| 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 | 53 | Low | 60.2 | Low | 230 Ų | 230 | 153.9 Ų | 153.9 | 100% | 1.133 | 77% | 0.766 | S | S | * | * | 0 | 48.9 | 0 | -66.2 | 175.7 | 166.7 | 0 | 0 | 112.8 | |||||
| 2 | R | 58.7 | Low | 60.4 | Low | 226 Ų | 226 | 160.8 Ų | 160.8 | 85% | 0.853 | 78% | 0.776 | S | S | * | * | trans | -118.9 | -2.8 | -177.8 | -82 | -173.3 | 175.4 | -178.9 | -1.1 | 115.2 | ||||
| 3 | V | 59 | Low | 60.9 | Low | 129 Ų | 129 | 158.2 Ų | 158.2 | 78% | 0.782 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -90.3 | -14 | -172.8 | -166.5 | 0 | 0 | 0 | 0 | 112.7 | ||
| 4 | T | 61.7 | Low | 61.6 | Low | 110 Ų | 110 | 152.9 Ų | 152.9 | 68% | 0.675 | 77% | 0.769 | S | S | * | * | S | Bend | trans | -81.4 | -20.6 | -175.6 | 32.9 | 0 | 0 | 0 | 0 | 114.7 | ||
| 5 | I | 63.8 | Low | 62.3 | Low | 115 Ų | 115 | 148.2 Ų | 148.2 | 59% | 0.59 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -76.9 | -30.5 | -174.9 | -60.4 | 175.6 | 0 | 0 | 0 | 111.9 | R7 L8 | I5-R7 VanDerWaalsContact C-N 3.27Å; I5-R7 PolarHBondContact O-N 2.86Å; I5-L8 PolarHBondContact O-N 3.02Å |
| 6 | I | 61.8 | Low | 62.9 | Low | 128 Ų | 128 | 146.1 Ų | 146.1 | 66% | 0.656 | 76% | 0.762 | S | S | * | * | G | 310 helix | trans | -69.3 | -23.7 | -174.6 | -61.4 | 175.2 | 0 | 0 | 0 | 112.3 | L8 | I6-L8 VanDerWaalsContact C-N 3.3Å; I6-L8 PolarHBondContact O-N 3.25Å |
| 7 | R | 57.6 | Low | 63.3 | Low | 229 Ų | 229 | 144.4 Ų | 144.4 | 86% | 0.864 | 76% | 0.762 | S | S | * | * | G | 310 helix | trans | -73.1 | -16.1 | 177.9 | -80.1 | -167 | 174.7 | -179.2 | -0.5 | 114.7 | I5 | I5-R7 VanDerWaalsContact C-N 3.27Å; I5-R7 PolarHBondContact O-N 2.86Å |
| 8 | L | 59.5 | Low | 63.8 | Low | 155 Ų | 155 | 140.7 Ų | 140.7 | 81% | 0.812 | 76% | 0.756 | S | S | * | * | G | 310 helix | trans | -84.3 | -19.2 | -180 | -90.5 | 152.8 | 0 | 0 | 0 | 113.6 | I5 I6 | I5-L8 PolarHBondContact O-N 3.02Å; I6-L8 VanDerWaalsContact C-N 3.3Å; I6-L8 PolarHBondContact O-N 3.25Å |
| 9 | I | 64.2 | Low | 64.1 | Low | 133 Ų | 133 | 140 Ų | 140 | 68% | 0.682 | 76% | 0.76 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98 | -9.3 | -173.9 | -56.9 | 174.1 | 0 | 0 | 0 | 112 | P11 | I9-P11 WeakPolarHBondContact O-CD 3.17Š|
| 10 | L | 58.4 | Low | 64.2 | Low | 135 Ų | 135 | 137.6 Ų | 137.6 | 71% | 0.707 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -67.6 | 109.5 | 172.8 | -133.7 | 79 | 0 | 0 | 0 | 107.4 | R12 | L10-R12 PolarHBondContact O-N 3.04Š|
| 11 | P | 64.1 | Low | 64.6 | Low | 103 Ų | 103 | 136.3 Ų | 136.3 | 67% | 0.669 | 74% | 0.742 | S | S | * | * | trans | -56.5 | 118.9 | 171.5 | 25.7 | -31.6 | 0 | 0 | 0 | 104.1 | I9 V13 | I9-P11 WeakPolarHBondContact O-CD 3.17Å; P11-V13 PolarHBondContact O-N 2.78Å | ||
| 12 | R | 62.7 | Low | 65.7 | Low | 237 Ų | 237 | 131.7 Ų | 131.7 | 89% | 0.894 | 72% | 0.721 | S | S | * | * | trans | -49.2 | 99.3 | 171.6 | -170.5 | 179.9 | -168.9 | -169.5 | 3.2 | 104.7 | L10 A14 | L10-R12 PolarHBondContact O-N 3.04Å; R12-A14 VanDerWaalsContact C-N 3.27Å; R12-A14 PolarHBondContact O-N 2.78Å | ||
| 13 | V | 67.5 | Low | 66.6 | Low | 127 Ų | 127 | 127.6 Ų | 127.6 | 77% | 0.77 | 71% | 0.712 | S | S | * | * | trans | -54.2 | 107.2 | 176.3 | 173 | 0 | 0 | 0 | 0 | 102.2 | P11 A15 | P11-V13 PolarHBondContact O-N 2.78Å; V13-A15 PolarHBondContact O-N 2.67Å | ||
| 14 | A | 70.7 | Confident | 67.6 | Low | 83 Ų | 83 | 126.1 Ų | 126.1 | 69% | 0.686 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 122.5 | -173.8 | 0 | 0 | 0 | 0 | 0 | 105.2 | R12 | R12-A14 VanDerWaalsContact C-N 3.27Å; R12-A14 PolarHBondContact O-N 2.78Å |
| 15 | A | 72 | Confident | 68.5 | Low | 83 Ų | 83 | 128.6 Ų | 128.6 | 69% | 0.686 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 138 | 177.2 | 0 | 0 | 0 | 0 | 0 | 107.1 | V13 | V13-A15 PolarHBondContact O-N 2.67Š|
| 16 | P | 71.2 | Confident | 69.5 | Low | 114 Ų | 114 | 127 Ų | 127 | 74% | 0.74 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 137.3 | 177.4 | 21.1 | -31.7 | 0 | 0 | 0 | 107.7 | A18 | P16-A18 PolarHBondContact O-N 2.85Š|
| 17 | P | 71 | Confident | 70.6 | Confident | 117 Ų | 117 | 125.5 Ų | 125.5 | 76% | 0.76 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 133.4 | 176.8 | 21 | -31.7 | 0 | 0 | 0 | 107.6 | ||
| 18 | A | 71.8 | Confident | 72 | Confident | 78 Ų | 78 | 118.8 Ų | 118.8 | 65% | 0.645 | 66% | 0.663 | S | S | * | * | trans | -45 | 141.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109 | P16 V20 | P16-A18 PolarHBondContact O-N 2.85Å; A18-V20 PolarHBondContact O-N 2.76Å | ||
| 19 | P | 68.4 | Low | 73.5 | Confident | 128 Ų | 128 | 118.8 Ų | 118.8 | 83% | 0.831 | 65% | 0.653 | S | S | * | * | trans | -53.6 | 105.6 | -178.5 | 22.2 | -32.4 | 0 | 0 | 0 | 107.7 | N21 | P19-N21 PolarHBondContact O-N 3.47Š| ||
| 20 | V | 67.2 | Low | 74.9 | Confident | 92 Ų | 92 | 121 Ų | 121 | 56% | 0.558 | 65% | 0.654 | S | S | * | * | trans | -58.3 | 120.8 | 175.7 | 179.8 | 0 | 0 | 0 | 0 | 104.2 | A18 L22 | A18-V20 PolarHBondContact O-N 2.76Å; V20-L22 PolarHBondContact O-N 2.64Å | ||
| 21 | N | 72.3 | Confident | 76.6 | Confident | 110 Ų | 110 | 122.4 Ų | 122.4 | 59% | 0.588 | 65% | 0.651 | S | S | * | * | trans | -56 | 105.7 | -169.5 | -150.8 | -27.4 | 0 | 0 | 0 | 108.1 | P19 Q23 Q24 R25 | P19-N21 PolarHBondContact O-N 3.47Å; N21-Q23 PolarHBondContact O-N 3.29Å; N21-Q23 VanDerWaalsContact O-N 3.08Å; N21-Q24 HydrophobicContact CB-CB 4.31Å; N21-Q24 WeakPolarHBondContact O-CB 3.24Å; N21-Q24 PolarHBondContact O-N 3.16Å; N21-R25 PolarHBondContact O-N 3.45Å | ||
| 22 | L | 75.9 | Confident | 78 | Confident | 133 Ų | 133 | 124.8 Ų | 124.8 | 70% | 0.696 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -57.6 | -31.1 | -170.5 | -73.4 | 169.8 | 0 | 0 | 0 | 110.9 | V20 R25 T26 | V20-L22 PolarHBondContact O-N 2.64Å; L22-R25 PolarHBondContact O-N 3.04Å; L22-T26 PolarHBondContact O-N 2.87Å; L22-T26 PolarHBondContact O-OG1 3.32Å |
