| 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 | 46.6 | Very low | 53.3 | Low | 247 Ų | 247 | 164.1 Ų | 164.1 | 100% | 1.217 | 78% | 0.775 | S | S | * | * | 0 | 150 | 0 | -61.4 | -151.3 | -131 | 0 | 0 | 108.7 | |||||
| 2 | A | 50.7 | Low | 52.9 | Low | 89 Ų | 89 | 168.8 Ų | 168.8 | 74% | 0.736 | 78% | 0.78 | S | S | * | * | trans | 88.5 | 57.4 | 180 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 3 | Q | 52.4 | Low | 53.4 | Low | 175 Ų | 175 | 167.7 Ų | 167.7 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -144.2 | 126.9 | 152.3 | -146.6 | 128.1 | 23.5 | 0 | 0 | 105.9 | ||||
| 4 | N | 56.2 | Low | 53.7 | Low | 123 Ų | 123 | 162.4 Ų | 162.4 | 66% | 0.658 | 77% | 0.768 | S | S | * | * | S | Bend | trans | 136 | -15.3 | 165.9 | -61.5 | -19.9 | 0 | 0 | 0 | 115.1 | K6 | N4-K6 PolarHBondContact O-N 3.2Š|
| 5 | W | 48.6 | Very low | 53.9 | Low | 164 Ų | 164 | 158.4 Ų | 158.4 | 62% | 0.621 | 76% | 0.761 | S | S | * | * | G | 310 helix | trans | -71.2 | -25.2 | -179.1 | 71.5 | -80.8 | 0 | 0 | 0 | 114.5 | R7 | W5-R7 VanDerWaalsContact C-N 3.33Å; W5-R7 PolarHBondContact O-N 2.73Å |
| 6 | K | 54.2 | Low | 54 | Low | 159 Ų | 159 | 160.1 Ų | 160.1 | 69% | 0.691 | 77% | 0.768 | S | S | * | * | G | 310 helix | trans | -75.2 | -12 | -177.9 | -68.9 | -171.9 | 177.1 | -176.6 | 0 | 115.2 | N4 | N4-K6 PolarHBondContact O-N 3.2Š|
| 7 | R | 55.8 | Low | 54.2 | Low | 219 Ų | 219 | 160.2 Ų | 160.2 | 83% | 0.826 | 77% | 0.772 | S | S | * | * | G | 310 helix | trans | -88.9 | -20.6 | -178.9 | -70.5 | -173.6 | -171.2 | 175.3 | 3.8 | 113.7 | W5 | W5-R7 VanDerWaalsContact C-N 3.33Å; W5-R7 PolarHBondContact O-N 2.73Å |
| 8 | Q | 54.5 | Low | 54.8 | Low | 166 Ų | 166 | 159.7 Ų | 159.7 | 78% | 0.776 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -8.5 | -177 | -66.4 | -160 | 1.2 | 0 | 0 | 114.7 | K10 | Q8-K10 PolarHBondContact O-N 3.26Š|
| 9 | Q | 52.7 | Low | 55.8 | Low | 138 Ų | 138 | 158.6 Ų | 158.6 | 65% | 0.645 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -5 | 179.4 | -84 | -179.1 | -6.9 | 0 | 0 | 114.8 | ||
| 10 | K | 57.1 | Low | 56.9 | Low | 185 Ų | 185 | 153.6 Ų | 153.6 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -108 | 28.8 | -163.8 | -139.4 | -178.4 | -174.5 | -176.1 | 0 | 116.9 | Q8 | Q8-K10 PolarHBondContact O-N 3.26Š|
| 11 | L | 57.9 | Low | 58.3 | Low | 140 Ų | 140 | 154.9 Ų | 154.9 | 73% | 0.733 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -133.5 | 2.4 | 176.7 | -72.2 | 171.5 | 0 | 0 | 0 | 115.6 | N13 V14 | L11-N13 VanDerWaalsContact C-N 3.31Å; L11-N13 PolarHBondContact O-N 2.82Å; L11-V14 HydrophobicContact CD2-CG2 4.05Å |
| 12 | W | 48.6 | Very low | 60.1 | Low | 221 Ų | 221 | 143.3 Ų | 143.3 | 84% | 0.837 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -11.3 | -177.5 | -67.5 | 86.1 | 0 | 0 | 0 | 114.2 | ||
| 13 | N | 58.6 | Low | 61.9 | Low | 154 Ų | 154 | 141.2 Ų | 141.2 | 82% | 0.824 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.9 | 19.8 | -176.4 | -63.5 | -43.7 | 0 | 0 | 0 | 113.4 | L11 P15 | L11-N13 VanDerWaalsContact C-N 3.31Å; L11-N13 PolarHBondContact O-N 2.82Å; N13-P15 WeakPolarHBondContact O-CD 3.23Å |
| 14 | V | 57.4 | Low | 63.5 | Low | 94 Ų | 94 | 139.1 Ų | 139.1 | 57% | 0.57 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -76 | 119.2 | 168.4 | -176.9 | 0 | 0 | 0 | 0 | 106.1 | L11 Q16 | L11-V14 HydrophobicContact CD2-CG2 4.05Å; V14-Q16 PolarHBondContact O-N 2.78Å |
| 15 | P | 57.3 | Low | 64.8 | Low | 102 Ų | 102 | 138 Ų | 138 | 66% | 0.662 | 65% | 0.653 | S | S | * | * | trans | -54.8 | 118 | 171.6 | 21.9 | -30.1 | 0 | 0 | 0 | 106.7 | N13 L17 | N13-P15 WeakPolarHBondContact O-CD 3.23Å; P15-L17 PolarHBondContact O-N 3.39Å | ||
| 16 | Q | 54.7 | Low | 66.4 | Low | 185 Ų | 185 | 131.9 Ų | 131.9 | 86% | 0.864 | 63% | 0.632 | S | S | * | * | trans | -59.6 | 99.4 | 170.5 | -102.5 | 178.6 | 1.8 | 0 | 0 | 105.8 | V14 L18 | V14-Q16 PolarHBondContact O-N 2.78Å; Q16-L18 PolarHBondContact O-N 3.33Å | ||
| 17 | L | 57.5 | Low | 67.7 | Low | 162 Ų | 162 | 126.9 Ų | 126.9 | 85% | 0.848 | 61% | 0.609 | S | S | * | * | trans | -60.5 | 100.1 | 167.9 | -76.2 | 170.3 | 0 | 0 | 0 | 104.8 | P15 F19 | P15-L17 PolarHBondContact O-N 3.39Å; L17-F19 PolarHBondContact O-N 2.98Å | ||
| 18 | L | 66 | Low | 68.7 | Low | 151 Ų | 151 | 123.3 Ų | 123.3 | 79% | 0.791 | 61% | 0.606 | S | S | * | * | trans | -49.7 | 109.1 | 176.7 | -91.6 | 156.5 | 0 | 0 | 0 | 106.7 | Q16 I20 | Q16-L18 PolarHBondContact O-N 3.33Å; L18-I20 WeakPolarHBondContact O-CG1 3.48Å; L18-I20 PolarHBondContact O-N 2.88Å | ||
| 19 | F | 73.1 | Confident | 70.2 | Confident | 140 Ų | 140 | 117.8 Ų | 117.8 | 61% | 0.614 | 58% | 0.584 | S | S | * | * | trans | -63.4 | 105.5 | 179.4 | -178.7 | -97.7 | 0 | 0 | 0 | 107.4 | L17 R21 | L17-F19 PolarHBondContact O-N 2.98Å; F19-R21 PolarHBondContact O-N 3.38Å | ||
| 20 | I | 78.1 | Confident | 71.7 | Confident | 58 Ų | 58 | 115.8 Ų | 115.8 | 30% | 0.297 | 59% | 0.585 | S | S | . | * | trans | -72.7 | 102.4 | -177.8 | -58.9 | -178.5 | 0 | 0 | 0 | 107.4 | L18 Y44 | L18-I20 WeakPolarHBondContact O-CG1 3.48Å; L18-I20 PolarHBondContact O-N 2.88Å; I20-Y44 HydrophobicContact CG2-CD1 3.51Å; I20-Y44 HydrophobicContact CG2-CE1 3.77Å | ||
| 21 | R | 85.9 | Confident | 73 | Confident | 181 Ų | 181 | 111.4 Ų | 111.4 | 68% | 0.683 | 57% | 0.57 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 121.7 | 173.2 | -168 | 174.9 | -176.4 | -175.8 | 1.7 | 109.1 | F19 P23 | F19-R21 PolarHBondContact O-N 3.38Å; R21-P23 WeakPolarHBondContact O-CD 3.42Å |
| 22 | V | 85.8 | Confident | 74.5 | Confident | 3 Ų | 3 | 104.7 Ų | 104.7 | 2% | 0.018 | 54% | 0.535 | C | S | . | . | P | Polyproline II helix | trans | -75.8 | 122.8 | 170.9 | -174.4 | 0 | 0 | 0 | 0 | 107.9 | Y27 L32 Q40 R41 Y44 | V22-Y27 HydrophobicContact CB-CE1 3.84Å; V22-Y27 HydrophobicContact CG1-CD1 4.09Å; V22-Y27 HydrophobicContact CG1-CE1 3.73Å; V22-Y27 PolarHBondContact O-OH 3.46Å; V22-L32 HydrophobicContact CG1-CD1 4.05Å; V22-Q40 HydrophobicContact CG2-CB 4.42Å; V22-R41 HydrophobicContact CG2-CB 4.43Å; V22-R41 HydrophobicContact CG2-CG 3.94Å; V22-Y44 HydrophobicContact CB-CD1 4.48Å; V22-Y44 HydrophobicContact CB-CG 4.46Å; V22-Y44 HydrophobicContact CG1-CD2 4.35Å; V22-Y44 HydrophobicContact CG1-CG 4.21Å; V22-Y44 HydrophobicContact CG2-CD1 3.96Å; V22-Y44 HydrophobicContact CG2-CG 3.97Å |
| 23 | P | 87.9 | Confident | 76.4 | Confident | 46 Ų | 46 | 100.2 Ų | 100.2 | 30% | 0.299 | 52% | 0.521 | S | S | . | . | P | Polyproline II helix | trans | -62 | 143 | 174 | -21.1 | 32 | 0 | 0 | 0 | 111.4 | R21 S25 I26 Y44 | R21-P23 WeakPolarHBondContact O-CD 3.42Å; P23-S25 PolarHBondContact O-N 3.1Å; P23-I26 HydrophobicContact CB-CD1 4.24Å; P23-I26 HydrophobicContact CB-CG1 4.29Å; P23-I26 HydrophobicContact CG-CD1 3.94Å; P23-I26 PolarHBondContact O-N 3.03Å; P23-I26 VanDerWaalsContact O-N 3.1Å; P23-Y44 VanDerWaalsContact CD-CZ 3.42Å; P23-Y44 WeakPolarHBondContact CD-OH 3.47Å; P23-Y44 HydrophobicContact CG-CE2 4.4Å |
| 24 | H | 84.8 | Confident | 78 | Confident | 130 Ų | 130 | 100 Ų | 100 | 60% | 0.602 | 52% | 0.52 | S | S | * | . | G | 310 helix | trans | -60.5 | -31.4 | -178.5 | -70.7 | 86.4 | 0 | 0 | 0 | 113.4 | I26 Y27 | H24-I26 PolarHBondContact O-N 3.33Å; H24-I26 VanDerWaalsContact O-N 3.08Å; H24-Y27 VanDerWaalsContact CA-CD2 3.44Å; H24-Y27 HydrophobicContact CB-CD2 4.14Å; H24-Y27 HydrophobicContact CB-CE2 4.22Å; H24-Y27 AromaticContact CD2-CD2 3.9Å; H24-Y27 AromaticContact CD2-CE2 3.5Å; H24-Y27 AromaticContact CG-CE2 3.84Å; H24-Y27 PolarHBondContact O-N 3.29Å |
| 25 | S | 84 | Confident | 79.5 | Confident | 101 Ų | 101 | 97.7 Ų | 97.7 | 71% | 0.706 | 50% | 0.504 | S | S | * | . | G | 310 helix | trans | -63.1 | -13 | 178.1 | 54.6 | 0 | 0 | 0 | 0 | 114.8 | P23 | P23-S25 PolarHBondContact O-N 3.1Š|
