| 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 | 43.3 | Very low | 42.8 | Very low | 242 Ų | 242 | 157 Ų | 157 | 100% | 1.192 | 84% | 0.842 | S | S | * | * | 0 | 91.3 | 0 | -83.3 | 167.9 | 138.4 | 0 | 0 | 107.1 | |||||
| 2 | E | 35.5 | Very low | 43.2 | Very low | 196 Ų | 196 | 153.9 Ų | 153.9 | 92% | 0.916 | 84% | 0.837 | S | S | * | * | trans | -144.4 | 129 | 157.8 | -79.7 | -156.7 | 127.9 | 0 | 0 | 107.1 | ||||
| 3 | S | 37 | Very low | 43.9 | Very low | 117 Ų | 117 | 155.8 Ų | 155.8 | 82% | 0.818 | 84% | 0.836 | S | S | * | * | trans | -80.5 | 123.7 | -163.2 | -70.3 | 0 | 0 | 0 | 0 | 112.1 | T5 | S3-T5 PolarHBondContact O-N 3.14Å; S3-T5 VanDerWaalsContact O-N 3.14Å | ||
| 4 | S | 38 | Very low | 44.5 | Very low | 117 Ų | 117 | 151.1 Ų | 151.1 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | trans | -69.5 | 102.4 | 165.1 | -60.6 | 0 | 0 | 0 | 0 | 110 | V6 | S4-V6 PolarHBondContact O-N 3.14Å; S4-V6 VanDerWaalsContact O-N 3.14Å | ||
| 5 | T | 44.8 | Very low | 45 | Very low | 129 Ų | 129 | 155.5 Ų | 155.5 | 79% | 0.791 | 83% | 0.831 | S | S | * | * | trans | -70 | 103.6 | 168 | 37.6 | 0 | 0 | 0 | 0 | 109.8 | S3 V7 | S3-T5 PolarHBondContact O-N 3.14Å; S3-T5 VanDerWaalsContact O-N 3.14Å; T5-V7 PolarHBondContact O-N 3.24Å | ||
| 6 | V | 44.6 | Very low | 45.5 | Very low | 130 Ų | 130 | 150.3 Ų | 150.3 | 79% | 0.788 | 83% | 0.826 | S | S | * | * | trans | -70.2 | 108.5 | 169.3 | 174.4 | 0 | 0 | 0 | 0 | 108.3 | S4 Q8 | S4-V6 PolarHBondContact O-N 3.14Å; S4-V6 VanDerWaalsContact O-N 3.14Å; V6-Q8 PolarHBondContact O-N 3.05Å | ||
| 7 | V | 44.7 | Very low | 46.5 | Very low | 125 Ų | 125 | 152.1 Ų | 152.1 | 76% | 0.758 | 83% | 0.827 | S | S | * | * | trans | -71.7 | 99.4 | 169.3 | 178.1 | 0 | 0 | 0 | 0 | 107.7 | T5 V9 | T5-V7 PolarHBondContact O-N 3.24Å; V7-V9 PolarHBondContact O-N 3.06Å | ||
| 8 | Q | 44.4 | Very low | 47.4 | Very low | 172 Ų | 172 | 156 Ų | 156 | 80% | 0.804 | 83% | 0.828 | S | S | * | * | trans | -73.5 | 95.8 | 175.2 | -167.5 | 168.9 | -4.2 | 0 | 0 | 109.2 | V6 R10 | V6-Q8 PolarHBondContact O-N 3.05Å; Q8-R10 PolarHBondContact O-N 3.25Å; Q8-R10 VanDerWaalsContact O-N 3.07Å | ||
| 9 | V | 44.5 | Very low | 48.1 | Very low | 117 Ų | 117 | 155.5 Ų | 155.5 | 71% | 0.709 | 82% | 0.823 | S | S | * | * | trans | -65.2 | 105.3 | 171.1 | 178.9 | 0 | 0 | 0 | 0 | 107.9 | V7 L11 | V7-V9 PolarHBondContact O-N 3.06Å; V9-L11 PolarHBondContact O-N 3.07Å | ||
| 10 | R | 43.4 | Very low | 49.2 | Very low | 228 Ų | 228 | 153.8 Ų | 153.8 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | trans | -69.6 | 114.4 | 168.5 | -68 | -171 | -155.2 | -151.5 | 5 | 108.2 | Q8 | Q8-R10 PolarHBondContact O-N 3.25Å; Q8-R10 VanDerWaalsContact O-N 3.07Å | ||
| 11 | L | 50.8 | Low | 50.5 | Low | 154 Ų | 154 | 149.7 Ų | 149.7 | 81% | 0.806 | 79% | 0.789 | S | S | * | * | trans | -65.4 | 135.3 | 166.4 | -70 | 167 | 0 | 0 | 0 | 108.7 | V9 Q13 | V9-L11 PolarHBondContact O-N 3.07Å; L11-Q13 PolarHBondContact O-N 3.25Å | ||
| 12 | P | 47.4 | Very low | 52.2 | Low | 120 Ų | 120 | 142.6 Ų | 142.6 | 78% | 0.779 | 76% | 0.759 | S | S | * | * | trans | -64.3 | 124.3 | 175.1 | 25.2 | -30.8 | 0 | 0 | 0 | 109.1 | A14 | P12-A14 PolarHBondContact O-N 3.06Š| ||
| 13 | Q | 52.5 | Low | 54.4 | Low | 178 Ų | 178 | 133.9 Ų | 133.9 | 83% | 0.832 | 72% | 0.721 | S | S | * | * | trans | -67.2 | 105.3 | 178.6 | -160.9 | 150.5 | -2.3 | 0 | 0 | 108.5 | L11 Y15 | L11-Q13 PolarHBondContact O-N 3.25Å; Q13-Y15 VanDerWaalsContact O-CD1 3.26Å; Q13-Y15 WeakPolarHBondContact O-CD1 3.47Å; Q13-Y15 PolarHBondContact O-N 2.89Å | ||
| 14 | A | 52.5 | Low | 56.5 | Low | 91 Ų | 91 | 133.6 Ų | 133.6 | 75% | 0.752 | 72% | 0.717 | S | S | * | * | trans | -71.2 | 92.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 109.5 | P12 | P12-A14 PolarHBondContact O-N 3.06Š| ||
| 15 | Y | 50.9 | Low | 58.5 | Low | 216 Ų | 216 | 134.3 Ų | 134.3 | 85% | 0.847 | 71% | 0.711 | S | S | * | * | trans | -88.4 | 136 | 169.3 | 54.7 | -94.6 | 0 | 0 | 0 | 110.1 | Q13 | Q13-Y15 VanDerWaalsContact O-CD1 3.26Å; Q13-Y15 WeakPolarHBondContact O-CD1 3.47Å; Q13-Y15 PolarHBondContact O-N 2.89Å | ||
| 16 | G | 54 | Low | 60 | Low | 73 Ų | 73 | 130 Ų | 130 | 75% | 0.753 | 69% | 0.693 | S | S | * | * | trans | 89.5 | 37.3 | 163 | 0 | 0 | 0 | 0 | 0 | 117.5 | R18 | G16-R18 PolarHBondContact O-N 3.33Å; G16-R18 VanDerWaalsContact O-N 3.15Å | ||
| 17 | Q | 62.8 | Low | 61.8 | Low | 180 Ų | 180 | 130.5 Ų | 130.5 | 84% | 0.841 | 69% | 0.69 | S | S | * | * | trans | -63 | 114.4 | 159 | -68.4 | -92.4 | -48.7 | 0 | 0 | 107.5 | M19 | Q17-M19 PolarHBondContact O-N 3.44Š| ||
| 18 | R | 61.4 | Low | 63.6 | Low | 223 Ų | 223 | 126 Ų | 126 | 84% | 0.842 | 67% | 0.669 | S | S | * | * | trans | -59.2 | 111.3 | 173.1 | -69.5 | 176.6 | 168.7 | -120 | -1.6 | 107.2 | G16 L20 | G16-R18 PolarHBondContact O-N 3.33Å; G16-R18 VanDerWaalsContact O-N 3.15Å; R18-L20 VanDerWaalsContact C-N 3.28Å; R18-L20 PolarHBondContact O-N 3.09Å | ||
| 19 | M | 61.9 | Low | 65.4 | Low | 147 Ų | 147 | 122.7 Ų | 122.7 | 72% | 0.724 | 66% | 0.657 | S | S | * | * | trans | -71.7 | 90.2 | 178.1 | -138.4 | 168 | 167.9 | 0 | 0 | 107.2 | Q17 F21 | Q17-M19 PolarHBondContact O-N 3.44Å; M19-F21 HydrophobicContact CB-CD2 4.33Å; M19-F21 HydrophobicContact CB-CE2 3.74Å; M19-F21 HydrophobicContact CB-CZ 3.95Å; M19-F21 HydrophobicContact CE-CE1 3.53Å; M19-F21 HydrophobicContact CE-CE2 4.37Å; M19-F21 HydrophobicContact CE-CZ 3.25Å; M19-F21 HydrophobicContact CG-CD1 4.46Å; M19-F21 HydrophobicContact CG-CD2 4.44Å; M19-F21 HydrophobicContact CG-CE1 3.68Å; M19-F21 HydrophobicContact CG-CE2 3.65Å; M19-F21 HydrophobicContact CG-CZ 3.3Å; M19-F21 PolarHBondContact O-N 2.98Å; M19-F21 HydrophobicContact SD-CE1 4Å; M19-F21 HydrophobicContact SD-CE2 3.84Å; M19-F21 HydrophobicContact SD-CZ 3.25Å; M19-F21 WeakPolarHBondContact SD-CZ 3.49Å | ||
| 20 | L | 70.1 | Confident | 67.2 | Low | 120 Ų | 120 | 124.2 Ų | 124.2 | 63% | 0.628 | 65% | 0.651 | S | S | * | * | trans | -80.6 | 102.8 | 175.2 | -69.9 | 174.9 | 0 | 0 | 0 | 107 | R18 W139 | R18-L20 VanDerWaalsContact C-N 3.28Å; R18-L20 PolarHBondContact O-N 3.09Å; L20-W139 HydrophobicContact CD1-CH2 4.49Å; L20-W139 HydrophobicContact CD1-CZ3 4.38Å | ||
| 21 | F | 76.5 | Confident | 68.9 | Low | 69 Ų | 69 | 122.1 Ų | 122.1 | 30% | 0.303 | 65% | 0.648 | S | S | . | * | trans | -92.4 | 115.3 | 172.6 | -61.2 | -64.4 | 0 | 0 | 0 | 108.7 | M19 G23 G26 I27 G28 | M19-F21 HydrophobicContact CB-CD2 4.33Å; M19-F21 HydrophobicContact CB-CE2 3.74Å; M19-F21 HydrophobicContact CB-CZ 3.95Å; M19-F21 HydrophobicContact CE-CE1 3.53Å; M19-F21 HydrophobicContact CE-CE2 4.37Å; M19-F21 HydrophobicContact CE-CZ 3.25Å; M19-F21 HydrophobicContact CG-CD1 4.46Å; M19-F21 HydrophobicContact CG-CD2 4.44Å; M19-F21 HydrophobicContact CG-CE1 3.68Å; M19-F21 HydrophobicContact CG-CE2 3.65Å; M19-F21 HydrophobicContact CG-CZ 3.3Å; M19-F21 PolarHBondContact O-N 2.98Å; M19-F21 HydrophobicContact SD-CE1 4Å; M19-F21 HydrophobicContact SD-CE2 3.84Å; M19-F21 HydrophobicContact SD-CZ 3.25Å; M19-F21 WeakPolarHBondContact SD-CZ 3.49Å; F21-G23 VanDerWaalsContact C-N 3.27Å; F21-G26 VanDerWaalsContact CD2-C 3.42Å; F21-G26 WeakPolarHBondContact CD2-O 3.22Å; F21-G26 WeakPolarHBondContact CE2-O 3.25Å; F21-G26 VanDerWaalsContact CG-C 3.47Å; F21-G26 WeakPolarHBondContact CG-O 3.46Å; F21-G26 WeakPolarHBondContact CZ-O 2.94Å; F21-I27 WeakPolarHBondContact CD1-O 3.26Å; F21-I27 WeakPolarHBondContact CE1-O 3.48Å; F21-G28 VanDerWaalsContact CD1-CA 3.41Å | ||
| 22 | T | 79.4 | Confident | 70.3 | Confident | 93 Ų | 93 | 118.1 Ų | 118.1 | 57% | 0.571 | 64% | 0.638 | S | S | * | * | trans | -81.1 | -12.9 | 172.7 | 55.2 | 0 | 0 | 0 | 0 | 112.3 | D29 Y30 | T22-D29 PolarHBondContact N-OD1 3.23Å; T22-D29 WeakPolarHBondContact OG1-CA 3.41Å; T22-D29 VanDerWaalsContact OG1-CB 3.26Å; T22-D29 WeakPolarHBondContact OG1-CB 3.44Å; T22-D29 PolarHBondContact OG1-OD1 3.39Å; T22-Y30 WeakPolarHBondContact O-CB 3.39Å; T22-Y30 PolarHBondContact OG1-N 3.47Å | ||