| 23 | Q | 77.4 | Confident | 79.5 | Confident | 140 Ų | 140 | 119.9 Ų | 119.9 | 65% | 0.654 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -59.7 | -43.6 | 173 | -69.9 | -168 | -18.9 | 0 | 0 | 112.8 | N21 R25 T26 I27 | N21-Q23 PolarHBondContact O-N 3.29Å; N21-Q23 VanDerWaalsContact O-N 3.08Å; Q23-R25 VanDerWaalsContact C-N 3.34Å; Q23-R25 PolarHBondContact O-N 3.34Å; Q23-T26 WeakPolarHBondContact CA-OG1 3.33Å; Q23-T26 PolarHBondContact O-N 3.47Å; Q23-T26 PolarHBondContact O-OG1 3.25Å; Q23-I27 WeakPolarHBondContact O-CD1 3.35Å; Q23-I27 VanDerWaalsContact O-CG1 3.23Å; Q23-I27 WeakPolarHBondContact O-CG1 3Å; Q23-I27 PolarHBondContact O-N 3.17Å |
| 24 | Q | 80 | Confident | 80.9 | Confident | 98 Ų | 98 | 121.4 Ų | 121.4 | 46% | 0.458 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -62.7 | -44.5 | 177.6 | -171.7 | 62.4 | 36.4 | 0 | 0 | 110.5 | N21 T26 I27 D28 | N21-Q24 HydrophobicContact CB-CB 4.31Å; N21-Q24 WeakPolarHBondContact O-CB 3.24Å; N21-Q24 PolarHBondContact O-N 3.16Å; Q24-T26 VanDerWaalsContact C-N 3.3Å; Q24-T26 PolarHBondContact O-N 3.44Å; Q24-I27 PolarHBondContact O-N 3.27Å; Q24-I27 VanDerWaalsContact O-N 3.14Å; Q24-D28 PolarHBondContact NE2-OD1 2.9Å; Q24-D28 PolarHBondContact O-N 3.44Å |
| 25 | R | 80.3 | Confident | 82 | Confident | 163 Ų | 163 | 124 Ų | 124 | 62% | 0.615 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -61.3 | -39.4 | 177.4 | -171.1 | -175.6 | -74.2 | -162.4 | -2.2 | 111.9 | N21 L22 Q23 Y29 | N21-R25 PolarHBondContact O-N 3.45Å; L22-R25 PolarHBondContact O-N 3.04Å; Q23-R25 VanDerWaalsContact C-N 3.34Å; Q23-R25 PolarHBondContact O-N 3.34Å; R25-Y29 WeakPolarHBondContact O-CB 3.37Å; R25-Y29 PolarHBondContact O-N 3.21Å |
| 26 | T | 84.9 | Confident | 83.1 | Confident | 82 Ų | 82 | 126.9 Ų | 126.9 | 50% | 0.503 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -66.8 | -37.7 | 176.1 | 49.7 | 0 | 0 | 0 | 0 | 112.6 | L22 Q23 Q24 Y30 | L22-T26 PolarHBondContact O-N 2.87Å; L22-T26 PolarHBondContact O-OG1 3.32Å; Q23-T26 WeakPolarHBondContact CA-OG1 3.33Å; Q23-T26 PolarHBondContact O-N 3.47Å; Q23-T26 PolarHBondContact O-OG1 3.25Å; Q24-T26 VanDerWaalsContact C-N 3.3Å; Q24-T26 PolarHBondContact O-N 3.44Å; T26-Y30 WeakPolarHBondContact O-CB 3.27Å; T26-Y30 PolarHBondContact O-N 3.35Å |
| 27 | I | 84.8 | Confident | 84.3 | Confident | 96 Ų | 96 | 127.5 Ų | 127.5 | 49% | 0.492 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -66.5 | -47.7 | 177 | -66.3 | 161.8 | 0 | 0 | 0 | 110 | Q23 Q24 Y29 Y30 Y31 | Q23-I27 WeakPolarHBondContact O-CD1 3.35Å; Q23-I27 VanDerWaalsContact O-CG1 3.23Å; Q23-I27 WeakPolarHBondContact O-CG1 3Å; Q23-I27 PolarHBondContact O-N 3.17Å; Q24-I27 PolarHBondContact O-N 3.27Å; Q24-I27 VanDerWaalsContact O-N 3.14Å; I27-Y29 VanDerWaalsContact C-N 3.3Å; I27-Y29 PolarHBondContact O-N 2.9Å; I27-Y30 PolarHBondContact O-N 3.06Å; I27-Y31 WeakPolarHBondContact O-CB 3.32Å; I27-Y31 PolarHBondContact O-N 3.12Å |
| 28 | D | 88 | Confident | 85.5 | Confident | 88 Ų | 88 | 128.7 Ų | 128.7 | 47% | 0.471 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -60.7 | -40.9 | 179.4 | -63.4 | -21.1 | 0 | 0 | 0 | 111.2 | Q24 Y31 Y32 | Q24-D28 PolarHBondContact NE2-OD1 2.9Å; Q24-D28 PolarHBondContact O-N 3.44Å; D28-Y31 PolarHBondContact O-N 3.45Å; D28-Y32 WeakPolarHBondContact O-CB 3.1Å; D28-Y32 PolarHBondContact O-N 3Å |
| 29 | Y | 91.4 | Very high | 86.7 | Confident | 155 Ų | 155 | 131.3 Ų | 131.3 | 61% | 0.608 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.4 | -45.3 | 176.2 | -177.3 | -95.6 | 0 | 0 | 0 | 112.3 | R25 I27 Y31 Y32 Y33 | R25-Y29 WeakPolarHBondContact O-CB 3.37Å; R25-Y29 PolarHBondContact O-N 3.21Å; I27-Y29 VanDerWaalsContact C-N 3.3Å; I27-Y29 PolarHBondContact O-N 2.9Å; Y29-Y31 VanDerWaalsContact C-N 3.34Å; Y29-Y31 PolarHBondContact O-N 3.46Å; Y29-Y32 PolarHBondContact O-N 3.33Å; Y29-Y33 WeakPolarHBondContact O-CB 3.44Å; Y29-Y33 PolarHBondContact O-N 3.33Å |
| 30 | Y | 93.5 | Very high | 88 | Confident | 180 Ų | 180 | 131.7 Ų | 131.7 | 71% | 0.706 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.1 | -41.8 | 177.2 | -110.1 | -84.3 | 0 | 0 | 0 | 111.9 | T26 I27 Y33 Y34 | T26-Y30 WeakPolarHBondContact O-CB 3.27Å; T26-Y30 PolarHBondContact O-N 3.35Å; I27-Y30 PolarHBondContact O-N 3.06Å; Y30-Y33 PolarHBondContact O-N 3.21Å; Y30-Y34 WeakPolarHBondContact O-CB 3.39Å; Y30-Y34 PolarHBondContact O-N 3.26Å |
| 31 | Y | 94.1 | Very high | 89.3 | Confident | 163 Ų | 163 | 133.9 Ų | 133.9 | 64% | 0.639 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64.9 | -44.6 | 178.3 | -169.3 | -94.6 | 0 | 0 | 0 | 111.5 | I27 D28 Y29 Y33 Y34 Y35 | I27-Y31 WeakPolarHBondContact O-CB 3.32Å; I27-Y31 PolarHBondContact O-N 3.12Å; D28-Y31 PolarHBondContact O-N 3.45Å; Y29-Y31 VanDerWaalsContact C-N 3.34Å; Y29-Y31 PolarHBondContact O-N 3.46Å; Y31-Y33 PolarHBondContact O-N 3.27Å; Y31-Y34 PolarHBondContact O-N 3.5Å; Y31-Y35 WeakPolarHBondContact O-CB 3.41Å; Y31-Y35 PolarHBondContact O-N 2.91Å |
| 32 | Y | 93.2 | Very high | 90.4 | Very high | 154 Ų | 154 | 135.3 Ų | 135.3 | 60% | 0.604 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -60 | -46.1 | 174.6 | 178.5 | -97.1 | 0 | 0 | 0 | 111.9 | D28 Y29 Y34 Y35 Y36 | D28-Y32 WeakPolarHBondContact O-CB 3.1Å; D28-Y32 PolarHBondContact O-N 3Å; Y29-Y32 PolarHBondContact O-N 3.33Å; Y32-Y34 PolarHBondContact O-N 3.48Å; Y32-Y35 PolarHBondContact O-N 2.85Å; Y32-Y36 WeakPolarHBondContact O-CB 3.29Å; Y32-Y36 PolarHBondContact O-N 3.32Å |
| 33 | Y | 94.9 | Very high | 91.4 | Very high | 134 Ų | 134 | 136 Ų | 136 | 53% | 0.525 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.9 | -43.6 | 178.5 | -173.9 | -94.5 | 0 | 0 | 0 | 112.1 | Y29 Y30 Y31 Y36 Y37 | Y29-Y33 WeakPolarHBondContact O-CB 3.44Å; Y29-Y33 PolarHBondContact O-N 3.33Å; Y30-Y33 PolarHBondContact O-N 3.21Å; Y31-Y33 PolarHBondContact O-N 3.27Å; Y33-Y36 PolarHBondContact O-N 2.84Å; Y33-Y37 WeakPolarHBondContact O-CB 3.33Å; Y33-Y37 PolarHBondContact O-N 3.42Å |
