| 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 | 39 | Very low | 58.2 | Low | 246 Ų | 246 | 151.8 Ų | 151.8 | 100% | 1.212 | 77% | 0.765 | S | S | * | * | 0 | 104.2 | 0 | -65.7 | 173.8 | -161.4 | 0 | 0 | 106.3 | |||||
| 2 | T | 43.1 | Very low | 59.3 | Low | 130 Ų | 130 | 145.6 Ų | 145.6 | 80% | 0.798 | 74% | 0.743 | S | S | * | * | trans | -99 | 116.7 | -175.7 | 47.8 | 0 | 0 | 0 | 0 | 108.9 | E4 | T2-E4 PolarHBondContact O-N 3.3Š| ||
| 3 | E | 55.5 | Low | 60.1 | Low | 185 Ų | 185 | 145.2 Ų | 145.2 | 86% | 0.864 | 74% | 0.736 | S | S | * | * | trans | -66.9 | 115.9 | 177.5 | -65.8 | -178.8 | 161.5 | 0 | 0 | 110 | V5 | E3-V5 PolarHBondContact O-N 3.11Š| ||
| 4 | E | 57.8 | Low | 60.6 | Low | 98 Ų | 98 | 146.5 Ų | 146.5 | 46% | 0.458 | 73% | 0.727 | S | S | . | * | trans | -83.1 | 107.1 | 175.8 | -65.5 | -175.9 | 176.9 | 0 | 0 | 109 | T2 W6 R14 | T2-E4 PolarHBondContact O-N 3.3Å; E4-W6 PolarHBondContact O-N 2.85Å; E4-R14 IonicContact OE1-CZ 3.04Å; E4-R14 IonicContact OE1-NH1 2.77Å; E4-R14 PolarHBondContact OE1-NH1 3.06Å; E4-R14 IonicContact OE1-NH2 2.65Å; E4-R14 PolarHBondContact OE1-NH2 2.99Å; E4-R14 IonicContact OE2-CZ 3.85Å; E4-R14 IonicContact OE2-NH2 2.77Å; E4-R14 PolarHBondContact OE2-NH2 3.01Å | ||
| 5 | V | 60 | Low | 61.3 | Low | 123 Ų | 123 | 143.2 Ų | 143.2 | 75% | 0.745 | 72% | 0.721 | S | S | * | * | trans | -77.7 | 115.3 | 176.1 | -179.4 | 0 | 0 | 0 | 0 | 109.1 | E3 | E3-V5 PolarHBondContact O-N 3.11Š| ||
| 6 | W | 56.7 | Low | 62.2 | Low | 150 Ų | 150 | 149.2 Ų | 149.2 | 57% | 0.568 | 73% | 0.732 | S | S | * | * | trans | -87.4 | 140 | 177.6 | -70.3 | 77.6 | 0 | 0 | 0 | 111.3 | E4 R11 | E4-W6 PolarHBondContact O-N 2.85Å; W6-R11 HydrophobicContact CZ3-CG 4.08Å | ||
| 7 | M | 55.2 | Low | 63.1 | Low | 152 Ų | 152 | 142.7 Ų | 142.7 | 75% | 0.749 | 71% | 0.713 | S | S | * | * | B | Isolated β-bridge | trans | -123.9 | 90.2 | 166.3 | -70.3 | -164.6 | 174 | 0 | 0 | 109.7 | ||
| 8 | G | 73.8 | Confident | 63.7 | Low | 67 Ų | 67 | 139.6 Ų | 139.6 | 69% | 0.691 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 64.8 | -146.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115 | W10 | G8-W10 VanDerWaalsContact C-N 3.33Š|
| 9 | T | 70.9 | Confident | 64 | Low | 156 Ų | 156 | 138.1 Ų | 138.1 | 96% | 0.957 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -5.7 | -177.2 | 50.9 | 0 | 0 | 0 | 0 | 114.3 | ||
| 10 | W | 56.7 | Low | 63.9 | Low | 176 Ų | 176 | 138.5 Ų | 138.5 | 67% | 0.667 | 70% | 0.698 | S | S | * | * | B | Isolated β-bridge | trans | -96.2 | 128.2 | -177.9 | -177.5 | 85 | 0 | 0 | 0 | 110.6 | G8 P12 | G8-W10 VanDerWaalsContact C-N 3.33Å; W10-P12 HydrophobicContact CE3-CB 4.32Å; W10-P12 HydrophobicContact CE3-CG 4.29Å; W10-P12 VanDerWaalsContact CH2-CA 3.48Å; W10-P12 HydrophobicContact CH2-CB 3.71Å; W10-P12 VanDerWaalsContact CZ3-CA 3.46Å; W10-P12 HydrophobicContact CZ3-CB 3.48Å; W10-P12 VanDerWaalsContact CZ3-CB 3.48Å; W10-P12 HydrophobicContact CZ3-CG 3.78Å |
