PolarHBondContact NE2-O 3.45Å; Q172-Y196 VanDerWaalsContact NE2-O 3.11Å; Q172-Y196 VanDerWaalsContact O-CD2 3.22Å; Q172-Y196 WeakPolarHBondContact O-CD2 3.2Å; Q172-Y196 PolarHBondContact OE1-O 3.07Å; K176-Y196 VanDerWaalsContact CA-CD1 3.48Å; K176-Y196 HydrophobicContact CB-CD1 3.91Å; K176-Y196 HydrophobicContact CB-CE1 3.68Å; K176-Y196 HydrophobicContact CB-CE2 4.41Å; K176-Y196 HydrophobicContact CB-CG 4.36Å; K176-Y196 HydrophobicContact CG-CD1 4.49Å; K176-Y196 HydrophobicContact CG-CD2 4.43Å; K176-Y196 HydrophobicContact CG-CE1 4.03Å; K176-Y196 HydrophobicContact CG-CE2 3.95Å |
| 197 | S | 89.9 | Confident | 88 | Confident | 2 Ų | 2 | 37.1 Ų | 37.1 | 1% | 0.014 | 18% | 0.182 | C | C | . | . | trans | -81.7 | -30.2 | -168.5 | 85 | 0 | 0 | 0 | 0 | 114.3 | R177 K178 P199 A200 H244 D248 | R177-S197 WeakPolarHBondContact CD-OG 3.48Å; R177-S197 WeakPolarHBondContact CG-OG 3.16Å; R177-S197 PolarHBondContact O-N 2.8Å; R177-S197 PolarHBondContact O-OG 2.95Å; K178-S197 PolarHBondContact O-OG 2.98Å; S197-P199 CarbonylContact O-C 3.31Å; S197-P199 VanDerWaalsContact O-C 3.31Å; S197-A200 PolarHBondContact O-N 3.05Å; S197-H244 PolarHBondContact O-ND1 3.11Å; S197-D248 WeakPolarHBondContact CB-OD2 3.35Å; S197-D248 VanDerWaalsContact O-CB 3.28Å; S197-D248 WeakPolarHBondContact O-CB 3.28Å; S197-D248 VanDerWaalsContact O-CG 3.32Å; S197-D248 PolarHBondContact OG-OD2 3.47Å | ||
| 198 | F | 93.6 | Very high | 88.9 | Confident | 49 Ų | 49 | 29.2 Ų | 29.2 | 22% | 0.215 | 15% | 0.147 | C | C | . | . | S | Bend | trans | -109.1 | 128 | -174.9 | -175.9 | -83.6 | 0 | 0 | 0 | 113 | V171 Q172 I175 R177 D248 C251 | V171-F198 HydrophobicContact CG1-CD1 4.28Å; V171-F198 HydrophobicContact CG1-CE1 4.17Å; Q172-F198 WeakPolarHBondContact CA-O 3.01Å; Q172-F198 VanDerWaalsContact CG-O 3.28Å; Q172-F198 WeakPolarHBondContact CG-O 3.47Å; I175-F198 HydrophobicContact CB-CD1 4.45Å; I175-F198 HydrophobicContact CD1-CD1 3.6Å; I175-F198 HydrophobicContact CD1-CE1 3.57Å; I175-F198 HydrophobicContact CG2-CB 4.41Å; I175-F198 HydrophobicContact CG2-CD1 4.09Å; R177-F198 HydrophobicContact CB-CB 3.78Å; R177-F198 HydrophobicContact CG-CB 4.44Å; F198-D248 WeakPolarHBondContact CB-OD1 3.27Å; F198-D248 WeakPolarHBondContact CD2-OD1 3.31Å; F198-C251 HydrophobicContact CE2-CB 3.61Å; F198-C251 HydrophobicContact CZ-CB 4.01Å |
| 199 | P | 95.5 | Very high | 89.9 | Confident | 3 Ų | 3 | 25.6 Ų | 25.6 | 2% | 0.019 | 13% | 0.128 | C | C | . | . | S | Bend | cis | -76.4 | 164.1 | -13.4 | 33 | -35.9 | 0 | 0 | 0 | 111 | V168 V171 Q172 S197 A201 L255 | V168-P199 HydrophobicContact CG1-CG 4.07Å; V168-P199 HydrophobicContact CG2-CG 4.27Å; V171-P199 HydrophobicContact CG1-CG 4.43Å; Q172-P199 PolarHBondContact NE2-O 3Å; S197-P199 CarbonylContact O-C 3.31Å; S197-P199 VanDerWaalsContact O-C 3.31Å; P199-A201 PolarHBondContact O-N 3.43Å; P199-A201 VanDerWaalsContact O-N 3.11Å; P199-L255 HydrophobicContact CB-CD2 4.26Å; P199-L255 HydrophobicContact CG-CD2 3.66Å |
| 200 | A | 95.9 | Very high | 90.9 | Very high | 2 Ų | 2 | 25.4 Ų | 25.4 | 2% | 0.017 | 13% | 0.128 | C | C | . | . | trans | -73.5 | 104.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | S197 H202 A203 S204 H244 D248 | S197-A200 PolarHBondContact O-N 3.05Å; A200-H202 VanDerWaalsContact C-N 3.3Å; A200-H202 PolarHBondContact O-N 3.25Å; A200-A203 HydrophobicContact CB-CB 4Å; A200-A203 WeakPolarHBondContact O-CB 3.45Å; A200-A203 PolarHBondContact O-N 3.09Å; A200-S204 PolarHBondContact O-N 2.98Å; A200-H244 HydrophobicContact CB-CB 4.25Å; A200-D248 HydrophobicContact CB-CB 4.24Å; A200-D248 WeakPolarHBondContact CB-O 3.34Å; A200-D248 PolarHBondContact N-O 3.04Å; A200-D248 VanDerWaalsContact N-O 3.07Å | ||
| 201 | A | 95.4 | Very high | 91.8 | Very high | 2 Ų | 2 | 22.6 Ų | 22.6 | 2% | 0.017 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -59 | -38.3 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | V168 D194 P199 S204 R205 | V168-A201 HydrophobicContact CB-CB 4.48Å; V168-A201 HydrophobicContact CG1-CB 3.53Å; D194-A201 HydrophobicContact CB-CB 4.32Å; D194-A201 WeakPolarHBondContact OD1-CB 3.26Å; P199-A201 PolarHBondContact O-N 3.43Å; P199-A201 VanDerWaalsContact O-N 3.11Å; A201-S204 PolarHBondContact O-N 3.4Å; A201-R205 PolarHBondContact O-N 3.23Å |
| 202 | H | 96.3 | Very high | 93 | Very high | 1 Ų | 1 | 19.5 Ų | 19.5 | 1% | 0.005 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -66.9 | -35.2 | 177.4 | -71.4 | 75.3 | 0 | 0 | 0 | 112.5 | A126 H130 D194 A200 A206 V234 R238 | A126-H202 PolarHBondContact O-CD2 3.49Å; A126-H202 VanDerWaalsContact O-CD2 3.24Å; H130-H202 AromaticContact CD2-CE1 3.95Å; H130-H202 AromaticContact CD2-NE2 3.54Å; D194-H202 IonicContact OD2-CE1 3.35Å; D194-H202 PolarHBondContact OD2-CE1 2.82Å; D194-H202 IonicContact OD2-ND1 3.44Å; D194-H202 PolarHBondContact OD2-ND1 2.68Å; A200-H202 VanDerWaalsContact C-N 3.3Å; A200-H202 PolarHBondContact O-N 3.25Å; H202-A206 VanDerWaalsContact O-CB 3.24Å; H202-A206 WeakPolarHBondContact O-CB 3.28Å; H202-A206 PolarHBondContact O-N 2.96Å; H202-A206 VanDerWaalsContact O-N 3.12Å; H202-V234 HydrophobicContact CB-CG1 4.14Å; H202-R238 HydrophobicContact CB-CG 3.74Å; H202-R238 PolarHBondContact ND1-NE 2.79Å |
| 203 | A | 98 | Very high | 94.2 | Very high | 1 Ų | 1 | 20.2 Ų | 20.2 | 1% | 0.008 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -71 | -42.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111 | A200 A206 A207 M249 F253 | A200-A203 HydrophobicContact CB-CB 4Å; A200-A203 WeakPolarHBondContact O-CB 3.45Å; A200-A203 PolarHBondContact O-N 3.09Å; A203-A206 PolarHBondContact O-N 3.36Å; A203-A207 WeakPolarHBondContact O-CB 3.49Å; A203-A207 PolarHBondContact O-N 3.02Å; A203-M249 HydrophobicContact CB-CG 4.18Å; A203-F253 HydrophobicContact CB-CD1 3.67Å; A203-F253 HydrophobicContact CB-CE1 3.64Å; A203-F253 HydrophobicContact CB-CG 4.2Å; A203-F253 HydrophobicContact CB-CZ 4.17Å; A203-F253 VanDerWaalsContact O-CD1 3.31Å; A203-F253 WeakPolarHBondContact O-CD1 3.44Å |
| 204 | S | 98.4 | Very high | 95.2 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -58.7 | -55.6 | 175.9 | -167.8 | 0 | 0 | 0 | 0 | 112 | D164 A200 A201 A206 A207 M208 G252 G256 | D164-S204 VanDerWaalsContact OD1-CB 3.25Å; D164-S204 WeakPolarHBondContact OD1-CB 3.12Å; D164-S204 PolarHBondContact OD1-OG 2.99Å; A200-S204 PolarHBondContact O-N 2.98Å; A201-S204 PolarHBondContact O-N 3.4Å; S204-A206 PolarHBondContact O-N 3.4Å; S204-A207 PolarHBondContact O-N 3.26Å; S204-M208 VanDerWaalsContact O-CB 3.31Å; S204-M208 WeakPolarHBondContact O-CB 3.41Å; S204-M208 PolarHBondContact O-N 2.62Å; S204-G252 WeakPolarHBondContact CA-O 3.38Å; S204-G252 WeakPolarHBondContact CB-O 3.39Å; S204-G256 VanDerWaalsContact O-CA 3.24Å; S204-G256 WeakPolarHBondContact O-CA 3.33Å; S204-G256 PolarHBondContact OG-N 2.88Å |
| 205 | R | 97.9 | Very high | 95.9 | Very high | 3 Ų | 3 | 18.9 Ų | 18.9 | 1% | 0.011 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -56.1 | -47.2 | 175.6 | -75.2 | -173.3 | -78.7 | -84.3 | 6.9 | 112.9 | G129 D164 A201 M208 V209 | G129-R205 PolarHBondContact O-NE 3.38Å; G129-R205 VanDerWaalsContact O-NE 3.09Å; D164-R205 HydrophobicContact CB-CG 4.5Å; D164-R205 WeakPolarHBondContact OD2-CG 3.22Å; D164-R205 IonicContact OD2-NH1 3.49Å; D164-R205 PolarHBondContact OD2-NH1 3.25Å; A201-R205 PolarHBondContact O-N 3.23Å; R205-M208 PolarHBondContact O-N 3.44Å; R205-V209 VanDerWaalsContact O-CB 3.29Å; R205-V209 WeakPolarHBondContact O-CB 3.49Å; R205-V209 VanDerWaalsContact O-CG2 3.25Å; R205-V209 WeakPolarHBondContact O-CG2 3.35Å; R205-V209 PolarHBondContact O-N 3.11Å |
| 206 | A | 98.3 | Very high | 96.4 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -69.5 | -37.9 | -173.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | H202 A203 S204 S210 W230 A231 V234 | H202-A206 VanDerWaalsContact O-CB 3.24Å; H202-A206 WeakPolarHBondContact O-CB 3.28Å; H202-A206 PolarHBondContact O-N 2.96Å; H202-A206 VanDerWaalsContact O-N 3.12Å; A203-A206 PolarHBondContact O-N 3.36Å; S204-A206 PolarHBondContact O-N 3.4Å; A206-S210 WeakPolarHBondContact O-CB 3.45Å; A206-S210 PolarHBondContact O-N 3.3Å; A206-S210 PolarHBondContact O-OG 3.33Å; A206-W230 HydrophobicContact CB-CE3 4.46Å; A206-W230 HydrophobicContact CB-CH2 3.91Å; A206-W230 HydrophobicContact CB-CZ3 3.88Å; A206-A231 HydrophobicContact CB-CB 3.89Å; A206-A231 WeakPolarHBondContact O-CB 3.2Å; A206-V234 HydrophobicContact CB-CB 4.02Å; A206-V234 HydrophobicContact CB-CG1 3.77Å |
| 207 | A | 98.6 | Very high | 96.6 | Very high | 11 Ų | 11 | 18.7 Ų | 18.7 | 9% | 0.091 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -65.1 | -45.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | A203 S204 K211 F253 | A203-A207 WeakPolarHBondContact O-CB 3.49Å; A203-A207 PolarHBondContact O-N 3.02Å; S204-A207 PolarHBondContact O-N 3.26Å; A207-K211 VanDerWaalsContact O-CB 3.32Å; A207-K211 WeakPolarHBondContact O-CB 3.26Å; A207-K211 PolarHBondContact O-N 2.98Å; A207-F253 HydrophobicContact CB-CB 4.38Å; A207-F253 HydrophobicContact CB-CD1 3.91Å |