| 34 | Y | 95.4 | Very high | 92.2 | Very high | 159 Ų | 159 | 134.4 Ų | 134.4 | 62% | 0.624 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -62.4 | -45.9 | 177 | -178 | -95.8 | 0 | 0 | 0 | 111.9 | Y30 Y31 Y32 Y36 Y37 Y38 | Y30-Y34 WeakPolarHBondContact O-CB 3.39Å; Y30-Y34 PolarHBondContact O-N 3.26Å; Y31-Y34 PolarHBondContact O-N 3.5Å; Y32-Y34 PolarHBondContact O-N 3.48Å; Y34-Y36 PolarHBondContact O-N 3.44Å; Y34-Y37 PolarHBondContact O-N 2.89Å; Y34-Y38 WeakPolarHBondContact O-CB 3.12Å; Y34-Y38 PolarHBondContact O-N 2.84Å |
| 35 | Y | 95.1 | Very high | 92.9 | Very high | 138 Ų | 138 | 137.5 Ų | 137.5 | 54% | 0.541 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.6 | -44.1 | 177.8 | -173.3 | -94.9 | 0 | 0 | 0 | 111.8 | Y31 Y32 Y37 Y38 Y39 | Y31-Y35 WeakPolarHBondContact O-CB 3.41Å; Y31-Y35 PolarHBondContact O-N 2.91Å; Y32-Y35 PolarHBondContact O-N 2.85Å; Y35-Y37 PolarHBondContact O-N 3.48Å; Y35-Y38 PolarHBondContact O-N 2.9Å; Y35-Y39 WeakPolarHBondContact O-CB 3.29Å; Y35-Y39 PolarHBondContact O-N 2.94Å |
| 36 | Y | 95.3 | Very high | 93.5 | Very high | 143 Ų | 143 | 134.9 Ų | 134.9 | 56% | 0.561 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61 | -45.4 | 176.5 | -176.5 | -93.8 | 0 | 0 | 0 | 112 | Y32 Y33 Y34 Y38 Y39 Y40 | Y32-Y36 WeakPolarHBondContact O-CB 3.29Å; Y32-Y36 PolarHBondContact O-N 3.32Å; Y33-Y36 PolarHBondContact O-N 2.84Å; Y34-Y36 PolarHBondContact O-N 3.44Å; Y36-Y38 PolarHBondContact O-N 3.1Å; Y36-Y39 PolarHBondContact O-N 3.49Å; Y36-Y40 WeakPolarHBondContact O-CB 3.28Å; Y36-Y40 PolarHBondContact O-N 3.34Å |
| 37 | Y | 95.7 | Very high | 93.9 | Very high | 127 Ų | 127 | 137.5 Ų | 137.5 | 50% | 0.498 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.1 | -43.1 | 178.7 | -169.3 | -93.1 | 0 | 0 | 0 | 112 | Y33 Y34 Y35 Y39 Y40 Y41 | Y33-Y37 WeakPolarHBondContact O-CB 3.33Å; Y33-Y37 PolarHBondContact O-N 3.42Å; Y34-Y37 PolarHBondContact O-N 2.89Å; Y35-Y37 PolarHBondContact O-N 3.48Å; Y37-Y39 PolarHBondContact O-N 3.17Å; Y37-Y40 PolarHBondContact O-N 3.5Å; Y37-Y41 HydrophobicContact CE1-CD2 4.04Å; Y37-Y41 PolarHBondContact O-N 3.48Å |
| 38 | Y | 96.2 | Very high | 94.2 | Very high | 142 Ų | 142 | 137.8 Ų | 137.8 | 56% | 0.557 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -60.9 | -45.5 | 176.5 | -175.5 | -94.6 | 0 | 0 | 0 | 111.8 | Y34 Y35 Y36 Y40 Y41 Y42 | Y34-Y38 WeakPolarHBondContact O-CB 3.12Å; Y34-Y38 PolarHBondContact O-N 2.84Å; Y35-Y38 PolarHBondContact O-N 2.9Å; Y36-Y38 PolarHBondContact O-N 3.1Å; Y38-Y40 PolarHBondContact O-N 3.38Å; Y38-Y41 PolarHBondContact O-N 2.97Å; Y38-Y42 WeakPolarHBondContact O-CB 3.38Å; Y38-Y42 PolarHBondContact O-N 3.33Å |
| 39 | Y | 96.1 | Very high | 94.2 | Very high | 133 Ų | 133 | 140.1 Ų | 140.1 | 52% | 0.522 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -63.9 | -41.8 | 179.3 | -159.6 | -90.4 | 0 | 0 | 0 | 112 | Y35 Y36 Y37 Y41 Y42 Y43 | Y35-Y39 WeakPolarHBondContact O-CB 3.29Å; Y35-Y39 PolarHBondContact O-N 2.94Å; Y36-Y39 PolarHBondContact O-N 3.49Å; Y37-Y39 PolarHBondContact O-N 3.17Å; Y39-Y41 PolarHBondContact O-N 3.47Å; Y39-Y42 PolarHBondContact O-N 2.92Å; Y39-Y43 WeakPolarHBondContact O-CB 3.18Å; Y39-Y43 PolarHBondContact O-N 2.86Å |
| 40 | Y | 96 | Very high | 94 | Very high | 136 Ų | 136 | 137.6 Ų | 137.6 | 53% | 0.533 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -60.3 | -45.6 | 175.4 | -178.1 | -94.8 | 0 | 0 | 0 | 111.9 | Y36 Y37 Y38 Y42 Y43 Y44 | Y36-Y40 WeakPolarHBondContact O-CB 3.28Å; Y36-Y40 PolarHBondContact O-N 3.34Å; Y37-Y40 PolarHBondContact O-N 3.5Å; Y38-Y40 PolarHBondContact O-N 3.38Å; Y40-Y42 PolarHBondContact O-N 2.97Å; Y40-Y43 PolarHBondContact O-N 3.5Å; Y40-Y44 WeakPolarHBondContact O-CB 3.38Å; Y40-Y44 PolarHBondContact O-N 3.41Å |
| 41 | Y | 95.1 | Very high | 93.7 | Very high | 137 Ų | 137 | 134.3 Ų | 134.3 | 54% | 0.537 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.9 | -41.6 | -179.8 | -140.9 | -87.7 | 0 | 0 | 0 | 112 | Y37 Y38 Y39 Y44 Y45 | Y37-Y41 HydrophobicContact CE1-CD2 4.04Å; Y37-Y41 PolarHBondContact O-N 3.48Å; Y38-Y41 PolarHBondContact O-N 2.97Å; Y39-Y41 PolarHBondContact O-N 3.47Å; Y41-Y44 PolarHBondContact O-N 3.37Å; Y41-Y45 WeakPolarHBondContact O-CB 3.42Å; Y41-Y45 PolarHBondContact O-N 2.88Å |
| 42 | Y | 95.5 | Very high | 93.2 | Very high | 140 Ų | 140 | 133.5 Ų | 133.5 | 55% | 0.549 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.3 | -46.1 | 175.4 | -176 | -96.1 | 0 | 0 | 0 | 111.5 | Y38 Y39 Y40 Y44 Y45 Y46 | Y38-Y42 WeakPolarHBondContact O-CB 3.38Å; Y38-Y42 PolarHBondContact O-N 3.33Å; Y39-Y42 PolarHBondContact O-N 2.92Å; Y40-Y42 PolarHBondContact O-N 2.97Å; Y42-Y44 PolarHBondContact O-N 3.41Å; Y42-Y45 PolarHBondContact O-N 2.88Å; Y42-Y46 WeakPolarHBondContact O-CB 3.33Å; Y42-Y46 PolarHBondContact O-N 2.92Å |
| 43 | Y | 95.6 | Very high | 92.7 | Very high | 147 Ų | 147 | 131.1 Ų | 131.1 | 58% | 0.576 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.7 | -41.3 | 179 | -159.4 | -90.5 | 0 | 0 | 0 | 112 | Y39 Y40 Y46 Y47 | Y39-Y43 WeakPolarHBondContact O-CB 3.18Å; Y39-Y43 PolarHBondContact O-N 2.86Å; Y40-Y43 PolarHBondContact O-N 3.5Å; Y43-Y46 PolarHBondContact O-N 2.89Å; Y43-Y47 WeakPolarHBondContact O-CB 3.35Å; Y43-Y47 PolarHBondContact O-N 2.83Å |
| 44 | Y | 94.9 | Very high | 92 | Very high | 108 Ų | 108 | 131 Ų | 131 | 42% | 0.424 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.4 | -46 | 176 | -175.7 | -94.7 | 0 | 0 | 0 | 111.8 | Y40 Y41 Y42 Y47 Y48 | Y40-Y44 WeakPolarHBondContact O-CB 3.38Å; Y40-Y44 PolarHBondContact O-N 3.41Å; Y41-Y44 PolarHBondContact O-N 3.37Å; Y42-Y44 PolarHBondContact O-N 3.41Å; Y44-Y47 PolarHBondContact O-N 3.49Å; Y44-Y48 HydrophobicContact CD1-CD2 4.3Å; Y44-Y48 AromaticContact CE1-CD2 3.73Å; Y44-Y48 HydrophobicContact CE1-CD2 3.73Å; Y44-Y48 AromaticContact CE1-CE2 3.92Å; Y44-Y48 HydrophobicContact CE1-CE2 3.92Å; Y44-Y48 HydrophobicContact CE2-CD2 4.05Å; Y44-Y48 AromaticContact CE2-CE2 3.89Å; Y44-Y48 HydrophobicContact CE2-CE2 3.89Å; Y44-Y48 AromaticContact CZ-CD2 3.6Å; Y44-Y48 AromaticContact CZ-CE2 3.37Å; Y44-Y48 WeakPolarHBondContact O-CB 3.49Å; Y44-Y48 PolarHBondContact O-N 3.42Å; Y44-Y48 WeakPolarHBondContact OH-CE2 3.44Å |