| 11 | R | 71.7 | Confident | 63.8 | Low | 187 Ų | 187 | 136.7 Ų | 136.7 | 71% | 0.706 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -97.4 | 118.9 | 174.9 | -66.8 | -175.4 | -177.8 | -177.2 | 0.8 | 109.3 | W6 H13 | W6-R11 HydrophobicContact CZ3-CG 4.08Å; R11-H13 PolarHBondContact O-N 3.37Å |
| 12 | P | 70.8 | Confident | 65 | Low | 77 Ų | 77 | 131 Ų | 131 | 50% | 0.5 | 68% | 0.679 | S | S | . | * | P | Polyproline II helix | trans | -60.5 | 128 | 170.6 | 6.2 | -5.4 | 0 | 0 | 0 | 109.8 | W10 R14 | W10-P12 HydrophobicContact CE3-CB 4.32Å; W10-P12 HydrophobicContact CE3-CG 4.29Å; W10-P12 VanDerWaalsContact CH2-CA 3.48Å; W10-P12 HydrophobicContact CH2-CB 3.71Å; W10-P12 VanDerWaalsContact CZ3-CA 3.46Å; W10-P12 HydrophobicContact CZ3-CB 3.48Å; W10-P12 VanDerWaalsContact CZ3-CB 3.48Å; W10-P12 HydrophobicContact CZ3-CG 3.78Å; P12-R14 PolarHBondContact O-N 3.2Å; P12-R14 VanDerWaalsContact O-N 3.14Å |
| 13 | H | 69.8 | Low | 66.3 | Low | 140 Ų | 140 | 131.2 Ų | 131.2 | 65% | 0.648 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 116.5 | 177.1 | -178.1 | -1.4 | 0 | 0 | 0 | 109.3 | R11 | R11-H13 PolarHBondContact O-N 3.37Š|
| 14 | R | 67.9 | Low | 66.5 | Low | 164 Ų | 164 | 128.3 Ų | 128.3 | 62% | 0.619 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 127.7 | 170.5 | -64.3 | -175.4 | -158.3 | 176 | 12.8 | 109.6 | E4 P12 R16 | E4-R14 IonicContact OE1-CZ 3.04Å; E4-R14 IonicContact OE1-NH1 2.77Å; E4-R14 PolarHBondContact OE1-NH1 3.06Å; E4-R14 IonicContact OE1-NH2 2.65Å; E4-R14 PolarHBondContact OE1-NH2 2.99Å; E4-R14 IonicContact OE2-CZ 3.85Å; E4-R14 IonicContact OE2-NH2 2.77Å; E4-R14 PolarHBondContact OE2-NH2 3.01Å; P12-R14 PolarHBondContact O-N 3.2Å; P12-R14 VanDerWaalsContact O-N 3.14Å; R14-R16 PolarHBondContact O-N 3.3Å |
| 15 | P | 70 | Confident | 66.6 | Low | 97 Ų | 97 | 127.3 Ų | 127.3 | 63% | 0.63 | 67% | 0.67 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 133.9 | 177.7 | 23.7 | -32.1 | 0 | 0 | 0 | 109.7 | G17 | P15-G17 PolarHBondContact O-N 3.11Å; P15-G17 VanDerWaalsContact O-N 3.1Å |
| 16 | R | 76.3 | Confident | 66.7 | Low | 239 Ų | 239 | 128 Ų | 128 | 90% | 0.902 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -72.6 | 1.5 | -173.4 | -63 | -163 | 175.9 | -165.8 | -1.9 | 114.4 | R14 | R14-R16 PolarHBondContact O-N 3.3Š|
| 17 | G | 78.3 | Confident | 66.8 | Low | 39 Ų | 39 | 122.9 Ų | 122.9 | 40% | 0.402 | 67% | 0.671 | S | S | . | * | S | Bend | trans | 167.3 | 172.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110.5 | P15 I19 | P15-G17 PolarHBondContact O-N 3.11Å; P15-G17 VanDerWaalsContact O-N 3.1Å; G17-I19 PolarHBondContact O-N 3.24Å |