| 23 | G | 81.8 | Confident | 71.5 | Confident | 12 Ų | 12 | 123.1 Ų | 123.1 | 12% | 0.124 | 64% | 0.641 | C | S | . | * | S | Bend | trans | -80.2 | 149.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | F21 D25 G26 G28 Y30 | F21-G23 VanDerWaalsContact C-N 3.27Å; G23-D25 PolarHBondContact O-N 2.97Å; G23-G26 PolarHBondContact O-N 2.71Å; G23-G28 VanDerWaalsContact CA-O 3.28Å; G23-G28 WeakPolarHBondContact CA-O 3.5Å; G23-G28 PolarHBondContact N-O 3.18Å; G23-Y30 VanDerWaalsContact N-N 3.18Å |
| 24 | P | 80.4 | Confident | 72.3 | Confident | 112 Ų | 112 | 121.7 Ų | 121.7 | 73% | 0.727 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | -27 | -179.8 | 26.4 | -35.3 | 0 | 0 | 0 | 113.1 | G26 | P24-G26 VanDerWaalsContact C-N 3.29Å; P24-G26 PolarHBondContact O-N 3.25Å |
| 25 | D | 80.3 | Confident | 73.2 | Confident | 131 Ų | 131 | 122.8 Ų | 122.8 | 70% | 0.701 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -4.8 | -175.6 | -55 | -35.4 | 0 | 0 | 0 | 113.3 | G23 I27 | G23-D25 PolarHBondContact O-N 2.97Å; D25-I27 WeakPolarHBondContact O-CG1 2.9Å; D25-I27 PolarHBondContact O-N 3.38Å; D25-I27 VanDerWaalsContact O-N 3.07Å |
| 26 | G | 76 | Confident | 73.9 | Confident | 40 Ų | 40 | 118.8 Ų | 118.8 | 41% | 0.412 | 62% | 0.623 | S | S | . | * | S | Bend | trans | 62.2 | 18.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | F21 G23 P24 | F21-G26 VanDerWaalsContact CD2-C 3.42Å; F21-G26 WeakPolarHBondContact CD2-O 3.22Å; F21-G26 WeakPolarHBondContact CE2-O 3.25Å; F21-G26 VanDerWaalsContact CG-C 3.47Å; F21-G26 WeakPolarHBondContact CG-O 3.46Å; F21-G26 WeakPolarHBondContact CZ-O 2.94Å; G23-G26 PolarHBondContact O-N 2.71Å; P24-G26 VanDerWaalsContact C-N 3.29Å; P24-G26 PolarHBondContact O-N 3.25Å |
| 27 | I | 82.4 | Confident | 74.5 | Confident | 139 Ų | 139 | 122.6 Ų | 122.6 | 71% | 0.713 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -116.2 | -19 | -179.3 | -65.3 | 162.3 | 0 | 0 | 0 | 111.7 | F21 D25 | F21-I27 WeakPolarHBondContact CD1-O 3.26Å; F21-I27 WeakPolarHBondContact CE1-O 3.48Å; D25-I27 WeakPolarHBondContact O-CG1 2.9Å; D25-I27 PolarHBondContact O-N 3.38Å; D25-I27 VanDerWaalsContact O-N 3.07Å |
| 28 | G | 81.7 | Confident | 74.6 | Confident | 32 Ų | 32 | 117.4 Ų | 117.4 | 33% | 0.33 | 60% | 0.602 | S | S | . | * | S | Bend | trans | -158.2 | 173 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | F21 G23 | F21-G28 VanDerWaalsContact CD1-CA 3.41Å; G23-G28 VanDerWaalsContact CA-O 3.28Å; G23-G28 WeakPolarHBondContact CA-O 3.5Å; G23-G28 PolarHBondContact N-O 3.18Å |
| 29 | D | 83.3 | Confident | 74.7 | Confident | 102 Ų | 102 | 114.9 Ų | 114.9 | 55% | 0.545 | 59% | 0.592 | S | S | . | * | trans | -67.3 | 148.8 | 169.4 | -77.7 | -39.3 | 0 | 0 | 0 | 112 | T22 K31 | T22-D29 PolarHBondContact N-OD1 3.23Å; T22-D29 WeakPolarHBondContact OG1-CA 3.41Å; T22-D29 VanDerWaalsContact OG1-CB 3.26Å; T22-D29 WeakPolarHBondContact OG1-CB 3.44Å; T22-D29 PolarHBondContact OG1-OD1 3.39Å; D29-K31 PolarHBondContact O-N 3.42Å | ||
| 30 | Y | 81.8 | Confident | 74.9 | Confident | 148 Ų | 148 | 115.8 Ų | 115.8 | 58% | 0.58 | 59% | 0.589 | S | S | * | * | trans | -64.3 | 117.9 | 175.7 | 179.1 | -109.6 | 0 | 0 | 0 | 109.5 | T22 G23 A32 | T22-Y30 WeakPolarHBondContact O-CB 3.39Å; T22-Y30 PolarHBondContact OG1-N 3.47Å; G23-Y30 VanDerWaalsContact N-N 3.18Å; Y30-A32 HydrophobicContact CD1-CB 4.48Å; Y30-A32 HydrophobicContact CE1-CB 3.7Å | ||
| 31 | K | 79.4 | Confident | 74.5 | Confident | 184 Ų | 184 | 117.3 Ų | 117.3 | 80% | 0.8 | 60% | 0.596 | S | S | * | * | trans | -104.6 | 104 | 169.3 | -66.6 | -177.7 | 179.7 | 178.9 | 0 | 107.9 | D29 R33 | D29-K31 PolarHBondContact O-N 3.42Å; K31-R33 PolarHBondContact O-N 3.46Å; K31-R33 VanDerWaalsContact O-N 3.09Å | ||
| 32 | A | 79 | Confident | 74 | Confident | 71 Ų | 71 | 114.9 Ų | 114.9 | 59% | 0.587 | 59% | 0.591 | S | S | * | * | trans | -59.3 | 115.1 | 169.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | Y30 L34 | Y30-A32 HydrophobicContact CD1-CB 4.48Å; Y30-A32 HydrophobicContact CE1-CB 3.7Å; A32-L34 PolarHBondContact O-N 3.21Å; A32-L34 VanDerWaalsContact O-N 3.14Å | ||
| 33 | R | 72.9 | Confident | 73.2 | Confident | 224 Ų | 224 | 118.1 Ų | 118.1 | 85% | 0.845 | 61% | 0.61 | S | S | * | * | trans | -72.3 | 105.2 | 166.9 | -89.6 | -176.7 | 69 | -173.4 | 1.3 | 107.5 | K31 I35 | K31-R33 PolarHBondContact O-N 3.46Å; K31-R33 VanDerWaalsContact O-N 3.09Å; R33-I35 PolarHBondContact O-N 3.45Å | ||
| 34 | L | 69.2 | Low | 72.8 | Confident | 149 Ų | 149 | 120 Ų | 120 | 78% | 0.78 | 63% | 0.629 | S | S | * | * | trans | -75 | 118.9 | 163.3 | -143.6 | 131.6 | 0 | 0 | 0 | 106.5 | A32 D36 | A32-L34 PolarHBondContact O-N 3.21Å; A32-L34 VanDerWaalsContact O-N 3.14Å; L34-D36 PolarHBondContact O-N 3.02Å | ||
| 35 | I | 71 | Confident | 72.1 | Confident | 114 Ų | 114 | 121.2 Ų | 121.2 | 59% | 0.585 | 64% | 0.637 | S | S | * | * | trans | -80.9 | 112.1 | 176 | -57.6 | -178.1 | 0 | 0 | 0 | 106.3 | R33 F37 | R33-I35 PolarHBondContact O-N 3.45Å; I35-F37 VanDerWaalsContact CG2-O 3.23Å; I35-F37 WeakPolarHBondContact CG2-O 3.13Å; I35-F37 PolarHBondContact O-N 2.63Å | ||
| 36 | D | 67.1 | Low | 71.4 | Confident | 131 Ų | 131 | 119.5 Ų | 119.5 | 70% | 0.701 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -60.8 | -25.4 | -179.7 | -63.5 | -39.1 | 0 | 0 | 0 | 112.5 | L34 | L34-D36 PolarHBondContact O-N 3.02Š|
| 37 | F | 66 | Low | 71 | Confident | 153 Ų | 153 | 120.7 Ų | 120.7 | 67% | 0.671 | 63% | 0.629 | S | S | * | * | trans | -133.8 | 98.5 | -179.5 | -56.8 | -77.5 | 0 | 0 | 0 | 111.2 | I35 R39 | I35-F37 VanDerWaalsContact CG2-O 3.23Å; I35-F37 WeakPolarHBondContact CG2-O 3.13Å; I35-F37 PolarHBondContact O-N 2.63Å; F37-R39 PolarHBondContact O-N 3.15Å; F37-R39 VanDerWaalsContact O-N 3.12Å | ||
| 38 | P | 64.1 | Low | 70.1 | Confident | 72 Ų | 72 | 120 Ų | 120 | 47% | 0.468 | 63% | 0.633 | S | S | . | * | trans | -72.2 | 1.4 | 177.2 | 29 | -34.5 | 0 | 0 | 0 | 113.6 | ||||
| 39 | R | 65.1 | Low | 69.4 | Low | 170 Ų | 170 | 125.7 Ų | 125.7 | 64% | 0.642 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -76.3 | 129.4 | 175.4 | -74.1 | 178.9 | 178.3 | -178.2 | -2.4 | 109.8 | F37 I41 S52 | F37-R39 PolarHBondContact O-N 3.15Å; F37-R39 VanDerWaalsContact O-N 3.12Å; R39-I41 PolarHBondContact O-N 3.07Å; R39-S52 WeakPolarHBondContact CA-OG 3.28Å |
| 40 | Y | 65.1 | Low | 68.3 | Low | 166 Ų | 166 | 122.9 Ų | 122.9 | 65% | 0.651 | 65% | 0.646 | S | S | * | * | trans | -60.9 | 115.1 | 170.1 | 178.4 | -106.4 | 0 | 0 | 0 | 110.1 | S52 | Y40-S52 PolarHBondContact N-OG 3.01Š| ||
| 41 | I | 63 | Low | 67.5 | Low | 151 Ų | 151 | 120.4 Ų | 120.4 | 77% | 0.774 | 65% | 0.647 | S | S | * | * | trans | -96.9 | 81.4 | 170.6 | -53.9 | 172.8 | 0 | 0 | 0 | 106.6 | R39 | R39-I41 PolarHBondContact O-N 3.07Š| ||
| 42 | G | 64.6 | Low | 66.9 | Low | 19 Ų | 19 | 113.2 Ų | 113.2 | 20% | 0.196 | 62% | 0.62 | C | S | . | * | trans | -78.5 | 155 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | G44 | G42-G44 PolarHBondContact O-N 2.87Š| ||
| 43 | V | 63.8 | Low | 66.3 | Low | 161 Ų | 161 | 111.6 Ų | 111.6 | 98% | 0.976 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -82.5 | 101.1 | 167.8 | -179.3 | 0 | 0 | 0 | 0 | 108.1 | ||
| 44 | G | 71.6 | Confident | 66 | Low | 50 Ų | 50 | 106 Ų | 106 | 52% | 0.515 | 59% | 0.587 | S | S | . | * | S | Bend | trans | 148.5 | 161.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | G42 L46 | G42-G44 PolarHBondContact O-N 2.87Å; G44-L46 PolarHBondContact O-N 3.17Å; G44-L46 VanDerWaalsContact O-N 3.17Å |
| 45 | P | 66.5 | Low | 65.7 | Low | 139 Ų | 139 | 102.1 Ų | 102.1 | 90% | 0.903 | 57% | 0.568 | S | S | * | * | trans | -64 | 115.6 | 175.1 | 25.3 | -30.8 | 0 | 0 | 0 | 109.8 | ||||
| 46 | L | 66.1 | Low | 65.3 | Low | 94 Ų | 94 | 103.6 Ų | 103.6 | 49% | 0.492 | 57% | 0.567 | S | S | . | * | trans | -69.9 | 138.7 | 168.2 | -73.1 | 115.2 | 0 | 0 | 0 | 108.9 | G44 | G44-L46 PolarHBondContact O-N 3.17Å; G44-L46 VanDerWaalsContact O-N 3.17Å | ||