| 45 | Y | 94.4 | Very high | 91.1 | Very high | 163 Ų | 163 | 127.2 Ų | 127.2 | 64% | 0.639 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.9 | -44.4 | 177.9 | -168.2 | -91.2 | 0 | 0 | 0 | 111.7 | Y41 Y42 Y47 Y48 Y49 | Y41-Y45 WeakPolarHBondContact O-CB 3.42Å; Y41-Y45 PolarHBondContact O-N 2.88Å; Y42-Y45 PolarHBondContact O-N 2.88Å; Y45-Y47 PolarHBondContact O-N 2.96Å; Y45-Y48 PolarHBondContact O-N 2.9Å; Y45-Y49 WeakPolarHBondContact O-CB 3.44Å; Y45-Y49 PolarHBondContact O-N 3.33Å |
| 46 | Y | 93.5 | Very high | 90 | Very high | 108 Ų | 108 | 126.7 Ų | 126.7 | 42% | 0.424 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.4 | -44.9 | 177 | -171 | -91.9 | 0 | 0 | 0 | 111.8 | Y42 Y43 Y49 Y50 | Y42-Y46 WeakPolarHBondContact O-CB 3.33Å; Y42-Y46 PolarHBondContact O-N 2.92Å; Y43-Y46 PolarHBondContact O-N 2.89Å; Y46-Y49 PolarHBondContact O-N 2.89Å; Y46-Y50 AromaticContact CD1-CD2 3.83Å; Y46-Y50 HydrophobicContact CD1-CD2 3.83Å; Y46-Y50 HydrophobicContact CD1-CE2 4.13Å; Y46-Y50 HydrophobicContact CD2-CD2 4.32Å; Y46-Y50 HydrophobicContact CD2-CE2 4.14Å; Y46-Y50 AromaticContact CE1-CD2 3.5Å; Y46-Y50 HydrophobicContact CE1-CD2 3.5Å; Y46-Y50 VanDerWaalsContact CE1-CD2 3.5Å; Y46-Y50 AromaticContact CE1-CE2 3.42Å; Y46-Y50 HydrophobicContact CE1-CE2 3.42Å; Y46-Y50 VanDerWaalsContact CE1-CE2 3.42Å; Y46-Y50 HydrophobicContact CE1-CG 4.27Å; Y46-Y50 HydrophobicContact CE2-CD2 4.05Å; Y46-Y50 AromaticContact CE2-CE2 3.45Å; Y46-Y50 HydrophobicContact CE2-CE2 3.45Å; Y46-Y50 VanDerWaalsContact CE2-CE2 3.45Å; Y46-Y50 HydrophobicContact CG-CD2 4.24Å; Y46-Y50 HydrophobicContact CG-CE2 4.45Å; Y46-Y50 AromaticContact CZ-CD2 3.65Å; Y46-Y50 AromaticContact CZ-CE2 3.05Å; Y46-Y50 AromaticContact CZ-CZ 3.68Å; Y46-Y50 WeakPolarHBondContact O-CD2 3.49Å; Y46-Y50 PolarHBondContact O-N 3.36Å; Y46-Y50 WeakPolarHBondContact OH-CE2 3.1Å; Y46-Y50 VanDerWaalsContact OH-CZ 3.28Å; Y46-Y50 PolarHBondContact OH-OH 3.48Å; Y46-Y50 VanDerWaalsContact OH-OH 3.1Å |
| 47 | Y | 92.9 | Very high | 89 | Confident | 136 Ų | 136 | 126.7 Ų | 126.7 | 53% | 0.533 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.5 | -46.6 | 176.1 | -179 | -94 | 0 | 0 | 0 | 111.8 | Y43 Y44 Y45 Y49 Y50 Y51 | Y43-Y47 WeakPolarHBondContact O-CB 3.35Å; Y43-Y47 PolarHBondContact O-N 2.83Å; Y44-Y47 PolarHBondContact O-N 3.49Å; Y45-Y47 PolarHBondContact O-N 2.96Å; Y47-Y49 PolarHBondContact O-N 3.41Å; Y47-Y50 PolarHBondContact O-N 3.5Å; Y47-Y51 VanDerWaalsContact O-CB 3.29Å; Y47-Y51 WeakPolarHBondContact O-CB 3.49Å; Y47-Y51 PolarHBondContact O-N 3.39Å |
| 48 | Y | 91.3 | Very high | 87.9 | Confident | 102 Ų | 102 | 128.9 Ų | 128.9 | 40% | 0.4 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.9 | -44.8 | 177.6 | -112.3 | -96.7 | 0 | 0 | 0 | 112 | Y44 Y45 Y50 Y51 Y52 | Y44-Y48 HydrophobicContact CD1-CD2 4.3Å; Y44-Y48 AromaticContact CE1-CD2 3.73Å; Y44-Y48 HydrophobicContact CE1-CD2 3.73Å; Y44-Y48 AromaticContact CE1-CE2 3.92Å; Y44-Y48 HydrophobicContact CE1-CE2 3.92Å; Y44-Y48 HydrophobicContact CE2-CD2 4.05Å; Y44-Y48 AromaticContact CE2-CE2 3.89Å; Y44-Y48 HydrophobicContact CE2-CE2 3.89Å; Y44-Y48 AromaticContact CZ-CD2 3.6Å; Y44-Y48 AromaticContact CZ-CE2 3.37Å; Y44-Y48 WeakPolarHBondContact O-CB 3.49Å; Y44-Y48 PolarHBondContact O-N 3.42Å; Y44-Y48 WeakPolarHBondContact OH-CE2 3.44Å; Y45-Y48 PolarHBondContact O-N 2.9Å; Y48-Y50 PolarHBondContact O-N 3.49Å; Y48-Y51 PolarHBondContact O-N 3.35Å; Y48-Y52 AromaticContact CD1-CD2 3.83Å; Y48-Y52 HydrophobicContact CD1-CD2 3.83Å; Y48-Y52 AromaticContact CD1-CE2 3.54Å; Y48-Y52 HydrophobicContact CD1-CE2 3.54Å; Y48-Y52 HydrophobicContact CE1-CD2 4.4Å; Y48-Y52 AromaticContact CE1-CE2 3.69Å; Y48-Y52 HydrophobicContact CE1-CE2 3.69Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.39Å; Y48-Y52 PolarHBondContact O-N 3.49Å |
| 49 | Y | 89 | Confident | 86.5 | Confident | 138 Ų | 138 | 128.1 Ų | 128.1 | 54% | 0.541 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.1 | -47.7 | 177.4 | -178.2 | -93.6 | 0 | 0 | 0 | 111.6 | Y45 Y46 Y47 Y52 Y53 | Y45-Y49 WeakPolarHBondContact O-CB 3.44Å; Y45-Y49 PolarHBondContact O-N 3.33Å; Y46-Y49 PolarHBondContact O-N 2.89Å; Y47-Y49 PolarHBondContact O-N 3.41Å; Y49-Y52 PolarHBondContact O-N 3.5Å; Y49-Y53 VanDerWaalsContact O-CB 3.28Å; Y49-Y53 WeakPolarHBondContact O-CB 3.47Å; Y49-Y53 PolarHBondContact O-N 3.38Å |
| 50 | Y | 87.3 | Confident | 84.9 | Confident | 101 Ų | 101 | 127.9 Ų | 127.9 | 40% | 0.396 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.1 | -44.3 | 177.2 | -95 | -99.2 | 0 | 0 | 0 | 112.4 | Y46 Y47 Y48 Y52 Y53 F54 | Y46-Y50 AromaticContact CD1-CD2 3.83Å; Y46-Y50 HydrophobicContact CD1-CD2 3.83Å; Y46-Y50 HydrophobicContact CD1-CE2 4.13Å; Y46-Y50 HydrophobicContact CD2-CD2 4.32Å; Y46-Y50 HydrophobicContact CD2-CE2 4.14Å; Y46-Y50 AromaticContact CE1-CD2 3.5Å; Y46-Y50 HydrophobicContact CE1-CD2 3.5Å; Y46-Y50 VanDerWaalsContact CE1-CD2 3.5Å; Y46-Y50 AromaticContact CE1-CE2 3.42Å; Y46-Y50 HydrophobicContact CE1-CE2 3.42Å; Y46-Y50 VanDerWaalsContact CE1-CE2 3.42Å; Y46-Y50 HydrophobicContact CE1-CG 4.27Å; Y46-Y50 HydrophobicContact CE2-CD2 4.05Å; Y46-Y50 AromaticContact CE2-CE2 3.45Å; Y46-Y50 HydrophobicContact CE2-CE2 3.45Å; Y46-Y50 VanDerWaalsContact CE2-CE2 3.45Å; Y46-Y50 HydrophobicContact CG-CD2 4.24Å; Y46-Y50 HydrophobicContact CG-CE2 4.45Å; Y46-Y50 AromaticContact CZ-CD2 3.65Å; Y46-Y50 AromaticContact CZ-CE2 3.05Å; Y46-Y50 AromaticContact CZ-CZ 3.68Å; Y46-Y50 WeakPolarHBondContact O-CD2 3.49Å; Y46-Y50 PolarHBondContact O-N 3.36Å; Y46-Y50 WeakPolarHBondContact OH-CE2 3.1Å; Y46-Y50 VanDerWaalsContact OH-CZ 3.28Å; Y46-Y50 PolarHBondContact OH-OH 3.48Å; Y46-Y50 VanDerWaalsContact OH-OH 3.1Å; Y47-Y50 PolarHBondContact O-N 3.5Å; Y48-Y50 PolarHBondContact O-N 3.49Å; Y50-Y52 PolarHBondContact O-N 2.98Å; Y50-Y53 PolarHBondContact O-N 2.97Å; Y50-F54 AromaticContact CD1-CD2 3.98Å; Y50-F54 HydrophobicContact CD1-CD2 3.98Å; Y50-F54 AromaticContact CD1-CE2 3.66Å; Y50-F54 HydrophobicContact CD1-CE2 3.66Å; Y50-F54 HydrophobicContact CE1-CE2 4.02Å; Y50-F54 WeakPolarHBondContact O-CB 3.39Å; Y50-F54 WeakPolarHBondContact O-CD2 3.38Å; Y50-F54 PolarHBondContact O-N 2.98Å |