| 208 | M | 98.6 | Very high | 96.7 | Very high | 0 Ų | 0 | 25.9 Ų | 25.9 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.6 | -54.3 | 178.1 | -179.3 | -85.4 | -74.3 | 0 | 0 | 111.2 | A160 L161 D164 S204 R205 K211 F212 G256 H259 F260 | A160-M208 HydrophobicContact CB-CE 3.99Å; A160-M208 HydrophobicContact CB-CG 4.46Å; A160-M208 HydrophobicContact CB-SD 3.51Å; A160-M208 VanDerWaalsContact CB-SD 3.51Å; A160-M208 WeakPolarHBondContact O-CE 3.45Å; L161-M208 HydrophobicContact CD2-CE 3.81Å; L161-M208 HydrophobicContact CG-CE 4.06Å; D164-M208 HydrophobicContact CB-CE 4.1Å; S204-M208 VanDerWaalsContact O-CB 3.31Å; S204-M208 WeakPolarHBondContact O-CB 3.41Å; S204-M208 PolarHBondContact O-N 2.62Å; R205-M208 PolarHBondContact O-N 3.44Å; M208-K211 PolarHBondContact O-N 3.42Å; M208-F212 VanDerWaalsContact O-CB 3.29Å; M208-F212 WeakPolarHBondContact O-CB 3.4Å; M208-F212 PolarHBondContact O-N 3.43Å; M208-G256 WeakPolarHBondContact CA-O 3.45Å; M208-G256 VanDerWaalsContact CB-O 3.27Å; M208-G256 WeakPolarHBondContact CB-O 3.19Å; M208-H259 HydrophobicContact CG-CB 3.97Å; M208-F260 HydrophobicContact CG-CB 4.48Å |
| 209 | V | 98.4 | Very high | 96.7 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -64.5 | -43.9 | -178.7 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | W134 L157 L161 R205 F212 L213 W230 | W134-V209 HydrophobicContact CD2-CG1 4.08Å; W134-V209 HydrophobicContact CD2-CG2 4.34Å; W134-V209 HydrophobicContact CE3-CG1 3.84Å; W134-V209 HydrophobicContact CE3-CG2 4.48Å; W134-V209 HydrophobicContact CH2-CG1 3.51Å; W134-V209 HydrophobicContact CZ2-CG1 3.76Å; W134-V209 HydrophobicContact CZ3-CG1 3.55Å; L157-V209 HydrophobicContact CD1-CG2 4.36Å; L161-V209 HydrophobicContact CD2-CG2 3.86Å; R205-V209 VanDerWaalsContact O-CB 3.29Å; R205-V209 WeakPolarHBondContact O-CB 3.49Å; R205-V209 VanDerWaalsContact O-CG2 3.25Å; R205-V209 WeakPolarHBondContact O-CG2 3.35Å; R205-V209 PolarHBondContact O-N 3.11Å; V209-F212 PolarHBondContact O-N 2.87Å; V209-L213 HydrophobicContact CG1-CD1 3.66Å; V209-L213 HydrophobicContact CG1-CG 4.22Å; V209-L213 WeakPolarHBondContact O-CB 3.23Å; V209-L213 VanDerWaalsContact O-CG 3.28Å; V209-L213 WeakPolarHBondContact O-CG 3.49Å; V209-L213 PolarHBondContact O-N 3.45Å; V209-W230 HydrophobicContact CG1-CH2 4.47Å; V209-W230 HydrophobicContact CG1-CZ3 4.5Å |
| 210 | S | 98.3 | Very high | 96.7 | Very high | 4 Ų | 4 | 27.9 Ų | 27.9 | 3% | 0.028 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62 | -45.7 | 176.1 | -75.6 | 0 | 0 | 0 | 0 | 112 | A206 F212 L213 L214 L227 W230 | A206-S210 WeakPolarHBondContact O-CB 3.45Å; A206-S210 PolarHBondContact O-N 3.3Å; A206-S210 PolarHBondContact O-OG 3.33Å; S210-F212 VanDerWaalsContact C-N 3.34Å; S210-F212 PolarHBondContact O-N 3.27Å; S210-L213 PolarHBondContact O-N 3.43Å; S210-L214 VanDerWaalsContact O-CB 3.26Å; S210-L214 WeakPolarHBondContact O-CB 3.28Å; S210-L214 WeakPolarHBondContact O-CD1 3.4Å; S210-L214 WeakPolarHBondContact O-CG 3.43Å; S210-L214 PolarHBondContact O-N 3.12Å; S210-L227 VanDerWaalsContact OG-CD1 3.25Å; S210-L227 WeakPolarHBondContact OG-CD1 3.46Å; S210-L227 WeakPolarHBondContact OG-CG 3.28Å; S210-L227 PolarHBondContact OG-O 2.77Å; S210-W230 VanDerWaalsContact OG-CE3 3.27Å; S210-W230 WeakPolarHBondContact OG-CZ3 3.38Å |
| 211 | K | 98.3 | Very high | 96.7 | Very high | 71 Ų | 71 | 32.7 Ų | 32.7 | 31% | 0.309 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64.1 | -39.9 | 177.5 | 177.7 | 62 | 174 | 98.3 | 0 | 111.7 | A207 M208 L214 S215 L257 F260 | A207-K211 VanDerWaalsContact O-CB 3.32Å; A207-K211 WeakPolarHBondContact O-CB 3.26Å; A207-K211 PolarHBondContact O-N 2.98Å; M208-K211 PolarHBondContact O-N 3.42Å; K211-L214 PolarHBondContact O-N 3.08Å; K211-S215 PolarHBondContact NZ-OG 2.96Å; K211-S215 WeakPolarHBondContact O-CB 3.35Å; K211-S215 PolarHBondContact O-N 2.91Å; K211-S215 VanDerWaalsContact O-N 3.09Å; K211-S215 PolarHBondContact O-OG 2.66Å; K211-L257 HydrophobicContact CB-CD2 4.03Å; K211-L257 HydrophobicContact CG-CD2 4.2Å; K211-F260 HydrophobicContact CB-CB 4.34Å; K211-F260 HydrophobicContact CB-CD1 4.42Å; K211-F260 HydrophobicContact CB-CD2 4.31Å; K211-F260 HydrophobicContact CB-CG 4.05Å; K211-F260 HydrophobicContact CD-CD1 4.2Å; K211-F260 HydrophobicContact CD-CE1 4.15Å; K211-F260 VanDerWaalsContact CE-CE1 3.45Å; K211-F260 HydrophobicContact CG-CB 4.06Å; K211-F260 HydrophobicContact CG-CD1 3.3Å; K211-F260 HydrophobicContact CG-CD2 3.8Å; K211-F260 HydrophobicContact CG-CE1 3.67Å; K211-F260 HydrophobicContact CG-CE2 4.12Å; K211-F260 HydrophobicContact CG-CG 3.38Å; K211-F260 HydrophobicContact CG-CZ 4.07Å |
| 212 | F | 98.3 | Very high | 96.7 | Very high | 1 Ų | 1 | 36.7 Ų | 36.7 | 0% | 0.004 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59 | -56.1 | 175.6 | -171.1 | -79.8 | 0 | 0 | 0 | 111.3 | V153 N156 L157 M208 V209 S210 L214 S215 H216 F260 V263 W267 | V153-F212 HydrophobicContact CG1-CE1 3.77Å; V153-F212 HydrophobicContact CG1-CZ 4.28Å; V153-F212 WeakPolarHBondContact O-CZ 3.43Å; N156-F212 HydrophobicContact CB-CE2 4.15Å; N156-F212 HydrophobicContact CB-CZ 4.05Å; L157-F212 HydrophobicContact CB-CD1 4.33Å; L157-F212 HydrophobicContact CB-CE1 3.69Å; L157-F212 HydrophobicContact CB-CE2 4.41Å; L157-F212 HydrophobicContact CB-CZ 3.75Å; L157-F212 HydrophobicContact CD1-CD1 3.88Å; L157-F212 HydrophobicContact CD1-CE1 4.13Å; L157-F212 HydrophobicContact CD1-CG 4.13Å; L157-F212 HydrophobicContact CG-CE1 4.35Å; M208-F212 VanDerWaalsContact O-CB 3.29Å; M208-F212 WeakPolarHBondContact O-CB 3.4Å; M208-F212 PolarHBondContact O-N 3.43Å; V209-F212 PolarHBondContact O-N 2.87Å; S210-F212 VanDerWaalsContact C-N 3.34Å; S210-F212 PolarHBondContact O-N 3.27Å; F212-L214 VanDerWaalsContact C-N 3.31Å; F212-L214 PolarHBondContact O-N 2.97Å; F212-S215 PolarHBondContact O-N 3.33Å; F212-H216 AromaticContact CD1-CD2 3.88Å; F212-H216 AromaticContact CD2-CD2 3.9Å; F212-H216 HydrophobicContact CE1-CB 4.49Å; F212-H216 AromaticContact CE1-CD2 3.91Å; F212-H216 AromaticContact CE2-CD2 3.95Å; F212-H216 AromaticContact CG-CD2 3.86Å; F212-H216 AromaticContact CZ-CD2 3.94Å; F212-H216 PolarHBondContact O-CD2 3.25Å; F212-H216 PolarHBondContact O-N 3.11Å; F212-F260 HydrophobicContact CB-CD2 4Å; F212-F260 HydrophobicContact CB-CE2 4.38Å; F212-F260 HydrophobicContact CD2-CD2 4.28Å; F212-F260 HydrophobicContact CD2-CE2 4.48Å; F212-V263 HydrophobicContact CE2-CG1 4.36Å; F212-W267 HydrophobicContact CD2-CZ3 4.44Å; F212-W267 AromaticContact CE2-CH2 3.89Å; F212-W267 HydrophobicContact CE2-CH2 3.89Å; F212-W267 AromaticContact CE2-CZ3 3.51Å; F212-W267 HydrophobicContact CE2-CZ3 3.51Å; F212-W267 AromaticContact CZ-CH2 3.62Å; F212-W267 HydrophobicContact CZ-CH2 3.62Å; F212-W267 AromaticContact CZ-CZ3 3.78Å; F212-W267 HydrophobicContact CZ-CZ3 3.78Å |
| 213 | L | 97.5 | Very high | 96.7 | Very high | 26 Ų | 26 | 41.2 Ų | 41.2 | 14% | 0.136 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.9 | -33.1 | -179.3 | -62.6 | 172 | 0 | 0 | 0 | 112.3 | W134 V209 S210 S215 L217 L227 | W134-L213 HydrophobicContact CH2-CD1 4.03Å; W134-L213 HydrophobicContact CZ3-CD1 4.24Å; V209-L213 HydrophobicContact CG1-CD1 3.66Å; V209-L213 HydrophobicContact CG1-CG 4.22Å; V209-L213 WeakPolarHBondContact O-CB 3.23Å; V209-L213 VanDerWaalsContact O-CG 3.28Å; V209-L213 WeakPolarHBondContact O-CG 3.49Å; V209-L213 PolarHBondContact O-N 3.45Å; S210-L213 PolarHBondContact O-N 3.43Å; L213-S215 VanDerWaalsContact C-N 3.29Å; L213-S215 PolarHBondContact O-N 3.46Å; L213-L217 HydrophobicContact CB-CD1 4.44Å; L213-L217 HydrophobicContact CD2-CD1 3.58Å; L213-L217 HydrophobicContact CD2-CG 4.36Å; L213-L217 WeakPolarHBondContact O-CB 3.49Å; L213-L217 PolarHBondContact O-N 3.48Å; L213-L217 VanDerWaalsContact O-N 3.15Å; L213-L227 HydrophobicContact CB-CD2 3.82Å; L213-L227 HydrophobicContact CD1-CD1 4.36Å |
| 214 | L | 97.2 | Very high | 96.6 | Very high | 34 Ų | 34 | 45.2 Ų | 45.2 | 18% | 0.178 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -66.1 | -28.2 | 172.6 | -74.6 | 169.8 | 0 | 0 | 0 | 113.6 | S210 K211 F212 R224 L227 V228 | S210-L214 VanDerWaalsContact O-CB 3.26Å; S210-L214 WeakPolarHBondContact O-CB 3.28Å; S210-L214 WeakPolarHBondContact O-CD1 3.4Å; S210-L214 WeakPolarHBondContact O-CG 3.43Å; S210-L214 PolarHBondContact O-N 3.12Å; K211-L214 PolarHBondContact O-N 3.08Å; F212-L214 VanDerWaalsContact C-N 3.31Å; F212-L214 PolarHBondContact O-N 2.97Å; L214-R224 HydrophobicContact CD2-CB 3.54Å; L214-R224 HydrophobicContact CD2-CG 3.61Å; L214-R224 PolarHBondContact O-NH1 3.27Å; L214-L227 HydrophobicContact CD2-CD2 4.1Å; L214-L227 HydrophobicContact CG-CD2 3.86Å; L214-V228 HydrophobicContact CD1-CG2 3.8Å |
| 215 | S | 96.3 | Very high | 96.6 | Very high | 49 Ų | 49 | 50.3 Ų | 50.3 | 34% | 0.343 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -89.4 | -44.2 | -177.1 | -50.4 | 0 | 0 | 0 | 0 | 111.7 | K211 F212 L213 F260 | K211-S215 PolarHBondContact NZ-OG 2.96Å; K211-S215 WeakPolarHBondContact O-CB 3.35Å; K211-S215 PolarHBondContact O-N 2.91Å; K211-S215 VanDerWaalsContact O-N 3.09Å; K211-S215 PolarHBondContact O-OG 2.66Å; F212-S215 PolarHBondContact O-N 3.33Å; L213-S215 VanDerWaalsContact C-N 3.29Å; L213-S215 PolarHBondContact O-N 3.46Å; S215-F260 WeakPolarHBondContact OG-CZ 3.43Å |