| 26 | I | 83.1 | Confident | 81.2 | Confident | 34 Ų | 34 | 97 Ų | 97 | 17% | 0.174 | 50% | 0.495 | C | S | . | . | G | 310 helix | trans | -106.5 | -13.1 | -174.5 | -50.4 | -178.7 | 0 | 0 | 0 | 111.3 | P23 H24 D28 T29 L32 Y44 M47 | P23-I26 HydrophobicContact CB-CD1 4.24Å; P23-I26 HydrophobicContact CB-CG1 4.29Å; P23-I26 HydrophobicContact CG-CD1 3.94Å; P23-I26 PolarHBondContact O-N 3.03Å; P23-I26 VanDerWaalsContact O-N 3.1Å; H24-I26 PolarHBondContact O-N 3.33Å; H24-I26 VanDerWaalsContact O-N 3.08Å; I26-D28 PolarHBondContact O-N 3.41Å; I26-T29 HydrophobicContact CG2-CG2 3.91Å; I26-T29 WeakPolarHBondContact O-CB 3.38Å; I26-T29 WeakPolarHBondContact O-CG2 3.44Å; I26-T29 PolarHBondContact O-N 3.44Å; I26-T29 VanDerWaalsContact O-N 3.13Å; I26-T29 PolarHBondContact O-OG1 3Å; I26-L32 HydrophobicContact CB-CD1 4.4Å; I26-L32 HydrophobicContact CG2-CD1 3.63Å; I26-Y44 HydrophobicContact CD1-CD2 4.16Å; I26-Y44 HydrophobicContact CD1-CE2 3.56Å; I26-M47 HydrophobicContact CG2-CE 3.89Å |
| 27 | Y | 81.7 | Confident | 82.8 | Confident | 54 Ų | 54 | 93.4 Ų | 93.4 | 21% | 0.212 | 48% | 0.478 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.8 | -36.7 | -179.9 | -72.3 | -52.4 | 0 | 0 | 0 | 112.8 | V22 H24 T29 | V22-Y27 HydrophobicContact CB-CE1 3.84Å; V22-Y27 HydrophobicContact CG1-CD1 4.09Å; V22-Y27 HydrophobicContact CG1-CE1 3.73Å; V22-Y27 PolarHBondContact O-OH 3.46Å; H24-Y27 VanDerWaalsContact CA-CD2 3.44Å; H24-Y27 HydrophobicContact CB-CD2 4.14Å; H24-Y27 HydrophobicContact CB-CE2 4.22Å; H24-Y27 AromaticContact CD2-CD2 3.9Å; H24-Y27 AromaticContact CD2-CE2 3.5Å; H24-Y27 AromaticContact CG-CE2 3.84Å; H24-Y27 PolarHBondContact O-N 3.29Å; Y27-T29 VanDerWaalsContact C-N 3.27Å; Y27-T29 PolarHBondContact O-N 2.97Å |
| 28 | D | 76.9 | Confident | 84.3 | Confident | 144 Ų | 144 | 87.7 Ų | 87.7 | 77% | 0.77 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.6 | 4.2 | -177.2 | -60.2 | -37.4 | 0 | 0 | 0 | 113.8 | I26 | I26-D28 PolarHBondContact O-N 3.41Š|
| 29 | T | 85.3 | Confident | 85.5 | Confident | 51 Ų | 51 | 84.5 Ų | 84.5 | 31% | 0.313 | 44% | 0.44 | S | S | . | . | S | Bend | trans | -66.7 | 143.9 | 173.8 | 60.4 | 0 | 0 | 0 | 0 | 110.2 | I26 Y27 L31 L32 K33 | I26-T29 HydrophobicContact CG2-CG2 3.91Å; I26-T29 WeakPolarHBondContact O-CB 3.38Å; I26-T29 WeakPolarHBondContact O-CG2 3.44Å; I26-T29 PolarHBondContact O-N 3.44Å; I26-T29 VanDerWaalsContact O-N 3.13Å; I26-T29 PolarHBondContact O-OG1 3Å; Y27-T29 VanDerWaalsContact C-N 3.27Å; Y27-T29 PolarHBondContact O-N 2.97Å; T29-L31 PolarHBondContact O-N 3.01Å; T29-L32 PolarHBondContact O-N 2.99Å; T29-K33 WeakPolarHBondContact O-CB 3.29Å; T29-K33 PolarHBondContact O-N 3.29Å |
| 30 | S | 84.4 | Confident | 86.3 | Confident | 95 Ų | 95 | 79 Ų | 79 | 66% | 0.664 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.5 | -23.5 | 179.8 | 56.3 | 0 | 0 | 0 | 0 | 114 | ||
| 31 | L | 84.4 | Confident | 86.9 | Confident | 93 Ų | 93 | 79.9 Ų | 79.9 | 49% | 0.487 | 42% | 0.415 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.3 | -32.8 | 177.4 | -175.5 | 64.2 | 0 | 0 | 0 | 113.7 | T29 L35 M47 | T29-L31 PolarHBondContact O-N 3.01Å; L31-L35 WeakPolarHBondContact O-CD1 3.5Å; L31-M47 HydrophobicContact CD2-SD 4.02Å |
| 32 | L | 88.2 | Confident | 87.1 | Confident | 0 Ų | 0 | 78.2 Ų | 78.2 | 0% | 0 | 41% | 0.41 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.9 | -10.7 | -174 | -61.2 | -168.5 | 0 | 0 | 0 | 114.1 | V22 I26 T29 L35 Q40 F43 | V22-L32 HydrophobicContact CG1-CD1 4.05Å; I26-L32 HydrophobicContact CB-CD1 4.4Å; I26-L32 HydrophobicContact CG2-CD1 3.63Å; T29-L32 PolarHBondContact O-N 2.99Å; L32-L35 HydrophobicContact CD2-CD1 4.26Å; L32-L35 WeakPolarHBondContact O-CB 3.49Å; L32-L35 PolarHBondContact O-N 3.31Å; L32-Q40 HydrophobicContact CB-CG 4.4Å; L32-Q40 PolarHBondContact O-NE2 2.99Å; L32-Q40 VanDerWaalsContact O-NE2 3.16Å; L32-F43 HydrophobicContact CD2-CB 3.65Å |
| 33 | K | 90 | Very high | 87.4 | Confident | 127 Ų | 127 | 82 Ų | 82 | 55% | 0.552 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59 | 141.8 | 176.6 | -168.6 | -175.6 | 170.9 | -179.4 | 0 | 110.7 | T29 L35 | T29-K33 WeakPolarHBondContact O-CB 3.29Å; T29-K33 PolarHBondContact O-N 3.29Å; K33-L35 PolarHBondContact O-N 3.43Å; K33-L35 VanDerWaalsContact O-N 3.08Å |
| 34 | D | 90.7 | Very high | 87.4 | Confident | 148 Ų | 148 | 81.6 Ų | 81.6 | 79% | 0.791 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.6 | 10.6 | 177.2 | -49.7 | -40.7 | 0 | 0 | 0 | 115.2 | ||
| 35 | L | 90.3 | Very high | 87.6 | Confident | 46 Ų | 46 | 76.7 Ų | 76.7 | 24% | 0.241 | 40% | 0.4 | C | S | . | . | trans | -90.2 | 148.6 | 174.1 | -63 | -173.8 | 0 | 0 | 0 | 111.9 | L31 L32 K33 Q39 Q40 F43 | L31-L35 WeakPolarHBondContact O-CD1 3.5Å; L32-L35 HydrophobicContact CD2-CD1 4.26Å; L32-L35 WeakPolarHBondContact O-CB 3.49Å; L32-L35 PolarHBondContact O-N 3.31Å; K33-L35 PolarHBondContact O-N 3.43Å; K33-L35 VanDerWaalsContact O-N 3.08Å; L35-Q39 HydrophobicContact CB-CB 4Å; L35-Q39 HydrophobicContact CD1-CB 4.3Å; L35-Q40 HydrophobicContact CB-CG 3.69Å; L35-Q40 PolarHBondContact O-NE2 3.42Å; L35-F43 HydrophobicContact CD1-CD2 3.58Å; L35-F43 HydrophobicContact CD1-CE2 3.98Å; L35-F43 HydrophobicContact CD1-CG 4.46Å | ||
| 36 | N | 92 | Very high | 87.8 | Confident | 88 Ų | 88 | 74.7 Ų | 74.7 | 47% | 0.471 | 38% | 0.381 | S | S | . | . | trans | -70.1 | 161.8 | 171.4 | 77.3 | 40.4 | 0 | 0 | 0 | 111.2 | G38 Q39 Q40 | N36-G38 PolarHBondContact O-N 3.41Å; N36-G38 VanDerWaalsContact O-N 3.14Å; N36-G38 WeakPolarHBondContact OD1-CA 3.08Å; N36-G38 PolarHBondContact OD1-N 3.01Å; N36-Q39 VanDerWaalsContact CG-OE1 3.31Å; N36-Q39 PolarHBondContact ND2-OE1 3.01Å; N36-Q39 WeakPolarHBondContact O-CB 3.46Å; N36-Q39 PolarHBondContact O-N 2.9Å; N36-Q39 VanDerWaalsContact O-N 3.12Å; N36-Q39 WeakPolarHBondContact OD1-CG 3.4Å; N36-Q39 PolarHBondContact OD1-N 3.3Å; N36-Q40 WeakPolarHBondContact O-CG 3.31Å; N36-Q40 PolarHBondContact O-N 3.22Å | ||
| 37 | Q | 88.8 | Confident | 88.1 | Confident | 110 Ų | 110 | 76.7 Ų | 76.7 | 51% | 0.514 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -58.5 | -33.8 | -174.9 | -161.6 | -174.7 | 19.9 | 0 | 0 | 113.5 | R41 | Q37-R41 VanDerWaalsContact O-CG 3.3Å; Q37-R41 WeakPolarHBondContact O-CG 3.41Å; Q37-R41 PolarHBondContact O-N 3.09Å; Q37-R41 VanDerWaalsContact O-N 3.14Å; Q37-R41 VanDerWaalsContact OE1-NH2 3.15Å |
| 38 | G | 89.3 | Confident | 88.3 | Confident | 42 Ų | 42 | 81.5 Ų | 81.5 | 43% | 0.433 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -69.3 | -45.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | N36 R41 Y42 | N36-G38 PolarHBondContact O-N 3.41Å; N36-G38 VanDerWaalsContact O-N 3.14Å; N36-G38 WeakPolarHBondContact OD1-CA 3.08Å; N36-G38 PolarHBondContact OD1-N 3.01Å; G38-R41 PolarHBondContact O-N 3.3Å; G38-Y42 PolarHBondContact O-N 3.4Å |
| 39 | Q | 90.4 | Very high | 88.8 | Confident | 83 Ų | 83 | 80.5 Ų | 80.5 | 39% | 0.388 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.4 | -44 | 175 | -71.4 | 168.1 | -30.9 | 0 | 0 | 110.9 | L35 N36 R41 Y42 F43 | L35-Q39 HydrophobicContact CB-CB 4Å; L35-Q39 HydrophobicContact CD1-CB 4.3Å; N36-Q39 VanDerWaalsContact CG-OE1 3.31Å; N36-Q39 PolarHBondContact ND2-OE1 3.01Å; N36-Q39 WeakPolarHBondContact O-CB 3.46Å; N36-Q39 PolarHBondContact O-N 2.9Å; N36-Q39 VanDerWaalsContact O-N 3.12Å; N36-Q39 WeakPolarHBondContact OD1-CG 3.4Å; N36-Q39 PolarHBondContact OD1-N 3.3Å; Q39-R41 VanDerWaalsContact C-N 3.34Å; Q39-R41 PolarHBondContact O-N 2.87Å; Q39-Y42 PolarHBondContact O-N 3.41Å; Q39-Y42 VanDerWaalsContact O-N 3.17Å; Q39-F43 VanDerWaalsContact O-CD2 3.28Å; Q39-F43 WeakPolarHBondContact O-CD2 3.32Å; Q39-F43 PolarHBondContact O-N 3.41Å |