| 51 | Y | 85.3 | Confident | 83 | Confident | 112 Ų | 112 | 127.4 Ų | 127.4 | 44% | 0.439 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -57.9 | -50.2 | 177.5 | -177.7 | -91.6 | 0 | 0 | 0 | 110.9 | Y47 Y48 F54 H55 | Y47-Y51 VanDerWaalsContact O-CB 3.29Å; Y47-Y51 WeakPolarHBondContact O-CB 3.49Å; Y47-Y51 PolarHBondContact O-N 3.39Å; Y48-Y51 PolarHBondContact O-N 3.35Å; Y51-F54 PolarHBondContact O-N 2.99Å; Y51-H55 AromaticContact CD1-CD2 3.98Å; Y51-H55 AromaticContact CD2-CD2 3.55Å; Y51-H55 AromaticContact CD2-NE2 3.71Å; Y51-H55 AromaticContact CE1-CD2 3.77Å; Y51-H55 AromaticContact CE2-CD2 3.33Å; Y51-H55 WeakPolarHBondContact CE2-CD2 3.35Å; Y51-H55 AromaticContact CE2-NE2 3.1Å; Y51-H55 WeakPolarHBondContact CE2-NE2 3.34Å; Y51-H55 AromaticContact CG-CD2 3.88Å; Y51-H55 AromaticContact CZ-CD2 3.43Å; Y51-H55 VanDerWaalsContact CZ-CD2 3.43Å; Y51-H55 AromaticContact CZ-CE1 3.92Å; Y51-H55 AromaticContact CZ-NE2 3.39Å; Y51-H55 VanDerWaalsContact O-CB 3.29Å; Y51-H55 WeakPolarHBondContact O-CB 3.49Å; Y51-H55 PolarHBondContact O-CD2 2.96Å; Y51-H55 VanDerWaalsContact O-CD2 3.26Å; Y51-H55 PolarHBondContact O-N 3.5Å |
| 52 | Y | 83.6 | Confident | 81.1 | Confident | 146 Ų | 146 | 125.4 Ų | 125.4 | 57% | 0.573 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62 | -46.8 | 176.8 | -91.7 | -79.2 | 0 | 0 | 0 | 112.1 | Y48 Y49 Y50 F54 H55 F56 | Y48-Y52 AromaticContact CD1-CD2 3.83Å; Y48-Y52 HydrophobicContact CD1-CD2 3.83Å; Y48-Y52 AromaticContact CD1-CE2 3.54Å; Y48-Y52 HydrophobicContact CD1-CE2 3.54Å; Y48-Y52 HydrophobicContact CE1-CD2 4.4Å; Y48-Y52 AromaticContact CE1-CE2 3.69Å; Y48-Y52 HydrophobicContact CE1-CE2 3.69Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.39Å; Y48-Y52 PolarHBondContact O-N 3.49Å; Y49-Y52 PolarHBondContact O-N 3.5Å; Y50-Y52 PolarHBondContact O-N 2.98Å; Y52-F54 PolarHBondContact O-N 3.02Å; Y52-H55 PolarHBondContact O-N 2.95Å; Y52-F56 WeakPolarHBondContact O-CB 3.39Å; Y52-F56 PolarHBondContact O-N 3.32Å |
| 53 | Y | 83.5 | Confident | 79.1 | Confident | 103 Ų | 103 | 123 Ų | 123 | 40% | 0.404 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.6 | -46.2 | -179.3 | -173.6 | -95.2 | 0 | 0 | 0 | 112.1 | Y49 Y50 R57 | Y49-Y53 VanDerWaalsContact O-CB 3.28Å; Y49-Y53 WeakPolarHBondContact O-CB 3.47Å; Y49-Y53 PolarHBondContact O-N 3.38Å; Y50-Y53 PolarHBondContact O-N 2.97Å; Y53-R57 HydrophobicContact CE1-CG 4.46Å; Y53-R57 WeakPolarHBondContact O-CB 3.36Å; Y53-R57 PolarHBondContact O-N 2.94Å; Y53-R57 PolarHBondContact OH-NE 3.5Å; Y53-R57 VanDerWaalsContact OH-NE 3.12Å; Y53-R57 PolarHBondContact OH-NH2 3.39Å |
| 54 | F | 80.2 | Confident | 77.2 | Confident | 132 Ų | 132 | 120.9 Ų | 120.9 | 58% | 0.579 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -70.3 | -43.9 | 179.3 | -90.2 | -83.3 | 0 | 0 | 0 | 112.6 | Y50 Y51 Y52 R58 | Y50-F54 AromaticContact CD1-CD2 3.98Å; Y50-F54 HydrophobicContact CD1-CD2 3.98Å; Y50-F54 AromaticContact CD1-CE2 3.66Å; Y50-F54 HydrophobicContact CD1-CE2 3.66Å; Y50-F54 HydrophobicContact CE1-CE2 4.02Å; Y50-F54 WeakPolarHBondContact O-CB 3.39Å; Y50-F54 WeakPolarHBondContact O-CD2 3.38Å; Y50-F54 PolarHBondContact O-N 2.98Å; Y51-F54 PolarHBondContact O-N 2.99Å; Y52-F54 PolarHBondContact O-N 3.02Å; F54-R58 VanDerWaalsContact O-CB 3.27Å; F54-R58 WeakPolarHBondContact O-CB 3.44Å; F54-R58 PolarHBondContact O-N 3.3Å |
| 55 | H | 76.3 | Confident | 75.3 | Confident | 79 Ų | 79 | 121.7 Ų | 121.7 | 37% | 0.366 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.1 | -42.1 | 179.5 | -86.9 | -88.7 | 0 | 0 | 0 | 112 | Y51 Y52 R58 L59 | Y51-H55 AromaticContact CD1-CD2 3.98Å; Y51-H55 AromaticContact CD2-CD2 3.55Å; Y51-H55 AromaticContact CD2-NE2 3.71Å; Y51-H55 AromaticContact CE1-CD2 3.77Å; Y51-H55 AromaticContact CE2-CD2 3.33Å; Y51-H55 WeakPolarHBondContact CE2-CD2 3.35Å; Y51-H55 AromaticContact CE2-NE2 3.1Å; Y51-H55 WeakPolarHBondContact CE2-NE2 3.34Å; Y51-H55 AromaticContact CG-CD2 3.88Å; Y51-H55 AromaticContact CZ-CD2 3.43Å; Y51-H55 VanDerWaalsContact CZ-CD2 3.43Å; Y51-H55 AromaticContact CZ-CE1 3.92Å; Y51-H55 AromaticContact CZ-NE2 3.39Å; Y51-H55 VanDerWaalsContact O-CB 3.29Å; Y51-H55 WeakPolarHBondContact O-CB 3.49Å; Y51-H55 PolarHBondContact O-CD2 2.96Å; Y51-H55 VanDerWaalsContact O-CD2 3.26Å; Y51-H55 PolarHBondContact O-N 3.5Å; Y52-H55 PolarHBondContact O-N 2.95Å; H55-R58 PolarHBondContact O-N 2.93Å; H55-L59 WeakPolarHBondContact O-CB 3.49Å; H55-L59 WeakPolarHBondContact O-CG 3.4Å; H55-L59 PolarHBondContact O-N 2.93Å |
| 56 | F | 72.9 | Confident | 73.1 | Confident | 128 Ų | 128 | 120.7 Ų | 120.7 | 56% | 0.561 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.5 | -46.4 | 178.1 | -154.1 | -98 | 0 | 0 | 0 | 110.5 | Y52 R58 L59 F60 | Y52-F56 WeakPolarHBondContact O-CB 3.39Å; Y52-F56 PolarHBondContact O-N 3.32Å; F56-R58 VanDerWaalsContact C-N 3.3Å; F56-R58 PolarHBondContact O-N 3.42Å; F56-L59 PolarHBondContact O-N 2.9Å; F56-F60 AromaticContact CD1-CD2 3.7Å; F56-F60 HydrophobicContact CD1-CD2 3.7Å; F56-F60 AromaticContact CD1-CE2 3.63Å; F56-F60 HydrophobicContact CD1-CE2 3.63Å; F56-F60 HydrophobicContact CD2-CE2 4.34Å; F56-F60 AromaticContact CE1-CD2 3.64Å; F56-F60 HydrophobicContact CE1-CD2 3.64Å; F56-F60 AromaticContact CE1-CE2 3.1Å; F56-F60 HydrophobicContact CE1-CE2 3.1Å; F56-F60 AromaticContact CE1-CZ 3.82Å; F56-F60 HydrophobicContact CE1-CZ 3.82Å; F56-F60 AromaticContact CE2-CE2 3.9Å; F56-F60 HydrophobicContact CE2-CE2 3.9Å; F56-F60 HydrophobicContact CG-CD2 4.3Å; F56-F60 HydrophobicContact CG-CE2 4.24Å; F56-F60 HydrophobicContact CZ-CD2 4.19Å; F56-F60 AromaticContact CZ-CE2 3.27Å; F56-F60 HydrophobicContact CZ-CE2 3.27Å; F56-F60 AromaticContact CZ-CZ 3.88Å; F56-F60 HydrophobicContact CZ-CZ 3.88Å; F56-F60 WeakPolarHBondContact O-CD2 3.42Å; F56-F60 PolarHBondContact O-N 3.41Å |