| 216 | H | 94.6 | Very high | 96.5 | Very high | 58 Ų | 58 | 55.1 Ų | 55.1 | 27% | 0.269 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -99.3 | -8.8 | -171.1 | -55.6 | -68.7 | 0 | 0 | 0 | 115 | V153 F212 F260 W267 | V153-H216 HydrophobicContact CG1-CB 4.21Å; V153-H216 HydrophobicContact CG2-CB 4.42Å; F212-H216 AromaticContact CD1-CD2 3.88Å; F212-H216 AromaticContact CD2-CD2 3.9Å; F212-H216 HydrophobicContact CE1-CB 4.49Å; F212-H216 AromaticContact CE1-CD2 3.91Å; F212-H216 AromaticContact CE2-CD2 3.95Å; F212-H216 AromaticContact CG-CD2 3.86Å; F212-H216 AromaticContact CZ-CD2 3.94Å; F212-H216 PolarHBondContact O-CD2 3.25Å; F212-H216 PolarHBondContact O-N 3.11Å; H216-F260 AromaticContact NE2-CE2 3.65Å; H216-W267 AromaticContact CD2-CH2 3.76Å; H216-W267 AromaticContact CD2-CZ3 3.8Å; H216-W267 AromaticContact CE1-CE3 3.97Å; H216-W267 AromaticContact CE1-CH2 3.46Å; H216-W267 VanDerWaalsContact CE1-CH2 3.46Å; H216-W267 WeakPolarHBondContact CE1-CH2 3.11Å; H216-W267 AromaticContact CE1-CZ3 3.31Å; H216-W267 WeakPolarHBondContact CE1-CZ3 3.09Å; H216-W267 AromaticContact CG-CH2 3.71Å; H216-W267 AromaticContact ND1-CH2 3.51Å; H216-W267 AromaticContact ND1-CZ3 3.88Å; H216-W267 AromaticContact NE2-CH2 3.65Å; H216-W267 AromaticContact NE2-CZ3 3.28Å; H216-W267 VanDerWaalsContact NE2-CZ3 3.28Å; H216-W267 WeakPolarHBondContact NE2-CZ3 3.41Å |
| 217 | L | 93.6 | Very high | 96.5 | Very high | 76 Ų | 76 | 56.2 Ų | 56.2 | 40% | 0.398 | 31% | 0.313 | S | S | . | . | S | Bend | trans | -119.1 | 142.1 | 176.2 | -58.2 | 179.7 | 0 | 0 | 0 | 112.5 | L213 L219 R224 | L213-L217 HydrophobicContact CB-CD1 4.44Å; L213-L217 HydrophobicContact CD2-CD1 3.58Å; L213-L217 HydrophobicContact CD2-CG 4.36Å; L213-L217 WeakPolarHBondContact O-CB 3.49Å; L213-L217 PolarHBondContact O-N 3.48Å; L213-L217 VanDerWaalsContact O-N 3.15Å; L217-L219 VanDerWaalsContact C-N 3.29Å; L217-L219 HydrophobicContact CB-CD1 3.39Å; L217-L219 HydrophobicContact CD1-CD1 4.31Å; L217-L219 PolarHBondContact O-N 3.49Å; L217-R224 PolarHBondContact O-NH2 2.93Å |
| 218 | V | 92.4 | Very high | 96.4 | Very high | 152 Ų | 152 | 59.6 Ų | 59.6 | 92% | 0.921 | 33% | 0.332 | S | S | * | . | trans | -81.2 | 73.6 | 179.4 | -172.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 219 | L | 93.4 | Very high | 96.4 | Very high | 36 Ų | 36 | 63.6 Ų | 63.6 | 19% | 0.188 | 35% | 0.353 | C | S | . | . | trans | -79.3 | 137.9 | 176 | -87.7 | 62.8 | 0 | 0 | 0 | 111.9 | L217 L223 R224 L227 | L217-L219 VanDerWaalsContact C-N 3.29Å; L217-L219 HydrophobicContact CB-CD1 3.39Å; L217-L219 HydrophobicContact CD1-CD1 4.31Å; L217-L219 PolarHBondContact O-N 3.49Å; L219-L223 HydrophobicContact CB-CB 4.19Å; L219-L223 HydrophobicContact CD2-CB 4.01Å; L219-L223 HydrophobicContact CG-CB 4.06Å; L219-L223 HydrophobicContact CG-CD1 4.5Å; L219-R224 HydrophobicContact CB-CG 3.69Å; L219-R224 PolarHBondContact O-NE 2.81Å; L219-R224 PolarHBondContact O-NH2 3.44Å; L219-L227 HydrophobicContact CD2-CD2 3.69Å | ||
| 220 | A | 95.6 | Very high | 96.4 | Very high | 59 Ų | 59 | 65.8 Ų | 65.8 | 49% | 0.488 | 36% | 0.361 | S | S | . | . | trans | -63.4 | 150.5 | 165.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | L223 R224 | A220-L223 WeakPolarHBondContact O-CB 3.49Å; A220-L223 PolarHBondContact O-N 3.29Å; A220-R224 PolarHBondContact O-N 3.43Å; A220-R224 VanDerWaalsContact O-N 3.12Å | ||
| 221 | V | 95 | Very high | 96.4 | Very high | 103 Ų | 103 | 65.9 Ų | 65.9 | 62% | 0.624 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -51.7 | -43.5 | -173.4 | -178.7 | 0 | 0 | 0 | 0 | 114.1 | L223 R224 I225 | V221-L223 VanDerWaalsContact C-N 3.34Å; V221-L223 PolarHBondContact O-N 3.19Å; V221-R224 WeakPolarHBondContact O-CB 3.32Å; V221-R224 PolarHBondContact O-N 2.96Å; V221-R224 VanDerWaalsContact O-N 3.16Å; V221-I225 HydrophobicContact CG1-CD1 4.12Å; V221-I225 WeakPolarHBondContact O-CG1 3.39Å; V221-I225 PolarHBondContact O-N 3.34Å; V221-I225 VanDerWaalsContact O-N 3.13Å |
| 222 | P | 96.4 | Very high | 96.4 | Very high | 86 Ų | 86 | 67.4 Ų | 67.4 | 56% | 0.558 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -61.6 | -38.5 | 176.9 | -24 | 35.5 | 0 | 0 | 0 | 113.4 | R224 I225 L226 | P222-R224 VanDerWaalsContact C-N 3.33Å; P222-I225 PolarHBondContact O-N 3.13Å; P222-L226 WeakPolarHBondContact O-CB 3.24Å; P222-L226 VanDerWaalsContact O-CG 3.32Å; P222-L226 WeakPolarHBondContact O-CG 3.4Å; P222-L226 PolarHBondContact O-N 2.95Å |
| 223 | L | 95.8 | Very high | 96.4 | Very high | 95 Ų | 95 | 70.9 Ų | 70.9 | 50% | 0.497 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -66.8 | -36.3 | 176.6 | -62.4 | 175.8 | 0 | 0 | 0 | 111.3 | L219 A220 V221 L226 L227 | L219-L223 HydrophobicContact CB-CB 4.19Å; L219-L223 HydrophobicContact CD2-CB 4.01Å; L219-L223 HydrophobicContact CG-CB 4.06Å; L219-L223 HydrophobicContact CG-CD1 4.5Å; A220-L223 WeakPolarHBondContact O-CB 3.49Å; A220-L223 PolarHBondContact O-N 3.29Å; V221-L223 VanDerWaalsContact C-N 3.34Å; V221-L223 PolarHBondContact O-N 3.19Å; L223-L226 HydrophobicContact CD2-CD1 4.43Å; L223-L226 PolarHBondContact O-N 3.32Å; L223-L227 VanDerWaalsContact O-CB 3.23Å; L223-L227 WeakPolarHBondContact O-CB 3.29Å; L223-L227 PolarHBondContact O-N 3.09Å |
| 224 | R | 96.4 | Very high | 96.4 | Very high | 85 Ų | 85 | 69.6 Ų | 69.6 | 32% | 0.321 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.5 | -44.3 | 174.7 | -61.7 | -174.5 | 175.5 | -92.7 | -10.9 | 111.5 | L214 L217 L219 A220 V221 P222 L227 V228 | L214-R224 HydrophobicContact CD2-CB 3.54Å; L214-R224 HydrophobicContact CD2-CG 3.61Å; L214-R224 PolarHBondContact O-NH1 3.27Å; L217-R224 PolarHBondContact O-NH2 2.93Å; L219-R224 HydrophobicContact CB-CG 3.69Å; L219-R224 PolarHBondContact O-NE 2.81Å; L219-R224 PolarHBondContact O-NH2 3.44Å; A220-R224 PolarHBondContact O-N 3.43Å; A220-R224 VanDerWaalsContact O-N 3.12Å; V221-R224 WeakPolarHBondContact O-CB 3.32Å; V221-R224 PolarHBondContact O-N 2.96Å; V221-R224 VanDerWaalsContact O-N 3.16Å; P222-R224 VanDerWaalsContact C-N 3.33Å; R224-L227 PolarHBondContact O-N 3.12Å; R224-V228 WeakPolarHBondContact O-CG2 3.3Å; R224-V228 PolarHBondContact O-N 3.36Å |
| 225 | I | 97.1 | Very high | 96.4 | Very high | 108 Ų | 108 | 68 Ų | 68 | 55% | 0.554 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -65.1 | -47.5 | 177.4 | -63.5 | 166.4 | 0 | 0 | 0 | 110.7 | V221 P222 L227 V228 L229 | V221-I225 HydrophobicContact CG1-CD1 4.12Å; V221-I225 WeakPolarHBondContact O-CG1 3.39Å; V221-I225 PolarHBondContact O-N 3.34Å; V221-I225 VanDerWaalsContact O-N 3.13Å; P222-I225 PolarHBondContact O-N 3.13Å; I225-L227 VanDerWaalsContact C-N 3.26Å; I225-L227 PolarHBondContact O-N 3.42Å; I225-V228 PolarHBondContact O-N 2.99Å; I225-L229 WeakPolarHBondContact O-CB 3.35Å; I225-L229 PolarHBondContact O-N 3.01Å |
| 226 | L | 97.1 | Very high | 96.4 | Very high | 104 Ų | 104 | 67.3 Ų | 67.3 | 55% | 0.545 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -58.7 | -36.7 | 177.6 | -74.6 | 167.4 | 0 | 0 | 0 | 112.5 | P222 L223 L229 W230 | P222-L226 WeakPolarHBondContact O-CB 3.24Å; P222-L226 VanDerWaalsContact O-CG 3.32Å; P222-L226 WeakPolarHBondContact O-CG 3.4Å; P222-L226 PolarHBondContact O-N 2.95Å; L223-L226 HydrophobicContact CD2-CD1 4.43Å; L223-L226 PolarHBondContact O-N 3.32Å; L226-L229 PolarHBondContact O-N 3.13Å; L226-W230 VanDerWaalsContact O-CB 3.25Å; L226-W230 WeakPolarHBondContact O-CB 3.33Å; L226-W230 PolarHBondContact O-N 3.38Å |
| 227 | L | 97.2 | Very high | 96.5 | Very high | 23 Ų | 23 | 64.5 Ų | 64.5 | 12% | 0.12 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -73.5 | -34.5 | -179.7 | -177.6 | 60.7 | 0 | 0 | 0 | 113.1 | S210 L213 L214 L219 L223 R224 I225 W230 A231 | S210-L227 VanDerWaalsContact OG-CD1 3.25Å; S210-L227 WeakPolarHBondContact OG-CD1 3.46Å; S210-L227 WeakPolarHBondContact OG-CG 3.28Å; S210-L227 PolarHBondContact OG-O 2.77Å; L213-L227 HydrophobicContact CB-CD2 3.82Å; L213-L227 HydrophobicContact CD1-CD1 4.36Å; L214-L227 HydrophobicContact CD2-CD2 4.1Å; L214-L227 HydrophobicContact CG-CD2 3.86Å; L219-L227 HydrophobicContact CD2-CD2 3.69Å; L223-L227 VanDerWaalsContact O-CB 3.23Å; L223-L227 WeakPolarHBondContact O-CB 3.29Å; L223-L227 PolarHBondContact O-N 3.09Å; R224-L227 PolarHBondContact O-N 3.12Å; I225-L227 VanDerWaalsContact C-N 3.26Å; I225-L227 PolarHBondContact O-N 3.42Å; L227-W230 HydrophobicContact CD1-CE3 3.94Å; L227-W230 HydrophobicContact CD1-CZ3 4.34Å; L227-A231 PolarHBondContact O-N 3.33Å |
| 228 | V | 97.8 | Very high | 96.6 | Very high | 82 Ų | 82 | 61.3 Ų | 61.3 | 50% | 0.497 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -69.7 | -44.4 | 170 | 175.7 | 0 | 0 | 0 | 0 | 110.6 | L214 R224 I225 W230 A231 F232 | L214-V228 HydrophobicContact CD1-CG2 3.8Å; R224-V228 WeakPolarHBondContact O-CG2 3.3Å; R224-V228 PolarHBondContact O-N 3.36Å; I225-V228 PolarHBondContact O-N 2.99Å; V228-W230 PolarHBondContact O-N 2.9Å; V228-A231 PolarHBondContact O-N 3.3Å; V228-F232 PolarHBondContact O-N 2.89Å; V228-F232 VanDerWaalsContact O-N 3.11Å |