| 40 | Q | 90.6 | Very high | 88.8 | Confident | 24 Ų | 24 | 87 Ų | 87 | 11% | 0.112 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -58.6 | -45.7 | 176.4 | -70.4 | 175.3 | -21.8 | 0 | 0 | 111.7 | V22 L32 L35 N36 Y42 Y44 | V22-Q40 HydrophobicContact CG2-CB 4.42Å; L32-Q40 HydrophobicContact CB-CG 4.4Å; L32-Q40 PolarHBondContact O-NE2 2.99Å; L32-Q40 VanDerWaalsContact O-NE2 3.16Å; L35-Q40 HydrophobicContact CB-CG 3.69Å; L35-Q40 PolarHBondContact O-NE2 3.42Å; N36-Q40 WeakPolarHBondContact O-CG 3.31Å; N36-Q40 PolarHBondContact O-N 3.22Å; Q40-Y42 VanDerWaalsContact C-N 3.33Å; Q40-Y42 PolarHBondContact O-N 3.47Å; Q40-Y44 WeakPolarHBondContact O-CB 3.49Å; Q40-Y44 PolarHBondContact O-N 3.23Å |
| 41 | R | 90.8 | Very high | 88.8 | Confident | 78 Ų | 78 | 86 Ų | 86 | 29% | 0.294 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -62.4 | -40.4 | 176.3 | -70.7 | 177.7 | -154.9 | 163.7 | 4.1 | 112 | V22 Q37 G38 Q39 S45 | V22-R41 HydrophobicContact CG2-CB 4.43Å; V22-R41 HydrophobicContact CG2-CG 3.94Å; Q37-R41 VanDerWaalsContact O-CG 3.3Å; Q37-R41 WeakPolarHBondContact O-CG 3.41Å; Q37-R41 PolarHBondContact O-N 3.09Å; Q37-R41 VanDerWaalsContact O-N 3.14Å; Q37-R41 VanDerWaalsContact OE1-NH2 3.15Å; G38-R41 PolarHBondContact O-N 3.3Å; Q39-R41 VanDerWaalsContact C-N 3.34Å; Q39-R41 PolarHBondContact O-N 2.87Å; R41-S45 WeakPolarHBondContact O-CB 3.41Å; R41-S45 PolarHBondContact O-N 3.49Å |
| 42 | Y | 90.5 | Very high | 88.8 | Confident | 145 Ų | 145 | 85.3 Ų | 85.3 | 57% | 0.569 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -65.7 | -49.5 | 178.2 | 178.2 | -102.8 | 0 | 0 | 0 | 112.3 | G38 Q39 Q40 S45 I46 | G38-Y42 PolarHBondContact O-N 3.4Å; Q39-Y42 PolarHBondContact O-N 3.41Å; Q39-Y42 VanDerWaalsContact O-N 3.17Å; Q40-Y42 VanDerWaalsContact C-N 3.33Å; Q40-Y42 PolarHBondContact O-N 3.47Å; Y42-S45 PolarHBondContact O-N 3Å; Y42-S45 PolarHBondContact O-OG 3.23Å; Y42-I46 HydrophobicContact CD1-CD1 4.16Å; Y42-I46 HydrophobicContact CE1-CD1 3.61Å; Y42-I46 HydrophobicContact CE2-CD1 4.23Å; Y42-I46 WeakPolarHBondContact O-CG1 3.48Å; Y42-I46 PolarHBondContact O-N 3.03Å |
| 43 | F | 90.9 | Very high | 88.7 | Confident | 83 Ų | 83 | 92.9 Ų | 92.9 | 36% | 0.364 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -66.8 | -40.4 | 177.8 | -79.6 | -70.4 | 0 | 0 | 0 | 112.2 | L32 L35 Q39 S45 I46 M47 | L32-F43 HydrophobicContact CD2-CB 3.65Å; L35-F43 HydrophobicContact CD1-CD2 3.58Å; L35-F43 HydrophobicContact CD1-CE2 3.98Å; L35-F43 HydrophobicContact CD1-CG 4.46Å; Q39-F43 VanDerWaalsContact O-CD2 3.28Å; Q39-F43 WeakPolarHBondContact O-CD2 3.32Å; Q39-F43 PolarHBondContact O-N 3.41Å; F43-S45 VanDerWaalsContact C-N 3.32Å; F43-S45 PolarHBondContact O-N 3.39Å; F43-I46 PolarHBondContact O-N 2.94Å; F43-M47 WeakPolarHBondContact O-CB 3.45Å; F43-M47 PolarHBondContact O-N 3.39Å |
| 44 | Y | 89.4 | Confident | 88.4 | Confident | 37 Ų | 37 | 90.1 Ų | 90.1 | 15% | 0.145 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -62.9 | -38.1 | 176.2 | 178 | -105.6 | 0 | 0 | 0 | 112.2 | I20 V22 P23 I26 Q40 I46 M47 R48 | I20-Y44 HydrophobicContact CG2-CD1 3.51Å; I20-Y44 HydrophobicContact CG2-CE1 3.77Å; V22-Y44 HydrophobicContact CB-CD1 4.48Å; V22-Y44 HydrophobicContact CB-CG 4.46Å; V22-Y44 HydrophobicContact CG1-CD2 4.35Å; V22-Y44 HydrophobicContact CG1-CG 4.21Å; V22-Y44 HydrophobicContact CG2-CD1 3.96Å; V22-Y44 HydrophobicContact CG2-CG 3.97Å; P23-Y44 VanDerWaalsContact CD-CZ 3.42Å; P23-Y44 WeakPolarHBondContact CD-OH 3.47Å; P23-Y44 HydrophobicContact CG-CE2 4.4Å; I26-Y44 HydrophobicContact CD1-CD2 4.16Å; I26-Y44 HydrophobicContact CD1-CE2 3.56Å; Q40-Y44 WeakPolarHBondContact O-CB 3.49Å; Q40-Y44 PolarHBondContact O-N 3.23Å; Y44-I46 PolarHBondContact O-N 3.01Å; Y44-M47 HydrophobicContact CD2-CE 3.9Å; Y44-M47 HydrophobicContact CE2-CE 4.38Å; Y44-M47 PolarHBondContact O-N 3.36Å; Y44-R48 VanDerWaalsContact O-CB 3.31Å; Y44-R48 WeakPolarHBondContact O-CB 3.34Å; Y44-R48 PolarHBondContact O-N 3.36Å |
| 45 | S | 87.8 | Confident | 88.2 | Confident | 28 Ų | 28 | 89.5 Ų | 89.5 | 20% | 0.196 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -63.5 | -41.9 | 177.8 | 74.7 | 0 | 0 | 0 | 0 | 111.8 | R41 Y42 F43 R48 I49 | R41-S45 WeakPolarHBondContact O-CB 3.41Å; R41-S45 PolarHBondContact O-N 3.49Å; Y42-S45 PolarHBondContact O-N 3Å; Y42-S45 PolarHBondContact O-OG 3.23Å; F43-S45 VanDerWaalsContact C-N 3.32Å; F43-S45 PolarHBondContact O-N 3.39Å; S45-R48 PolarHBondContact O-N 2.85Å; S45-I49 WeakPolarHBondContact O-CG1 3.35Å; S45-I49 PolarHBondContact O-N 3.31Å |
| 46 | I | 89.4 | Confident | 88 | Confident | 59 Ų | 59 | 91.9 Ų | 91.9 | 30% | 0.303 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -63.1 | -50.3 | 174.2 | -64.1 | 171 | 0 | 0 | 0 | 110.1 | Y42 F43 Y44 R48 I49 Y50 | Y42-I46 HydrophobicContact CD1-CD1 4.16Å; Y42-I46 HydrophobicContact CE1-CD1 3.61Å; Y42-I46 HydrophobicContact CE2-CD1 4.23Å; Y42-I46 WeakPolarHBondContact O-CG1 3.48Å; Y42-I46 PolarHBondContact O-N 3.03Å; F43-I46 PolarHBondContact O-N 2.94Å; Y44-I46 PolarHBondContact O-N 3.01Å; I46-R48 PolarHBondContact O-N 3.34Å; I46-I49 WeakPolarHBondContact O-CB 3.47Å; I46-I49 PolarHBondContact O-N 3.47Å; I46-Y50 HydrophobicContact CG2-CD2 4.04Å; I46-Y50 HydrophobicContact CG2-CE2 3.93Å; I46-Y50 WeakPolarHBondContact O-CD2 3.36Å; I46-Y50 PolarHBondContact O-N 3.02Å |
| 47 | M | 87.9 | Confident | 87.8 | Confident | 75 Ų | 75 | 91.8 Ų | 91.8 | 37% | 0.369 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -58.2 | -35.2 | -179.8 | -165.1 | 174 | 66.3 | 0 | 0 | 111.8 | I26 L31 F43 Y44 N51 | I26-M47 HydrophobicContact CG2-CE 3.89Å; L31-M47 HydrophobicContact CD2-SD 4.02Å; F43-M47 WeakPolarHBondContact O-CB 3.45Å; F43-M47 PolarHBondContact O-N 3.39Å; Y44-M47 HydrophobicContact CD2-CE 3.9Å; Y44-M47 HydrophobicContact CE2-CE 4.38Å; Y44-M47 PolarHBondContact O-N 3.36Å; M47-N51 WeakPolarHBondContact O-CB 3.43Å; M47-N51 PolarHBondContact O-N 2.94Å; M47-N51 VanDerWaalsContact O-N 3.16Å |
| 48 | R | 86.7 | Confident | 87.8 | Confident | 156 Ų | 156 | 88.7 Ų | 88.7 | 59% | 0.589 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -68.2 | -35.2 | 176 | -173.7 | 175.3 | 175.5 | -109.7 | 0 | 113.2 | Y44 S45 I46 Y50 N51 | Y44-R48 VanDerWaalsContact O-CB 3.31Å; Y44-R48 WeakPolarHBondContact O-CB 3.34Å; Y44-R48 PolarHBondContact O-N 3.36Å; S45-R48 PolarHBondContact O-N 2.85Å; I46-R48 PolarHBondContact O-N 3.34Å; R48-Y50 VanDerWaalsContact C-N 3.33Å; R48-N51 WeakPolarHBondContact O-CB 3.42Å; R48-N51 PolarHBondContact O-N 3.25Å |
| 49 | I | 87.1 | Confident | 87.9 | Confident | 122 Ų | 122 | 91.3 Ų | 91.3 | 63% | 0.626 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -64.6 | -40.3 | 177.4 | -68.6 | 165.1 | 0 | 0 | 0 | 110.9 | S45 I46 N51 | S45-I49 WeakPolarHBondContact O-CG1 3.35Å; S45-I49 PolarHBondContact O-N 3.31Å; I46-I49 WeakPolarHBondContact O-CB 3.47Å; I46-I49 PolarHBondContact O-N 3.47Å; I49-N51 VanDerWaalsContact C-N 3.29Å |
| 50 | Y | 86.1 | Confident | 88 | Confident | 189 Ų | 189 | 89.2 Ų | 89.2 | 74% | 0.741 | 42% | 0.417 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.5 | -2.6 | 178.3 | -66.4 | -76.6 | 0 | 0 | 0 | 113.6 | I46 R48 S52 | I46-Y50 HydrophobicContact CG2-CD2 4.04Å; I46-Y50 HydrophobicContact CG2-CE2 3.93Å; I46-Y50 WeakPolarHBondContact O-CD2 3.36Å; I46-Y50 PolarHBondContact O-N 3.02Å; R48-Y50 VanDerWaalsContact C-N 3.33Å; Y50-S52 PolarHBondContact O-N 2.89Å; Y50-S52 VanDerWaalsContact O-N 3.15Å |
| 51 | N | 84.7 | Confident | 88.1 | Confident | 74 Ų | 74 | 92.7 Ų | 92.7 | 40% | 0.396 | 44% | 0.44 | S | S | . | . | trans | -79.9 | 98.1 | 176.4 | -172.4 | 4 | 0 | 0 | 0 | 110.2 | M47 R48 I49 R53 P54 | M47-N51 WeakPolarHBondContact O-CB 3.43Å; M47-N51 PolarHBondContact O-N 2.94Å; M47-N51 VanDerWaalsContact O-N 3.16Å; R48-N51 WeakPolarHBondContact O-CB 3.42Å; R48-N51 PolarHBondContact O-N 3.25Å; I49-N51 VanDerWaalsContact C-N 3.29Å; N51-R53 VanDerWaalsContact C-N 3.26Å; N51-R53 PolarHBondContact O-N 3.28Å; N51-R53 WeakPolarHBondContact OD1-CB 3.44Å; N51-R53 PolarHBondContact OD1-N 3.14Å; N51-R53 VanDerWaalsContact OD1-N 3.1Å; N51-P54 WeakPolarHBondContact O-CD 3.42Å | ||