| 18 | P | 73.6 | Confident | 66.9 | Low | 86 Ų | 86 | 121.2 Ų | 121.2 | 56% | 0.558 | 67% | 0.671 | S | S | * | * | trans | -65.1 | 124.6 | 174.6 | 28 | -32.9 | 0 | 0 | 0 | 109.7 | L22 Y23 | P18-L22 HydrophobicContact CB-CD1 4.31Å; P18-Y23 HydrophobicContact CB-CE2 3.8Å; P18-Y23 WeakPolarHBondContact CB-OH 3.18Å; P18-Y23 HydrophobicContact CG-CE2 4.26Å; P18-Y23 VanDerWaalsContact CG-OH 3.27Å; P18-Y23 WeakPolarHBondContact CG-OH 3.4Å | ||
| 19 | I | 68.6 | Low | 65.9 | Low | 112 Ų | 112 | 127.3 Ų | 127.3 | 57% | 0.574 | 68% | 0.679 | S | S | * | * | trans | -86.5 | 144.7 | 176.2 | -33.9 | 172 | 0 | 0 | 0 | 107.6 | G17 A21 L22 | G17-I19 PolarHBondContact O-N 3.24Å; I19-A21 PolarHBondContact O-N 3.26Å; I19-L22 WeakPolarHBondContact O-CB 3.38Å; I19-L22 PolarHBondContact O-N 3.27Å | ||
| 20 | M | 61.5 | Low | 65.4 | Low | 146 Ų | 146 | 129 Ų | 129 | 72% | 0.719 | 67% | 0.669 | S | S | * | * | G | 310 helix | trans | -49.3 | -27.7 | -178.1 | -80.5 | -73.3 | -67.5 | 0 | 0 | 115.1 | L22 Y23 | M20-L22 PolarHBondContact O-N 3.14Å; M20-Y23 PolarHBondContact O-N 3.4Å; M20-Y23 VanDerWaalsContact O-N 3.16Å |
| 21 | A | 63.3 | Low | 65.8 | Low | 101 Ų | 101 | 128.8 Ų | 128.8 | 84% | 0.835 | 68% | 0.679 | S | S | * | * | G | 310 helix | trans | -67.2 | -16.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | I19 Y23 | I19-A21 PolarHBondContact O-N 3.26Å; A21-Y23 VanDerWaalsContact C-N 3.33Å |
| 22 | L | 64.6 | Low | 65.7 | Low | 126 Ų | 126 | 126.7 Ų | 126.7 | 66% | 0.66 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -81.3 | -15 | 174 | -67.8 | 165.3 | 0 | 0 | 0 | 112.5 | P18 I19 M20 | P18-L22 HydrophobicContact CB-CD1 4.31Å; I19-L22 WeakPolarHBondContact O-CB 3.38Å; I19-L22 PolarHBondContact O-N 3.27Å; M20-L22 PolarHBondContact O-N 3.14Å |
| 23 | Y | 68.6 | Low | 65.8 | Low | 134 Ų | 134 | 125.9 Ų | 125.9 | 53% | 0.525 | 68% | 0.676 | S | S | . | * | S | Bend | trans | -94.9 | 113.7 | 174.1 | -62.2 | -82.6 | 0 | 0 | 0 | 108.3 | P18 M20 A21 S25 | P18-Y23 HydrophobicContact CB-CE2 3.8Å; P18-Y23 WeakPolarHBondContact CB-OH 3.18Å; P18-Y23 HydrophobicContact CG-CE2 4.26Å; P18-Y23 VanDerWaalsContact CG-OH 3.27Å; P18-Y23 WeakPolarHBondContact CG-OH 3.4Å; M20-Y23 PolarHBondContact O-N 3.4Å; M20-Y23 VanDerWaalsContact O-N 3.16Å; A21-Y23 VanDerWaalsContact C-N 3.33Å; Y23-S25 PolarHBondContact O-N 3.23Å |
| 24 | S | 61.4 | Low | 65.9 | Low | 125 Ų | 125 | 122.1 Ų | 122.1 | 87% | 0.874 | 66% | 0.664 | S | S | * | * | trans | -68.3 | 69.3 | 166.1 | 36.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 25 | S | 58.6 | Low | 66.2 | Low | 76 Ų | 76 | 117.2 Ų | 117.2 | 53% | 0.531 | 65% | 0.652 | S | S | . | * | trans | -60.9 | 151.6 | 162.1 | 59.4 | 0 | 0 | 0 | 0 | 108.3 | Y23 G27 | Y23-S25 PolarHBondContact O-N 3.23Å; S25-G27 PolarHBondContact O-N 3.28Å | ||
| 26 | P | 62.9 | Low | 66.5 | Low | 139 Ų | 139 | 116.4 Ų | 116.4 | 90% | 0.903 | 65% | 0.645 | S | S | * | * | trans | -67.6 | 68.9 | 167.2 | 29.8 | -32.7 | 0 | 0 | 0 | 108.4 | ||||