| 229 | L | 98.2 | Very high | 96.7 | Very high | 83 Ų | 83 | 54 Ų | 54 | 44% | 0.435 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -61.3 | -43.3 | 177.3 | 178.9 | 60.7 | 0 | 0 | 0 | 111.5 | I225 L226 A231 F232 L233 | I225-L229 WeakPolarHBondContact O-CB 3.35Å; I225-L229 PolarHBondContact O-N 3.01Å; L226-L229 PolarHBondContact O-N 3.13Å; L229-A231 PolarHBondContact O-N 3.22Å; L229-F232 PolarHBondContact O-N 3.47Å; L229-L233 HydrophobicContact CD1-CD1 3.99Å; L229-L233 HydrophobicContact CD1-CG 4.03Å; L229-L233 HydrophobicContact CD2-CD1 4.49Å; L229-L233 HydrophobicContact CG-CD1 3.82Å; L229-L233 HydrophobicContact CG-CG 4.29Å; L229-L233 WeakPolarHBondContact O-CB 3.49Å; L229-L233 VanDerWaalsContact O-CG 3.24Å; L229-L233 WeakPolarHBondContact O-CG 3.37Å; L229-L233 PolarHBondContact O-N 2.72Å |
| 230 | W | 98.4 | Very high | 96.7 | Very high | 46 Ų | 46 | 53.8 Ų | 53.8 | 17% | 0.174 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -56.1 | -47.5 | 174 | 168 | 78.2 | 0 | 0 | 0 | 111.7 | T128 W134 A206 V209 S210 L226 L227 V228 F232 L233 V234 | T128-W230 PolarHBondContact OG1-NE1 2.96Å; W134-W230 AromaticContact CE2-CH2 3.92Å; W134-W230 AromaticContact CZ2-CH2 3.61Å; W134-W230 HydrophobicContact CZ2-CH2 3.61Å; W134-W230 AromaticContact CZ2-CZ2 3.83Å; W134-W230 HydrophobicContact CZ2-CZ2 3.83Å; W134-W230 HydrophobicContact CZ2-CZ3 4.43Å; W134-W230 AromaticContact NE1-CH2 3.84Å; W134-W230 AromaticContact NE1-CZ2 3.85Å; A206-W230 HydrophobicContact CB-CE3 4.46Å; A206-W230 HydrophobicContact CB-CH2 3.91Å; A206-W230 HydrophobicContact CB-CZ3 3.88Å; V209-W230 HydrophobicContact CG1-CH2 4.47Å; V209-W230 HydrophobicContact CG1-CZ3 4.5Å; S210-W230 VanDerWaalsContact OG-CE3 3.27Å; S210-W230 WeakPolarHBondContact OG-CZ3 3.38Å; L226-W230 VanDerWaalsContact O-CB 3.25Å; L226-W230 WeakPolarHBondContact O-CB 3.33Å; L226-W230 PolarHBondContact O-N 3.38Å; L227-W230 HydrophobicContact CD1-CE3 3.94Å; L227-W230 HydrophobicContact CD1-CZ3 4.34Å; V228-W230 PolarHBondContact O-N 2.9Å; W230-F232 PolarHBondContact O-N 3.48Å; W230-L233 PolarHBondContact O-N 2.79Å; W230-V234 HydrophobicContact CD2-CG2 4.26Å; W230-V234 HydrophobicContact CG-CG2 4.37Å; W230-V234 HydrophobicContact CZ2-CG2 4.11Å; W230-V234 WeakPolarHBondContact O-CB 3.25Å; W230-V234 WeakPolarHBondContact O-CG2 3.23Å; W230-V234 PolarHBondContact O-N 2.81Å |
| 231 | A | 98.2 | Very high | 96.5 | Very high | 7 Ų | 7 | 51 Ų | 51 | 6% | 0.058 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.4 | -43.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | A206 L227 V228 L229 V234 G235 F253 | A206-A231 HydrophobicContact CB-CB 3.89Å; A206-A231 WeakPolarHBondContact O-CB 3.2Å; L227-A231 PolarHBondContact O-N 3.33Å; V228-A231 PolarHBondContact O-N 3.3Å; L229-A231 PolarHBondContact O-N 3.22Å; A231-V234 PolarHBondContact O-N 2.82Å; A231-G235 PolarHBondContact O-N 3.23Å; A231-F253 WeakPolarHBondContact O-CE1 3.32Å |
| 232 | F | 98.3 | Very high | 96.3 | Very high | 102 Ų | 102 | 46.1 Ų | 46.1 | 45% | 0.447 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -61 | -47.2 | 174.6 | -179.8 | -101.4 | 0 | 0 | 0 | 111.9 | V228 L229 W230 V234 G235 M236 F253 | V228-F232 PolarHBondContact O-N 2.89Å; V228-F232 VanDerWaalsContact O-N 3.11Å; L229-F232 PolarHBondContact O-N 3.47Å; W230-F232 PolarHBondContact O-N 3.48Å; F232-V234 PolarHBondContact O-N 3.47Å; F232-G235 PolarHBondContact O-N 3.24Å; F232-M236 HydrophobicContact CE1-CE 4.44Å; F232-M236 HydrophobicContact CE2-CE 4.34Å; F232-M236 HydrophobicContact CZ-CE 3.8Å; F232-M236 VanDerWaalsContact O-CB 3.31Å; F232-M236 WeakPolarHBondContact O-CB 3.48Å; F232-M236 PolarHBondContact O-N 2.9Å; F232-F253 HydrophobicContact CD2-CE2 4.32Å; F232-F253 HydrophobicContact CD2-CZ 4.46Å |
| 233 | L | 98.1 | Very high | 96 | Very high | 74 Ų | 74 | 44.4 Ų | 44.4 | 39% | 0.387 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -64 | -38.3 | 179.1 | -72.7 | 176.1 | 0 | 0 | 0 | 112.4 | L125 L229 W230 M236 S237 | L125-L233 HydrophobicContact CD1-CB 4.26Å; L125-L233 HydrophobicContact CD2-CB 4.06Å; L229-L233 HydrophobicContact CD1-CD1 3.99Å; L229-L233 HydrophobicContact CD1-CG 4.03Å; L229-L233 HydrophobicContact CD2-CD1 4.49Å; L229-L233 HydrophobicContact CG-CD1 3.82Å; L229-L233 HydrophobicContact CG-CG 4.29Å; L229-L233 WeakPolarHBondContact O-CB 3.49Å; L229-L233 VanDerWaalsContact O-CG 3.24Å; L229-L233 WeakPolarHBondContact O-CG 3.37Å; L229-L233 PolarHBondContact O-N 2.72Å; W230-L233 PolarHBondContact O-N 2.79Å; L233-M236 PolarHBondContact O-N 3.37Å; L233-S237 WeakPolarHBondContact O-CB 3.49Å; L233-S237 PolarHBondContact O-N 3.33Å |
| 234 | V | 98 | Very high | 95.9 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64.3 | -46.2 | 174.5 | 165 | 0 | 0 | 0 | 0 | 111.4 | L125 H202 A206 W230 A231 F232 S237 | L125-V234 HydrophobicContact CD1-CG2 3.95Å; H202-V234 HydrophobicContact CB-CG1 4.14Å; A206-V234 HydrophobicContact CB-CB 4.02Å; A206-V234 HydrophobicContact CB-CG1 3.77Å; W230-V234 HydrophobicContact CD2-CG2 4.26Å; W230-V234 HydrophobicContact CG-CG2 4.37Å; W230-V234 HydrophobicContact CZ2-CG2 4.11Å; W230-V234 WeakPolarHBondContact O-CB 3.25Å; W230-V234 WeakPolarHBondContact O-CG2 3.23Å; W230-V234 PolarHBondContact O-N 2.81Å; A231-V234 PolarHBondContact O-N 2.82Å; F232-V234 PolarHBondContact O-N 3.47Å; V234-S237 WeakPolarHBondContact O-CB 3.38Å; V234-S237 PolarHBondContact O-N 3.39Å; V234-S237 PolarHBondContact O-OG 3.34Å |
| 235 | G | 96.8 | Very high | 95.9 | Very high | 1 Ų | 1 | 36.5 Ų | 36.5 | 1% | 0.01 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.9 | -48.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112 | A231 F232 S237 R238 M249 | A231-G235 PolarHBondContact O-N 3.23Å; F232-G235 PolarHBondContact O-N 3.24Å; G235-S237 VanDerWaalsContact C-N 3.3Å; G235-S237 PolarHBondContact O-N 2.8Å; G235-R238 PolarHBondContact O-N 2.63Å; G235-M249 VanDerWaalsContact C-SD 3.57Å |
| 236 | M | 96.8 | Very high | 95.8 | Very high | 33 Ų | 33 | 33 Ų | 33 | 16% | 0.163 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -62 | -35 | 178.9 | -173.8 | 55.9 | 64.2 | 0 | 0 | 112.5 | F232 L233 R238 V239 L240 L246 M249 | F232-M236 HydrophobicContact CE1-CE 4.44Å; F232-M236 HydrophobicContact CE2-CE 4.34Å; F232-M236 HydrophobicContact CZ-CE 3.8Å; F232-M236 VanDerWaalsContact O-CB 3.31Å; F232-M236 WeakPolarHBondContact O-CB 3.48Å; F232-M236 PolarHBondContact O-N 2.9Å; L233-M236 PolarHBondContact O-N 3.37Å; M236-R238 PolarHBondContact O-N 3.09Å; M236-R238 VanDerWaalsContact O-N 3.14Å; M236-V239 WeakPolarHBondContact O-CB 3.44Å; M236-V239 PolarHBondContact O-N 3.31Å; M236-V239 HydrophobicContact SD-CB 4.23Å; M236-L240 HydrophobicContact CG-CD1 4.13Å; M236-L240 HydrophobicContact CG-CG 4.09Å; M236-L240 WeakPolarHBondContact O-CG 3.43Å; M236-L240 PolarHBondContact O-N 3.43Å; M236-L240 HydrophobicContact SD-CG 4.41Å; M236-L246 HydrophobicContact CE-CD2 4.26Å; M236-M249 HydrophobicContact CB-SD 4.4Å; M236-M249 HydrophobicContact CE-CE 3.92Å; M236-M249 HydrophobicContact CE-SD 4.01Å |
| 237 | S | 96.4 | Very high | 95.7 | Very high | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -53.7 | -37.2 | 179 | 77.1 | 0 | 0 | 0 | 0 | 112.7 | A126 L233 V234 G235 L240 L241 | A126-S237 WeakPolarHBondContact CB-OG 3.35Å; L233-S237 WeakPolarHBondContact O-CB 3.49Å; L233-S237 PolarHBondContact O-N 3.33Å; V234-S237 WeakPolarHBondContact O-CB 3.38Å; V234-S237 PolarHBondContact O-N 3.39Å; V234-S237 PolarHBondContact O-OG 3.34Å; G235-S237 VanDerWaalsContact C-N 3.3Å; G235-S237 PolarHBondContact O-N 2.8Å; S237-L240 PolarHBondContact O-N 2.94Å; S237-L241 WeakPolarHBondContact O-CB 3.11Å; S237-L241 WeakPolarHBondContact O-CD1 3.4Å; S237-L241 WeakPolarHBondContact O-CG 3.19Å; S237-L241 PolarHBondContact O-N 3.35Å |
| 238 | R | 94.4 | Very high | 95.6 | Very high | 8 Ų | 8 | 29.7 Ų | 29.7 | 3% | 0.03 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -76.5 | -25.2 | -179 | -63 | -65.7 | -76.4 | -169.9 | -5.3 | 113 | D189 D194 H202 G235 M236 G242 R243 H244 | D189-R238 IonicContact OD1-CZ 3.42Å; D189-R238 VanDerWaalsContact OD1-CZ 3.28Å; D189-R238 IonicContact OD1-NH1 3.09Å; D189-R238 PolarHBondContact OD1-NH1 3.07Å; D189-R238 IonicContact OD1-NH2 3.34Å; D189-R238 PolarHBondContact OD1-NH2 3.24Å; D194-R238 IonicContact OD2-CZ 2.65Å; D194-R238 IonicContact OD2-NE 3.28Å; D194-R238 IonicContact OD2-NH2 2.68Å; D194-R238 PolarHBondContact OD2-NH2 3.24Å; H202-R238 HydrophobicContact CB-CG 3.74Å; H202-R238 PolarHBondContact ND1-NE 2.79Å; G235-R238 PolarHBondContact O-N 2.63Å; M236-R238 PolarHBondContact O-N 3.09Å; M236-R238 VanDerWaalsContact O-N 3.14Å; R238-G242 PolarHBondContact O-N 2.93Å; R238-R243 VanDerWaalsContact NH2-CD 3.34Å; R238-R243 PolarHBondContact O-N 3.03Å; R238-H244 PolarHBondContact NE-NE2 3.18Å; R238-H244 PolarHBondContact O-N 3.44Å |
| 239 | V | 95 | Very high | 95.6 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -76.9 | -44.1 | 170.4 | -174.7 | 0 | 0 | 0 | 0 | 110.2 | L105 M236 L241 G242 L246 M249 | L105-V239 HydrophobicContact CB-CG1 4.02Å; L105-V239 HydrophobicContact CD1-CG1 4.26Å; M236-V239 WeakPolarHBondContact O-CB 3.44Å; M236-V239 PolarHBondContact O-N 3.31Å; M236-V239 HydrophobicContact SD-CB 4.23Å; V239-L241 VanDerWaalsContact C-N 3.3Å; V239-L241 PolarHBondContact O-N 3.12Å; V239-G242 WeakPolarHBondContact O-CA 3.49Å; V239-G242 PolarHBondContact O-N 2.96Å; V239-L246 HydrophobicContact CG1-CD2 4.08Å; V239-L246 HydrophobicContact CG1-CG 4.28Å; V239-L246 HydrophobicContact CG2-CD2 4.33Å; V239-M249 HydrophobicContact CG2-CB 4.08Å; V239-M249 HydrophobicContact CG2-CG 4.44Å; V239-M249 HydrophobicContact CG2-SD 3.92Å |