| 57 | R | 74.1 | Confident | 70.9 | Confident | 142 Ų | 142 | 123.1 Ų | 123.1 | 54% | 0.536 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -58.4 | -42 | 173.4 | -91.2 | -165.4 | 164.8 | -142.9 | -1.6 | 112.7 | Y53 F60 L61 | Y53-R57 HydrophobicContact CE1-CG 4.46Å; Y53-R57 WeakPolarHBondContact O-CB 3.36Å; Y53-R57 PolarHBondContact O-N 2.94Å; Y53-R57 PolarHBondContact OH-NE 3.5Å; Y53-R57 VanDerWaalsContact OH-NE 3.12Å; Y53-R57 PolarHBondContact OH-NH2 3.39Å; R57-F60 PolarHBondContact O-N 3.48Å; R57-L61 VanDerWaalsContact O-CB 3.24Å; R57-L61 WeakPolarHBondContact O-CB 3.32Å; R57-L61 PolarHBondContact O-N 3.38Å |
| 58 | R | 72.2 | Confident | 68.7 | Low | 173 Ų | 173 | 125.9 Ų | 125.9 | 65% | 0.653 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -64.8 | -40.8 | 178.7 | -171.4 | 175.4 | -179.1 | -173.1 | 0.2 | 111.6 | F54 H55 F56 F60 L61 L62 | F54-R58 VanDerWaalsContact O-CB 3.27Å; F54-R58 WeakPolarHBondContact O-CB 3.44Å; F54-R58 PolarHBondContact O-N 3.3Å; H55-R58 PolarHBondContact O-N 2.93Å; F56-R58 VanDerWaalsContact C-N 3.3Å; F56-R58 PolarHBondContact O-N 3.42Å; R58-F60 VanDerWaalsContact C-N 3.32Å; R58-F60 PolarHBondContact O-N 3.5Å; R58-L61 PolarHBondContact O-N 3.4Å; R58-L62 HydrophobicContact CG-CD1 3.94Å; R58-L62 WeakPolarHBondContact O-CD1 3.45Å; R58-L62 PolarHBondContact O-N 3.5Å |
| 59 | L | 66.4 | Low | 66.6 | Low | 126 Ų | 126 | 127 Ų | 127 | 66% | 0.66 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -62.6 | -37.3 | 176.6 | -79.9 | 161.1 | 0 | 0 | 0 | 112.5 | H55 F56 | H55-L59 WeakPolarHBondContact O-CB 3.49Å; H55-L59 WeakPolarHBondContact O-CG 3.4Å; H55-L59 PolarHBondContact O-N 2.93Å; F56-L59 PolarHBondContact O-N 2.9Å |
| 60 | F | 61.9 | Low | 64.7 | Low | 129 Ų | 129 | 126.8 Ų | 126.8 | 57% | 0.566 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -81.4 | -25.9 | 176.7 | -82.3 | -94 | 0 | 0 | 0 | 113.8 | F56 R57 R58 | F56-F60 AromaticContact CD1-CD2 3.7Å; F56-F60 HydrophobicContact CD1-CD2 3.7Å; F56-F60 AromaticContact CD1-CE2 3.63Å; F56-F60 HydrophobicContact CD1-CE2 3.63Å; F56-F60 HydrophobicContact CD2-CE2 4.34Å; F56-F60 AromaticContact CE1-CD2 3.64Å; F56-F60 HydrophobicContact CE1-CD2 3.64Å; F56-F60 AromaticContact CE1-CE2 3.1Å; F56-F60 HydrophobicContact CE1-CE2 3.1Å; F56-F60 AromaticContact CE1-CZ 3.82Å; F56-F60 HydrophobicContact CE1-CZ 3.82Å; F56-F60 AromaticContact CE2-CE2 3.9Å; F56-F60 HydrophobicContact CE2-CE2 3.9Å; F56-F60 HydrophobicContact CG-CD2 4.3Å; F56-F60 HydrophobicContact CG-CE2 4.24Å; F56-F60 HydrophobicContact CZ-CD2 4.19Å; F56-F60 AromaticContact CZ-CE2 3.27Å; F56-F60 HydrophobicContact CZ-CE2 3.27Å; F56-F60 AromaticContact CZ-CZ 3.88Å; F56-F60 HydrophobicContact CZ-CZ 3.88Å; F56-F60 WeakPolarHBondContact O-CD2 3.42Å; F56-F60 PolarHBondContact O-N 3.41Å; R57-F60 PolarHBondContact O-N 3.48Å; R58-F60 VanDerWaalsContact C-N 3.32Å; R58-F60 PolarHBondContact O-N 3.5Å |
| 61 | L | 57.6 | Low | 63.1 | Low | 126 Ų | 126 | 125.6 Ų | 125.6 | 66% | 0.66 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -84.2 | -18.3 | 178.5 | -88.1 | 161.4 | 0 | 0 | 0 | 114 | R57 R58 P63 | R57-L61 VanDerWaalsContact O-CB 3.24Å; R57-L61 WeakPolarHBondContact O-CB 3.32Å; R57-L61 PolarHBondContact O-N 3.38Å; R58-L61 PolarHBondContact O-N 3.4Å; L61-P63 WeakPolarHBondContact O-CD 3.23Å; L61-P63 VanDerWaalsContact O-N 3.14Å |
| 62 | L | 54.2 | Low | 61.5 | Low | 94 Ų | 94 | 124.5 Ų | 124.5 | 49% | 0.492 | 62% | 0.62 | S | S | . | * | S | Bend | trans | -69.5 | 106.8 | 164.6 | -94.5 | 113.8 | 0 | 0 | 0 | 106.2 | R58 | R58-L62 HydrophobicContact CG-CD1 3.94Å; R58-L62 WeakPolarHBondContact O-CD1 3.45Å; R58-L62 PolarHBondContact O-N 3.5Å |
| 63 | P | 54.9 | Low | 59.7 | Low | 91 Ų | 91 | 122 Ų | 122 | 59% | 0.591 | 63% | 0.629 | S | S | * | * | trans | -52.7 | 134.9 | 168.8 | 24.5 | -32.3 | 0 | 0 | 0 | 105.4 | L61 I65 | L61-P63 WeakPolarHBondContact O-CD 3.23Å; L61-P63 VanDerWaalsContact O-N 3.14Å; P63-I65 VanDerWaalsContact C-N 3.32Å; P63-I65 PolarHBondContact O-N 3.46Å | ||
| 64 | P | 54.7 | Low | 58.2 | Low | 101 Ų | 101 | 121.9 Ų | 121.9 | 66% | 0.656 | 64% | 0.635 | S | S | * | * | trans | -51.1 | 114.1 | 169.2 | 23.1 | -31.4 | 0 | 0 | 0 | 104.1 | H66 | P64-H66 PolarHBondContact O-N 2.94Š| ||
| 65 | I | 56 | Low | 56.7 | Low | 126 Ų | 126 | 122.1 Ų | 122.1 | 65% | 0.646 | 64% | 0.641 | S | S | * | * | trans | -71 | 69.2 | 171.5 | -53.5 | 174.2 | 0 | 0 | 0 | 102.5 | P63 H67 | P63-I65 VanDerWaalsContact C-N 3.32Å; P63-I65 PolarHBondContact O-N 3.46Å; I65-H67 PolarHBondContact O-N 2.89Å | ||
| 66 | H | 46.4 | Very low | 55.4 | Low | 142 Ų | 142 | 124.6 Ų | 124.6 | 66% | 0.657 | 66% | 0.664 | S | S | * | * | trans | -56.2 | 103 | 158.3 | -97.1 | -80.7 | 0 | 0 | 0 | 101.3 | P64 Y68 | P64-H66 PolarHBondContact O-N 2.94Å; H66-Y68 PolarHBondContact O-N 3.03Å | ||
| 67 | H | 48.4 | Very low | 54.4 | Low | 159 Ų | 159 | 121.2 Ų | 121.2 | 74% | 0.736 | 67% | 0.666 | S | S | * | * | trans | -43.9 | 93.2 | 154 | -73 | -60 | 0 | 0 | 0 | 105.6 | I65 L69 | I65-H67 PolarHBondContact O-N 2.89Å; H67-L69 HydrophobicContact CB-CD1 4.36Å; H67-L69 PolarHBondContact O-N 3.37Å | ||
| 68 | Y | 47.4 | Very low | 53.1 | Low | 193 Ų | 193 | 121.3 Ų | 121.3 | 76% | 0.757 | 67% | 0.672 | S | S | * | * | trans | -62.5 | 86.3 | 164.8 | -103.3 | -98.9 | 0 | 0 | 0 | 103.1 | H66 P70 | H66-Y68 PolarHBondContact O-N 3.03Å; Y68-P70 WeakPolarHBondContact O-CD 2.99Å | ||
| 69 | L | 46.9 | Very low | 51.9 | Low | 127 Ų | 127 | 120.1 Ų | 120.1 | 67% | 0.665 | 68% | 0.678 | S | S | * | * | trans | -61.6 | 113.9 | 155.3 | -89.7 | 94.7 | 0 | 0 | 0 | 104.5 | H67 G71 | H67-L69 HydrophobicContact CB-CD1 4.36Å; H67-L69 PolarHBondContact O-N 3.37Å; L69-G71 VanDerWaalsContact C-N 3.31Å; L69-G71 PolarHBondContact O-N 3.23Å | ||