| 52 | S | 83.9 | Confident | 88.2 | Confident | 78 Ų | 78 | 98 Ų | 98 | 55% | 0.545 | 46% | 0.46 | S | S | . | . | trans | -76.1 | -11.6 | 177 | 57.7 | 0 | 0 | 0 | 0 | 113.7 | Y50 Q55 W56 | Y50-S52 PolarHBondContact O-N 2.89Å; Y50-S52 VanDerWaalsContact O-N 3.15Å; S52-Q55 PolarHBondContact O-N 3.14Å; S52-W56 WeakPolarHBondContact O-CB 3.48Å; S52-W56 PolarHBondContact O-N 2.68Å | ||
| 53 | R | 84.6 | Confident | 88.4 | Confident | 158 Ų | 158 | 95.4 Ų | 95.4 | 60% | 0.596 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -58.9 | -48.7 | -173.9 | -177.6 | 178.3 | 176 | 169.5 | 3.8 | 113.6 | N51 Q55 W56 E57 | N51-R53 VanDerWaalsContact C-N 3.26Å; N51-R53 PolarHBondContact O-N 3.28Å; N51-R53 WeakPolarHBondContact OD1-CB 3.44Å; N51-R53 PolarHBondContact OD1-N 3.14Å; N51-R53 VanDerWaalsContact OD1-N 3.1Å; R53-Q55 VanDerWaalsContact C-N 3.28Å; R53-Q55 PolarHBondContact O-N 2.95Å; R53-W56 PolarHBondContact O-N 3.49Å; R53-E57 HydrophobicContact CG-CG 4.47Å; R53-E57 WeakPolarHBondContact CG-OE1 3.48Å; R53-E57 IonicContact CZ-OE1 3.63Å; R53-E57 IonicContact NE-OE1 3.87Å; R53-E57 PolarHBondContact NE-OE1 3.29Å; R53-E57 IonicContact NH2-OE1 3.86Å; R53-E57 WeakPolarHBondContact O-CG 3.42Å; R53-E57 PolarHBondContact O-N 3.43Å |
| 54 | P | 85.3 | Confident | 88.6 | Confident | 70 Ų | 70 | 94.4 Ų | 94.4 | 46% | 0.455 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -64.2 | -34.6 | 179.4 | -20.4 | 33.8 | 0 | 0 | 0 | 112.6 | N51 A58 | N51-P54 WeakPolarHBondContact O-CD 3.42Å; P54-A58 WeakPolarHBondContact O-CB 3.42Å; P54-A58 PolarHBondContact O-N 3.43Å |
| 55 | Q | 85.7 | Confident | 88.9 | Confident | 134 Ų | 134 | 98.8 Ų | 98.8 | 63% | 0.626 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -68.3 | -41.4 | 177.6 | -63.7 | 166.9 | -10 | 0 | 0 | 110.7 | S52 R53 A58 L59 | S52-Q55 PolarHBondContact O-N 3.14Å; R53-Q55 VanDerWaalsContact C-N 3.28Å; R53-Q55 PolarHBondContact O-N 2.95Å; Q55-A58 PolarHBondContact O-N 3.39Å; Q55-L59 PolarHBondContact O-N 3.45Å |
| 56 | W | 85.3 | Confident | 89.3 | Confident | 96 Ų | 96 | 99.9 Ų | 99.9 | 36% | 0.364 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.4 | -45.9 | 175 | -173.5 | -105.3 | 0 | 0 | 0 | 112.2 | S52 R53 A58 L59 Q60 T92 | S52-W56 WeakPolarHBondContact O-CB 3.48Å; S52-W56 PolarHBondContact O-N 2.68Å; R53-W56 PolarHBondContact O-N 3.49Å; W56-A58 VanDerWaalsContact C-N 3.31Å; W56-A58 PolarHBondContact O-N 2.92Å; W56-L59 HydrophobicContact CE3-CD2 4.16Å; W56-L59 HydrophobicContact CZ3-CD2 3.95Å; W56-L59 PolarHBondContact O-N 3.17Å; W56-Q60 WeakPolarHBondContact O-CB 3.38Å; W56-Q60 PolarHBondContact O-N 2.93Å; W56-T92 PolarHBondContact NE1-OG1 3.08Å; W56-T92 VanDerWaalsContact NE1-OG1 3.14Å |
| 57 | E | 88.1 | Confident | 89.6 | Confident | 87 Ų | 87 | 97.4 Ų | 97.4 | 41% | 0.407 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.5 | -40 | 176.5 | -72.9 | 170.2 | -175.8 | 0 | 0 | 111.9 | R53 Q60 T61 | R53-E57 HydrophobicContact CG-CG 4.47Å; R53-E57 WeakPolarHBondContact CG-OE1 3.48Å; R53-E57 IonicContact CZ-OE1 3.63Å; R53-E57 IonicContact NE-OE1 3.87Å; R53-E57 PolarHBondContact NE-OE1 3.29Å; R53-E57 IonicContact NH2-OE1 3.86Å; R53-E57 WeakPolarHBondContact O-CG 3.42Å; R53-E57 PolarHBondContact O-N 3.43Å; E57-Q60 PolarHBondContact O-N 2.9Å; E57-T61 PolarHBondContact O-N 3.46Å; E57-T61 PolarHBondContact O-OG1 3.02Å |
| 58 | A | 90.3 | Very high | 89.9 | Confident | 45 Ų | 45 | 99.6 Ų | 99.6 | 37% | 0.372 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.2 | -43.6 | 175 | 0 | 0 | 0 | 0 | 0 | 112.1 | P54 Q55 W56 T61 R62 | P54-A58 WeakPolarHBondContact O-CB 3.42Å; P54-A58 PolarHBondContact O-N 3.43Å; Q55-A58 PolarHBondContact O-N 3.39Å; W56-A58 VanDerWaalsContact C-N 3.31Å; W56-A58 PolarHBondContact O-N 2.92Å; A58-T61 PolarHBondContact O-N 3.45Å; A58-R62 WeakPolarHBondContact O-CG 3.48Å; A58-R62 PolarHBondContact O-N 2.99Å |
| 59 | L | 91.2 | Very high | 90.4 | Very high | 96 Ų | 96 | 97 Ų | 97 | 50% | 0.503 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.8 | -45 | 176.5 | -178 | 64.8 | 0 | 0 | 0 | 111.3 | Q55 W56 T61 R62 Y63 | Q55-L59 PolarHBondContact O-N 3.45Å; W56-L59 HydrophobicContact CE3-CD2 4.16Å; W56-L59 HydrophobicContact CZ3-CD2 3.95Å; W56-L59 PolarHBondContact O-N 3.17Å; L59-T61 PolarHBondContact O-N 3.04Å; L59-R62 PolarHBondContact O-N 2.97Å; L59-Y63 WeakPolarHBondContact O-CB 3.41Å; L59-Y63 PolarHBondContact O-N 3.42Å |
| 60 | Q | 91.2 | Very high | 90.9 | Very high | 40 Ų | 40 | 94.4 Ų | 94.4 | 19% | 0.187 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -57.4 | -47.9 | 176.5 | 169.9 | 164.7 | 8.5 | 0 | 0 | 111.3 | W56 E57 R62 Y63 I64 L88 T92 | W56-Q60 WeakPolarHBondContact O-CB 3.38Å; W56-Q60 PolarHBondContact O-N 2.93Å; E57-Q60 PolarHBondContact O-N 2.9Å; Q60-R62 PolarHBondContact O-N 3.27Å; Q60-Y63 PolarHBondContact O-N 3.41Å; Q60-I64 HydrophobicContact CG-CD1 3.92Å; Q60-I64 WeakPolarHBondContact O-CG1 3.37Å; Q60-I64 PolarHBondContact O-N 2.83Å; Q60-L88 HydrophobicContact CB-CD2 4.4Å; Q60-L88 HydrophobicContact CG-CD1 4.5Å; Q60-L88 HydrophobicContact CG-CD2 3.66Å; Q60-L88 HydrophobicContact CG-CG 4.05Å; Q60-T92 PolarHBondContact OE1-OG1 2.96Å |
| 61 | T | 92.3 | Very high | 91.4 | Very high | 96 Ų | 96 | 88.8 Ų | 88.8 | 59% | 0.589 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -59.7 | -45.9 | 178.5 | -57.8 | 0 | 0 | 0 | 0 | 111.6 | E57 A58 L59 Y63 I64 H65 | E57-T61 PolarHBondContact O-N 3.46Å; E57-T61 PolarHBondContact O-OG1 3.02Å; A58-T61 PolarHBondContact O-N 3.45Å; L59-T61 PolarHBondContact O-N 3.04Å; T61-Y63 VanDerWaalsContact C-N 3.34Å; T61-Y63 PolarHBondContact O-N 3.21Å; T61-I64 PolarHBondContact O-N 3.44Å; T61-H65 WeakPolarHBondContact O-CB 3.38Å; T61-H65 PolarHBondContact O-N 3.17Å |
| 62 | R | 94.9 | Very high | 91.9 | Very high | 191 Ų | 191 | 92.2 Ų | 92.2 | 72% | 0.721 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -61.8 | -42.3 | 177.6 | -72.1 | 175.6 | -177.1 | -150.2 | 0.6 | 112 | A58 L59 Q60 H65 S66 | A58-R62 WeakPolarHBondContact O-CG 3.48Å; A58-R62 PolarHBondContact O-N 2.99Å; L59-R62 PolarHBondContact O-N 2.97Å; Q60-R62 PolarHBondContact O-N 3.27Å; R62-H65 PolarHBondContact O-N 3.28Å; R62-S66 PolarHBondContact O-N 2.98Å |
| 63 | Y | 94.4 | Very high | 92.6 | Very high | 90 Ų | 90 | 92.7 Ų | 92.7 | 35% | 0.353 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -66.3 | -43.5 | 179.9 | -176.7 | -103.7 | 0 | 0 | 0 | 111.9 | L59 Q60 T61 H65 S66 L67 L88 | L59-Y63 WeakPolarHBondContact O-CB 3.41Å; L59-Y63 PolarHBondContact O-N 3.42Å; Q60-Y63 PolarHBondContact O-N 3.41Å; T61-Y63 VanDerWaalsContact C-N 3.34Å; T61-Y63 PolarHBondContact O-N 3.21Å; Y63-H65 VanDerWaalsContact C-N 3.32Å; Y63-H65 PolarHBondContact O-N 3.27Å; Y63-S66 WeakPolarHBondContact O-CB 3.33Å; Y63-S66 PolarHBondContact O-N 3.42Å; Y63-L67 HydrophobicContact CD1-CD1 3.88Å; Y63-L67 HydrophobicContact CD1-CG 4.29Å; Y63-L67 HydrophobicContact CE1-CD1 3.45Å; Y63-L67 VanDerWaalsContact CE1-CD1 3.45Å; Y63-L67 HydrophobicContact CE1-CD2 4.4Å; Y63-L67 HydrophobicContact CE1-CG 3.94Å; Y63-L67 PolarHBondContact O-N 2.9Å; Y63-L88 HydrophobicContact CD1-CD1 4.34Å; Y63-L88 HydrophobicContact CD1-CD2 3.72Å; Y63-L88 HydrophobicContact CE1-CD2 4.4Å |
| 64 | I | 94.3 | Very high | 93.1 | Very high | 61 Ų | 61 | 88 Ų | 88 | 31% | 0.313 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -59.1 | -45.7 | 174.7 | -68.6 | 167.7 | 0 | 0 | 0 | 110.8 | Q60 T61 S66 L67 Q68 L88 | Q60-I64 HydrophobicContact CG-CD1 3.92Å; Q60-I64 WeakPolarHBondContact O-CG1 3.37Å; Q60-I64 PolarHBondContact O-N 2.83Å; T61-I64 PolarHBondContact O-N 3.44Å; I64-S66 VanDerWaalsContact C-N 3.31Å; I64-S66 PolarHBondContact O-N 2.92Å; I64-L67 PolarHBondContact O-N 3.44Å; I64-Q68 WeakPolarHBondContact O-CG 3.49Å; I64-Q68 PolarHBondContact O-N 3.41Å; I64-L88 HydrophobicContact CD1-CD2 4.09Å; I64-L88 HydrophobicContact CG1-CD2 3.73Å |