| 240 | L | 93.8 | Very high | 95.6 | Very high | 31 Ų | 31 | 25.1 Ų | 25.1 | 16% | 0.162 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -60.5 | -37.6 | 175.2 | -65.5 | 175.9 | 0 | 0 | 0 | 112.6 | L105 G106 V107 C108 I122 M236 S237 G242 | L105-L240 WeakPolarHBondContact O-CA 3.46Å; L105-L240 WeakPolarHBondContact O-CD2 3.45Å; G106-L240 CarbonylContact C-O 3.32Å; G106-L240 VanDerWaalsContact C-O 3.32Å; G106-L240 WeakPolarHBondContact CA-O 3.41Å; V107-L240 HydrophobicContact CG2-CD2 4.2Å; C108-L240 CarbonylContact C-O 3.59Å; C108-L240 WeakPolarHBondContact CA-O 3.48Å; C108-L240 WeakPolarHBondContact CB-O 3.49Å; C108-L240 PolarHBondContact N-O 3.22Å; I122-L240 HydrophobicContact CD1-CD1 4.21Å; I122-L240 HydrophobicContact CG2-CB 4.18Å; I122-L240 HydrophobicContact CG2-CD1 4.42Å; M236-L240 HydrophobicContact CG-CD1 4.13Å; M236-L240 HydrophobicContact CG-CG 4.09Å; M236-L240 WeakPolarHBondContact O-CG 3.43Å; M236-L240 PolarHBondContact O-N 3.43Å; M236-L240 HydrophobicContact SD-CG 4.41Å; S237-L240 PolarHBondContact O-N 2.94Å; L240-G242 PolarHBondContact O-N 3.31Å |
| 241 | L | 92.1 | Very high | 95.5 | Very high | 0 Ų | 0 | 25.5 Ų | 25.5 | 0% | 0 | 14% | 0.14 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | 0.1 | 172.2 | -69.3 | 168 | 0 | 0 | 0 | 113.6 | C108 R119 I122 A126 M183 S237 V239 R243 | C108-L241 HydrophobicContact CB-CD2 4.21Å; R119-L241 HydrophobicContact CG-CD2 3.77Å; I122-L241 HydrophobicContact CB-CD2 4.49Å; I122-L241 HydrophobicContact CG2-CD1 4.05Å; I122-L241 HydrophobicContact CG2-CD2 4.26Å; I122-L241 HydrophobicContact CG2-CG 3.78Å; A126-L241 HydrophobicContact CB-CD1 4.2Å; M183-L241 WeakPolarHBondContact CE-O 3.2Å; S237-L241 WeakPolarHBondContact O-CB 3.11Å; S237-L241 WeakPolarHBondContact O-CD1 3.4Å; S237-L241 WeakPolarHBondContact O-CG 3.19Å; S237-L241 PolarHBondContact O-N 3.35Å; V239-L241 VanDerWaalsContact C-N 3.3Å; V239-L241 PolarHBondContact O-N 3.12Å; L241-R243 VanDerWaalsContact C-N 3.33Å; L241-R243 PolarHBondContact O-N 3.43Å |
| 242 | G | 90.2 | Very high | 95.5 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 14% | 0.137 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 74.6 | 10.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | P180 W181 R238 V239 L240 | P180-G242 WeakPolarHBondContact CD-O 3.4Å; W181-G242 VanDerWaalsContact CD1-CA 3.48Å; W181-G242 PolarHBondContact N-O 3Å; R238-G242 PolarHBondContact O-N 2.93Å; V239-G242 WeakPolarHBondContact O-CA 3.49Å; V239-G242 PolarHBondContact O-N 2.96Å; L240-G242 PolarHBondContact O-N 3.31Å |
| 243 | R | 90.2 | Very high | 95.5 | Very high | 51 Ų | 51 | 22.2 Ų | 22.2 | 19% | 0.192 | 12% | 0.124 | C | C | . | . | S | Bend | trans | -85.9 | -31.7 | -174.9 | -78 | -175.5 | 173.9 | 91.3 | -19.5 | 114.1 | G179 D189 R238 L241 | G179-R243 WeakPolarHBondContact CA-O 3.35Å; D189-R243 IonicContact OD1-CZ 3.87Å; D189-R243 IonicContact OD1-NE 2.79Å; D189-R243 IonicContact OD1-NH2 3.69Å; D189-R243 IonicContact OD2-CZ 3.6Å; D189-R243 IonicContact OD2-NE 2.81Å; D189-R243 PolarHBondContact OD2-NE 3.01Å; D189-R243 IonicContact OD2-NH2 3.24Å; D189-R243 PolarHBondContact OD2-NH2 3.41Å; R238-R243 VanDerWaalsContact NH2-CD 3.34Å; R238-R243 PolarHBondContact O-N 3.03Å; L241-R243 VanDerWaalsContact C-N 3.33Å; L241-R243 PolarHBondContact O-N 3.43Å |
| 244 | H | 94.1 | Very high | 95.6 | Very high | 4 Ų | 4 | 21.6 Ų | 21.6 | 2% | 0.019 | 13% | 0.13 | C | C | . | . | S | Bend | trans | -129.2 | 151.2 | -176.3 | -55.4 | -110.7 | 0 | 0 | 0 | 111.5 | P180 D194 S197 A200 R238 D248 | P180-H244 VanDerWaalsContact CD-C 3.48Å; P180-H244 WeakPolarHBondContact CG-O 3.25Å; D194-H244 IonicContact OD1-CE1 3.8Å; D194-H244 PolarHBondContact OD1-CE1 2.78Å; D194-H244 IonicContact OD2-CE1 3.67Å; D194-H244 IonicContact OD2-NE2 3.91Å; S197-H244 PolarHBondContact O-ND1 3.11Å; A200-H244 HydrophobicContact CB-CB 4.25Å; R238-H244 PolarHBondContact NE-NE2 3.18Å; R238-H244 PolarHBondContact O-N 3.44Å; H244-D248 HydrophobicContact CB-CB 4.09Å |
| 245 | H | 95 | Very high | 95.6 | Very high | 9 Ų | 9 | 23 Ų | 23 | 4% | 0.042 | 14% | 0.137 | C | C | . | . | trans | -80.1 | 161.6 | 173.7 | -55.5 | -99.6 | 0 | 0 | 0 | 110.6 | D98 S102 R177 K178 P180 T247 D248 M249 | D98-H245 WeakPolarHBondContact OD2-CB 3.33Å; S102-H245 WeakPolarHBondContact OG-CA 3.49Å; R177-H245 VanDerWaalsContact CZ-CD2 3.42Å; R177-H245 PolarHBondContact NE-CD2 2.93Å; R177-H245 PolarHBondContact NH2-CD2 3.29Å; R177-H245 PolarHBondContact NH2-ND1 2.63Å; K178-H245 PolarHBondContact O-NE2 2.98Å; P180-H245 HydrophobicContact CG-CB 4.42Å; H245-T247 VanDerWaalsContact C-N 3.29Å; H245-T247 PolarHBondContact O-N 3.38Å; H245-D248 IonicContact CD2-OD2 3.55Å; H245-D248 PolarHBondContact CD2-OD2 3.35Å; H245-D248 VanDerWaalsContact CD2-OD2 3.24Å; H245-D248 IonicContact CG-OD2 3.86Å; H245-D248 PolarHBondContact N-OD2 2.89Å; H245-D248 WeakPolarHBondContact O-CB 3.42Å; H245-D248 PolarHBondContact O-N 2.9Å; H245-D248 VanDerWaalsContact O-N 3.12Å; H245-M249 PolarHBondContact O-N 3.48Å; H245-M249 VanDerWaalsContact O-N 3.11Å | ||
| 246 | L | 95.4 | Very high | 95.7 | Very high | 36 Ų | 36 | 23 Ų | 23 | 19% | 0.188 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -62.9 | -36.9 | 177.6 | -78.8 | 173.8 | 0 | 0 | 0 | 112.1 | D98 L101 S102 L105 M236 V239 D248 M249 A250 | D98-L246 PolarHBondContact OD1-N 3.47Å; L101-L246 HydrophobicContact CB-CD1 4.21Å; L101-L246 HydrophobicContact CD2-CD1 3.43Å; L101-L246 VanDerWaalsContact CD2-CD1 3.43Å; L101-L246 HydrophobicContact CG-CD1 3.57Å; S102-L246 PolarHBondContact OG-N 3.34Å; L105-L246 HydrophobicContact CD1-CD1 3.74Å; L105-L246 HydrophobicContact CD1-CD2 3.91Å; L105-L246 HydrophobicContact CD1-CG 4.04Å; M236-L246 HydrophobicContact CE-CD2 4.26Å; V239-L246 HydrophobicContact CG1-CD2 4.08Å; V239-L246 HydrophobicContact CG1-CG 4.28Å; V239-L246 HydrophobicContact CG2-CD2 4.33Å; L246-D248 VanDerWaalsContact C-N 3.33Å; L246-M249 HydrophobicContact CD2-CE 3.74Å; L246-M249 WeakPolarHBondContact O-CB 3.24Å; L246-M249 PolarHBondContact O-N 2.82Å; L246-A250 PolarHBondContact O-N 3.26Å |
| 247 | T | 95.3 | Very high | 95.7 | Very high | 56 Ų | 56 | 25.7 Ų | 25.7 | 34% | 0.344 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -61.7 | -39.5 | 172.1 | 53 | 0 | 0 | 0 | 0 | 112.3 | D98 R177 H245 M249 A250 C251 | D98-T247 HydrophobicContact CB-CG2 4Å; D98-T247 VanDerWaalsContact CG-CG2 3.44Å; D98-T247 VanDerWaalsContact CG-OG1 3.28Å; D98-T247 PolarHBondContact OD1-N 3.04Å; D98-T247 PolarHBondContact OD1-OG1 2.89Å; D98-T247 WeakPolarHBondContact OD2-CG2 3.49Å; D98-T247 PolarHBondContact OD2-OG1 2.96Å; R177-T247 PolarHBondContact NH1-OG1 3.12Å; H245-T247 VanDerWaalsContact C-N 3.29Å; H245-T247 PolarHBondContact O-N 3.38Å; T247-M249 VanDerWaalsContact C-N 3.31Å; T247-M249 PolarHBondContact O-N 2.89Å; T247-A250 PolarHBondContact O-N 2.67Å; T247-C251 WeakPolarHBondContact O-CB 3.05Å; T247-C251 PolarHBondContact O-N 2.87Å; T247-C251 PolarHBondContact O-SG 2.65Å; T247-C251 VanDerWaalsContact O-SG 3.41Å |
| 248 | D | 96.1 | Very high | 95.8 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62.7 | -39.2 | 176.1 | -57.7 | -23.3 | 0 | 0 | 0 | 111.8 | R177 S197 F198 A200 H244 H245 L246 G252 | R177-D248 VanDerWaalsContact CD-OD1 3.28Å; R177-D248 WeakPolarHBondContact CD-OD1 3.48Å; R177-D248 IonicContact CZ-OD1 2.8Å; R177-D248 IonicContact NE-OD1 3.7Å; R177-D248 IonicContact NH1-OD1 3.78Å; R177-D248 PolarHBondContact NH1-OD1 3.27Å; S197-D248 WeakPolarHBondContact CB-OD2 3.35Å; S197-D248 VanDerWaalsContact O-CB 3.28Å; S197-D248 WeakPolarHBondContact O-CB 3.28Å; S197-D248 VanDerWaalsContact O-CG 3.32Å; S197-D248 PolarHBondContact OG-OD2 3.47Å; F198-D248 WeakPolarHBondContact CB-OD1 3.27Å; F198-D248 WeakPolarHBondContact CD2-OD1 3.31Å; A200-D248 HydrophobicContact CB-CB 4.24Å; A200-D248 WeakPolarHBondContact CB-O 3.34Å; A200-D248 PolarHBondContact N-O 3.04Å; A200-D248 VanDerWaalsContact N-O 3.07Å; H244-D248 HydrophobicContact CB-CB 4.09Å; H245-D248 IonicContact CD2-OD2 3.55Å; H245-D248 PolarHBondContact CD2-OD2 3.35Å; H245-D248 VanDerWaalsContact CD2-OD2 3.24Å; H245-D248 IonicContact CG-OD2 3.86Å; H245-D248 PolarHBondContact N-OD2 2.89Å; H245-D248 WeakPolarHBondContact O-CB 3.42Å; H245-D248 PolarHBondContact O-N 2.9Å; H245-D248 VanDerWaalsContact O-N 3.12Å; L246-D248 VanDerWaalsContact C-N 3.33Å; D248-G252 PolarHBondContact O-N 2.9Å |