| 47 | S | 67.1 | Low | 65.3 | Low | 65 Ų | 65 | 102.8 Ų | 102.8 | 46% | 0.455 | 56% | 0.562 | S | S | . | * | trans | -56.7 | 137.6 | 167 | 149.1 | 0 | 0 | 0 | 0 | 108.7 | E49 G50 | S47-E49 PolarHBondContact O-N 2.94Å; S47-E49 PolarHBondContact OG-N 3.48Å; S47-E49 PolarHBondContact OG-OE2 3.15Å; S47-G50 PolarHBondContact O-N 2.72Å | ||
| 48 | P | 63.8 | Low | 65.1 | Low | 124 Ų | 124 | 101 Ų | 101 | 81% | 0.805 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.4 | -21.7 | 179.5 | 22.8 | -29.7 | 0 | 0 | 0 | 112.8 | ||
| 49 | E | 66.8 | Low | 65.2 | Low | 153 Ų | 153 | 106.1 Ų | 106.1 | 72% | 0.715 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.8 | -13.9 | 171.9 | -61.8 | 83 | -171.4 | 0 | 0 | 113.9 | S47 T51 | S47-E49 PolarHBondContact O-N 2.94Å; S47-E49 PolarHBondContact OG-N 3.48Å; S47-E49 PolarHBondContact OG-OE2 3.15Å; E49-T51 PolarHBondContact O-N 2.86Å |
| 50 | G | 60.8 | Low | 65.3 | Low | 42 Ų | 42 | 102.8 Ų | 102.8 | 43% | 0.433 | 58% | 0.578 | S | S | . | * | trans | -79.6 | 99.2 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113 | S47 | S47-G50 PolarHBondContact O-N 2.72Š| ||
| 51 | T | 63.6 | Low | 65.8 | Low | 97 Ų | 97 | 98.1 Ų | 98.1 | 60% | 0.595 | 57% | 0.573 | S | S | * | * | trans | -92.7 | 115.6 | 174 | -65.6 | 0 | 0 | 0 | 0 | 110.8 | E49 D53 Y56 | E49-T51 PolarHBondContact O-N 2.86Å; T51-D53 VanDerWaalsContact C-N 3.3Å; T51-D53 HydrophobicContact CG2-CB 3.62Å; T51-Y56 HydrophobicContact CG2-CE1 4.35Å | ||
| 52 | S | 66.9 | Low | 66.5 | Low | 32 Ų | 32 | 97 Ų | 97 | 22% | 0.224 | 58% | 0.576 | C | S | . | * | trans | -87.1 | -1 | 171.7 | 62.5 | 0 | 0 | 0 | 0 | 113.6 | R39 Y40 L54 | R39-S52 WeakPolarHBondContact CA-OG 3.28Å; Y40-S52 PolarHBondContact N-OG 3.01Å; S52-L54 PolarHBondContact O-N 3.09Å; S52-L54 VanDerWaalsContact O-N 3.1Å | ||
| 53 | D | 66.9 | Low | 67.2 | Low | 37 Ų | 37 | 102.6 Ų | 102.6 | 20% | 0.198 | 61% | 0.61 | C | S | . | * | trans | -76.9 | 92.3 | -178.3 | -176 | 9.6 | 0 | 0 | 0 | 110.9 | T51 N55 Y56 | T51-D53 VanDerWaalsContact C-N 3.3Å; T51-D53 HydrophobicContact CG2-CB 3.62Å; D53-N55 PolarHBondContact O-N 3.33Å; D53-N55 VanDerWaalsContact O-N 3.08Å; D53-N55 WeakPolarHBondContact OD1-CB 3.45Å; D53-N55 PolarHBondContact OD1-N 3.17Å; D53-N55 VanDerWaalsContact OD1-N 3.07Å; D53-N55 PolarHBondContact OD1-ND2 3.44Å; D53-Y56 WeakPolarHBondContact O-CD1 3.26Å; D53-Y56 WeakPolarHBondContact O-CE1 3.23Å | ||
| 54 | L | 66.9 | Low | 68 | Low | 107 Ų | 107 | 97.2 Ų | 97.2 | 56% | 0.56 | 58% | 0.582 | S | S | * | * | G | 310 helix | trans | -70.1 | 0.3 | 177.8 | -65.4 | 168 | 0 | 0 | 0 | 113.8 | S52 Y56 L57 | S52-L54 PolarHBondContact O-N 3.09Å; S52-L54 VanDerWaalsContact O-N 3.1Å; L54-Y56 PolarHBondContact O-N 3.12Å; L54-Y56 VanDerWaalsContact O-N 3.1Å; L54-L57 HydrophobicContact CD2-CD1 3.61Å; L54-L57 WeakPolarHBondContact O-CB 3.39Å; L54-L57 PolarHBondContact O-N 3.18Å |
| 55 | N | 63.9 | Low | 68.4 | Low | 68 Ų | 68 | 100 Ų | 100 | 36% | 0.364 | 59% | 0.591 | S | S | . | * | G | 310 helix | trans | -61.3 | -21 | 179.7 | -72.5 | -52.6 | 0 | 0 | 0 | 113 | D53 L57 R59 | D53-N55 PolarHBondContact O-N 3.33Å; D53-N55 VanDerWaalsContact O-N 3.08Å; D53-N55 WeakPolarHBondContact OD1-CB 3.45Å; D53-N55 PolarHBondContact OD1-N 3.17Å; D53-N55 VanDerWaalsContact OD1-N 3.07Å; D53-N55 PolarHBondContact OD1-ND2 3.44Å; N55-L57 VanDerWaalsContact C-N 3.3Å; N55-L57 PolarHBondContact O-N 3.31Å; N55-R59 WeakPolarHBondContact O-CB 3.46Å; N55-R59 WeakPolarHBondContact O-CG 2.9Å; N55-R59 PolarHBondContact O-N 3.14Å |
| 56 | Y | 61.6 | Low | 69.1 | Low | 145 Ų | 145 | 98.7 Ų | 98.7 | 57% | 0.569 | 58% | 0.583 | S | S | * | * | G | 310 helix | trans | -70.1 | -24.3 | 174.9 | 64.9 | -97.5 | 0 | 0 | 0 | 113.2 | T51 D53 L54 | T51-Y56 HydrophobicContact CG2-CE1 4.35Å; D53-Y56 WeakPolarHBondContact O-CD1 3.26Å; D53-Y56 WeakPolarHBondContact O-CE1 3.23Å; L54-Y56 PolarHBondContact O-N 3.12Å; L54-Y56 VanDerWaalsContact O-N 3.1Å |
| 57 | L | 66.4 | Low | 69.8 | Low | 114 Ų | 114 | 100.2 Ų | 100.2 | 60% | 0.597 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | -34.7 | -179.8 | -68.3 | 177 | 0 | 0 | 0 | 112.5 | L54 N55 | L54-L57 HydrophobicContact CD2-CD1 3.61Å; L54-L57 WeakPolarHBondContact O-CB 3.39Å; L54-L57 PolarHBondContact O-N 3.18Å; N55-L57 VanDerWaalsContact C-N 3.3Å; N55-L57 PolarHBondContact O-N 3.31Å |
| 58 | C | 62.7 | Low | 70.6 | Confident | 115 Ų | 115 | 103.3 Ų | 103.3 | 78% | 0.777 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -114.4 | 15.5 | -171.7 | -62.8 | 0 | 0 | 0 | 0 | 113.6 | P60 | C58-P60 VanDerWaalsContact O-CD 3.29Å; C58-P60 WeakPolarHBondContact O-CD 3.14Å |
| 59 | R | 66 | Low | 71.4 | Confident | 179 Ų | 179 | 101 Ų | 101 | 68% | 0.675 | 59% | 0.593 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 119 | 175.4 | -97.3 | 175 | -158.9 | -99.2 | 3.1 | 110.4 | N55 | N55-R59 WeakPolarHBondContact O-CB 3.46Å; N55-R59 WeakPolarHBondContact O-CG 2.9Å; N55-R59 PolarHBondContact O-N 3.14Å |
| 60 | P | 66.7 | Low | 72.2 | Confident | 101 Ų | 101 | 101.6 Ų | 101.6 | 66% | 0.656 | 59% | 0.593 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 142 | 161.5 | 25.6 | -30.5 | 0 | 0 | 0 | 108.5 | C58 A64 | C58-P60 VanDerWaalsContact O-CD 3.29Å; C58-P60 WeakPolarHBondContact O-CD 3.14Å; P60-A64 HydrophobicContact CB-CB 3.99Å |
| 61 | A | 76.8 | Confident | 73.2 | Confident | 67 Ų | 67 | 103.6 Ų | 103.6 | 55% | 0.554 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 148.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110 | C63 A64 | A61-C63 PolarHBondContact O-N 3.01Å; A61-A64 HydrophobicContact CB-CB 4.29Å; A61-A64 WeakPolarHBondContact O-CB 3.17Å; A61-A64 PolarHBondContact O-N 2.7Å |
| 62 | P | 76 | Confident | 74.1 | Confident | 128 Ų | 128 | 101.7 Ų | 101.7 | 83% | 0.831 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.3 | 128.7 | 170.7 | -24.4 | 33.6 | 0 | 0 | 0 | 109.5 | A64 | P62-A64 VanDerWaalsContact C-N 3.3Å; P62-A64 PolarHBondContact O-N 3.21Å |
| 63 | C | 80.9 | Confident | 74.8 | Confident | 137 Ų | 137 | 102.8 Ų | 102.8 | 93% | 0.926 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 68.3 | 15.3 | -175.6 | -49.7 | 0 | 0 | 0 | 0 | 116.3 | A61 | A61-C63 PolarHBondContact O-N 3.01Š|
| 64 | A | 79.6 | Confident | 75.7 | Confident | 47 Ų | 47 | 108 Ų | 108 | 39% | 0.388 | 61% | 0.614 | S | S | . | * | P | Polyproline II helix | trans | -65.5 | 131.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | P60 A61 P62 | P60-A64 HydrophobicContact CB-CB 3.99Å; A61-A64 HydrophobicContact CB-CB 4.29Å; A61-A64 WeakPolarHBondContact O-CB 3.17Å; A61-A64 PolarHBondContact O-N 2.7Å; P62-A64 VanDerWaalsContact C-N 3.3Å; P62-A64 PolarHBondContact O-N 3.21Å |
| 65 | P | 80.7 | Confident | 76.5 | Confident | 108 Ų | 108 | 106.2 Ų | 106.2 | 70% | 0.701 | 62% | 0.621 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 156.6 | 174.1 | 28.1 | -33.8 | 0 | 0 | 0 | 110.5 | ||
| 66 | P | 81.3 | Confident | 77.6 | Confident | 113 Ų | 113 | 104.1 Ų | 104.1 | 73% | 0.734 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 145.8 | 173.9 | 23.8 | -32.6 | 0 | 0 | 0 | 110.6 | M68 | P66-M68 PolarHBondContact O-N 2.93Š|
| 67 | P | 81.3 | Confident | 78.5 | Confident | 126 Ų | 126 | 103.4 Ų | 103.4 | 82% | 0.818 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 139.3 | -179.6 | 25.7 | -33.9 | 0 | 0 | 0 | 110.2 | ||
| 68 | M | 82.3 | Confident | 79.4 | Confident | 129 Ų | 129 | 99.6 Ų | 99.6 | 64% | 0.635 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 145.9 | 178.8 | -66.9 | -168.7 | -65.7 | 0 | 0 | 111 | P66 C72 | P66-M68 PolarHBondContact O-N 2.93Å; M68-C72 HydrophobicContact CB-CB 4.14Å; M68-C72 HydrophobicContact SD-CB 4.4Å |
| 69 | P | 81.9 | Confident | 80.5 | Confident | 76 Ų | 76 | 101 Ų | 101 | 49% | 0.494 | 60% | 0.604 | S | S | . | * | P | Polyproline II helix | trans | -53.7 | 146.6 | 170 | -25.2 | 34.5 | 0 | 0 | 0 | 111.5 | Q71 C72 | P69-Q71 HydrophobicContact CB-CG 4.06Å; P69-Q71 PolarHBondContact O-N 3.31Å; P69-Q71 VanDerWaalsContact O-N 3.07Å; P69-C72 WeakPolarHBondContact O-CB 3.4Å; P69-C72 PolarHBondContact O-N 3.23Å |