| 65 | H | 96 | Very high | 93.7 | Very high | 130 Ų | 130 | 93 Ų | 93 | 60% | 0.602 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -60.7 | -41.4 | 176.8 | -176.2 | -87.6 | 0 | 0 | 0 | 111.9 | T61 R62 Y63 Q68 H69 | T61-H65 WeakPolarHBondContact O-CB 3.38Å; T61-H65 PolarHBondContact O-N 3.17Å; R62-H65 PolarHBondContact O-N 3.28Å; Y63-H65 VanDerWaalsContact C-N 3.32Å; Y63-H65 PolarHBondContact O-N 3.27Å; H65-Q68 PolarHBondContact O-N 3.22Å; H65-H69 WeakPolarHBondContact O-CB 3.37Å; H65-H69 PolarHBondContact O-N 2.88Å |
| 66 | S | 95.7 | Very high | 94.3 | Very high | 51 Ų | 51 | 87.8 Ų | 87.8 | 36% | 0.357 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.4 | -42 | 174.7 | -170.4 | 0 | 0 | 0 | 0 | 112.3 | R62 Y63 I64 H69 Q70 | R62-S66 PolarHBondContact O-N 2.98Å; Y63-S66 WeakPolarHBondContact O-CB 3.33Å; Y63-S66 PolarHBondContact O-N 3.42Å; I64-S66 VanDerWaalsContact C-N 3.31Å; I64-S66 PolarHBondContact O-N 2.92Å; S66-H69 PolarHBondContact O-N 3.15Å; S66-Q70 WeakPolarHBondContact O-CB 3.41Å; S66-Q70 VanDerWaalsContact O-CG 3.31Å; S66-Q70 WeakPolarHBondContact O-CG 3.4Å; S66-Q70 PolarHBondContact O-N 3.1Å |
| 67 | L | 95.6 | Very high | 94.8 | Very high | 7 Ų | 7 | 86.8 Ų | 86.8 | 4% | 0.037 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 177 | -75.5 | 176 | 0 | 0 | 0 | 111.6 | Y63 I64 H69 Q70 Q71 I76 Y84 | Y63-L67 HydrophobicContact CD1-CD1 3.88Å; Y63-L67 HydrophobicContact CD1-CG 4.29Å; Y63-L67 HydrophobicContact CE1-CD1 3.45Å; Y63-L67 VanDerWaalsContact CE1-CD1 3.45Å; Y63-L67 HydrophobicContact CE1-CD2 4.4Å; Y63-L67 HydrophobicContact CE1-CG 3.94Å; Y63-L67 PolarHBondContact O-N 2.9Å; I64-L67 PolarHBondContact O-N 3.44Å; L67-H69 VanDerWaalsContact C-N 3.28Å; L67-H69 PolarHBondContact O-N 2.91Å; L67-Q70 PolarHBondContact O-N 3.23Å; L67-Q71 WeakPolarHBondContact O-CB 3.33Å; L67-Q71 PolarHBondContact O-N 2.94Å; L67-I76 HydrophobicContact CB-CD1 4.5Å; L67-I76 HydrophobicContact CD2-CD1 3.77Å; L67-Y84 HydrophobicContact CD2-CD2 3.75Å; L67-Y84 HydrophobicContact CD2-CG 4.25Å |
| 68 | Q | 95.3 | Very high | 95.2 | Very high | 120 Ų | 120 | 88.8 Ų | 88.8 | 56% | 0.561 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -58.9 | -43.8 | 175.8 | -72.5 | 175.5 | -21.2 | 0 | 0 | 111.2 | I64 H65 Q71 L72 | I64-Q68 WeakPolarHBondContact O-CG 3.49Å; I64-Q68 PolarHBondContact O-N 3.41Å; H65-Q68 PolarHBondContact O-N 3.22Å; Q68-Q71 PolarHBondContact O-N 3.42Å; Q68-L72 PolarHBondContact O-N 2.87Å |
| 69 | H | 97 | Very high | 95.4 | Very high | 101 Ų | 101 | 97.1 Ų | 97.1 | 47% | 0.468 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -65 | -44.4 | 177.4 | -173.3 | 59 | 0 | 0 | 0 | 112.4 | H65 S66 L67 Q71 L72 L73 | H65-H69 WeakPolarHBondContact O-CB 3.37Å; H65-H69 PolarHBondContact O-N 2.88Å; S66-H69 PolarHBondContact O-N 3.15Å; L67-H69 VanDerWaalsContact C-N 3.28Å; L67-H69 PolarHBondContact O-N 2.91Å; H69-Q71 VanDerWaalsContact C-N 3.3Å; H69-Q71 PolarHBondContact O-N 3.03Å; H69-L72 PolarHBondContact O-N 3.41Å; H69-L73 WeakPolarHBondContact NE2-CD1 3.49Å; H69-L73 WeakPolarHBondContact O-CG 3.5Å; H69-L73 PolarHBondContact O-N 3Å |
| 70 | Q | 96.2 | Very high | 95.7 | Very high | 68 Ų | 68 | 96.4 Ų | 96.4 | 32% | 0.318 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.5 | -37.3 | 176.4 | -75 | 174.9 | -38.5 | 0 | 0 | 112.5 | S66 L67 L73 G74 Y75 I76 | S66-Q70 WeakPolarHBondContact O-CB 3.41Å; S66-Q70 VanDerWaalsContact O-CG 3.31Å; S66-Q70 WeakPolarHBondContact O-CG 3.4Å; S66-Q70 PolarHBondContact O-N 3.1Å; L67-Q70 PolarHBondContact O-N 3.23Å; Q70-L73 PolarHBondContact O-N 3.23Å; Q70-G74 PolarHBondContact O-N 3.35Å; Q70-Y75 HydrophobicContact CG-CD2 4.49Å; Q70-Y75 PolarHBondContact O-N 3.33Å; Q70-I76 HydrophobicContact CB-CD1 3.88Å; Q70-I76 HydrophobicContact CB-CG1 3.92Å; Q70-I76 HydrophobicContact CB-CG2 4.49Å |
| 71 | Q | 96.5 | Very high | 95.9 | Very high | 72 Ų | 72 | 94.9 Ų | 94.9 | 34% | 0.336 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -66.1 | -42.7 | 175.3 | -175.1 | -174.3 | -16.6 | 0 | 0 | 111.1 | L67 Q68 H69 L73 G74 I76 | L67-Q71 WeakPolarHBondContact O-CB 3.33Å; L67-Q71 PolarHBondContact O-N 2.94Å; Q68-Q71 PolarHBondContact O-N 3.42Å; H69-Q71 VanDerWaalsContact C-N 3.3Å; H69-Q71 PolarHBondContact O-N 3.03Å; Q71-L73 VanDerWaalsContact C-N 3.29Å; Q71-L73 PolarHBondContact O-N 2.98Å; Q71-G74 PolarHBondContact O-N 3.06Å; Q71-G74 VanDerWaalsContact O-N 3.09Å; Q71-I76 HydrophobicContact CB-CD1 4.41Å; Q71-I76 HydrophobicContact CB-CG1 4.03Å |
| 72 | L | 96.4 | Very high | 96 | Very high | 146 Ų | 146 | 95.2 Ų | 95.2 | 76% | 0.764 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -62.5 | -37.3 | 177.5 | -177.9 | 65.8 | 0 | 0 | 0 | 112.2 | Q68 H69 G74 | Q68-L72 PolarHBondContact O-N 2.87Å; H69-L72 PolarHBondContact O-N 3.41Å; L72-G74 PolarHBondContact O-N 3.28Å |
| 73 | L | 97.5 | Very high | 96 | Very high | 88 Ų | 88 | 88.6 Ų | 88.6 | 46% | 0.461 | 44% | 0.44 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.3 | -4 | 176.7 | -65.5 | -180 | 0 | 0 | 0 | 113.6 | H69 Q70 Q71 Y75 | H69-L73 WeakPolarHBondContact NE2-CD1 3.49Å; H69-L73 WeakPolarHBondContact O-CG 3.5Å; H69-L73 PolarHBondContact O-N 3Å; Q70-L73 PolarHBondContact O-N 3.23Å; Q71-L73 VanDerWaalsContact C-N 3.29Å; Q71-L73 PolarHBondContact O-N 2.98Å; L73-Y75 VanDerWaalsContact C-N 3.26Å; L73-Y75 HydrophobicContact CB-CD2 3.71Å; L73-Y75 HydrophobicContact CB-CE2 3.72Å; L73-Y75 HydrophobicContact CB-CG 4.37Å; L73-Y75 HydrophobicContact CD1-CD2 4.05Å; L73-Y75 HydrophobicContact CD1-CE2 3.49Å; L73-Y75 VanDerWaalsContact CD1-CE2 3.49Å; L73-Y75 HydrophobicContact CG-CE2 4.27Å; L73-Y75 PolarHBondContact O-N 3.06Å |
| 74 | G | 96.9 | Very high | 96 | Very high | 60 Ų | 60 | 89.2 Ų | 89.2 | 62% | 0.619 | 44% | 0.442 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.1 | 12.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | Q70 Q71 L72 I76 | Q70-G74 PolarHBondContact O-N 3.35Å; Q71-G74 PolarHBondContact O-N 3.06Å; Q71-G74 VanDerWaalsContact O-N 3.09Å; L72-G74 PolarHBondContact O-N 3.28Å; G74-I76 VanDerWaalsContact C-N 3.29Å |
| 75 | Y | 97.7 | Very high | 95.9 | Very high | 174 Ų | 174 | 88.2 Ų | 88.2 | 68% | 0.682 | 44% | 0.444 | S | S | * | . | S | Bend | trans | -71.2 | -28.1 | 175.2 | -65.4 | -45.6 | 0 | 0 | 0 | 112.8 | Q70 L73 | Q70-Y75 HydrophobicContact CG-CD2 4.49Å; Q70-Y75 PolarHBondContact O-N 3.33Å; L73-Y75 VanDerWaalsContact C-N 3.26Å; L73-Y75 HydrophobicContact CB-CD2 3.71Å; L73-Y75 HydrophobicContact CB-CE2 3.72Å; L73-Y75 HydrophobicContact CB-CG 4.37Å; L73-Y75 HydrophobicContact CD1-CD2 4.05Å; L73-Y75 HydrophobicContact CD1-CE2 3.49Å; L73-Y75 VanDerWaalsContact CD1-CE2 3.49Å; L73-Y75 HydrophobicContact CG-CE2 4.27Å; L73-Y75 PolarHBondContact O-N 3.06Å |
| 76 | I | 97.3 | Very high | 95.8 | Very high | 25 Ų | 25 | 86.9 Ų | 86.9 | 13% | 0.128 | 44% | 0.44 | C | S | . | . | S | Bend | trans | -131.7 | 150.7 | 176.6 | 65.6 | 177.1 | 0 | 0 | 0 | 110 | L67 Q70 Q71 G74 E80 A81 | L67-I76 HydrophobicContact CB-CD1 4.5Å; L67-I76 HydrophobicContact CD2-CD1 3.77Å; Q70-I76 HydrophobicContact CB-CD1 3.88Å; Q70-I76 HydrophobicContact CB-CG1 3.92Å; Q70-I76 HydrophobicContact CB-CG2 4.49Å; Q71-I76 HydrophobicContact CB-CD1 4.41Å; Q71-I76 HydrophobicContact CB-CG1 4.03Å; G74-I76 VanDerWaalsContact C-N 3.29Å; I76-E80 HydrophobicContact CB-CB 4.44Å; I76-A81 HydrophobicContact CD1-CB 3.79Å; I76-A81 HydrophobicContact CG1-CB 4.46Å |
| 77 | T | 96.9 | Very high | 95.7 | Very high | 75 Ų | 75 | 89.3 Ų | 89.3 | 46% | 0.46 | 45% | 0.452 | S | S | . | . | trans | -77.5 | 158.1 | 172.3 | 65.5 | 0 | 0 | 0 | 0 | 110.9 | R79 E80 A81 | T77-R79 PolarHBondContact O-N 2.81Å; T77-E80 WeakPolarHBondContact CB-OE2 3.49Å; T77-E80 PolarHBondContact N-OE2 2.88Å; T77-E80 PolarHBondContact O-N 2.8Å; T77-E80 VanDerWaalsContact OG1-CG 3.23Å; T77-E80 WeakPolarHBondContact OG1-CG 3.19Å; T77-E80 PolarHBondContact OG1-N 3.26Å; T77-E80 PolarHBondContact OG1-OE2 2.86Å; T77-A81 PolarHBondContact O-N 2.86Å | ||