| 249 | M | 97 | Very high | 96 | Very high | 15 Ų | 15 | 30.9 Ų | 30.9 | 7% | 0.074 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -65.8 | -46.4 | 176.5 | -177 | -169.1 | 69.9 | 0 | 0 | 111.2 | A203 G235 M236 V239 H245 L246 T247 G252 F253 | A203-M249 HydrophobicContact CB-CG 4.18Å; G235-M249 VanDerWaalsContact C-SD 3.57Å; M236-M249 HydrophobicContact CB-SD 4.4Å; M236-M249 HydrophobicContact CE-CE 3.92Å; M236-M249 HydrophobicContact CE-SD 4.01Å; V239-M249 HydrophobicContact CG2-CB 4.08Å; V239-M249 HydrophobicContact CG2-CG 4.44Å; V239-M249 HydrophobicContact CG2-SD 3.92Å; H245-M249 PolarHBondContact O-N 3.48Å; H245-M249 VanDerWaalsContact O-N 3.11Å; L246-M249 HydrophobicContact CD2-CE 3.74Å; L246-M249 WeakPolarHBondContact O-CB 3.24Å; L246-M249 PolarHBondContact O-N 2.82Å; T247-M249 VanDerWaalsContact C-N 3.31Å; T247-M249 PolarHBondContact O-N 2.89Å; M249-G252 PolarHBondContact O-N 3.36Å; M249-F253 HydrophobicContact CE-CE2 4.1Å; M249-F253 HydrophobicContact CG-CD2 4.14Å; M249-F253 HydrophobicContact CG-CE2 3.57Å; M249-F253 HydrophobicContact CG-CZ 3.97Å; M249-F253 WeakPolarHBondContact O-CD2 3.32Å; M249-F253 PolarHBondContact O-N 3.3Å; M249-F253 HydrophobicContact SD-CE2 3.93Å; M249-F253 HydrophobicContact SD-CZ 4.3Å |
| 250 | A | 97.5 | Very high | 96.2 | Very high | 54 Ų | 54 | 31 Ų | 31 | 45% | 0.446 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -64.7 | -45.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | L246 T247 G252 F253 A254 | L246-A250 PolarHBondContact O-N 3.26Å; T247-A250 PolarHBondContact O-N 2.67Å; A250-G252 VanDerWaalsContact C-N 3.3Å; A250-G252 PolarHBondContact O-N 3.35Å; A250-F253 PolarHBondContact O-N 3.29Å; A250-A254 PolarHBondContact O-N 3.28Å |
| 251 | C | 97.6 | Very high | 96.4 | Very high | 55 Ų | 55 | 32 Ų | 32 | 37% | 0.372 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -65.2 | -33.7 | 173.7 | -69.1 | 0 | 0 | 0 | 0 | 112.1 | F198 T247 A254 L255 | F198-C251 HydrophobicContact CE2-CB 3.61Å; F198-C251 HydrophobicContact CZ-CB 4.01Å; T247-C251 WeakPolarHBondContact O-CB 3.05Å; T247-C251 PolarHBondContact O-N 2.87Å; T247-C251 PolarHBondContact O-SG 2.65Å; T247-C251 VanDerWaalsContact O-SG 3.41Å; C251-A254 PolarHBondContact O-N 3.4Å; C251-L255 VanDerWaalsContact O-CB 3.31Å; C251-L255 WeakPolarHBondContact O-CB 3.19Å; C251-L255 PolarHBondContact O-N 3.37Å |
| 252 | G | 98 | Very high | 96.6 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59.1 | -53.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112 | S204 D248 M249 A250 A254 L255 G256 | S204-G252 WeakPolarHBondContact CA-O 3.38Å; S204-G252 WeakPolarHBondContact CB-O 3.39Å; D248-G252 PolarHBondContact O-N 2.9Å; M249-G252 PolarHBondContact O-N 3.36Å; A250-G252 VanDerWaalsContact C-N 3.3Å; A250-G252 PolarHBondContact O-N 3.35Å; G252-A254 VanDerWaalsContact C-N 3.32Å; G252-A254 PolarHBondContact O-N 2.72Å; G252-L255 PolarHBondContact O-N 2.98Å; G252-G256 PolarHBondContact O-N 2.9Å |
| 253 | F | 98.6 | Very high | 96.9 | Very high | 39 Ų | 39 | 35.9 Ų | 35.9 | 17% | 0.171 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58 | -42.2 | 177 | -67.2 | -43.6 | 0 | 0 | 0 | 112.8 | A203 A207 A231 F232 M249 A250 G256 L257 | A203-F253 HydrophobicContact CB-CD1 3.67Å; A203-F253 HydrophobicContact CB-CE1 3.64Å; A203-F253 HydrophobicContact CB-CG 4.2Å; A203-F253 HydrophobicContact CB-CZ 4.17Å; A203-F253 VanDerWaalsContact O-CD1 3.31Å; A203-F253 WeakPolarHBondContact O-CD1 3.44Å; A207-F253 HydrophobicContact CB-CB 4.38Å; A207-F253 HydrophobicContact CB-CD1 3.91Å; A231-F253 WeakPolarHBondContact O-CE1 3.32Å; F232-F253 HydrophobicContact CD2-CE2 4.32Å; F232-F253 HydrophobicContact CD2-CZ 4.46Å; M249-F253 HydrophobicContact CE-CE2 4.1Å; M249-F253 HydrophobicContact CG-CD2 4.14Å; M249-F253 HydrophobicContact CG-CE2 3.57Å; M249-F253 HydrophobicContact CG-CZ 3.97Å; M249-F253 WeakPolarHBondContact O-CD2 3.32Å; M249-F253 PolarHBondContact O-N 3.3Å; M249-F253 HydrophobicContact SD-CE2 3.93Å; M249-F253 HydrophobicContact SD-CZ 4.3Å; A250-F253 PolarHBondContact O-N 3.29Å; F253-G256 PolarHBondContact O-N 3.31Å; F253-L257 WeakPolarHBondContact O-CG 3.48Å; F253-L257 PolarHBondContact O-N 3.32Å; F253-L257 VanDerWaalsContact O-N 3.1Å |
| 254 | A | 98.4 | Very high | 97.2 | Very high | 62 Ų | 62 | 38 Ų | 38 | 51% | 0.512 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -63 | -42.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A250 C251 G252 L257 L258 | A250-A254 PolarHBondContact O-N 3.28Å; C251-A254 PolarHBondContact O-N 3.4Å; G252-A254 VanDerWaalsContact C-N 3.32Å; G252-A254 PolarHBondContact O-N 2.72Å; A254-L257 PolarHBondContact O-N 2.96Å; A254-L258 PolarHBondContact O-N 3.29Å |
| 255 | L | 98.4 | Very high | 97.3 | Very high | 30 Ų | 30 | 43 Ų | 43 | 16% | 0.157 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.8 | -38.6 | 175.9 | -178.7 | 61.2 | 0 | 0 | 0 | 112 | T167 V168 P199 C251 G252 L257 L258 H259 | T167-L255 HydrophobicContact CG2-CD1 4.46Å; V168-L255 HydrophobicContact CG2-CD2 3.87Å; P199-L255 HydrophobicContact CB-CD2 4.26Å; P199-L255 HydrophobicContact CG-CD2 3.66Å; C251-L255 VanDerWaalsContact O-CB 3.31Å; C251-L255 WeakPolarHBondContact O-CB 3.19Å; C251-L255 PolarHBondContact O-N 3.37Å; G252-L255 PolarHBondContact O-N 2.98Å; L255-L257 PolarHBondContact O-N 3.47Å; L255-L258 HydrophobicContact CD1-CD2 4.33Å; L255-L258 WeakPolarHBondContact O-CB 3.45Å; L255-L258 PolarHBondContact O-N 3.38Å; L255-H259 WeakPolarHBondContact CD1-NE2 3.5Å; L255-H259 VanDerWaalsContact CG-CE1 3.44Å; L255-H259 WeakPolarHBondContact CG-CE1 3.16Å; L255-H259 PolarHBondContact O-N 3.48Å |
| 256 | G | 98.4 | Very high | 97.3 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.3 | -40.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | S204 M208 G252 F253 H259 F260 | S204-G256 VanDerWaalsContact O-CA 3.24Å; S204-G256 WeakPolarHBondContact O-CA 3.33Å; S204-G256 PolarHBondContact OG-N 2.88Å; M208-G256 WeakPolarHBondContact CA-O 3.45Å; M208-G256 VanDerWaalsContact CB-O 3.27Å; M208-G256 WeakPolarHBondContact CB-O 3.19Å; G252-G256 PolarHBondContact O-N 2.9Å; F253-G256 PolarHBondContact O-N 3.31Å; G256-H259 PolarHBondContact O-N 2.68Å; G256-F260 PolarHBondContact O-N 3.15Å |
| 257 | L | 98.5 | Very high | 97.4 | Very high | 90 Ų | 90 | 47.9 Ų | 47.9 | 47% | 0.471 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -66.7 | -37.7 | 173 | -66.6 | 174.5 | 0 | 0 | 0 | 111.9 | K211 F253 A254 L255 F260 S261 | K211-L257 HydrophobicContact CB-CD2 4.03Å; K211-L257 HydrophobicContact CG-CD2 4.2Å; F253-L257 WeakPolarHBondContact O-CG 3.48Å; F253-L257 PolarHBondContact O-N 3.32Å; F253-L257 VanDerWaalsContact O-N 3.1Å; A254-L257 PolarHBondContact O-N 2.96Å; L255-L257 PolarHBondContact O-N 3.47Å; L257-F260 PolarHBondContact O-N 3.4Å; L257-S261 PolarHBondContact O-N 2.95Å |
| 258 | L | 98.4 | Very high | 97.4 | Very high | 111 Ų | 111 | 47.4 Ų | 47.4 | 58% | 0.581 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -64.5 | -41.2 | 173.5 | -179.6 | 62.7 | 0 | 0 | 0 | 112.2 | A254 L255 S261 L262 | A254-L258 PolarHBondContact O-N 3.29Å; L255-L258 HydrophobicContact CD1-CD2 4.33Å; L255-L258 WeakPolarHBondContact O-CB 3.45Å; L255-L258 PolarHBondContact O-N 3.38Å; L258-S261 PolarHBondContact O-N 3.48Å; L258-L262 WeakPolarHBondContact O-CB 3.5Å; L258-L262 PolarHBondContact O-N 2.95Å |
| 259 | H | 98.3 | Very high | 97.3 | Very high | 5 Ų | 5 | 50.2 Ų | 50.2 | 2% | 0.023 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -61.6 | -42.2 | 174.3 | -67.8 | 155.4 | 0 | 0 | 0 | 111.9 | L163 D164 T167 M208 L255 G256 L262 V263 | L163-H259 HydrophobicContact CD2-CB 4.33Å; D164-H259 IonicContact OD1-CE1 3.44Å; D164-H259 PolarHBondContact OD1-CE1 3.37Å; D164-H259 IonicContact OD1-ND1 2.92Å; D164-H259 PolarHBondContact OD1-ND1 2.86Å; T167-H259 WeakPolarHBondContact CB-NE2 3.41Å; T167-H259 WeakPolarHBondContact CG2-NE2 3.37Å; M208-H259 HydrophobicContact CG-CB 3.97Å; L255-H259 WeakPolarHBondContact CD1-NE2 3.5Å; L255-H259 VanDerWaalsContact CG-CE1 3.44Å; L255-H259 WeakPolarHBondContact CG-CE1 3.16Å; L255-H259 PolarHBondContact O-N 3.48Å; G256-H259 PolarHBondContact O-N 2.68Å; H259-L262 PolarHBondContact O-N 3.47Å; H259-V263 WeakPolarHBondContact O-CG2 3.19Å; H259-V263 PolarHBondContact O-N 2.99Å; H259-V263 VanDerWaalsContact O-N 3.07Å |
| 260 | F | 98.2 | Very high | 97.1 | Very high | 2 Ų | 2 | 51.1 Ų | 51.1 | 1% | 0.009 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.3 | -52.8 | 173.2 | 167.3 | -93.4 | 0 | 0 | 0 | 111.3 | M208 K211 F212 S215 H216 G256 L257 L262 V263 E264 | M208-F260 HydrophobicContact CG-CB 4.48Å; K211-F260 HydrophobicContact CB-CB 4.34Å; K211-F260 HydrophobicContact CB-CD1 4.42Å; K211-F260 HydrophobicContact CB-CD2 4.31Å; K211-F260 HydrophobicContact CB-CG 4.05Å; K211-F260 HydrophobicContact CD-CD1 4.2Å; K211-F260 HydrophobicContact CD-CE1 4.15Å; K211-F260 VanDerWaalsContact CE-CE1 3.45Å; K211-F260 HydrophobicContact CG-CB 4.06Å; K211-F260 HydrophobicContact CG-CD1 3.3Å; K211-F260 HydrophobicContact CG-CD2 3.8Å; K211-F260 HydrophobicContact CG-CE1 3.67Å; K211-F260 HydrophobicContact CG-CE2 4.12Å; K211-F260 HydrophobicContact CG-CG 3.38Å; K211-F260 HydrophobicContact CG-CZ 4.07Å; F212-F260 HydrophobicContact CB-CD2 4Å; F212-F260 HydrophobicContact CB-CE2 4.38Å; F212-F260 HydrophobicContact CD2-CD2 4.28Å; F212-F260 HydrophobicContact CD2-CE2 4.48Å; S215-F260 WeakPolarHBondContact OG-CZ 3.43Å; H216-F260 AromaticContact NE2-CE2 3.65Å; G256-F260 PolarHBondContact O-N 3.15Å; L257-F260 PolarHBondContact O-N 3.4Å; F260-L262 VanDerWaalsContact C-N 3.29Å; F260-L262 PolarHBondContact O-N 2.91Å; F260-V263 PolarHBondContact O-N 3.14Å; F260-V263 VanDerWaalsContact O-N 3.15Å; F260-E264 HydrophobicContact CE1-CB 4.31Å; F260-E264 VanDerWaalsContact CE1-CD 3.45Å; F260-E264 HydrophobicContact CE1-CG 4.44Å; F260-E264 WeakPolarHBondContact CE1-OE2 3.45Å; F260-E264 HydrophobicContact CZ-CB 4.27Å; F260-E264 HydrophobicContact CZ-CG 4.27Å; F260-E264 VanDerWaalsContact CZ-OE1 3.27Å; F260-E264 WeakPolarHBondContact CZ-OE1 3.36Å; F260-E264 WeakPolarHBondContact O-CB 3.46Å; F260-E264 PolarHBondContact O-N 2.83Å |