| 70 | K | 83.6 | Confident | 81.2 | Confident | 165 Ų | 165 | 93.8 Ų | 93.8 | 72% | 0.717 | 59% | 0.585 | S | S | * | * | G | 310 helix | trans | -55.3 | -32.3 | -176.5 | -66.3 | -177.8 | 178.3 | -179.7 | 0 | 113.6 | C72 C73 G76 | K70-C72 PolarHBondContact O-N 3.43Å; K70-C73 PolarHBondContact O-N 3.02Å; K70-G76 WeakPolarHBondContact O-CA 3.2Å |
| 71 | Q | 81.5 | Confident | 81.9 | Confident | 85 Ų | 85 | 93.8 Ų | 93.8 | 40% | 0.397 | 58% | 0.577 | S | S | . | * | G | 310 helix | trans | -66.4 | -21.6 | 176.9 | 65.8 | -175.3 | 3.8 | 0 | 0 | 113.8 | P69 V77 G78 W79 | P69-Q71 HydrophobicContact CB-CG 4.06Å; P69-Q71 PolarHBondContact O-N 3.31Å; P69-Q71 VanDerWaalsContact O-N 3.07Å; Q71-V77 PolarHBondContact N-O 3.3Å; Q71-G78 WeakPolarHBondContact CB-O 3.46Å; Q71-W79 WeakPolarHBondContact O-CA 3.12Å |
| 72 | C | 81.8 | Confident | 82.2 | Confident | 57 Ų | 57 | 96.8 Ų | 96.8 | 39% | 0.385 | 58% | 0.58 | S | S | . | * | G | 310 helix | trans | -86.5 | -14.1 | 178.1 | -56.8 | 0 | 0 | 0 | 0 | 112.1 | M68 P69 K70 | M68-C72 HydrophobicContact CB-CB 4.14Å; M68-C72 HydrophobicContact SD-CB 4.4Å; P69-C72 WeakPolarHBondContact O-CB 3.4Å; P69-C72 PolarHBondContact O-N 3.23Å; K70-C72 PolarHBondContact O-N 3.43Å |
| 73 | C | 82.9 | Confident | 82.5 | Confident | 55 Ų | 55 | 97.2 Ų | 97.2 | 37% | 0.372 | 57% | 0.566 | S | S | . | * | S | Bend | trans | -84.4 | 135.5 | 176.4 | -63.3 | 0 | 0 | 0 | 0 | 110.5 | K70 G75 G76 W79 | K70-C73 PolarHBondContact O-N 3.02Å; C73-G75 PolarHBondContact O-N 2.96Å; C73-G76 PolarHBondContact O-N 3.09Å; C73-W79 WeakPolarHBondContact O-CB 2.92Å |
| 74 | I | 83.9 | Confident | 82.4 | Confident | 147 Ų | 147 | 94 Ų | 94 | 75% | 0.754 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.5 | 126.6 | 175.3 | -62.3 | 168.8 | 0 | 0 | 0 | 109.5 | G76 W79 | I74-G76 PolarHBondContact O-N 3.19Å; I74-W79 HydrophobicContact CB-CZ2 4.37Å; I74-W79 HydrophobicContact CG1-CZ2 4.15Å; I74-W79 HydrophobicContact CG2-CH2 4.22Å; I74-W79 HydrophobicContact CG2-CZ2 3.94Å |
| 75 | G | 84.2 | Confident | 82.4 | Confident | 68 Ų | 68 | 97.9 Ų | 97.9 | 70% | 0.701 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.4 | 3.1 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | C73 | C73-G75 PolarHBondContact O-N 2.96Š|
| 76 | G | 86.8 | Confident | 82.5 | Confident | 24 Ų | 24 | 98.9 Ų | 98.9 | 25% | 0.247 | 55% | 0.546 | C | S | . | . | S | Bend | trans | -70.1 | 160.1 | 173 | 0 | 0 | 0 | 0 | 0 | 112.6 | K70 C73 I74 G78 W79 | K70-G76 WeakPolarHBondContact O-CA 3.2Å; C73-G76 PolarHBondContact O-N 3.09Å; I74-G76 PolarHBondContact O-N 3.19Å; G76-G78 PolarHBondContact O-N 3.12Å; G76-W79 WeakPolarHBondContact O-CB 2.81Å; G76-W79 PolarHBondContact O-N 3.05Å |
| 77 | V | 81.9 | Confident | 82.4 | Confident | 130 Ų | 130 | 99.5 Ų | 99.5 | 79% | 0.788 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.5 | 123.7 | 173.6 | -179.2 | 0 | 0 | 0 | 0 | 109.1 | Q71 | Q71-V77 PolarHBondContact N-O 3.3Š|
| 78 | G | 83.6 | Confident | 82.2 | Confident | 35 Ų | 35 | 97.3 Ų | 97.3 | 36% | 0.361 | 52% | 0.524 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 85.3 | 5.9 | -174.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | Q71 G76 G80 M81 | Q71-G78 WeakPolarHBondContact CB-O 3.46Å; G76-G78 PolarHBondContact O-N 3.12Å; G78-G80 PolarHBondContact O-N 3.42Å; G78-M81 WeakPolarHBondContact O-CB 3.29Å; G78-M81 PolarHBondContact O-N 3.1Å; G78-M81 VanDerWaalsContact O-N 3.1Å |
| 79 | W | 86.8 | Confident | 82.1 | Confident | 145 Ų | 145 | 93.6 Ų | 93.6 | 55% | 0.549 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.3 | 131.4 | 175.5 | -176.7 | 62.9 | 0 | 0 | 0 | 111.8 | Q71 C73 I74 G76 M81 | Q71-W79 WeakPolarHBondContact O-CA 3.12Å; C73-W79 WeakPolarHBondContact O-CB 2.92Å; I74-W79 HydrophobicContact CB-CZ2 4.37Å; I74-W79 HydrophobicContact CG1-CZ2 4.15Å; I74-W79 HydrophobicContact CG2-CH2 4.22Å; I74-W79 HydrophobicContact CG2-CZ2 3.94Å; G76-W79 WeakPolarHBondContact O-CB 2.81Å; G76-W79 PolarHBondContact O-N 3.05Å; W79-M81 PolarHBondContact O-N 3.23Å |
| 80 | G | 81.4 | Confident | 82 | Confident | 27 Ų | 27 | 100.3 Ų | 100.3 | 28% | 0.278 | 53% | 0.526 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 76 | 2.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115 | G78 E82 Y83 H84 | G78-G80 PolarHBondContact O-N 3.42Å; G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 2.9Å; G80-Y83 PolarHBondContact O-N 3.19Å; G80-Y83 VanDerWaalsContact O-N 3.09Å; G80-H84 PolarHBondContact O-N 2.91Å |
| 81 | M | 81.7 | Confident | 81.7 | Confident | 100 Ų | 100 | 96 Ų | 96 | 49% | 0.493 | 51% | 0.514 | S | S | . | . | G | 310 helix | trans | -60.9 | -34.1 | 179.4 | -171.3 | 64.6 | -175.7 | 0 | 0 | 111.9 | G78 W79 Y83 H84 | G78-M81 WeakPolarHBondContact O-CB 3.29Å; G78-M81 PolarHBondContact O-N 3.1Å; G78-M81 VanDerWaalsContact O-N 3.1Å; W79-M81 PolarHBondContact O-N 3.23Å; M81-Y83 PolarHBondContact O-N 3.27Å; M81-H84 VanDerWaalsContact CE-CE1 3.41Å; M81-H84 WeakPolarHBondContact CE-CE1 3.39Å; M81-H84 VanDerWaalsContact CE-ND1 3.3Å; M81-H84 WeakPolarHBondContact CE-ND1 3.48Å; M81-H84 VanDerWaalsContact O-CB 3.23Å; M81-H84 WeakPolarHBondContact O-CB 3.21Å; M81-H84 PolarHBondContact O-CD2 3.49Å; M81-H84 PolarHBondContact O-N 3.1Å; M81-H84 VanDerWaalsContact O-N 3.09Å; M81-H84 HydrophobicContact SD-CB 4.15Å |
| 82 | E | 81.6 | Confident | 81.3 | Confident | 130 Ų | 130 | 95.7 Ų | 95.7 | 61% | 0.607 | 52% | 0.515 | S | S | * | . | G | 310 helix | trans | -61 | -28.7 | 177.8 | -63.7 | 180 | 174.8 | 0 | 0 | 112.7 | G80 | G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 2.9Å |
| 83 | Y | 82.1 | Confident | 81.1 | Confident | 138 Ų | 138 | 103.2 Ų | 103.2 | 54% | 0.541 | 54% | 0.535 | S | S | . | . | G | 310 helix | trans | -95 | -0.3 | -179.8 | -49.9 | -76 | 0 | 0 | 0 | 113.1 | G80 M81 Q85 L86 L87 | G80-Y83 PolarHBondContact O-N 3.19Å; G80-Y83 VanDerWaalsContact O-N 3.09Å; M81-Y83 PolarHBondContact O-N 3.27Å; Y83-Q85 VanDerWaalsContact C-N 3.28Å; Y83-Q85 PolarHBondContact O-N 3.3Å; Y83-L86 PolarHBondContact O-N 3.07Å; Y83-L86 VanDerWaalsContact O-N 3.1Å; Y83-L87 WeakPolarHBondContact O-CB 3.49Å; Y83-L87 WeakPolarHBondContact O-CG 3.34Å; Y83-L87 PolarHBondContact O-N 3.08Å |
| 84 | H | 80.2 | Confident | 80.9 | Confident | 68 Ų | 68 | 103.1 Ų | 103.1 | 32% | 0.315 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -55.6 | -39.5 | -173.3 | 74.7 | 142.1 | 0 | 0 | 0 | 113.6 | G80 M81 N88 | G80-H84 PolarHBondContact O-N 2.91Å; M81-H84 VanDerWaalsContact CE-CE1 3.41Å; M81-H84 WeakPolarHBondContact CE-CE1 3.39Å; M81-H84 VanDerWaalsContact CE-ND1 3.3Å; M81-H84 WeakPolarHBondContact CE-ND1 3.48Å; M81-H84 VanDerWaalsContact O-CB 3.23Å; M81-H84 WeakPolarHBondContact O-CB 3.21Å; M81-H84 PolarHBondContact O-CD2 3.49Å; M81-H84 PolarHBondContact O-N 3.1Å; M81-H84 VanDerWaalsContact O-N 3.09Å; M81-H84 HydrophobicContact SD-CB 4.15Å; H84-N88 WeakPolarHBondContact O-CB 3.27Å; H84-N88 PolarHBondContact O-N 2.87Å; H84-N88 PolarHBondContact O-ND2 3.41Å |
| 85 | Q | 77.9 | Confident | 80.3 | Confident | 129 Ų | 129 | 102 Ų | 102 | 60% | 0.603 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -72.1 | -39.6 | -179.9 | -79.9 | 168.4 | 12.8 | 0 | 0 | 111.8 | Y83 S89 | Y83-Q85 VanDerWaalsContact C-N 3.28Å; Y83-Q85 PolarHBondContact O-N 3.3Å; Q85-S89 VanDerWaalsContact O-CA 3.26Å; Q85-S89 WeakPolarHBondContact O-CA 3.22Å; Q85-S89 VanDerWaalsContact O-CB 3.3Å; Q85-S89 WeakPolarHBondContact O-CB 3.19Å; Q85-S89 PolarHBondContact O-N 3.01Å |
| 86 | L | 83 | Confident | 79.8 | Confident | 130 Ų | 130 | 104.2 Ų | 104.2 | 68% | 0.681 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -69.5 | -48.3 | 179.2 | -168.5 | 111.4 | 0 | 0 | 0 | 110.4 | Y83 N88 S89 | Y83-L86 PolarHBondContact O-N 3.07Å; Y83-L86 VanDerWaalsContact O-N 3.1Å; L86-N88 PolarHBondContact O-N 3.19Å; L86-S89 VanDerWaalsContact O-CB 3.3Å; L86-S89 WeakPolarHBondContact O-CB 3.3Å; L86-S89 PolarHBondContact O-N 3.45Å; L86-S89 PolarHBondContact O-OG 3.3Å |