| 78 | Q | 94.8 | Very high | 95.5 | Very high | 129 Ų | 129 | 90 Ų | 90 | 60% | 0.603 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -58.2 | -36.8 | 174 | -176.4 | 173.4 | 2.9 | 0 | 0 | 112.2 | A81 L82 | Q78-A81 PolarHBondContact O-N 2.78Å; Q78-L82 HydrophobicContact CG-CD1 4.29Å; Q78-L82 WeakPolarHBondContact O-CB 3.49Å; Q78-L82 VanDerWaalsContact O-CG 3.29Å; Q78-L82 WeakPolarHBondContact O-CG 3.33Å; Q78-L82 PolarHBondContact O-N 2.75Å |
| 79 | R | 96.1 | Very high | 95.2 | Very high | 219 Ų | 219 | 91.2 Ų | 91.2 | 83% | 0.826 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -64.4 | -41.9 | 178.7 | -173.8 | 177.9 | 179.4 | -175.5 | -0.7 | 111.4 | T77 S83 | T77-R79 PolarHBondContact O-N 2.81Å; R79-S83 PolarHBondContact O-N 3.1Å |
| 80 | E | 96.1 | Very high | 94.8 | Very high | 82 Ų | 82 | 89.8 Ų | 89.8 | 38% | 0.383 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -65.7 | -47.5 | 176.2 | -72.1 | 162.4 | 152 | 0 | 0 | 111.1 | I76 T77 L82 S83 Y84 | I76-E80 HydrophobicContact CB-CB 4.44Å; T77-E80 WeakPolarHBondContact CB-OE2 3.49Å; T77-E80 PolarHBondContact N-OE2 2.88Å; T77-E80 PolarHBondContact O-N 2.8Å; T77-E80 VanDerWaalsContact OG1-CG 3.23Å; T77-E80 WeakPolarHBondContact OG1-CG 3.19Å; T77-E80 PolarHBondContact OG1-N 3.26Å; T77-E80 PolarHBondContact OG1-OE2 2.86Å; E80-L82 VanDerWaalsContact C-N 3.28Å; E80-L82 PolarHBondContact O-N 2.78Å; E80-S83 WeakPolarHBondContact O-CA 3.42Å; E80-S83 WeakPolarHBondContact O-CB 3.46Å; E80-S83 PolarHBondContact O-N 2.96Å; E80-S83 PolarHBondContact O-OG 3.34Å; E80-Y84 HydrophobicContact CB-CD2 4.49Å; E80-Y84 HydrophobicContact CB-CE2 4.04Å; E80-Y84 WeakPolarHBondContact O-CD2 3.31Å; E80-Y84 PolarHBondContact O-N 2.93Å |
| 81 | A | 95.1 | Very high | 94.3 | Very high | 8 Ų | 8 | 88.5 Ų | 88.5 | 7% | 0.066 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -54.9 | -44.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I76 T77 Q78 Y84 A85 | I76-A81 HydrophobicContact CD1-CB 3.79Å; I76-A81 HydrophobicContact CG1-CB 4.46Å; T77-A81 PolarHBondContact O-N 2.86Å; Q78-A81 PolarHBondContact O-N 2.78Å; A81-Y84 PolarHBondContact O-N 3.02Å; A81-A85 WeakPolarHBondContact O-CB 3.1Å; A81-A85 PolarHBondContact O-N 3.37Å |
| 82 | L | 94.4 | Very high | 93.7 | Very high | 102 Ų | 102 | 86.9 Ų | 86.9 | 53% | 0.534 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -64.5 | -41.1 | 175 | -71.3 | 174.9 | 0 | 0 | 0 | 112.2 | Q78 E80 Y84 A85 L86 | Q78-L82 HydrophobicContact CG-CD1 4.29Å; Q78-L82 WeakPolarHBondContact O-CB 3.49Å; Q78-L82 VanDerWaalsContact O-CG 3.29Å; Q78-L82 WeakPolarHBondContact O-CG 3.33Å; Q78-L82 PolarHBondContact O-N 2.75Å; E80-L82 VanDerWaalsContact C-N 3.28Å; E80-L82 PolarHBondContact O-N 2.78Å; L82-Y84 VanDerWaalsContact C-N 3.34Å; L82-Y84 PolarHBondContact O-N 3.2Å; L82-A85 PolarHBondContact O-N 3.26Å; L82-L86 WeakPolarHBondContact O-CG 3.42Å; L82-L86 PolarHBondContact O-N 3.2Å |
| 83 | S | 95.9 | Very high | 93.2 | Very high | 53 Ų | 53 | 84.8 Ų | 84.8 | 37% | 0.371 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -60.8 | -43.5 | 177.4 | 84 | 0 | 0 | 0 | 0 | 111.8 | R79 E80 L86 V87 | R79-S83 PolarHBondContact O-N 3.1Å; E80-S83 WeakPolarHBondContact O-CA 3.42Å; E80-S83 WeakPolarHBondContact O-CB 3.46Å; E80-S83 PolarHBondContact O-N 2.96Å; E80-S83 PolarHBondContact O-OG 3.34Å; S83-L86 PolarHBondContact O-N 3.16Å; S83-V87 WeakPolarHBondContact O-CG2 3.37Å; S83-V87 PolarHBondContact O-N 2.88Å; S83-V87 VanDerWaalsContact O-N 3.1Å |
| 84 | Y | 94.6 | Very high | 92.5 | Very high | 102 Ų | 102 | 89.8 Ų | 89.8 | 40% | 0.4 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -67 | -40.8 | 178 | -64.6 | -51.2 | 0 | 0 | 0 | 111.8 | L67 E80 A81 L82 L86 V87 L88 | L67-Y84 HydrophobicContact CD2-CD2 3.75Å; L67-Y84 HydrophobicContact CD2-CG 4.25Å; E80-Y84 HydrophobicContact CB-CD2 4.49Å; E80-Y84 HydrophobicContact CB-CE2 4.04Å; E80-Y84 WeakPolarHBondContact O-CD2 3.31Å; E80-Y84 PolarHBondContact O-N 2.93Å; A81-Y84 PolarHBondContact O-N 3.02Å; L82-Y84 VanDerWaalsContact C-N 3.34Å; L82-Y84 PolarHBondContact O-N 3.2Å; Y84-L86 VanDerWaalsContact C-N 3.3Å; Y84-L86 PolarHBondContact O-N 3.2Å; Y84-V87 PolarHBondContact O-N 3.02Å; Y84-L88 WeakPolarHBondContact O-CB 3.28Å; Y84-L88 PolarHBondContact O-N 3.05Å |
| 85 | A | 92.4 | Very high | 91.4 | Very high | 41 Ų | 41 | 89.3 Ų | 89.3 | 34% | 0.339 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -62.1 | -36.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | A81 L82 R89 | A81-A85 WeakPolarHBondContact O-CB 3.1Å; A81-A85 PolarHBondContact O-N 3.37Å; L82-A85 PolarHBondContact O-N 3.26Å; A85-R89 WeakPolarHBondContact O-CB 3.47Å; A85-R89 PolarHBondContact O-N 2.87Å |
| 86 | L | 94.3 | Very high | 90.1 | Very high | 102 Ų | 102 | 84.6 Ų | 84.6 | 53% | 0.534 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -66.3 | -48.8 | 175.6 | -73.5 | 172.1 | 0 | 0 | 0 | 112 | L82 S83 Y84 L88 R89 D90 | L82-L86 WeakPolarHBondContact O-CG 3.42Å; L82-L86 PolarHBondContact O-N 3.2Å; S83-L86 PolarHBondContact O-N 3.16Å; Y84-L86 VanDerWaalsContact C-N 3.3Å; Y84-L86 PolarHBondContact O-N 3.2Å; L86-L88 PolarHBondContact O-N 2.94Å; L86-R89 WeakPolarHBondContact O-CB 3.47Å; L86-R89 PolarHBondContact O-N 2.81Å; L86-R89 VanDerWaalsContact O-N 3.14Å; L86-D90 PolarHBondContact O-N 3.28Å |
| 87 | V | 93.3 | Very high | 88.9 | Confident | 101 Ų | 101 | 87.2 Ų | 87.2 | 61% | 0.612 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -56.9 | -43.4 | 176.2 | 172.7 | 0 | 0 | 0 | 0 | 110.6 | S83 Y84 D90 S91 | S83-V87 WeakPolarHBondContact O-CG2 3.37Å; S83-V87 PolarHBondContact O-N 2.88Å; S83-V87 VanDerWaalsContact O-N 3.1Å; Y84-V87 PolarHBondContact O-N 3.02Å; V87-D90 PolarHBondContact O-N 3.35Å; V87-S91 WeakPolarHBondContact O-CB 3.39Å; V87-S91 PolarHBondContact O-N 3.13Å |
| 88 | L | 90.5 | Very high | 87.4 | Confident | 21 Ų | 21 | 92.2 Ų | 92.2 | 11% | 0.11 | 47% | 0.466 | C | S | . | . | H | α-helix | trans | -61.8 | -46.7 | 177 | -171.1 | 68.1 | 0 | 0 | 0 | 111.6 | Q60 Y63 I64 Y84 L86 D90 S91 T92 | Q60-L88 HydrophobicContact CB-CD2 4.4Å; Q60-L88 HydrophobicContact CG-CD1 4.5Å; Q60-L88 HydrophobicContact CG-CD2 3.66Å; Q60-L88 HydrophobicContact CG-CG 4.05Å; Y63-L88 HydrophobicContact CD1-CD1 4.34Å; Y63-L88 HydrophobicContact CD1-CD2 3.72Å; Y63-L88 HydrophobicContact CE1-CD2 4.4Å; I64-L88 HydrophobicContact CD1-CD2 4.09Å; I64-L88 HydrophobicContact CG1-CD2 3.73Å; Y84-L88 WeakPolarHBondContact O-CB 3.28Å; Y84-L88 PolarHBondContact O-N 3.05Å; L86-L88 PolarHBondContact O-N 2.94Å; L88-D90 VanDerWaalsContact C-N 3.32Å; L88-D90 PolarHBondContact O-N 3.49Å; L88-S91 PolarHBondContact O-N 3.44Å; L88-S91 PolarHBondContact O-OG 2.96Å; L88-T92 PolarHBondContact O-N 2.88Å; L88-T92 PolarHBondContact O-OG1 3.16Å |
| 89 | R | 88.7 | Confident | 85.7 | Confident | 146 Ų | 146 | 91.8 Ų | 91.8 | 55% | 0.551 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -59.1 | -43.7 | 177.2 | -170.2 | -170.7 | -176.4 | -143.2 | 5 | 111.7 | A85 L86 T92 K93 | A85-R89 WeakPolarHBondContact O-CB 3.47Å; A85-R89 PolarHBondContact O-N 2.87Å; L86-R89 WeakPolarHBondContact O-CB 3.47Å; L86-R89 PolarHBondContact O-N 2.81Å; L86-R89 VanDerWaalsContact O-N 3.14Å; R89-T92 PolarHBondContact O-N 3.27Å; R89-K93 WeakPolarHBondContact O-CG 3.42Å; R89-K93 PolarHBondContact O-N 3.44Å |
| 90 | D | 90.1 | Very high | 83.6 | Confident | 71 Ų | 71 | 84.7 Ų | 84.7 | 38% | 0.38 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -70.6 | -36.1 | -179.8 | -72.6 | -16.4 | 0 | 0 | 0 | 112.2 | L86 V87 L88 T92 K93 R94 | L86-D90 PolarHBondContact O-N 3.28Å; V87-D90 PolarHBondContact O-N 3.35Å; L88-D90 VanDerWaalsContact C-N 3.32Å; L88-D90 PolarHBondContact O-N 3.49Å; D90-T92 VanDerWaalsContact C-N 3.33Å; D90-T92 PolarHBondContact O-N 3.34Å; D90-K93 PolarHBondContact O-N 2.94Å; D90-K93 IonicContact OD1-NZ 2.96Å; D90-R94 WeakPolarHBondContact O-CB 3.37Å; D90-R94 WeakPolarHBondContact O-CG 3.41Å; D90-R94 PolarHBondContact O-N 3.38Å |