| 261 | S | 97.9 | Very high | 96.9 | Very high | 54 Ų | 54 | 52.5 Ų | 52.5 | 38% | 0.378 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -66.4 | -29 | -177.9 | -71.7 | 0 | 0 | 0 | 0 | 113.4 | L257 L258 T265 | L257-S261 PolarHBondContact O-N 2.95Å; L258-S261 PolarHBondContact O-N 3.48Å; S261-T265 WeakPolarHBondContact O-CG2 3.28Å; S261-T265 PolarHBondContact O-N 2.97Å; S261-T265 VanDerWaalsContact O-N 3.12Å; S261-T265 PolarHBondContact O-OG1 2.84Å |
| 262 | L | 97.4 | Very high | 96.7 | Very high | 80 Ų | 80 | 51.5 Ų | 51.5 | 42% | 0.419 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -67.9 | -42.3 | 171.9 | -178.3 | 55.2 | 0 | 0 | 0 | 111.5 | L163 L258 H259 F260 E264 T265 V266 | L163-L262 HydrophobicContact CD1-CD2 4.35Å; L163-L262 HydrophobicContact CD2-CB 4.48Å; L163-L262 HydrophobicContact CD2-CD2 4.06Å; L163-L262 HydrophobicContact CD2-CG 4.36Å; L258-L262 WeakPolarHBondContact O-CB 3.5Å; L258-L262 PolarHBondContact O-N 2.95Å; H259-L262 PolarHBondContact O-N 3.47Å; F260-L262 VanDerWaalsContact C-N 3.29Å; F260-L262 PolarHBondContact O-N 2.91Å; L262-E264 VanDerWaalsContact C-N 3.34Å; L262-T265 PolarHBondContact O-N 2.91Å; L262-T265 PolarHBondContact O-OG1 2.87Å; L262-V266 HydrophobicContact CD1-CG1 4.45Å; L262-V266 WeakPolarHBondContact O-CG2 3.36Å; L262-V266 PolarHBondContact O-N 3.25Å; L262-V266 VanDerWaalsContact O-N 3.11Å |
| 263 | V | 97.1 | Very high | 96.5 | Very high | 1 Ų | 1 | 51.5 Ų | 51.5 | 1% | 0.006 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -68 | -35.4 | 175.9 | 173.5 | 0 | 0 | 0 | 0 | 111.7 | N156 A160 L163 F212 H259 F260 T265 V266 W267 | N156-V263 HydrophobicContact CB-CG1 4.43Å; A160-V263 HydrophobicContact CB-CB 4.4Å; A160-V263 HydrophobicContact CB-CG1 4.29Å; A160-V263 HydrophobicContact CB-CG2 3.76Å; L163-V263 HydrophobicContact CD2-CG2 3.78Å; F212-V263 HydrophobicContact CE2-CG1 4.36Å; H259-V263 WeakPolarHBondContact O-CG2 3.19Å; H259-V263 PolarHBondContact O-N 2.99Å; H259-V263 VanDerWaalsContact O-N 3.07Å; F260-V263 PolarHBondContact O-N 3.14Å; F260-V263 VanDerWaalsContact O-N 3.15Å; V263-T265 VanDerWaalsContact C-N 3.3Å; V263-T265 PolarHBondContact O-N 3.42Å; V263-V266 CarbonylContact O-C 3.56Å; V263-V266 PolarHBondContact O-N 3.34Å; V263-W267 HydrophobicContact CG1-CE3 4.33Å; V263-W267 WeakPolarHBondContact O-CA 3.48Å; V263-W267 PolarHBondContact O-N 3.22Å |
| 264 | E | 96.1 | Very high | 96.2 | Very high | 94 Ų | 94 | 52.6 Ų | 52.6 | 44% | 0.439 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -61.7 | -34.9 | 172.9 | -169.1 | 172.7 | -131.1 | 0 | 0 | 111.9 | F260 L262 | F260-E264 HydrophobicContact CE1-CB 4.31Å; F260-E264 VanDerWaalsContact CE1-CD 3.45Å; F260-E264 HydrophobicContact CE1-CG 4.44Å; F260-E264 WeakPolarHBondContact CE1-OE2 3.45Å; F260-E264 HydrophobicContact CZ-CB 4.27Å; F260-E264 HydrophobicContact CZ-CG 4.27Å; F260-E264 VanDerWaalsContact CZ-OE1 3.27Å; F260-E264 WeakPolarHBondContact CZ-OE1 3.36Å; F260-E264 WeakPolarHBondContact O-CB 3.46Å; F260-E264 PolarHBondContact O-N 2.83Å; L262-E264 VanDerWaalsContact C-N 3.34Å |
| 265 | T | 95.9 | Very high | 95.9 | Very high | 111 Ų | 111 | 53.7 Ų | 53.7 | 68% | 0.681 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -82.7 | -19.8 | 175.9 | 58.4 | 0 | 0 | 0 | 0 | 115 | S261 L262 V263 | S261-T265 WeakPolarHBondContact O-CG2 3.28Å; S261-T265 PolarHBondContact O-N 2.97Å; S261-T265 VanDerWaalsContact O-N 3.12Å; S261-T265 PolarHBondContact O-OG1 2.84Å; L262-T265 PolarHBondContact O-N 2.91Å; L262-T265 PolarHBondContact O-OG1 2.87Å; V263-T265 VanDerWaalsContact C-N 3.3Å; V263-T265 PolarHBondContact O-N 3.42Å |
| 266 | V | 95.6 | Very high | 95.6 | Very high | 79 Ų | 79 | 56.6 Ų | 56.6 | 48% | 0.479 | 32% | 0.323 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.1 | 24.9 | 176.3 | -51.6 | 0 | 0 | 0 | 0 | 113.4 | L262 V263 L268 | L262-V266 HydrophobicContact CD1-CG1 4.45Å; L262-V266 WeakPolarHBondContact O-CG2 3.36Å; L262-V266 PolarHBondContact O-N 3.25Å; L262-V266 VanDerWaalsContact O-N 3.11Å; V263-V266 CarbonylContact O-C 3.56Å; V263-V266 PolarHBondContact O-N 3.34Å; V266-L268 PolarHBondContact O-N 3.2Å |
| 267 | W | 96.6 | Very high | 95.2 | Very high | 67 Ų | 67 | 58.4 Ų | 58.4 | 25% | 0.254 | 33% | 0.332 | S | S | . | . | P | Polyproline II helix | trans | -53.7 | 122.9 | -171.3 | -171.5 | -90.8 | 0 | 0 | 0 | 113.1 | E152 V153 N156 F212 H216 V263 S269 | E152-W267 PolarHBondContact OE1-NE1 3.05Å; V153-W267 HydrophobicContact CG2-CZ2 4.35Å; N156-W267 HydrophobicContact CB-CD2 4.19Å; N156-W267 HydrophobicContact CB-CE3 3.88Å; N156-W267 HydrophobicContact CB-CH2 3.6Å; N156-W267 HydrophobicContact CB-CZ2 3.91Å; N156-W267 HydrophobicContact CB-CZ3 3.59Å; F212-W267 HydrophobicContact CD2-CZ3 4.44Å; F212-W267 AromaticContact CE2-CH2 3.89Å; F212-W267 HydrophobicContact CE2-CH2 3.89Å; F212-W267 AromaticContact CE2-CZ3 3.51Å; F212-W267 HydrophobicContact CE2-CZ3 3.51Å; F212-W267 AromaticContact CZ-CH2 3.62Å; F212-W267 HydrophobicContact CZ-CH2 3.62Å; F212-W267 AromaticContact CZ-CZ3 3.78Å; F212-W267 HydrophobicContact CZ-CZ3 3.78Å; H216-W267 AromaticContact CD2-CH2 3.76Å; H216-W267 AromaticContact CD2-CZ3 3.8Å; H216-W267 AromaticContact CE1-CE3 3.97Å; H216-W267 AromaticContact CE1-CH2 3.46Å; H216-W267 VanDerWaalsContact CE1-CH2 3.46Å; H216-W267 WeakPolarHBondContact CE1-CH2 3.11Å; H216-W267 AromaticContact CE1-CZ3 3.31Å; H216-W267 WeakPolarHBondContact CE1-CZ3 3.09Å; H216-W267 AromaticContact CG-CH2 3.71Å; H216-W267 AromaticContact ND1-CH2 3.51Å; H216-W267 AromaticContact ND1-CZ3 3.88Å; H216-W267 AromaticContact NE2-CH2 3.65Å; H216-W267 AromaticContact NE2-CZ3 3.28Å; H216-W267 VanDerWaalsContact NE2-CZ3 3.28Å; H216-W267 WeakPolarHBondContact NE2-CZ3 3.41Å; V263-W267 HydrophobicContact CG1-CE3 4.33Å; V263-W267 WeakPolarHBondContact O-CA 3.48Å; V263-W267 PolarHBondContact O-N 3.22Å; W267-S269 PolarHBondContact O-N 3.36Å |
| 268 | L | 95.1 | Very high | 94.7 | Very high | 47 Ų | 47 | 56.9 Ų | 56.9 | 25% | 0.246 | 33% | 0.329 | C | S | . | . | P | Polyproline II helix | trans | -78.9 | 119.3 | 179.3 | -60.7 | -179.3 | 0 | 0 | 0 | 110 | E152 V155 N156 L159 V266 C273 L276 | E152-L268 VanDerWaalsContact CG-O 3.31Å; E152-L268 WeakPolarHBondContact CG-O 3.33Å; V155-L268 HydrophobicContact CG1-CD1 4.2Å; N156-L268 PolarHBondContact ND2-O 2.77Å; N156-L268 PolarHBondContact OD1-N 2.77Å; L159-L268 HydrophobicContact CD2-CD1 3.95Å; L159-L268 HydrophobicContact CD2-CG 4.16Å; V266-L268 PolarHBondContact O-N 3.2Å; L268-C273 PolarHBondContact O-SG 2.99Å; L268-C273 VanDerWaalsContact O-SG 3.41Å; L268-L276 HydrophobicContact CD1-CD1 3.69Å |
| 269 | S | 94.7 | Very high | 94.2 | Very high | 59 Ų | 59 | 56.6 Ų | 56.6 | 41% | 0.413 | 33% | 0.327 | S | S | . | . | P | Polyproline II helix | trans | -66.7 | 160.1 | 175 | 62.5 | 0 | 0 | 0 | 0 | 112.5 | W267 S271 A272 C273 | W267-S269 PolarHBondContact O-N 3.36Å; S269-S271 PolarHBondContact O-N 3.07Å; S269-S271 VanDerWaalsContact O-N 3.11Å; S269-S271 PolarHBondContact OG-OG 3.39Å; S269-A272 PolarHBondContact O-N 2.76Å; S269-A272 VanDerWaalsContact O-N 3.08Å; S269-C273 PolarHBondContact O-N 3Å; S269-C273 PolarHBondContact O-SG 3.41Å |
| 270 | S | 93.1 | Very high | 93.4 | Very high | 33 Ų | 33 | 57.7 Ų | 57.7 | 23% | 0.231 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -47.5 | -40.9 | 177.3 | -81.4 | 0 | 0 | 0 | 0 | 113.5 | E152 C273 Q274 | E152-S270 VanDerWaalsContact OE2-CA 3.26Å; E152-S270 WeakPolarHBondContact OE2-CA 3.47Å; E152-S270 VanDerWaalsContact OE2-CB 3.25Å; E152-S270 WeakPolarHBondContact OE2-CB 3.48Å; E152-S270 PolarHBondContact OE2-N 2.69Å; E152-S270 PolarHBondContact OE2-OG 3.1Å; S270-C273 PolarHBondContact O-N 2.91Å; S270-Q274 WeakPolarHBondContact O-CG 3.42Å; S270-Q274 PolarHBondContact O-N 3.43Å |
| 271 | S | 93.1 | Very high | 92.6 | Very high | 84 Ų | 84 | 61.6 Ų | 61.6 | 59% | 0.587 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -66.6 | -46.3 | 179.6 | 50.9 | 0 | 0 | 0 | 0 | 112.5 | S269 C273 Q274 T275 | S269-S271 PolarHBondContact O-N 3.07Å; S269-S271 VanDerWaalsContact O-N 3.11Å; S269-S271 PolarHBondContact OG-OG 3.39Å; S271-C273 VanDerWaalsContact C-N 3.3Å; S271-C273 PolarHBondContact O-N 3.05Å; S271-Q274 PolarHBondContact O-N 3.19Å; S271-T275 PolarHBondContact O-N 2.99Å; S271-T275 PolarHBondContact O-OG1 3.13Å |
| 272 | A | 92.9 | Very high | 91.2 | Very high | 33 Ų | 33 | 64.6 Ų | 64.6 | 27% | 0.273 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.6 | -39.9 | 174 | 0 | 0 | 0 | 0 | 0 | 111.5 | S269 T275 L276 | S269-A272 PolarHBondContact O-N 2.76Å; S269-A272 VanDerWaalsContact O-N 3.08Å; A272-T275 PolarHBondContact O-N 2.95Å; A272-L276 WeakPolarHBondContact O-CG 3.41Å; A272-L276 PolarHBondContact O-N 3.14Å |