| 70 | P | 49.5 | Very low | 50.7 | Low | 133 Ų | 133 | 118.6 Ų | 118.6 | 86% | 0.864 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.8 | 96.7 | 174.7 | 28.7 | -31.4 | 0 | 0 | 0 | 106.9 | Y68 | Y68-P70 WeakPolarHBondContact O-CD 2.99Š|
| 71 | G | 52.7 | Low | 50 | Low | 75 Ų | 75 | 118 Ų | 118 | 77% | 0.773 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 161.3 | -20.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | L69 A73 | L69-G71 VanDerWaalsContact C-N 3.31Å; L69-G71 PolarHBondContact O-N 3.23Å; G71-A73 PolarHBondContact O-N 2.92Å |
| 72 | S | 52.2 | Low | 49.5 | Very low | 89 Ų | 89 | 117.5 Ų | 117.5 | 62% | 0.622 | 68% | 0.68 | S | S | * | * | trans | -86.1 | 99.9 | 175.2 | 53.3 | 0 | 0 | 0 | 0 | 110 | I74 | S72-I74 PolarHBondContact O-N 3.01Š| ||
| 73 | A | 46.4 | Very low | 49.2 | Very low | 93 Ų | 93 | 116.2 Ų | 116.2 | 77% | 0.769 | 68% | 0.683 | S | S | * | * | trans | -51.6 | 109.2 | 166.3 | 0 | 0 | 0 | 0 | 0 | 109.2 | G71 L75 | G71-A73 PolarHBondContact O-N 2.92Å; A73-L75 PolarHBondContact O-N 2.88Å | ||
| 74 | I | 51 | Low | 48.9 | Very low | 102 Ų | 102 | 116 Ų | 116 | 52% | 0.523 | 68% | 0.684 | S | S | . | * | trans | -71.6 | 101.7 | 175.6 | -60.6 | 172.7 | 0 | 0 | 0 | 106.3 | S72 | S72-I74 PolarHBondContact O-N 3.01Š| ||
| 75 | L | 48.3 | Very low | 48.6 | Very low | 137 Ų | 137 | 119.4 Ų | 119.4 | 72% | 0.717 | 69% | 0.689 | S | S | * | * | trans | -60.5 | 131.8 | 166.9 | -78.8 | 157.5 | 0 | 0 | 0 | 108.1 | A73 G77 | A73-L75 PolarHBondContact O-N 2.88Å; L75-G77 VanDerWaalsContact C-N 3.27Å; L75-G77 PolarHBondContact O-N 3.14Å | ||
| 76 | P | 49.5 | Very low | 47.8 | Very low | 131 Ų | 131 | 117.1 Ų | 117.1 | 85% | 0.851 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67 | 89 | 177.6 | 28.3 | -33.1 | 0 | 0 | 0 | 108.8 | ||
| 77 | G | 51.3 | Low | 47.4 | Very low | 57 Ų | 57 | 117.8 Ų | 117.8 | 59% | 0.588 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -177 | -26.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | L75 | L75-G77 VanDerWaalsContact C-N 3.27Å; L75-G77 PolarHBondContact O-N 3.14Å |
| 78 | Q | 48.2 | Very low | 47.2 | Very low | 144 Ų | 144 | 116.3 Ų | 116.3 | 67% | 0.673 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -12.5 | -179.4 | -78.2 | -176.7 | -20 | 0 | 0 | 115 | C80 | Q78-C80 PolarHBondContact O-N 2.97Š|
| 79 | L | 45.3 | Very low | 46.9 | Very low | 148 Ų | 148 | 112.3 Ų | 112.3 | 78% | 0.775 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | -16.8 | 176.8 | -82.6 | 162.9 | 0 | 0 | 0 | 113.6 | I81 | L79-I81 PolarHBondContact O-N 3.32Š|
| 80 | C | 41.8 | Very low | 46.4 | Very low | 94 Ų | 94 | 114.8 Ų | 114.8 | 64% | 0.635 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -71 | -26.7 | 179.3 | -95.8 | 0 | 0 | 0 | 0 | 113.9 | Q78 V82 A83 S84 | Q78-C80 PolarHBondContact O-N 2.97Å; C80-V82 VanDerWaalsContact C-N 3.31Å; C80-V82 PolarHBondContact O-N 3.46Å; C80-A83 PolarHBondContact O-N 3.25Å; C80-S84 PolarHBondContact O-N 3Å; C80-S84 PolarHBondContact O-OG 3.35Å |
| 81 | I | 47.7 | Very low | 46 | Very low | 115 Ų | 115 | 117.9 Ų | 117.9 | 59% | 0.59 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -69.5 | -30.9 | -169.7 | -57.9 | 178 | 0 | 0 | 0 | 111.7 | L79 | L79-I81 PolarHBondContact O-N 3.32Å |
| 82 | V | 46.4 | Very low | 45.2 | Very low | 116 Ų | 116 | 122.2 Ų | 122.2 | 70% | 0.703 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -81.9 | -33.1 | -177.3 | -173.6 | 0 | 0 | 0 | 0 | 111.8 | C80 S84 F85 | C80-V82 VanDerWaalsContact C-N 3.31Å; C80-V82 PolarHBondContact O-N 3.46Å; V82-S84 VanDerWaalsContact C-N 3.33Å; V82-S84 PolarHBondContact O-N 3.31Å; V82-F85 PolarHBondContact O-N 2.86Å |
| 83 | A | 47.4 | Very low | 44.6 | Very low | 68 Ų | 68 | 126 Ų | 126 | 56% | 0.562 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -69.8 | -29.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | C80 F85 C86 | C80-A83 PolarHBondContact O-N 3.25Å; A83-F85 PolarHBondContact O-N 3.08Å; A83-C86 PolarHBondContact O-N 3.05Å; A83-C86 VanDerWaalsContact O-N 3.17Å |
| 84 | S | 50 | Low | 44.2 | Very low | 86 Ų | 86 | 130.5 Ų | 130.5 | 60% | 0.601 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -66.5 | -20.8 | -179.7 | -60.5 | 0 | 0 | 0 | 0 | 114 | C80 V82 | C80-S84 PolarHBondContact O-N 3Å; C80-S84 PolarHBondContact O-OG 3.35Å; V82-S84 VanDerWaalsContact C-N 3.33Å; V82-S84 PolarHBondContact O-N 3.31Å |
| 85 | F | 47.3 | Very low | 43.8 | Very low | 172 Ų | 172 | 129.6 Ų | 129.6 | 75% | 0.754 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -82.4 | -13.2 | 175.8 | -85.6 | -81 | 0 | 0 | 0 | 114.1 | V82 A83 | V82-F85 PolarHBondContact O-N 2.86Å; A83-F85 PolarHBondContact O-N 3.08Å |
| 86 | C | 39.1 | Very low | 43.3 | Very low | 78 Ų | 78 | 127 Ų | 127 | 53% | 0.527 | 72% | 0.715 | S | S | . | * | G | 310 helix | trans | -91.3 | -1.1 | -179.6 | -78.1 | 0 | 0 | 0 | 0 | 114.5 | A83 | A83-C86 PolarHBondContact O-N 3.05Å; A83-C86 VanDerWaalsContact O-N 3.17Å |
| 87 | H | 39.1 | Very low | 42.9 | Very low | 156 Ų | 156 | 129.6 Ų | 129.6 | 72% | 0.722 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -115.3 | 25.7 | 179.8 | -140.7 | -56.3 | 0 | 0 | 0 | 114.3 | N89 | H87-N89 PolarHBondContact O-N 2.71Š|
| 88 | V | 44.1 | Very low | 42.4 | Very low | 129 Ų | 129 | 133.6 Ų | 133.6 | 78% | 0.782 | 73% | 0.726 | S | S | * | * | trans | -89.4 | 58.2 | 157.5 | -167.4 | 0 | 0 | 0 | 0 | 107.8 | E90 | V88-E90 PolarHBondContact O-N 3.18Š| ||
| 89 | N | 40 | Very low | 42.3 | Very low | 108 Ų | 108 | 130.6 Ų | 130.6 | 58% | 0.578 | 73% | 0.726 | S | S | * | * | trans | -79.2 | 113.8 | 164.1 | -79.3 | -23.9 | 0 | 0 | 0 | 107.4 | H87 F91 | H87-N89 PolarHBondContact O-N 2.71Å; N89-F91 PolarHBondContact O-N 3.3Å; N89-F91 VanDerWaalsContact O-N 3.17Å | ||
| 90 | E | 37.8 | Very low | 42 | Very low | 180 Ų | 180 | 128.4 Ų | 128.4 | 84% | 0.841 | 72% | 0.723 | S | S | * | * | S | Bend | 65.7 | 37 | 122.9 | -145.1 | 161.9 | -148.1 | 0 | 0 | 117.6 | V88 | V88-E90 PolarHBondContact O-N 3.18Š| |