| 91 | S | 85.5 | Confident | 81.5 | Confident | 41 Ų | 41 | 86.4 Ų | 86.4 | 29% | 0.287 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60 | -43.2 | 172 | 79.2 | 0 | 0 | 0 | 0 | 111.6 | V87 L88 R94 A95 | V87-S91 WeakPolarHBondContact O-CB 3.39Å; V87-S91 PolarHBondContact O-N 3.13Å; L88-S91 PolarHBondContact O-N 3.44Å; L88-S91 PolarHBondContact O-OG 2.96Å; S91-R94 PolarHBondContact O-N 3.13Å; S91-A95 WeakPolarHBondContact O-CB 3.44Å; S91-A95 PolarHBondContact O-N 3.08Å |
| 92 | T | 83.7 | Confident | 79.3 | Confident | 39 Ų | 39 | 93.3 Ų | 93.3 | 24% | 0.239 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -66.2 | -41.1 | 177.6 | -62.8 | 0 | 0 | 0 | 0 | 111.7 | W56 Q60 L88 R89 D90 A95 S96 | W56-T92 PolarHBondContact NE1-OG1 3.08Å; W56-T92 VanDerWaalsContact NE1-OG1 3.14Å; Q60-T92 PolarHBondContact OE1-OG1 2.96Å; L88-T92 PolarHBondContact O-N 2.88Å; L88-T92 PolarHBondContact O-OG1 3.16Å; R89-T92 PolarHBondContact O-N 3.27Å; D90-T92 VanDerWaalsContact C-N 3.33Å; D90-T92 PolarHBondContact O-N 3.34Å; T92-A95 PolarHBondContact O-N 3.1Å; T92-S96 WeakPolarHBondContact O-CB 3.38Å; T92-S96 PolarHBondContact O-N 3.02Å |
| 93 | K | 84.8 | Confident | 77 | Confident | 102 Ų | 102 | 99.1 Ų | 99.1 | 44% | 0.443 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.8 | -46.5 | 173.5 | -73.2 | 175.5 | -176.7 | 170.3 | 0 | 111.8 | R89 D90 S96 A97 | R89-K93 WeakPolarHBondContact O-CG 3.42Å; R89-K93 PolarHBondContact O-N 3.44Å; D90-K93 PolarHBondContact O-N 2.94Å; D90-K93 IonicContact OD1-NZ 2.96Å; K93-S96 PolarHBondContact O-N 2.73Å; K93-A97 WeakPolarHBondContact O-CB 3.3Å; K93-A97 PolarHBondContact O-N 3.34Å |
| 94 | R | 83.1 | Confident | 74.7 | Confident | 192 Ų | 192 | 103.1 Ų | 103.1 | 73% | 0.725 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.3 | -39.4 | 178.4 | -71 | 177.1 | -177.2 | -151.1 | 1.8 | 112.2 | D90 S91 A97 K98 | D90-R94 WeakPolarHBondContact O-CB 3.37Å; D90-R94 WeakPolarHBondContact O-CG 3.41Å; D90-R94 PolarHBondContact O-N 3.38Å; S91-R94 PolarHBondContact O-N 3.13Å; R94-A97 PolarHBondContact O-N 3.25Å; R94-K98 PolarHBondContact O-N 3.31Å |
| 95 | A | 73.4 | Confident | 72.8 | Confident | 51 Ų | 51 | 105.2 Ų | 105.2 | 42% | 0.421 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.4 | -43.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | S91 T92 K98 | S91-A95 WeakPolarHBondContact O-CB 3.44Å; S91-A95 PolarHBondContact O-N 3.08Å; T92-A95 PolarHBondContact O-N 3.1Å; A95-K98 PolarHBondContact O-N 3.17Å |
| 96 | S | 70.6 | Confident | 70.9 | Confident | 75 Ų | 75 | 107.7 Ų | 107.7 | 52% | 0.524 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.6 | -41.7 | 175.9 | -173.1 | 0 | 0 | 0 | 0 | 112.1 | T92 K93 K98 V99 | T92-S96 WeakPolarHBondContact O-CB 3.38Å; T92-S96 PolarHBondContact O-N 3.02Å; K93-S96 PolarHBondContact O-N 2.73Å; S96-K98 PolarHBondContact O-N 3Å; S96-V99 WeakPolarHBondContact O-CB 3.36Å; S96-V99 WeakPolarHBondContact O-CG2 3.49Å; S96-V99 PolarHBondContact O-N 3.46Å; S96-V99 VanDerWaalsContact O-N 3.17Å |
| 97 | A | 73.6 | Confident | 68.8 | Low | 80 Ų | 80 | 113.3 Ų | 113.3 | 66% | 0.661 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -66.3 | -22.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | K93 R94 V99 | K93-A97 WeakPolarHBondContact O-CB 3.3Å; K93-A97 PolarHBondContact O-N 3.34Å; R94-A97 PolarHBondContact O-N 3.25Å; A97-V99 VanDerWaalsContact C-N 3.25Å; A97-V99 PolarHBondContact O-N 2.91Å |
| 98 | K | 63.6 | Low | 66.8 | Low | 180 Ų | 180 | 117.4 Ų | 117.4 | 78% | 0.783 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -5.1 | 175.5 | -82.3 | -170.8 | 176.3 | -165 | 0 | 114 | R94 A95 S96 A100 | R94-K98 PolarHBondContact O-N 3.31Å; A95-K98 PolarHBondContact O-N 3.17Å; S96-K98 PolarHBondContact O-N 3Å; K98-A100 PolarHBondContact O-N 3.42Å |
| 99 | V | 60.7 | Low | 64.9 | Low | 119 Ų | 119 | 122.2 Ų | 122.2 | 72% | 0.721 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -67.7 | 89.6 | 164.4 | -178.5 | 0 | 0 | 0 | 0 | 106.6 | S96 A97 | S96-V99 WeakPolarHBondContact O-CB 3.36Å; S96-V99 WeakPolarHBondContact O-CG2 3.49Å; S96-V99 PolarHBondContact O-N 3.46Å; S96-V99 VanDerWaalsContact O-N 3.17Å; A97-V99 VanDerWaalsContact C-N 3.25Å; A97-V99 PolarHBondContact O-N 2.91Å |
| 100 | A | 51.4 | Low | 63.5 | Low | 71 Ų | 71 | 120.2 Ų | 120.2 | 59% | 0.587 | 64% | 0.64 | S | S | * | * | trans | -50.2 | 143.3 | -171 | 0 | 0 | 0 | 0 | 0 | 111.6 | K98 Q102 | K98-A100 PolarHBondContact O-N 3.42Å; A100-Q102 PolarHBondContact O-N 2.81Å | ||
| 101 | P | 50.8 | Low | 61.9 | Low | 118 Ų | 118 | 121.2 Ų | 121.2 | 77% | 0.766 | 66% | 0.658 | S | S | * | * | trans | -54.2 | 130.1 | 163.8 | -10.8 | 23.3 | 0 | 0 | 0 | 106.7 | R103 | P101-R103 PolarHBondContact O-N 3.12Š| ||
| 102 | Q | 49.7 | Very low | 60.3 | Low | 152 Ų | 152 | 126.7 Ų | 126.7 | 71% | 0.71 | 68% | 0.681 | S | S | * | * | trans | -33.3 | 110.5 | 173 | -78.1 | -86.2 | 6.6 | 0 | 0 | 108.8 | A100 T104 | A100-Q102 PolarHBondContact O-N 2.81Å; Q102-T104 VanDerWaalsContact C-N 3.28Å; Q102-T104 PolarHBondContact O-N 3.31Å | ||
| 103 | R | 46.7 | Very low | 58.9 | Low | 225 Ų | 225 | 130.9 Ų | 130.9 | 85% | 0.849 | 71% | 0.707 | S | S | * | * | trans | -56.7 | 106.1 | 169.4 | -84.4 | -176.6 | 175.5 | 140.1 | -2.3 | 104.6 | P101 I105 | P101-R103 PolarHBondContact O-N 3.12Å; R103-I105 HydrophobicContact CB-CG1 4.49Å; R103-I105 PolarHBondContact O-N 3.14Å | ||
| 104 | T | 47.9 | Very low | 57.5 | Low | 137 Ų | 137 | 136.4 Ų | 136.4 | 84% | 0.84 | 73% | 0.725 | S | S | * | * | trans | -64.7 | 89.9 | 165.8 | -25 | 0 | 0 | 0 | 0 | 103.5 | Q102 S106 | Q102-T104 VanDerWaalsContact C-N 3.28Å; Q102-T104 PolarHBondContact O-N 3.31Å; T104-S106 PolarHBondContact O-N 2.99Å | ||
| 105 | I | 54.8 | Low | 55.8 | Low | 146 Ų | 146 | 138.5 Ų | 138.5 | 75% | 0.749 | 73% | 0.733 | S | S | * | * | trans | -63.9 | 98.1 | 169 | -60.5 | 175.8 | 0 | 0 | 0 | 102.9 | R103 R107 | R103-I105 HydrophobicContact CB-CG1 4.49Å; R103-I105 PolarHBondContact O-N 3.14Å; I105-R107 VanDerWaalsContact C-N 3.26Å; I105-R107 PolarHBondContact O-N 2.89Å | ||
| 106 | S | 51.1 | Low | 54.4 | Low | 92 Ų | 92 | 141.3 Ų | 141.3 | 64% | 0.643 | 75% | 0.749 | S | S | * | * | trans | -57.1 | 101.5 | 168.6 | 177.1 | 0 | 0 | 0 | 0 | 105.4 | T104 K108 | T104-S106 PolarHBondContact O-N 2.99Å; S106-K108 PolarHBondContact O-N 2.86Å | ||
| 107 | R | 51.9 | Low | 53.1 | Low | 221 Ų | 221 | 143.2 Ų | 143.2 | 83% | 0.834 | 76% | 0.759 | S | S | * | * | trans | -68.3 | 81.9 | 177.2 | -177.1 | -179.7 | 174.2 | -175 | -2.2 | 106.4 | I105 T109 | I105-R107 VanDerWaalsContact C-N 3.26Å; I105-R107 PolarHBondContact O-N 2.89Å; R107-T109 PolarHBondContact O-N 2.81Å | ||
| 108 | K | 51.1 | Low | 52 | Low | 187 Ų | 187 | 144.6 Ų | 144.6 | 81% | 0.813 | 76% | 0.764 | S | S | * | * | trans | -62.4 | 109.1 | 161 | -74 | -175.6 | 176.6 | -177.1 | 0 | 105.9 | S106 S110 | S106-K108 PolarHBondContact O-N 2.86Å; K108-S110 VanDerWaalsContact C-N 3.26Å; K108-S110 PolarHBondContact O-N 2.95Å | ||
| 109 | T | 50.7 | Low | 51.2 | Low | 121 Ų | 121 | 142.3 Ų | 142.3 | 74% | 0.742 | 76% | 0.764 | S | S | * | * | trans | -61.1 | 89.4 | 170.1 | 25.7 | 0 | 0 | 0 | 0 | 108.4 | R107 A111 | R107-T109 PolarHBondContact O-N 2.81Å; T109-A111 PolarHBondContact O-N 2.76Å | ||
| 110 | S | 58.3 | Low | 50.8 | Low | 104 Ų | 104 | 143.3 Ų | 143.3 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | trans | -77.2 | 104.4 | 162.5 | -175.9 | 0 | 0 | 0 | 0 | 107 | K108 M112 | K108-S110 VanDerWaalsContact C-N 3.26Å; K108-S110 PolarHBondContact O-N 2.95Å; S110-M112 PolarHBondContact O-N 3.42Å | ||