| 87 | L | 80.3 | Confident | 79.2 | Confident | 126 Ų | 126 | 107.4 Ų | 107.4 | 66% | 0.66 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -64.4 | -39.7 | 179.9 | -67.1 | 173.4 | 0 | 0 | 0 | 112.2 | Y83 | Y83-L87 WeakPolarHBondContact O-CB 3.49Å; Y83-L87 WeakPolarHBondContact O-CG 3.34Å; Y83-L87 PolarHBondContact O-N 3.08Å |
| 88 | N | 76.1 | Confident | 78.7 | Confident | 80 Ų | 80 | 108.2 Ų | 108.2 | 43% | 0.428 | 54% | 0.537 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.1 | 3.7 | 178.9 | -65.1 | -62.9 | 0 | 0 | 0 | 113.6 | H84 L86 R90 T91 L92 | H84-N88 WeakPolarHBondContact O-CB 3.27Å; H84-N88 PolarHBondContact O-N 2.87Å; H84-N88 PolarHBondContact O-ND2 3.41Å; L86-N88 PolarHBondContact O-N 3.19Å; N88-R90 PolarHBondContact O-N 3.01Å; N88-R90 VanDerWaalsContact O-N 3.1Å; N88-T91 CarbonylContact O-C 3.55Å; N88-T91 WeakPolarHBondContact O-CA 3.42Å; N88-T91 PolarHBondContact O-N 2.83Å; N88-L92 HydrophobicContact CB-CD1 4.33Å; N88-L92 HydrophobicContact CB-CG 4.11Å; N88-L92 VanDerWaalsContact O-CG 3.3Å; N88-L92 WeakPolarHBondContact O-CG 3.47Å; N88-L92 PolarHBondContact O-N 3.19Å |
| 89 | S | 80 | Confident | 78.1 | Confident | 50 Ų | 50 | 114.4 Ų | 114.4 | 35% | 0.35 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -51.6 | -41.1 | -172.8 | 57.5 | 0 | 0 | 0 | 0 | 113.5 | Q85 L86 L92 R93 | Q85-S89 VanDerWaalsContact O-CA 3.26Å; Q85-S89 WeakPolarHBondContact O-CA 3.22Å; Q85-S89 VanDerWaalsContact O-CB 3.3Å; Q85-S89 WeakPolarHBondContact O-CB 3.19Å; Q85-S89 PolarHBondContact O-N 3.01Å; L86-S89 VanDerWaalsContact O-CB 3.3Å; L86-S89 WeakPolarHBondContact O-CB 3.3Å; L86-S89 PolarHBondContact O-N 3.45Å; L86-S89 PolarHBondContact O-OG 3.3Å; S89-L92 PolarHBondContact O-N 2.97Å; S89-R93 WeakPolarHBondContact O-CB 3.35Å; S89-R93 VanDerWaalsContact O-CG 3.29Å; S89-R93 WeakPolarHBondContact O-CG 3.45Å; S89-R93 PolarHBondContact O-N 3.5Å; S89-R93 VanDerWaalsContact O-N 3.09Å |
| 90 | R | 79.9 | Confident | 77.3 | Confident | 217 Ų | 217 | 112.4 Ų | 112.4 | 82% | 0.819 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66 | -44.3 | 177.2 | -170.8 | 177.7 | -179.7 | -178.4 | -0.2 | 112.3 | N88 R93 S94 | N88-R90 PolarHBondContact O-N 3.01Å; N88-R90 VanDerWaalsContact O-N 3.1Å; R90-R93 PolarHBondContact O-N 3.18Å; R90-S94 WeakPolarHBondContact O-CB 3.49Å; R90-S94 PolarHBondContact O-N 3.1Å; R90-S94 VanDerWaalsContact O-N 3.08Å |
| 91 | T | 77.9 | Confident | 77.1 | Confident | 76 Ų | 76 | 114.2 Ų | 114.2 | 47% | 0.466 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -70.7 | -32.1 | 177.2 | -48.1 | 0 | 0 | 0 | 0 | 111.9 | N88 R93 S94 | N88-T91 CarbonylContact O-C 3.55Å; N88-T91 WeakPolarHBondContact O-CA 3.42Å; N88-T91 PolarHBondContact O-N 2.83Å; T91-R93 VanDerWaalsContact C-N 3.32Å; T91-S94 WeakPolarHBondContact CA-OG 3.48Å; T91-S94 PolarHBondContact O-OG 3.02Å |
| 92 | L | 73.6 | Confident | 77.1 | Confident | 78 Ų | 78 | 117.9 Ų | 117.9 | 41% | 0.408 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -68.1 | -35.3 | 175.7 | -66.6 | 173.3 | 0 | 0 | 0 | 111.5 | N88 S89 Q97 | N88-L92 HydrophobicContact CB-CD1 4.33Å; N88-L92 HydrophobicContact CB-CG 4.11Å; N88-L92 VanDerWaalsContact O-CG 3.3Å; N88-L92 WeakPolarHBondContact O-CG 3.47Å; N88-L92 PolarHBondContact O-N 3.19Å; S89-L92 PolarHBondContact O-N 2.97Å; L92-Q97 VanDerWaalsContact CA-NE2 3.27Å; L92-Q97 PolarHBondContact O-NE2 3.35Å |
| 93 | R | 77 | Confident | 76.9 | Confident | 215 Ų | 215 | 119.5 Ų | 119.5 | 81% | 0.811 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -89 | -11.1 | -179.3 | -68.4 | 177.8 | -179.7 | -166.7 | 0.8 | 114.3 | S89 R90 T91 N95 | S89-R93 WeakPolarHBondContact O-CB 3.35Å; S89-R93 VanDerWaalsContact O-CG 3.29Å; S89-R93 WeakPolarHBondContact O-CG 3.45Å; S89-R93 PolarHBondContact O-N 3.5Å; S89-R93 VanDerWaalsContact O-N 3.09Å; R90-R93 PolarHBondContact O-N 3.18Å; T91-R93 VanDerWaalsContact C-N 3.32Å; R93-N95 PolarHBondContact O-N 3.18Å |
| 94 | S | 78.8 | Confident | 76.7 | Confident | 52 Ų | 52 | 119.5 Ų | 119.5 | 36% | 0.364 | 58% | 0.579 | S | S | . | * | S | Bend | trans | -78.7 | -1.8 | -173.6 | 59 | 0 | 0 | 0 | 0 | 114.3 | R90 T91 V96 | R90-S94 WeakPolarHBondContact O-CB 3.49Å; R90-S94 PolarHBondContact O-N 3.1Å; R90-S94 VanDerWaalsContact O-N 3.08Å; T91-S94 WeakPolarHBondContact CA-OG 3.48Å; T91-S94 PolarHBondContact O-OG 3.02Å; S94-V96 PolarHBondContact O-N 3.44Å; S94-V96 WeakPolarHBondContact OG-CG2 3.37Å |
| 95 | N | 71.6 | Confident | 76.7 | Confident | 125 Ų | 125 | 118.3 Ų | 118.3 | 67% | 0.668 | 58% | 0.578 | S | S | * | * | S | Bend | trans | 55.6 | 9.8 | -176.1 | -84.3 | -46.6 | 0 | 0 | 0 | 115 | R93 Q97 | R93-N95 PolarHBondContact O-N 3.18Å; N95-Q97 VanDerWaalsContact C-N 3.34Å |
| 96 | V | 73.8 | Confident | 76.8 | Confident | 114 Ų | 114 | 115 Ų | 115 | 69% | 0.691 | 57% | 0.573 | S | S | * | * | trans | -94.7 | 8 | 174.2 | -57.1 | 0 | 0 | 0 | 0 | 112.6 | S94 | S94-V96 PolarHBondContact O-N 3.44Å; S94-V96 WeakPolarHBondContact OG-CG2 3.37Å | ||
| 97 | Q | 74.6 | Confident | 76.7 | Confident | 91 Ų | 91 | 113.1 Ų | 113.1 | 43% | 0.425 | 56% | 0.563 | S | S | . | * | S | Bend | trans | -57.4 | 152.4 | 170 | -65.3 | 170.1 | -37 | 0 | 0 | 109.7 | L92 N95 K99 | L92-Q97 VanDerWaalsContact CA-NE2 3.27Å; L92-Q97 PolarHBondContact O-NE2 3.35Å; N95-Q97 VanDerWaalsContact C-N 3.34Å; Q97-K99 VanDerWaalsContact C-N 3.34Å; Q97-K99 PolarHBondContact O-N 3.33Å |
| 98 | I | 71 | Confident | 76.7 | Confident | 146 Ų | 146 | 109.8 Ų | 109.8 | 75% | 0.749 | 54% | 0.544 | S | S | * | . | trans | -56.7 | 100.8 | 172.8 | -61.2 | 172.1 | 0 | 0 | 0 | 107.7 | R100 | I98-R100 PolarHBondContact O-N 2.73Å; I98-R100 VanDerWaalsContact O-N 3.13Å | ||
| 99 | K | 71.1 | Confident | 76.8 | Confident | 166 Ų | 166 | 109.4 Ų | 109.4 | 72% | 0.722 | 54% | 0.542 | S | S | * | . | trans | -66.2 | 115.1 | 173.8 | -66.7 | -175.5 | -179.6 | 179.9 | 0 | 106.2 | Q97 A101 | Q97-K99 VanDerWaalsContact C-N 3.34Å; Q97-K99 PolarHBondContact O-N 3.33Å; K99-A101 PolarHBondContact O-N 2.96Å | ||
| 100 | R | 69.8 | Low | 76.8 | Confident | 102 Ų | 102 | 115.5 Ų | 115.5 | 39% | 0.385 | 56% | 0.557 | S | S | . | * | trans | -66.1 | 106.3 | 173.9 | -68.4 | 174.4 | 63.5 | -153.7 | -23 | 106.1 | I98 R104 S105 E108 | I98-R100 PolarHBondContact O-N 2.73Å; I98-R100 VanDerWaalsContact O-N 3.13Å; R100-R104 PolarHBondContact NH2-O 2.59Å; R100-S105 PolarHBondContact NH2-O 3.47Å; R100-E108 IonicContact CZ-OE1 3.55Å; R100-E108 IonicContact CZ-OE2 2.75Å; R100-E108 VanDerWaalsContact NE-CD 3.32Å; R100-E108 IonicContact NE-OE1 3.2Å; R100-E108 PolarHBondContact NE-OE1 3.41Å; R100-E108 IonicContact NE-OE2 3.18Å; R100-E108 PolarHBondContact NE-OE2 2.96Å; R100-E108 IonicContact NH1-OE2 3.05Å; R100-E108 PolarHBondContact NH1-OE2 2.86Å; R100-E108 IonicContact NH2-OE1 3.66Å; R100-E108 IonicContact NH2-OE2 2.94Å; R100-E108 PolarHBondContact NH2-OE2 3.23Å | ||
| 101 | A | 77.6 | Confident | 76.4 | Confident | 66 Ų | 66 | 108 Ų | 108 | 55% | 0.545 | 54% | 0.535 | S | S | . | . | trans | -57 | 156.1 | 173 | 0 | 0 | 0 | 0 | 0 | 109.7 | K99 F103 R104 S105 | K99-A101 PolarHBondContact O-N 2.96Å; A101-F103 PolarHBondContact O-N 2.92Å; A101-R104 PolarHBondContact O-N 3.45Å; A101-S105 PolarHBondContact O-N 2.71Å | ||
| 102 | E | 81.8 | Confident | 76 | Confident | 177 Ų | 177 | 107.9 Ų | 107.9 | 83% | 0.827 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -47.8 | -41.7 | -173.3 | -62.6 | -177.7 | 162.9 | 0 | 0 | 112.7 | S105 A106 | E102-S105 PolarHBondContact O-N 3.32Å; E102-A106 VanDerWaalsContact O-CB 3.31Å; E102-A106 WeakPolarHBondContact O-CB 3.31Å; E102-A106 PolarHBondContact O-N 3.35Å |
| 103 | F | 77.4 | Confident | 75.7 | Confident | 164 Ų | 164 | 110.2 Ų | 110.2 | 72% | 0.719 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.1 | -47.2 | 179.1 | -173.4 | -97.8 | 0 | 0 | 0 | 113.3 | A101 S105 L107 | A101-F103 PolarHBondContact O-N 2.92Å; F103-S105 VanDerWaalsContact C-N 3.35Å; F103-L107 HydrophobicContact CE1-CD1 4.2Å; F103-L107 HydrophobicContact CZ-CD1 4.27Å; F103-L107 VanDerWaalsContact O-CB 3.24Å; F103-L107 WeakPolarHBondContact O-CB 3.35Å; F103-L107 PolarHBondContact O-N 2.87Å |