| 91 | F | 39.8 | Very low | 42.1 | Very low | 198 Ų | 198 | 128.7 Ų | 128.7 | 87% | 0.868 | 72% | 0.724 | S | S | * | * | trans | -131.1 | 136.4 | 155.3 | -98.2 | -94.8 | 0 | 0 | 0 | 107.8 | N89 | N89-F91 PolarHBondContact O-N 3.3Å; N89-F91 VanDerWaalsContact O-N 3.17Å | ||
| 92 | Q | 37.5 | Very low | 41.8 | Very low | 165 Ų | 165 | 134.4 Ų | 134.4 | 77% | 0.771 | 74% | 0.738 | S | S | * | * | trans | 109.8 | 17.7 | 172.1 | -49.1 | -113.2 | -19.6 | 0 | 0 | 116.5 | ||||
| 93 | L | 39.1 | Very low | 41.6 | Very low | 170 Ų | 170 | 139.5 Ų | 139.5 | 89% | 0.89 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -81.5 | 119 | 144.8 | -147.8 | 78 | 0 | 0 | 0 | 106 | ||
| 94 | E | 37.5 | Very low | 41.4 | Very low | 187 Ų | 187 | 140 Ų | 140 | 87% | 0.874 | 75% | 0.745 | S | S | * | * | S | Bend | trans | 91.8 | 59.3 | -176.9 | -48.3 | -158 | 167.8 | 0 | 0 | 117.2 | ||
| 95 | S | 42.4 | Very low | 41 | Very low | 82 Ų | 82 | 141 Ų | 141 | 57% | 0.573 | 75% | 0.753 | S | S | * | * | -161.4 | 127.5 | 122.4 | 59 | 0 | 0 | 0 | 0 | 109.1 | F97 | S95-F97 VanDerWaalsContact C-N 3.28Å; S95-F97 PolarHBondContact O-N 2.73Å | |||
| 96 | G | 37.9 | Very low | 40.7 | Very low | 83 Ų | 83 | 141.4 Ų | 141.4 | 86% | 0.856 | 76% | 0.756 | S | S | * | * | trans | -70 | 80.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 97 | F | 40.2 | Very low | 41 | Very low | 185 Ų | 185 | 142 Ų | 142 | 81% | 0.811 | 77% | 0.767 | S | S | * | * | trans | -118.6 | 105.1 | 164.6 | -112.9 | -93.8 | 0 | 0 | 0 | 110.2 | S95 A99 | S95-F97 VanDerWaalsContact C-N 3.28Å; S95-F97 PolarHBondContact O-N 2.73Å; F97-A99 PolarHBondContact O-N 2.83Å | ||
| 98 | V | 42.6 | Very low | 41.1 | Very low | 141 Ų | 141 | 143 Ų | 143 | 86% | 0.855 | 77% | 0.772 | S | S | * | * | trans | -63.3 | 86.4 | 164.3 | 179.8 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 99 | A | 46.3 | Very low | 41 | Very low | 82 Ų | 82 | 143.4 Ų | 143.4 | 68% | 0.678 | 78% | 0.779 | S | S | * | * | trans | -105.2 | 95.4 | 168 | 0 | 0 | 0 | 0 | 0 | 107.6 | F97 | F97-A99 PolarHBondContact O-N 2.83Š| ||
| 100 | S | 37.5 | Very low | 41.2 | Very low | 102 Ų | 102 | 142.7 Ų | 142.7 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | trans | -48.2 | 124.7 | 168.5 | -80 | 0 | 0 | 0 | 0 | 109.6 | R102 | S100-R102 PolarHBondContact O-N 2.93Š| ||
| 101 | P | 45.3 | Very low | 41.4 | Very low | 100 Ų | 100 | 143.1 Ų | 143.1 | 65% | 0.649 | 79% | 0.787 | S | S | * | * | trans | -68.3 | 98 | 175 | 25.9 | -30.4 | 0 | 0 | 0 | 108.4 | Y103 | P101-Y103 HydrophobicContact CB-CD2 4.01Å; P101-Y103 HydrophobicContact CB-CE2 4.06Å; P101-Y103 PolarHBondContact O-N 2.77Å | ||
| 102 | R | 40.4 | Very low | 41.5 | Very low | 235 Ų | 235 | 142.7 Ų | 142.7 | 89% | 0.887 | 79% | 0.788 | S | S | * | * | trans | -64.5 | 94.6 | 155.8 | -78.8 | -173.2 | -161.5 | 176.7 | 6 | 105.9 | S100 S104 | S100-R102 PolarHBondContact O-N 2.93Å; R102-S104 PolarHBondContact O-N 2.99Å | ||
| 103 | Y | 42.8 | Very low | 41.6 | Very low | 222 Ų | 222 | 144.3 Ų | 144.3 | 87% | 0.871 | 82% | 0.818 | S | S | * | * | trans | -67.6 | 84.1 | 161.9 | -92.3 | -89.4 | 0 | 0 | 0 | 107.7 | P101 S105 | P101-Y103 HydrophobicContact CB-CD2 4.01Å; P101-Y103 HydrophobicContact CB-CE2 4.06Å; P101-Y103 PolarHBondContact O-N 2.77Å; Y103-S105 PolarHBondContact O-N 2.67Å | ||
| 104 | S | 42.1 | Very low | 41.7 | Very low | 79 Ų | 79 | 143.1 Ų | 143.1 | 55% | 0.552 | 81% | 0.814 | S | S | * | * | trans | -71.1 | 103.4 | 164.6 | 57.5 | 0 | 0 | 0 | 0 | 107.9 | R102 H106 | R102-S104 PolarHBondContact O-N 2.99Å; S104-H106 PolarHBondContact O-N 3.37Å | ||
| 105 | S | 42.1 | Very low | 41.9 | Very low | 108 Ų | 108 | 140.7 Ų | 140.7 | 76% | 0.755 | 81% | 0.811 | S | S | * | * | trans | 13.1 | 70.2 | 139.5 | 60.5 | 0 | 0 | 0 | 0 | 117.1 | Y103 A107 | Y103-S105 PolarHBondContact O-N 2.67Å; S105-A107 VanDerWaalsContact C-N 3.28Å; S105-A107 PolarHBondContact O-N 3.27Å | ||
| 106 | H | 41.7 | Very low | 41.9 | Very low | 179 Ų | 179 | 144 Ų | 144 | 83% | 0.829 | 82% | 0.824 | S | S | * | * | trans | -94.3 | 66.9 | 156.6 | -90.1 | -79.7 | 0 | 0 | 0 | 108.3 | S104 | S104-H106 PolarHBondContact O-N 3.37Š| ||
| 107 | A | 45.6 | Very low | 42.1 | Very low | 92 Ų | 92 | 147.6 Ų | 147.6 | 76% | 0.76 | 82% | 0.822 | S | S | * | * | trans | -120.3 | 44.3 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | S105 | S105-A107 VanDerWaalsContact C-N 3.28Å; S105-A107 PolarHBondContact O-N 3.27Å | ||
| 108 | E | 41.4 | Very low | 42.3 | Very low | 177 Ų | 177 | 145.3 Ų | 145.3 | 83% | 0.827 | 82% | 0.823 | S | S | * | * | trans | -91.7 | 2.6 | 167.8 | -94.1 | -175.3 | 155.2 | 0 | 0 | 112.8 | A110 | E108-A110 VanDerWaalsContact C-N 3.28Å; E108-A110 PolarHBondContact O-N 3.26Å; E108-A110 VanDerWaalsContact O-N 3.16Å | ||
| 109 | C | 41.5 | Very low | 42.3 | Very low | 137 Ų | 137 | 145.5 Ų | 145.5 | 93% | 0.926 | 82% | 0.821 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.3 | 48.3 | -179.4 | -143.8 | 0 | 0 | 0 | 0 | 112.5 | ||
| 110 | A | 44.3 | Very low | 42 | Very low | 92 Ų | 92 | 150.1 Ų | 150.1 | 76% | 0.76 | 83% | 0.831 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.3 | 15.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | E108 | E108-A110 VanDerWaalsContact C-N 3.28Å; E108-A110 PolarHBondContact O-N 3.26Å; E108-A110 VanDerWaalsContact O-N 3.16Å |
| 111 | K | 41.6 | Very low | 42.3 | Very low | 190 Ų | 190 | 153.8 Ų | 153.8 | 83% | 0.826 | 84% | 0.84 | S | S | * | * | trans | -129.1 | 75.9 | 175.1 | -71.7 | -175.2 | -179.2 | 177 | 0 | 110.5 | ||||
| 112 | Q | 40.7 | Very low | 42.1 | Very low | 188 Ų | 188 | 158.3 Ų | 158.3 | 88% | 0.879 | 86% | 0.856 | S | S | * | * | trans | -169 | 128.9 | 154.5 | -104.3 | 154 | 40.5 | 0 | 0 | 108.6 | ||||
| 113 | S | 40.5 | Very low | 42.2 | Very low | 200 Ų | 200 | 151.3 Ų | 151.3 | 100% | 1.399 | 85% | 0.853 | S | S | * | * | trans | 73.1 | 0 | -177.5 | 79.3 | 0 | 0 | 0 | 0 | 117.7 |
Retrieved 113 of 113 residues in 71.2 ms
(Link to these results)