| 111 | A | 56.7 | Low | 50.3 | Low | 92 Ų | 92 | 145.9 Ų | 145.9 | 76% | 0.76 | 78% | 0.776 | S | S | * | * | trans | -69.2 | 79.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 109 | T109 T113 | T109-A111 PolarHBondContact O-N 2.76Å; A111-T113 PolarHBondContact O-N 3.25Å | ||
| 112 | M | 51.3 | Low | 49.7 | Very low | 156 Ų | 156 | 146.2 Ų | 146.2 | 77% | 0.768 | 78% | 0.775 | S | S | * | * | trans | -82.9 | 92.4 | 168.1 | -169 | 93.3 | 141.4 | 0 | 0 | 107.6 | S110 R114 | S110-M112 PolarHBondContact O-N 3.42Å; M112-R114 VanDerWaalsContact C-N 3.31Å; M112-R114 PolarHBondContact O-N 3.2Å | ||
| 113 | T | 54.1 | Low | 49.6 | Very low | 127 Ų | 127 | 144.4 Ų | 144.4 | 78% | 0.779 | 78% | 0.78 | S | S | * | * | trans | -66.3 | 90.1 | 172.2 | -42.8 | 0 | 0 | 0 | 0 | 108.8 | A111 R115 | A111-T113 PolarHBondContact O-N 3.25Å; T113-R115 PolarHBondContact O-N 3.25Å; T113-R115 VanDerWaalsContact O-N 3.1Å | ||
| 114 | R | 55.7 | Low | 49.3 | Very low | 218 Ų | 218 | 139.3 Ų | 139.3 | 82% | 0.823 | 77% | 0.773 | S | S | * | * | trans | -67.9 | 107.5 | 164.5 | -72.7 | -167.3 | -169.5 | -176.2 | 3.7 | 107.2 | M112 C116 | M112-R114 VanDerWaalsContact C-N 3.31Å; M112-R114 PolarHBondContact O-N 3.2Å; R114-C116 VanDerWaalsContact C-N 3.34Å; R114-C116 PolarHBondContact O-N 3.4Å | ||
| 115 | R | 47 | Very low | 48.8 | Very low | 237 Ų | 237 | 138.6 Ų | 138.6 | 89% | 0.894 | 77% | 0.769 | S | S | * | * | trans | -65.8 | 99.3 | 159.6 | -78.8 | -171.4 | 176.7 | -175.4 | -0.2 | 107.2 | T113 P117 | T113-R115 PolarHBondContact O-N 3.25Å; T113-R115 VanDerWaalsContact O-N 3.1Å; R115-P117 WeakPolarHBondContact O-CD 3.44Å | ||
| 116 | C | 44.6 | Very low | 48 | Very low | 110 Ų | 110 | 139.3 Ų | 139.3 | 74% | 0.743 | 77% | 0.773 | S | S | * | * | trans | -67.2 | 121.1 | 158.9 | -64.2 | 0 | 0 | 0 | 0 | 106.9 | R114 S118 | R114-C116 VanDerWaalsContact C-N 3.34Å; R114-C116 PolarHBondContact O-N 3.4Å; C116-S118 PolarHBondContact O-N 3.14Å; C116-S118 VanDerWaalsContact O-N 3.13Å | ||
| 117 | P | 44.4 | Very low | 47.2 | Very low | 114 Ų | 114 | 143 Ų | 143 | 74% | 0.74 | 79% | 0.785 | S | S | * | * | trans | -66.2 | 114.3 | 162.4 | 26.5 | -28.5 | 0 | 0 | 0 | 107 | R115 V119 | R115-P117 WeakPolarHBondContact O-CD 3.44Å; P117-V119 PolarHBondContact O-N 2.99Å | ||
| 118 | S | 49.9 | Very low | 46.6 | Very low | 109 Ų | 109 | 142.3 Ų | 142.3 | 76% | 0.762 | 78% | 0.782 | S | S | * | * | trans | -65.6 | 101.8 | 170.9 | 57.6 | 0 | 0 | 0 | 0 | 108.4 | C116 L120 | C116-S118 PolarHBondContact O-N 3.14Å; C116-S118 VanDerWaalsContact O-N 3.13Å; S118-L120 PolarHBondContact O-N 3.35Å | ||
| 119 | V | 47.2 | Very low | 45.8 | Very low | 132 Ų | 132 | 138.3 Ų | 138.3 | 80% | 0.8 | 78% | 0.784 | S | S | * | * | trans | -82.8 | 101 | 168.5 | -177.9 | 0 | 0 | 0 | 0 | 106.5 | P117 | P117-V119 PolarHBondContact O-N 2.99Š| ||
| 120 | L | 51.3 | Low | 45.2 | Very low | 140 Ų | 140 | 140 Ų | 140 | 73% | 0.733 | 78% | 0.783 | S | S | * | * | trans | -52.3 | 140.2 | 166.3 | -74.4 | 157.2 | 0 | 0 | 0 | 109.2 | S118 V122 | S118-L120 PolarHBondContact O-N 3.35Å; L120-V122 PolarHBondContact O-N 3.33Å | ||
| 121 | P | 41.9 | Very low | 44.3 | Very low | 125 Ų | 125 | 140.7 Ų | 140.7 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | trans | -72.3 | 104.2 | 177.1 | 29.3 | -30.9 | 0 | 0 | 0 | 108.8 | S123 | P121-S123 PolarHBondContact O-N 3.35Š| ||
| 122 | V | 36.9 | Very low | 43.5 | Very low | 125 Ų | 125 | 145.8 Ų | 145.8 | 76% | 0.758 | 79% | 0.793 | S | S | * | * | trans | -74.8 | 108.8 | 167.2 | -176.7 | 0 | 0 | 0 | 0 | 107.1 | L120 V124 | L120-V122 PolarHBondContact O-N 3.33Å; V122-V124 HydrophobicContact CG1-CG2 3.86Å; V122-V124 PolarHBondContact O-N 3.17Å | ||
| 123 | S | 48.5 | Very low | 42.8 | Very low | 115 Ų | 115 | 149.6 Ų | 149.6 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | trans | -67.4 | 111.9 | 169.1 | 36.9 | 0 | 0 | 0 | 0 | 110.5 | P121 | P121-S123 PolarHBondContact O-N 3.35Š| ||
| 124 | V | 39.8 | Very low | 42.1 | Very low | 117 Ų | 117 | 147.4 Ų | 147.4 | 71% | 0.709 | 80% | 0.802 | S | S | * | * | trans | -142.6 | 102.5 | 165.3 | -171.7 | 0 | 0 | 0 | 0 | 111.2 | V122 | V122-V124 HydrophobicContact CG1-CG2 3.86Å; V122-V124 PolarHBondContact O-N 3.17Å | ||
| 125 | V | 38.5 | Very low | 41.2 | Very low | 123 Ų | 123 | 145 Ų | 145 | 75% | 0.745 | 80% | 0.8 | S | S | * | * | trans | 61.1 | 109.3 | 137.9 | -172.6 | 0 | 0 | 0 | 0 | 119.2 | L127 | V125-L127 PolarHBondContact O-N 3.17Š| ||
| 126 | L | 37.2 | Very low | 40.6 | Very low | 161 Ų | 161 | 142.9 Ų | 142.9 | 84% | 0.843 | 80% | 0.802 | S | S | * | * | trans | -57.8 | 112.8 | 160.8 | -172.8 | 79.6 | 0 | 0 | 0 | 110.9 | R128 | L126-R128 PolarHBondContact O-N 3.5Š| ||
| 127 | L | 34.4 | Very low | 40.6 | Very low | 169 Ų | 169 | 144.3 Ų | 144.3 | 89% | 0.885 | 80% | 0.802 | S | S | * | * | trans | -80.5 | 98.3 | 172.3 | -110.2 | 148 | 0 | 0 | 0 | 110.1 | V125 A129 | V125-L127 PolarHBondContact O-N 3.17Å; L127-A129 PolarHBondContact O-N 3.36Å | ||
| 128 | R | 38.6 | Very low | 40.2 | Very low | 206 Ų | 206 | 149 Ų | 149 | 78% | 0.777 | 81% | 0.805 | S | S | * | * | trans | -69.3 | 109.2 | 174.1 | -154.7 | 176.9 | -167.4 | 178 | 2.8 | 108.9 | L126 Q130 | L126-R128 PolarHBondContact O-N 3.5Å; R128-Q130 PolarHBondContact O-N 3.48Å; R128-Q130 VanDerWaalsContact O-N 3.17Å | ||
| 129 | A | 35.6 | Very low | 39.6 | Very low | 104 Ų | 104 | 155 Ų | 155 | 86% | 0.86 | 83% | 0.828 | S | S | * | * | trans | -68.8 | 108.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | L127 | L127-A129 PolarHBondContact O-N 3.36Š| ||
| 130 | Q | 37.4 | Very low | 39.3 | Very low | 156 Ų | 156 | 156.1 Ų | 156.1 | 73% | 0.729 | 83% | 0.829 | S | S | * | * | trans | -86.4 | 110.2 | 171 | -73.2 | -78.1 | 5.4 | 0 | 0 | 108.8 | R128 K132 | R128-Q130 PolarHBondContact O-N 3.48Å; R128-Q130 VanDerWaalsContact O-N 3.17Å; Q130-K132 PolarHBondContact O-N 3.4Å | ||
| 131 | S | 39.5 | Very low | 38.6 | Very low | 118 Ų | 118 | 156.9 Ų | 156.9 | 83% | 0.825 | 84% | 0.835 | S | S | * | * | trans | -75.8 | 108.7 | 170.9 | 179.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 132 | K | 39.1 | Very low | 38.4 | Very low | 200 Ų | 200 | 158.7 Ų | 158.7 | 87% | 0.87 | 84% | 0.836 | S | S | * | * | trans | -88.4 | 119.1 | 171.6 | -89.3 | -175.6 | 174.8 | -178.4 | 0 | 109.9 | Q130 G134 | Q130-K132 PolarHBondContact O-N 3.4Å; K132-G134 PolarHBondContact O-N 3.37Å | ||
| 133 | R | 37.5 | Very low | 38.5 | Very low | 235 Ų | 235 | 160.7 Ų | 160.7 | 89% | 0.887 | 84% | 0.84 | S | S | * | * | trans | -54.4 | 128 | 163.6 | -72.4 | 177.5 | -171.7 | -169.3 | 1.1 | 110.1 | ||||
| 134 | G | 38.7 | Very low | 37.9 | Very low | 81 Ų | 81 | 163.6 Ų | 163.6 | 84% | 0.835 | 84% | 0.843 | S | S | * | * | trans | -105.5 | 100.4 | 158.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | K132 | K132-G134 PolarHBondContact O-N 3.37Š| ||
| 135 | Q | 36.8 | Very low | 37.8 | Very low | 168 Ų | 168 | 166.7 Ų | 166.7 | 79% | 0.785 | 85% | 0.852 | S | S | * | * | trans | -78.5 | 128 | 156.6 | -83.8 | 175.6 | -14.4 | 0 | 0 | 107.2 | ||||
| 136 | M | 35.3 | Very low | 37.7 | Very low | 192 Ų | 192 | 169.8 Ų | 169.8 | 95% | 0.946 | 86% | 0.859 | S | S | * | * | trans | -114.8 | 126 | 157.8 | -80.9 | -164.9 | 74 | 0 | 0 | 108 | ||||
| 137 | L | 43.2 | Very low | 37.8 | Very low | 140 Ų | 140 | 170.5 Ų | 170.5 | 73% | 0.733 | 86% | 0.86 | S | S | * | * | trans | -108.4 | 142.7 | 176 | -101.8 | 161.3 | 0 | 0 | 0 | 109.2 | ||||
| 138 | R | 36.4 | Very low | 38.1 | Very low | 214 Ų | 214 | 170.6 Ų | 170.6 | 81% | 0.808 | 86% | 0.858 | S | S | * | * | trans | 70.9 | 126.4 | 154.2 | -74.6 | 178.2 | 175.6 | -125.2 | 0.1 | 118.9 | ||||
| 139 | N | 38.7 | Very low | 38 | Very low | 233 Ų | 233 | 167.4 Ų | 167.4 | 100% | 1.246 | 87% | 0.866 | S | S | * | * | -137.2 | 0 | 73.6 | -74.9 | -36.8 | 0 | 0 | 0 | 111.1 |
Retrieved 139 of 139 residues in 233.1 ms
(Link to these results)