| 104 | R | 76.6 | Confident | 75.1 | Confident | 138 Ų | 138 | 106.5 Ų | 106.5 | 52% | 0.521 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -72.6 | -31.5 | 178.3 | -176.2 | 174.9 | 168 | 167.8 | -1.5 | 111.1 | R100 A101 E108 | R100-R104 PolarHBondContact NH2-O 2.59Å; A101-R104 PolarHBondContact O-N 3.45Å; R104-E108 HydrophobicContact CG-CG 4.44Å; R104-E108 VanDerWaalsContact CG-OE1 3.24Å; R104-E108 WeakPolarHBondContact CG-OE1 3.3Å; R104-E108 IonicContact CZ-OE1 3.54Å; R104-E108 IonicContact NE-OE1 2.75Å; R104-E108 PolarHBondContact NE-OE1 3.16Å; R104-E108 IonicContact NH2-OE1 3.44Å; R104-E108 PolarHBondContact NH2-OE1 3.35Å; R104-E108 WeakPolarHBondContact O-CG 3.24Å; R104-E108 PolarHBondContact O-N 3.32Å; R104-E108 VanDerWaalsContact O-N 3.16Å |
| 105 | S | 80.6 | Confident | 74.2 | Confident | 43 Ų | 43 | 112.2 Ų | 112.2 | 30% | 0.301 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.5 | -55.7 | 172.7 | -154.8 | 0 | 0 | 0 | 0 | 110.8 | R100 A101 E102 F103 L107 E108 D109 | R100-S105 PolarHBondContact NH2-O 3.47Å; A101-S105 PolarHBondContact O-N 2.71Å; E102-S105 PolarHBondContact O-N 3.32Å; F103-S105 VanDerWaalsContact C-N 3.35Å; S105-L107 VanDerWaalsContact C-N 3.32Å; S105-L107 PolarHBondContact O-N 3.07Å; S105-E108 PolarHBondContact O-N 3.07Å; S105-D109 WeakPolarHBondContact O-CB 3.23Å; S105-D109 PolarHBondContact O-N 3.48Å |
| 106 | A | 80.3 | Confident | 73.7 | Confident | 59 Ų | 59 | 112.6 Ų | 112.6 | 49% | 0.488 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -61.9 | -37.2 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E102 R110 | E102-A106 VanDerWaalsContact O-CB 3.31Å; E102-A106 WeakPolarHBondContact O-CB 3.31Å; E102-A106 PolarHBondContact O-N 3.35Å; A106-R110 VanDerWaalsContact O-CB 3.22Å; A106-R110 WeakPolarHBondContact O-CB 3.15Å; A106-R110 PolarHBondContact O-N 2.94Å |
| 107 | L | 80.9 | Confident | 73.1 | Confident | 91 Ų | 91 | 113.6 Ų | 113.6 | 48% | 0.476 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -70.4 | -46.6 | -179.8 | -170 | 136.7 | 0 | 0 | 0 | 112.1 | F103 S105 R110 V111 | F103-L107 HydrophobicContact CE1-CD1 4.2Å; F103-L107 HydrophobicContact CZ-CD1 4.27Å; F103-L107 VanDerWaalsContact O-CB 3.24Å; F103-L107 WeakPolarHBondContact O-CB 3.35Å; F103-L107 PolarHBondContact O-N 2.87Å; S105-L107 VanDerWaalsContact C-N 3.32Å; S105-L107 PolarHBondContact O-N 3.07Å; L107-R110 PolarHBondContact O-N 3.23Å; L107-V111 VanDerWaalsContact O-CG2 3.3Å; L107-V111 WeakPolarHBondContact O-CG2 3.48Å; L107-V111 PolarHBondContact O-N 3.03Å |
| 108 | E | 79.5 | Confident | 72.6 | Confident | 55 Ų | 55 | 111.8 Ų | 111.8 | 26% | 0.257 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -69.2 | -38.5 | 175.7 | -50.2 | 170.8 | -156.5 | 0 | 0 | 110.1 | R100 R104 S105 R110 V111 T112 | R100-E108 IonicContact CZ-OE1 3.55Å; R100-E108 IonicContact CZ-OE2 2.75Å; R100-E108 VanDerWaalsContact NE-CD 3.32Å; R100-E108 IonicContact NE-OE1 3.2Å; R100-E108 PolarHBondContact NE-OE1 3.41Å; R100-E108 IonicContact NE-OE2 3.18Å; R100-E108 PolarHBondContact NE-OE2 2.96Å; R100-E108 IonicContact NH1-OE2 3.05Å; R100-E108 PolarHBondContact NH1-OE2 2.86Å; R100-E108 IonicContact NH2-OE1 3.66Å; R100-E108 IonicContact NH2-OE2 2.94Å; R100-E108 PolarHBondContact NH2-OE2 3.23Å; R104-E108 HydrophobicContact CG-CG 4.44Å; R104-E108 VanDerWaalsContact CG-OE1 3.24Å; R104-E108 WeakPolarHBondContact CG-OE1 3.3Å; R104-E108 IonicContact CZ-OE1 3.54Å; R104-E108 IonicContact NE-OE1 2.75Å; R104-E108 PolarHBondContact NE-OE1 3.16Å; R104-E108 IonicContact NH2-OE1 3.44Å; R104-E108 PolarHBondContact NH2-OE1 3.35Å; R104-E108 WeakPolarHBondContact O-CG 3.24Å; R104-E108 PolarHBondContact O-N 3.32Å; R104-E108 VanDerWaalsContact O-N 3.16Å; S105-E108 PolarHBondContact O-N 3.07Å; E108-R110 VanDerWaalsContact C-N 3.29Å; E108-R110 PolarHBondContact O-N 3.05Å; E108-V111 CarbonylContact O-C 3.54Å; E108-V111 WeakPolarHBondContact O-CA 3.15Å; E108-V111 PolarHBondContact O-N 3.18Å; E108-T112 WeakPolarHBondContact O-CB 3.41Å; E108-T112 PolarHBondContact O-N 3.39Å; E108-T112 PolarHBondContact O-OG1 2.91Å |
| 109 | D | 79.4 | Confident | 72 | Confident | 73 Ų | 73 | 114.9 Ų | 114.9 | 39% | 0.39 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -56.2 | -46.2 | 173.8 | -77.3 | -5.1 | 0 | 0 | 0 | 110.7 | S105 V111 T112 H113 | S105-D109 WeakPolarHBondContact O-CB 3.23Å; S105-D109 PolarHBondContact O-N 3.48Å; D109-V111 PolarHBondContact O-N 3.24Å; D109-T112 PolarHBondContact O-N 3.17Å; D109-H113 WeakPolarHBondContact O-CB 3.3Å; D109-H113 VanDerWaalsContact O-CG 3.23Å; D109-H113 PolarHBondContact O-N 3.32Å; D109-H113 PolarHBondContact O-ND1 3.36Å |
| 110 | R | 78.9 | Confident | 71.6 | Confident | 177 Ų | 177 | 112.3 Ų | 112.3 | 67% | 0.668 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -60.9 | -28.7 | 175.3 | -176.2 | -178.7 | 170.3 | 179.1 | -1 | 113.5 | A106 L107 E108 R114 | A106-R110 VanDerWaalsContact O-CB 3.22Å; A106-R110 WeakPolarHBondContact O-CB 3.15Å; A106-R110 PolarHBondContact O-N 2.94Å; L107-R110 PolarHBondContact O-N 3.23Å; E108-R110 VanDerWaalsContact C-N 3.29Å; E108-R110 PolarHBondContact O-N 3.05Å; R110-R114 PolarHBondContact O-NE 2.95Å |
| 111 | V | 72.9 | Confident | 71.4 | Confident | 59 Ų | 59 | 108.6 Ų | 108.6 | 36% | 0.358 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -86.8 | -44.9 | 179.3 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | L107 E108 D109 H113 R114 Y115 | L107-V111 VanDerWaalsContact O-CG2 3.3Å; L107-V111 WeakPolarHBondContact O-CG2 3.48Å; L107-V111 PolarHBondContact O-N 3.03Å; E108-V111 CarbonylContact O-C 3.54Å; E108-V111 WeakPolarHBondContact O-CA 3.15Å; E108-V111 PolarHBondContact O-N 3.18Å; D109-V111 PolarHBondContact O-N 3.24Å; V111-H113 PolarHBondContact O-N 3.1Å; V111-R114 WeakPolarHBondContact O-CA 3.29Å; V111-R114 WeakPolarHBondContact O-CB 3.26Å; V111-R114 PolarHBondContact O-N 2.95Å; V111-Y115 HydrophobicContact CG1-CD2 4.26Å; V111-Y115 HydrophobicContact CG1-CE2 4.37Å; V111-Y115 WeakPolarHBondContact O-CD2 3.21Å; V111-Y115 PolarHBondContact O-N 3.28Å |
| 112 | T | 68.3 | Low | 71 | Confident | 75 Ų | 75 | 108 Ų | 108 | 46% | 0.46 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.5 | -47.8 | 178.6 | -27.9 | 0 | 0 | 0 | 0 | 110.1 | E108 D109 R114 Y115 Q116 | E108-T112 WeakPolarHBondContact O-CB 3.41Å; E108-T112 PolarHBondContact O-N 3.39Å; E108-T112 PolarHBondContact O-OG1 2.91Å; D109-T112 PolarHBondContact O-N 3.17Å; T112-R114 PolarHBondContact O-N 3.27Å; T112-Y115 PolarHBondContact O-N 3.19Å; T112-Q116 VanDerWaalsContact O-CG 3.27Å; T112-Q116 WeakPolarHBondContact O-CG 3.24Å; T112-Q116 PolarHBondContact O-N 3.09Å |
| 113 | H | 67.3 | Low | 70.2 | Confident | 127 Ų | 127 | 103.8 Ų | 103.8 | 59% | 0.588 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.4 | -19.7 | 175.6 | -64.6 | 121.7 | 0 | 0 | 0 | 113.5 | D109 V111 | D109-H113 WeakPolarHBondContact O-CB 3.3Å; D109-H113 VanDerWaalsContact O-CG 3.23Å; D109-H113 PolarHBondContact O-N 3.32Å; D109-H113 PolarHBondContact O-ND1 3.36Å; V111-H113 PolarHBondContact O-N 3.1Å |
| 114 | R | 64.3 | Low | 69.8 | Low | 137 Ų | 137 | 100.8 Ų | 100.8 | 52% | 0.517 | 49% | 0.49 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.5 | -26.2 | 178 | -129.7 | -175 | -67.4 | 178.4 | 0.6 | 112.9 | R110 V111 T112 | R110-R114 PolarHBondContact O-NE 2.95Å; V111-R114 WeakPolarHBondContact O-CA 3.29Å; V111-R114 WeakPolarHBondContact O-CB 3.26Å; V111-R114 PolarHBondContact O-N 2.95Å; T112-R114 PolarHBondContact O-N 3.27Å |
| 115 | Y | 60.4 | Low | 69.3 | Low | 172 Ų | 172 | 100 Ų | 100 | 68% | 0.675 | 49% | 0.49 | S | S | * | . | S | Bend | trans | -127.3 | 20.7 | -172.2 | -60.7 | -70.6 | 0 | 0 | 0 | 113 | V111 T112 N117 | V111-Y115 HydrophobicContact CG1-CD2 4.26Å; V111-Y115 HydrophobicContact CG1-CE2 4.37Å; V111-Y115 WeakPolarHBondContact O-CD2 3.21Å; V111-Y115 PolarHBondContact O-N 3.28Å; T112-Y115 PolarHBondContact O-N 3.19Å; Y115-N117 PolarHBondContact O-N 2.75Å; Y115-N117 VanDerWaalsContact O-N 3.1Å |