| 273 | C | 93.3 | Very high | 89.5 | Confident | 0 Ų | 0 | 65.1 Ų | 65.1 | 0% | 0 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -61.4 | -43.5 | 174.1 | -65.3 | 0 | 0 | 0 | 0 | 112.2 | V155 L268 S269 S270 S271 T275 L276 I277 | V155-C273 HydrophobicContact CB-CB 4.27Å; V155-C273 HydrophobicContact CG1-CB 4.32Å; V155-C273 HydrophobicContact CG2-CB 4.3Å; L268-C273 PolarHBondContact O-SG 2.99Å; L268-C273 VanDerWaalsContact O-SG 3.41Å; S269-C273 PolarHBondContact O-N 3Å; S269-C273 PolarHBondContact O-SG 3.41Å; S270-C273 PolarHBondContact O-N 2.91Å; S271-C273 VanDerWaalsContact C-N 3.3Å; S271-C273 PolarHBondContact O-N 3.05Å; C273-T275 PolarHBondContact O-N 3.02Å; C273-L276 PolarHBondContact O-N 3.36Å; C273-I277 WeakPolarHBondContact O-CB 3.33Å; C273-I277 WeakPolarHBondContact O-CD1 3.42Å; C273-I277 VanDerWaalsContact O-CG1 3.24Å; C273-I277 WeakPolarHBondContact O-CG1 3.48Å; C273-I277 PolarHBondContact O-N 3.4Å |
| 274 | Q | 93.2 | Very high | 87.7 | Confident | 63 Ų | 63 | 75.3 Ų | 75.3 | 29% | 0.294 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -62.3 | -41.7 | 174.5 | -69 | -43.7 | -68.7 | 0 | 0 | 112.1 | L148 S270 S271 L276 I277 S278 | L148-Q274 HydrophobicContact CD2-CG 3.98Å; S270-Q274 WeakPolarHBondContact O-CG 3.42Å; S270-Q274 PolarHBondContact O-N 3.43Å; S271-Q274 PolarHBondContact O-N 3.19Å; Q274-L276 PolarHBondContact O-N 3.26Å; Q274-I277 PolarHBondContact O-N 2.68Å; Q274-S278 VanDerWaalsContact O-CB 3.28Å; Q274-S278 WeakPolarHBondContact O-CB 3.27Å; Q274-S278 PolarHBondContact O-N 2.99Å |
| 275 | T | 91.7 | Very high | 85.5 | Confident | 84 Ų | 84 | 74 Ų | 74 | 52% | 0.515 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -61 | -44.9 | 175.9 | -56.9 | 0 | 0 | 0 | 0 | 111.5 | S271 A272 C273 S278 I279 | S271-T275 PolarHBondContact O-N 2.99Å; S271-T275 PolarHBondContact O-OG1 3.13Å; A272-T275 PolarHBondContact O-N 2.95Å; C273-T275 PolarHBondContact O-N 3.02Å; T275-S278 PolarHBondContact O-N 3.42Å; T275-I279 HydrophobicContact CG2-CD1 3.81Å; T275-I279 HydrophobicContact CG2-CG1 4.49Å; T275-I279 WeakPolarHBondContact O-CB 3.48Å; T275-I279 VanDerWaalsContact O-CG1 3.27Å; T275-I279 WeakPolarHBondContact O-CG1 3.27Å; T275-I279 PolarHBondContact O-N 3.33Å |
| 276 | L | 91.3 | Very high | 83.6 | Confident | 91 Ų | 91 | 73 Ų | 73 | 48% | 0.476 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 177 | -70.2 | 173.3 | 0 | 0 | 0 | 112.6 | V155 L268 A272 C273 Q274 G280 | V155-L276 HydrophobicContact CG1-CD1 4.26Å; L268-L276 HydrophobicContact CD1-CD1 3.69Å; A272-L276 WeakPolarHBondContact O-CG 3.41Å; A272-L276 PolarHBondContact O-N 3.14Å; C273-L276 PolarHBondContact O-N 3.36Å; Q274-L276 PolarHBondContact O-N 3.26Å; L276-G280 PolarHBondContact O-N 3.46Å |
| 277 | I | 90 | Very high | 81.5 | Confident | 38 Ų | 38 | 79.7 Ų | 79.7 | 20% | 0.195 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -62.8 | -44.2 | 176.2 | -68.3 | 163.9 | 0 | 0 | 0 | 110.3 | L142 Q151 V155 C273 Q274 G280 T281 | L142-I277 HydrophobicContact CD1-CD1 4.1Å; Q151-I277 HydrophobicContact CB-CD1 3.91Å; Q151-I277 HydrophobicContact CG-CD1 4.21Å; V155-I277 HydrophobicContact CG2-CD1 4.02Å; V155-I277 HydrophobicContact CG2-CG1 4.12Å; C273-I277 WeakPolarHBondContact O-CB 3.33Å; C273-I277 WeakPolarHBondContact O-CD1 3.42Å; C273-I277 VanDerWaalsContact O-CG1 3.24Å; C273-I277 WeakPolarHBondContact O-CG1 3.48Å; C273-I277 PolarHBondContact O-N 3.4Å; Q274-I277 PolarHBondContact O-N 2.68Å; I277-G280 CarbonylContact O-C 3.58Å; I277-G280 WeakPolarHBondContact O-CA 3.48Å; I277-G280 PolarHBondContact O-N 3.41Å; I277-T281 PolarHBondContact O-N 3.28Å; I277-T281 PolarHBondContact O-OG1 3.08Å |
| 278 | S | 88.3 | Confident | 79.1 | Confident | 58 Ų | 58 | 89.9 Ų | 89.9 | 41% | 0.406 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.6 | -42.6 | 179.9 | -175.7 | 0 | 0 | 0 | 0 | 112.9 | Q274 T275 G280 T281 L282 | Q274-S278 VanDerWaalsContact O-CB 3.28Å; Q274-S278 WeakPolarHBondContact O-CB 3.27Å; Q274-S278 PolarHBondContact O-N 2.99Å; T275-S278 PolarHBondContact O-N 3.42Å; S278-G280 VanDerWaalsContact C-N 3.26Å; S278-G280 PolarHBondContact O-N 3.37Å; S278-T281 PolarHBondContact O-N 3.08Å; S278-T281 PolarHBondContact O-OG1 2.88Å; S278-L282 WeakPolarHBondContact O-CB 3.48Å; S278-L282 WeakPolarHBondContact O-CD1 3.06Å; S278-L282 VanDerWaalsContact O-CG 3.26Å; S278-L282 WeakPolarHBondContact O-CG 3.19Å; S278-L282 PolarHBondContact O-N 3.1Å |
| 279 | I | 88.7 | Confident | 78.2 | Confident | 106 Ų | 106 | 92 Ų | 92 | 54% | 0.544 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.9 | -41.1 | 172.3 | -69.9 | 166.6 | 0 | 0 | 0 | 109.8 | T275 S283 | T275-I279 HydrophobicContact CG2-CD1 3.81Å; T275-I279 HydrophobicContact CG2-CG1 4.49Å; T275-I279 WeakPolarHBondContact O-CB 3.48Å; T275-I279 VanDerWaalsContact O-CG1 3.27Å; T275-I279 WeakPolarHBondContact O-CG1 3.27Å; T275-I279 PolarHBondContact O-N 3.33Å; I279-S283 PolarHBondContact O-N 3.38Å |
| 280 | G | 81.5 | Confident | 77.4 | Confident | 28 Ų | 28 | 93.7 Ų | 93.7 | 29% | 0.289 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -54.2 | -61.3 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L276 I277 S278 L282 S283 | L276-G280 PolarHBondContact O-N 3.46Å; I277-G280 CarbonylContact O-C 3.58Å; I277-G280 WeakPolarHBondContact O-CA 3.48Å; I277-G280 PolarHBondContact O-N 3.41Å; S278-G280 VanDerWaalsContact C-N 3.26Å; S278-G280 PolarHBondContact O-N 3.37Å; G280-L282 VanDerWaalsContact C-N 3.32Å; G280-L282 PolarHBondContact O-N 3.08Å; G280-S283 WeakPolarHBondContact O-CB 3.21Å; G280-S283 PolarHBondContact O-N 3.2Å; G280-S283 PolarHBondContact O-OG 2.84Å |
| 281 | T | 80.8 | Confident | 76.5 | Confident | 84 Ų | 84 | 97.1 Ų | 97.1 | 52% | 0.515 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.9 | -33.3 | -176.2 | 54.5 | 0 | 0 | 0 | 0 | 113.7 | I277 S278 S283 W284 S285 | I277-T281 PolarHBondContact O-N 3.28Å; I277-T281 PolarHBondContact O-OG1 3.08Å; S278-T281 PolarHBondContact O-N 3.08Å; S278-T281 PolarHBondContact O-OG1 2.88Å; T281-S283 PolarHBondContact O-N 3.16Å; T281-W284 PolarHBondContact O-N 3.49Å; T281-S285 PolarHBondContact O-N 3.01Å; T281-S285 VanDerWaalsContact O-N 3.12Å |
| 282 | L | 69.4 | Low | 75.5 | Confident | 116 Ų | 116 | 97.9 Ų | 97.9 | 61% | 0.607 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.5 | -22.2 | 173.5 | -75.7 | 165.7 | 0 | 0 | 0 | 113.6 | S278 G280 W284 S285 | S278-L282 WeakPolarHBondContact O-CB 3.48Å; S278-L282 WeakPolarHBondContact O-CD1 3.06Å; S278-L282 VanDerWaalsContact O-CG 3.26Å; S278-L282 WeakPolarHBondContact O-CG 3.19Å; S278-L282 PolarHBondContact O-N 3.1Å; G280-L282 VanDerWaalsContact C-N 3.32Å; G280-L282 PolarHBondContact O-N 3.08Å; L282-W284 VanDerWaalsContact C-N 3.33Å; L282-S285 PolarHBondContact O-OG 3.49Å |
| 283 | S | 62.3 | Low | 74.4 | Confident | 92 Ų | 92 | 101.9 Ų | 101.9 | 64% | 0.643 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80 | -12.8 | 170.6 | 74.3 | 0 | 0 | 0 | 0 | 114 | I279 G280 T281 | I279-S283 PolarHBondContact O-N 3.38Å; G280-S283 WeakPolarHBondContact O-CB 3.21Å; G280-S283 PolarHBondContact O-N 3.2Å; G280-S283 PolarHBondContact O-OG 2.84Å; T281-S283 PolarHBondContact O-N 3.16Å |
| 284 | W | 58.5 | Low | 73.2 | Confident | 214 Ų | 214 | 108.7 Ų | 108.7 | 81% | 0.811 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.6 | -13.4 | 179.2 | -66.4 | 98 | 0 | 0 | 0 | 113.8 | T281 L282 P286 | T281-W284 PolarHBondContact O-N 3.49Å; L282-W284 VanDerWaalsContact C-N 3.33Å; W284-P286 VanDerWaalsContact O-CD 3.26Å; W284-P286 WeakPolarHBondContact O-CD 3.42Å |
| 285 | S | 49.9 | Very low | 71.8 | Confident | 66 Ų | 66 | 112 Ų | 112 | 46% | 0.462 | 58% | 0.58 | S | S | . | * | S | Bend | trans | -64.7 | 117.1 | 169.8 | 47.4 | 0 | 0 | 0 | 0 | 109.4 | T281 L282 | T281-S285 PolarHBondContact O-N 3.01Å; T281-S285 VanDerWaalsContact O-N 3.12Å; L282-S285 PolarHBondContact O-OG 3.49Å |
| 286 | P | 56.6 | Low | 70.2 | Confident | 91 Ų | 91 | 114.2 Ų | 114.2 | 59% | 0.591 | 59% | 0.585 | S | S | * | * | trans | -64.3 | 145.7 | -178.5 | -20.9 | 33.5 | 0 | 0 | 0 | 111.5 | W284 Y288 | W284-P286 VanDerWaalsContact O-CD 3.26Å; W284-P286 WeakPolarHBondContact O-CD 3.42Å; P286-Y288 HydrophobicContact CB-CD2 4.38Å; P286-Y288 HydrophobicContact CG-CE2 4.49Å; P286-Y288 PolarHBondContact O-N 3.44Å; P286-Y288 VanDerWaalsContact O-N 3.09Å | ||
| 287 | F | 51 | Low | 68.5 | Low | 219 Ų | 219 | 116.1 Ų | 116.1 | 96% | 0.961 | 59% | 0.594 | S | S | * | * | trans | -65.3 | 104.1 | 152.4 | -63.8 | -87.8 | 0 | 0 | 0 | 107 | ||||
| 288 | Y | 44.8 | Very low | 66.5 | Low | 281 Ų | 281 | 123.2 Ų | 123.2 | 100% | 1.102 | 63% | 0.63 | S | S | * | * | trans | -77.2 | 0 | 170.2 | -91 | -86 | 0 | 0 | 0 | 111 | P286 | P286-Y288 HydrophobicContact CB-CD2 4.38Å; P286-Y288 HydrophobicContact CG-CE2 4.49Å; P286-Y288 PolarHBondContact O-N 3.44Å; P286-Y288 VanDerWaalsContact O-N 3.09Å |
Retrieved 288 of 288 residues in 1858.3 ms
(Link to these results)