| 116 | Q | 62 | Low | 68.3 | Low | 133 Ų | 133 | 99.4 Ų | 99.4 | 62% | 0.621 | 48% | 0.484 | S | S | * | . | trans | -67.5 | 114.5 | 171 | -72.3 | -162.6 | -22.6 | 0 | 0 | 109 | T112 | T112-Q116 VanDerWaalsContact O-CG 3.27Å; T112-Q116 WeakPolarHBondContact O-CG 3.24Å; T112-Q116 PolarHBondContact O-N 3.09Å | ||
| 117 | N | 60.8 | Low | 67.6 | Low | 135 Ų | 135 | 101.3 Ų | 101.3 | 72% | 0.722 | 49% | 0.486 | S | S | * | . | P | Polyproline II helix | trans | -55.9 | 133.8 | 164 | -66.9 | -16.8 | 0 | 0 | 0 | 107.3 | Y115 | Y115-N117 PolarHBondContact O-N 2.75Å; Y115-N117 VanDerWaalsContact O-N 3.1Å |
| 118 | P | 64.3 | Low | 67.2 | Low | 53 Ų | 53 | 105.3 Ų | 105.3 | 34% | 0.344 | 50% | 0.499 | S | S | . | . | P | Polyproline II helix | trans | -53.9 | 148.2 | 175.4 | 30.5 | -40.8 | 0 | 0 | 0 | 108.9 | H120 H141 | P118-H120 PolarHBondContact O-CD2 3.19Å; P118-H120 PolarHBondContact O-N 3.41Å; P118-H120 VanDerWaalsContact O-N 3.12Å; P118-H120 PolarHBondContact O-NE2 3.09Å; P118-H141 WeakPolarHBondContact CD-NE2 3.5Å; P118-H141 VanDerWaalsContact CG-CE1 3.4Å; P118-H141 WeakPolarHBondContact CG-CE1 3.45Å; P118-H141 WeakPolarHBondContact CG-NE2 3.35Å |
| 119 | W | 58.2 | Low | 66.5 | Low | 210 Ų | 210 | 108.2 Ų | 108.2 | 80% | 0.795 | 51% | 0.513 | S | S | * | . | P | Polyproline II helix | trans | -55.2 | 124.3 | 175.6 | -178.3 | 90.8 | 0 | 0 | 0 | 109.9 | A121 | W119-A121 VanDerWaalsContact CH2-CA 3.5Å; W119-A121 HydrophobicContact CH2-CB 3.75Å; W119-A121 HydrophobicContact CZ3-CB 3.73Å |
| 120 | H | 61.4 | Low | 65.8 | Low | 112 Ų | 112 | 109.2 Ų | 109.2 | 52% | 0.519 | 53% | 0.526 | S | S | . | . | trans | -104.2 | 131.5 | 174.3 | -66 | -77.5 | 0 | 0 | 0 | 109.1 | P118 | P118-H120 PolarHBondContact O-CD2 3.19Å; P118-H120 PolarHBondContact O-N 3.41Å; P118-H120 VanDerWaalsContact O-N 3.12Å; P118-H120 PolarHBondContact O-NE2 3.09Å | ||
| 121 | A | 67 | Low | 64.8 | Low | 25 Ų | 25 | 108.3 Ų | 108.3 | 21% | 0.207 | 54% | 0.54 | C | S | . | . | trans | -61.3 | 140.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | W119 F125 | W119-A121 VanDerWaalsContact CH2-CA 3.5Å; W119-A121 HydrophobicContact CH2-CB 3.75Å; W119-A121 HydrophobicContact CZ3-CB 3.73Å; A121-F125 HydrophobicContact CB-CB 4.16Å | ||
| 122 | P | 68.2 | Low | 64.2 | Low | 52 Ų | 52 | 107.3 Ų | 107.3 | 34% | 0.338 | 54% | 0.542 | S | S | . | . | trans | -53.5 | 145.7 | 173.6 | -25.3 | 33.1 | 0 | 0 | 0 | 111.3 | H124 F125 | P122-H124 PolarHBondContact O-N 3.3Å; P122-F125 HydrophobicContact CB-CD2 4.17Å; P122-F125 HydrophobicContact CG-CD2 4.15Å; P122-F125 HydrophobicContact CG-CE2 4.42Å; P122-F125 WeakPolarHBondContact O-CB 3.3Å; P122-F125 PolarHBondContact O-N 3.32Å | ||
| 123 | P | 65.6 | Low | 63.8 | Low | 89 Ų | 89 | 104.4 Ų | 104.4 | 58% | 0.578 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -52.5 | -36.9 | -170.8 | -27.1 | 32.9 | 0 | 0 | 0 | 114.2 | F125 L126 D127 | P123-F125 PolarHBondContact O-N 3.02Å; P123-L126 WeakPolarHBondContact O-CB 3.34Å; P123-L126 PolarHBondContact O-N 2.93Å; P123-D127 PolarHBondContact O-N 2.94Å |
| 124 | H | 68.8 | Low | 63.3 | Low | 102 Ų | 102 | 105.5 Ų | 105.5 | 47% | 0.472 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.5 | -18.1 | -178.8 | 76.5 | -92.9 | 0 | 0 | 0 | 114.5 | P122 | P122-H124 PolarHBondContact O-N 3.3Å |
| 125 | F | 66.3 | Low | 62.9 | Low | 120 Ų | 120 | 103.5 Ų | 103.5 | 53% | 0.526 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -77.6 | -34.8 | 171.3 | -83.7 | -88.9 | 0 | 0 | 0 | 111.6 | A121 P122 P123 D127 K128 | A121-F125 HydrophobicContact CB-CB 4.16Å; P122-F125 HydrophobicContact CB-CD2 4.17Å; P122-F125 HydrophobicContact CG-CD2 4.15Å; P122-F125 HydrophobicContact CG-CE2 4.42Å; P122-F125 WeakPolarHBondContact O-CB 3.3Å; P122-F125 PolarHBondContact O-N 3.32Å; P123-F125 PolarHBondContact O-N 3.02Å; F125-D127 VanDerWaalsContact C-N 3.32Å; F125-K128 PolarHBondContact O-N 3.32Å |
| 126 | L | 60.5 | Low | 62.7 | Low | 31 Ų | 31 | 103 Ų | 103 | 16% | 0.162 | 53% | 0.532 | C | S | . | . | H | α-helix | trans | -74.8 | -25.3 | 179.5 | -61.5 | 172.7 | 0 | 0 | 0 | 112.1 | P123 K128 Q129 R134 L137 | P123-L126 WeakPolarHBondContact O-CB 3.34Å; P123-L126 PolarHBondContact O-N 2.93Å; L126-K128 VanDerWaalsContact C-N 3.26Å; L126-K128 PolarHBondContact O-N 2.75Å; L126-Q129 WeakPolarHBondContact O-CB 3.44Å; L126-Q129 PolarHBondContact O-N 3.44Å; L126-R134 HydrophobicContact CB-CG 4.22Å; L126-R134 HydrophobicContact CD1-CG 4.48Å; L126-L137 HydrophobicContact CD1-CD1 4.21Å; L126-L137 HydrophobicContact CD2-CD1 3.59Å |
| 127 | D | 65.6 | Low | 62.4 | Low | 100 Ų | 100 | 100.7 Ų | 100.7 | 54% | 0.535 | 52% | 0.524 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -21.3 | 176.8 | -62.9 | -21.5 | 0 | 0 | 0 | 113 | P123 F125 Q129 R134 | P123-D127 PolarHBondContact O-N 2.94Å; F125-D127 VanDerWaalsContact C-N 3.32Å; D127-Q129 VanDerWaalsContact C-N 3.31Å; D127-R134 IonicContact OD1-CZ 3.38Å; D127-R134 IonicContact OD1-NE 3.47Å; D127-R134 PolarHBondContact OD1-NE 2.96Å; D127-R134 IonicContact OD1-NH2 2.63Å; D127-R134 PolarHBondContact OD1-NH2 3.28Å; D127-R134 IonicContact OD2-NH2 3.77Å |
| 128 | K | 72.3 | Confident | 62 | Low | 174 Ų | 174 | 97.1 Ų | 97.1 | 76% | 0.757 | 51% | 0.513 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.6 | -4.5 | 174.6 | -61.4 | -178.5 | -176.5 | -177 | 0 | 112.8 | F125 L126 | F125-K128 PolarHBondContact O-N 3.32Å; L126-K128 VanDerWaalsContact C-N 3.26Å; L126-K128 PolarHBondContact O-N 2.75Å |
| 129 | Q | 64.4 | Low | 61.2 | Low | 116 Ų | 116 | 104.9 Ų | 104.9 | 54% | 0.542 | 54% | 0.535 | S | S | . | . | S | Bend | trans | -99.8 | 156.5 | -173.9 | -148 | 170.9 | 18.6 | 0 | 0 | 110.7 | L126 D127 A133 | L126-Q129 WeakPolarHBondContact O-CB 3.44Å; L126-Q129 PolarHBondContact O-N 3.44Å; D127-Q129 VanDerWaalsContact C-N 3.31Å; Q129-A133 HydrophobicContact CB-CB 3.66Å; Q129-A133 HydrophobicContact CG-CB 3.76Å |
| 130 | S | 63.7 | Low | 60.7 | Low | 94 Ų | 94 | 100.4 Ų | 100.4 | 66% | 0.657 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -55.6 | 147.4 | -175.3 | 60.6 | 0 | 0 | 0 | 0 | 112.8 | G132 A133 | S130-G132 PolarHBondContact O-N 3.2Å; S130-G132 VanDerWaalsContact O-N 3.09Å; S130-A133 WeakPolarHBondContact O-CB 3.3Å; S130-A133 PolarHBondContact O-N 2.9Å |
| 131 | V | 58.8 | Low | 60.1 | Low | 158 Ų | 158 | 99.9 Ų | 99.9 | 96% | 0.958 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -46 | 116.7 | 175.7 | -178.2 | 0 | 0 | 0 | 0 | 110.2 | ||
| 132 | G | 59.7 | Low | 58.9 | Low | 39 Ų | 39 | 107.1 Ų | 107.1 | 40% | 0.402 | 56% | 0.556 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 105.4 | 0 | -176.1 | 0 | 0 | 0 | 0 | 0 | 116 | S130 R134 S135 | S130-G132 PolarHBondContact O-N 3.2Å; S130-G132 VanDerWaalsContact O-N 3.09Å; G132-R134 VanDerWaalsContact C-N 3.31Å; G132-R134 PolarHBondContact O-N 3.13Å; G132-S135 PolarHBondContact O-N 3.37Å; G132-S135 PolarHBondContact O-OG 3Å |
| 133 | A | 60 | Low | 57.7 | Low | 13 Ų | 13 | 114.4 Ų | 114.4 | 11% | 0.107 | 58% | 0.578 | C | S | . | * | H | α-helix | trans | -61.6 | -38.7 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113 | Q129 S130 S135 K136 | Q129-A133 HydrophobicContact CB-CB 3.66Å; Q129-A133 HydrophobicContact CG-CB 3.76Å; S130-A133 WeakPolarHBondContact O-CB 3.3Å; S130-A133 PolarHBondContact O-N 2.9Å; A133-S135 VanDerWaalsContact C-N 3.31Å; A133-S135 PolarHBondContact O-N 3.49Å; A133-K136 PolarHBondContact O-N 3.1Å |
| 134 | R | 56.9 | Low | 56.7 | Low | 151 Ų | 151 | 114.7 Ų | 114.7 | 57% | 0.57 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -63.4 | -32.9 | 177.7 | -70.1 | -177 | 171.9 | -157.1 | -2.2 | 113.2 | L126 D127 G132 | L126-R134 HydrophobicContact CB-CG 4.22Å; L126-R134 HydrophobicContact CD1-CG 4.48Å; D127-R134 IonicContact OD1-CZ 3.38Å; D127-R134 IonicContact OD1-NE 3.47Å; D127-R134 PolarHBondContact OD1-NE 2.96Å; D127-R134 IonicContact OD1-NH2 2.63Å; D127-R134 PolarHBondContact OD1-NH2 3.28Å; D127-R134 IonicContact OD2-NH2 3.77Å; G132-R134 VanDerWaalsContact C-N 3.31Å; G132-R134 PolarHBondContact O-N 3.13Å |
| 135 | S | 55.5 | Low | 55.3 | Low | 94 Ų | 94 | 115.1 Ų | 115.1 | 66% | 0.657 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -79.1 | -19.2 | -176.8 | 58.5 | 0 | 0 | 0 | 0 | 113.7 | G132 A133 | G132-S135 PolarHBondContact O-N 3.37Å; G132-S135 PolarHBondContact O-OG 3Å; A133-S135 VanDerWaalsContact C-N 3.31Å; A133-S135 PolarHBondContact O-N 3.49Å |
| 136 | K | 56.4 | Low | 54.3 | Low | 163 Ų | 163 | 120.9 Ų | 120.9 | 71% | 0.709 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -80.8 | -23.5 | 179.2 | -85.8 | 177.2 | 175.6 | 174.4 | 0 | 114.7 | A133 T140 | A133-K136 PolarHBondContact O-N 3.1Å; K136-T140 PolarHBondContact O-OG1 2.76Å |
| 137 | L | 55.7 | Low | 53.3 | Low | 84 Ų | 84 | 126.5 Ų | 126.5 | 44% | 0.44 | 64% | 0.636 | S | S | . | * | S | Bend | trans | -87 | -17.6 | -175.3 | -68.1 | 173.8 | 0 | 0 | 0 | 113.9 | L126 W139 | L126-L137 HydrophobicContact CD1-CD1 4.21Å; L126-L137 HydrophobicContact CD2-CD1 3.59Å; L137-W139 VanDerWaalsContact C-N 3.32Å; L137-W139 PolarHBondContact O-N 2.91Å |
| 138 | A | 52.8 | Low | 52.2 | Low | 60 Ų | 60 | 129.5 Ų | 129.5 | 50% | 0.496 | 65% | 0.647 | S | S | . | * | S | Bend | trans | -70.9 | -23.4 | -167.4 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 139 | W | 46.9 | Very low | 50.6 | Low | 216 Ų | 216 | 126.8 Ų | 126.8 | 82% | 0.818 | 64% | 0.641 | S | S | * | * | S | Bend | trans | -150.1 | 16.8 | -167 | -62.2 | 102.7 | 0 | 0 | 0 | 116.9 | L20 L137 H141 | L20-W139 HydrophobicContact CD1-CH2 4.49Å; L20-W139 HydrophobicContact CD1-CZ3 4.38Å; L137-W139 VanDerWaalsContact C-N 3.32Å; L137-W139 PolarHBondContact O-N 2.91Å; W139-H141 PolarHBondContact O-N 2.97Å; W139-H141 VanDerWaalsContact O-N 3.15Å |
| 140 | T | 49.1 | Very low | 49.5 | Very low | 115 Ų | 115 | 128.2 Ų | 128.2 | 71% | 0.706 | 65% | 0.652 | S | S | * | * | trans | -88 | 43.6 | 177 | 42.7 | 0 | 0 | 0 | 0 | 112.8 | K136 K142 | K136-T140 PolarHBondContact O-OG1 2.76Å; T140-K142 PolarHBondContact O-N 2.77Å | ||
| 141 | H | 48 | Very low | 48.6 | Very low | 102 Ų | 102 | 129.7 Ų | 129.7 | 47% | 0.472 | 65% | 0.653 | S | S | . | * | trans | -92.2 | 94.5 | 164.2 | -81.7 | -44.4 | 0 | 0 | 0 | 110 | P118 W139 Y143 | P118-H141 WeakPolarHBondContact CD-NE2 3.5Å; P118-H141 VanDerWaalsContact CG-CE1 3.4Å; P118-H141 WeakPolarHBondContact CG-CE1 3.45Å; P118-H141 WeakPolarHBondContact CG-NE2 3.35Å; W139-H141 PolarHBondContact O-N 2.97Å; W139-H141 VanDerWaalsContact O-N 3.15Å; H141-Y143 HydrophobicContact CB-CD2 4.17Å; H141-Y143 HydrophobicContact CB-CE2 3.74Å; H141-Y143 PolarHBondContact O-N 2.87Å; H141-Y143 VanDerWaalsContact O-N 3.09Å | ||
| 142 | K | 42.5 | Very low | 47.9 | Very low | 177 Ų | 177 | 130.9 Ų | 130.9 | 77% | 0.77 | 65% | 0.645 | S | S | * | * | trans | -71.8 | 95.3 | 165.3 | -135.6 | -170.5 | -174.8 | -127.2 | 0 | 107.6 | T140 D144 | T140-K142 PolarHBondContact O-N 2.77Å; K142-D144 WeakPolarHBondContact CD-OD2 3.44Å; K142-D144 VanDerWaalsContact CE-OD2 3.22Å; K142-D144 WeakPolarHBondContact CE-OD2 3Å; K142-D144 IonicContact NZ-OD2 2.71Å; K142-D144 PolarHBondContact NZ-OD2 3.3Å; K142-D144 PolarHBondContact O-N 3.08Å | ||
| 143 | Y | 42.8 | Very low | 47.3 | Very low | 205 Ų | 205 | 136.7 Ų | 136.7 | 80% | 0.804 | 66% | 0.662 | S | S | * | * | trans | -76.8 | 56.9 | 170 | -66.7 | -82 | 0 | 0 | 0 | 110.4 | H141 | H141-Y143 HydrophobicContact CB-CD2 4.17Å; H141-Y143 HydrophobicContact CB-CE2 3.74Å; H141-Y143 PolarHBondContact O-N 2.87Å; H141-Y143 VanDerWaalsContact O-N 3.09Å | ||
| 144 | D | 43.3 | Very low | 46.2 | Very low | 95 Ų | 95 | 146.5 Ų | 146.5 | 51% | 0.508 | 70% | 0.702 | S | S | . | * | trans | -90.7 | 129.9 | 166.9 | -71.2 | -27 | 0 | 0 | 0 | 107.6 | K142 | K142-D144 WeakPolarHBondContact CD-OD2 3.44Å; K142-D144 VanDerWaalsContact CE-OD2 3.22Å; K142-D144 WeakPolarHBondContact CE-OD2 3Å; K142-D144 IonicContact NZ-OD2 2.71Å; K142-D144 PolarHBondContact NZ-OD2 3.3Å; K142-D144 PolarHBondContact O-N 3.08Å | ||
| 145 | C | 40.7 | Very low | 45.6 | Very low | 111 Ų | 111 | 145.6 Ų | 145.6 | 75% | 0.75 | 71% | 0.708 | S | S | * | * | trans | 84.9 | 71.5 | 163.6 | -45 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 146 | Y | 43.7 | Very low | 45.2 | Very low | 240 Ų | 240 | 149.1 Ų | 149.1 | 94% | 0.941 | 72% | 0.719 | S | S | * | * | trans | -139.3 | 40.3 | 147 | -71.2 | -72 | 0 | 0 | 0 | 112.7 | ||||
| 147 | I | 39.9 | Very low | 44.1 | Very low | 149 Ų | 149 | 148.6 Ų | 148.6 | 76% | 0.764 | 72% | 0.724 | S | S | * | * | trans | -103.5 | 79.6 | 154.4 | -53.7 | -179.6 | 0 | 0 | 0 | 105.9 | ||||
| 148 | Q | 43.4 | Very low | 43.4 | Very low | 164 Ų | 164 | 155.1 Ų | 155.1 | 77% | 0.766 | 74% | 0.743 | S | S | * | * | trans | -113 | 95.4 | 152.1 | -83.9 | -178.1 | -14.8 | 0 | 0 | 105.6 | N150 | Q148-N150 PolarHBondContact O-N 3.09Š| ||
| 149 | D | 39.3 | Very low | 42.9 | Very low | 117 Ų | 117 | 163.5 Ų | 163.5 | 63% | 0.626 | 76% | 0.761 | S | S | * | * | trans | -54.4 | 89.5 | 159.4 | -63.9 | -45.3 | 0 | 0 | 0 | 108 | N151 | D149-N151 PolarHBondContact O-N 3.4Å; D149-N151 PolarHBondContact O-OD1 3.45Å | ||
| 150 | N | 41.2 | Very low | 42.7 | Very low | 146 Ų | 146 | 163.9 Ų | 163.9 | 78% | 0.781 | 78% | 0.78 | S | S | * | * | trans | -82.1 | 56.9 | 167.4 | -70.9 | -26.5 | 0 | 0 | 0 | 108.8 | Q148 | Q148-N150 PolarHBondContact O-N 3.09Š| ||
| 151 | N | 43.5 | Very low | 42.4 | Very low | 125 Ų | 125 | 166.4 Ų | 166.4 | 67% | 0.668 | 78% | 0.783 | S | S | * | * | trans | -102.2 | 50.3 | 163.5 | 66.2 | -12.4 | 0 | 0 | 0 | 109.6 | D149 | D149-N151 PolarHBondContact O-N 3.4Å; D149-N151 PolarHBondContact O-OD1 3.45Å | ||
| 152 | K | 44.8 | Very low | 42.1 | Very low | 183 Ų | 183 | 169.7 Ų | 169.7 | 80% | 0.796 | 80% | 0.8 | S | S | * | * | S | Bend | trans | -129.7 | 107.7 | 170.3 | -65.8 | -169.9 | -177.9 | -179 | 0 | 110.9 | ||
| 153 | Q | 46 | Very low | 42.1 | Very low | 161 Ų | 161 | 169.3 Ų | 169.3 | 75% | 0.752 | 80% | 0.801 | S | S | * | * | trans | 74.6 | 78.7 | 154.2 | -59.6 | 179.4 | -6 | 0 | 0 | 118.2 | L155 | Q153-L155 VanDerWaalsContact C-N 3.34Å; Q153-L155 HydrophobicContact CB-CG 4.47Å; Q153-L155 PolarHBondContact O-N 2.77Å | ||
| 154 | F | 38.6 | Very low | 42 | Very low | 218 Ų | 218 | 167.2 Ų | 167.2 | 96% | 0.956 | 80% | 0.801 | S | S | * | * | trans | -80.9 | 87.3 | 141.5 | -79.2 | -86.5 | 0 | 0 | 0 | 108 | L156 | F154-L156 PolarHBondContact O-N 2.96Š| ||
| 155 | L | 43.6 | Very low | 41.9 | Very low | 132 Ų | 132 | 171.8 Ų | 171.8 | 69% | 0.691 | 82% | 0.819 | S | S | * | * | trans | -75.2 | 109.4 | 165.1 | -75.9 | 171.3 | 0 | 0 | 0 | 108.1 | Q153 N157 | Q153-L155 VanDerWaalsContact C-N 3.34Å; Q153-L155 HydrophobicContact CB-CG 4.47Å; Q153-L155 PolarHBondContact O-N 2.77Å; L155-N157 PolarHBondContact O-N 3.1Å | ||
| 156 | L | 46.3 | Very low | 42 | Very low | 169 Ų | 169 | 175.8 Ų | 175.8 | 89% | 0.885 | 82% | 0.824 | S | S | * | * | trans | -62.6 | 96.6 | 166.3 | -75.8 | 163.2 | 0 | 0 | 0 | 108.9 | F154 R158 | F154-L156 PolarHBondContact O-N 2.96Å; L156-R158 PolarHBondContact O-N 2.91Å | ||
| 157 | N | 35.1 | Very low | 41.9 | Very low | 152 Ų | 152 | 171.2 Ų | 171.2 | 81% | 0.813 | 82% | 0.816 | S | S | * | * | trans | -87.4 | 91.3 | 160.7 | -80.2 | -31.4 | 0 | 0 | 0 | 108.5 | L155 | L155-N157 PolarHBondContact O-N 3.1Š| ||
| 158 | R | 40.8 | Very low | 42.1 | Very low | 220 Ų | 220 | 172.9 Ų | 172.9 | 83% | 0.83 | 82% | 0.82 | S | S | * | * | trans | -86.9 | 120.1 | 157.6 | -160.3 | -169 | -149.7 | -179.2 | 5.4 | 106.4 | L156 | L156-R158 PolarHBondContact O-N 2.91Š| ||
| 159 | R | 40.4 | Very low | 41.9 | Very low | 237 Ų | 237 | 173.7 Ų | 173.7 | 89% | 0.894 | 82% | 0.824 | S | S | * | * | trans | -142.2 | 131.4 | 154.6 | -74.5 | -165.3 | 173.8 | 144.8 | -0.7 | 108.9 | ||||
| 160 | D | 43.8 | Very low | 42.2 | Very low | 224 Ų | 224 | 178.8 Ų | 178.8 | 100% | 1.198 | 84% | 0.842 | S | S | * | * | trans | -63.3 | 0 | 175.2 | -51.5 | -65.3 | 0 | 0 | 0 | 112.4 |
Retrieved 160 of 160 residues in 270 ms
(Link to these results)