| 27 | G | 59.1 | Low | 66.3 | Low | 42 Ų | 42 | 105.5 Ų | 105.5 | 43% | 0.433 | 61% | 0.608 | S | S | . | * | trans | -62.2 | 155.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | S25 K29 | S25-G27 PolarHBondContact O-N 3.28Å; G27-K29 PolarHBondContact O-N 3.29Å | ||
| 28 | P | 55.7 | Low | 66 | Low | 116 Ų | 116 | 111.1 Ų | 111.1 | 75% | 0.753 | 62% | 0.621 | S | S | * | * | trans | -49.8 | 125.7 | -163.4 | 18.9 | -31.5 | 0 | 0 | 0 | 111.5 | Y30 | P28-Y30 PolarHBondContact O-N 3.07Š| ||
| 29 | K | 52.9 | Low | 66.1 | Low | 196 Ų | 196 | 114.2 Ų | 114.2 | 85% | 0.852 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -65 | 25 | 178.6 | -163.2 | -177 | 174 | 178.8 | 0 | 113.2 | G27 | G27-K29 PolarHBondContact O-N 3.29Š|
| 30 | Y | 61.1 | Low | 66.5 | Low | 191 Ų | 191 | 117.5 Ų | 117.5 | 75% | 0.749 | 64% | 0.64 | S | S | * | * | trans | -128.2 | 90.8 | 178.9 | -51.6 | -69.8 | 0 | 0 | 0 | 107.1 | P28 I32 | P28-Y30 PolarHBondContact O-N 3.07Å; Y30-I32 PolarHBondContact O-N 3.15Å | ||
| 31 | L | 64.7 | Low | 67.4 | Low | 171 Ų | 171 | 112.4 Ų | 112.4 | 90% | 0.895 | 61% | 0.614 | S | S | * | * | trans | -57.4 | 110.1 | 166.3 | -90.7 | 118.1 | 0 | 0 | 0 | 107.8 | P33 | L31-P33 WeakPolarHBondContact O-CD 3.46Š| ||
| 32 | I | 70.4 | Confident | 68.1 | Low | 143 Ų | 143 | 108.3 Ų | 108.3 | 73% | 0.733 | 58% | 0.579 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 124.2 | 168.1 | -58.9 | 173.2 | 0 | 0 | 0 | 106.2 | Y30 | Y30-I32 PolarHBondContact O-N 3.15Š|
| 33 | P | 71.7 | Confident | 68.7 | Low | 60 Ų | 60 | 108.4 Ų | 108.4 | 39% | 0.39 | 59% | 0.588 | S | S | . | * | P | Polyproline II helix | trans | -65.4 | 144.6 | -178.6 | -13.7 | 26.3 | 0 | 0 | 0 | 110.5 | L31 K40 T42 | L31-P33 WeakPolarHBondContact O-CD 3.46Å; P33-K40 VanDerWaalsContact CB-O 3.24Å; P33-K40 WeakPolarHBondContact CB-O 3.17Å; P33-T42 HydrophobicContact CB-CG2 3.52Å; P33-T42 HydrophobicContact CG-CG2 3.65Å |
| 34 | P | 73.1 | Confident | 69.3 | Low | 61 Ų | 61 | 108 Ų | 108 | 40% | 0.396 | 60% | 0.599 | S | S | . | * | P | Polyproline II helix | trans | -63.6 | 147.8 | -176.5 | 26.3 | -35.1 | 0 | 0 | 0 | 111.7 | K40 H41 | P34-K40 WeakPolarHBondContact CD-O 2.98Å; P34-H41 WeakPolarHBondContact O-CA 3.38Å |
| 35 | T | 74 | Confident | 70.2 | Confident | 62 Ų | 62 | 107.7 Ų | 107.7 | 38% | 0.38 | 58% | 0.582 | S | S | . | * | S | Bend | trans | -93.2 | -1.2 | 174.9 | 51.7 | 0 | 0 | 0 | 0 | 113.1 | H41 K45 A48 | T35-H41 PolarHBondContact O-CD2 3.26Å; T35-H41 VanDerWaalsContact O-CD2 3.29Å; T35-K45 HydrophobicContact CG2-CD 3.76Å; T35-A48 PolarHBondContact O-N 2.52Å |
| 36 | T | 76.2 | Confident | 71.2 | Confident | 79 Ų | 79 | 112.2 Ų | 112.2 | 49% | 0.485 | 60% | 0.599 | S | S | . | * | B | Isolated β-bridge | trans | -112.8 | 139.8 | -179.1 | 38.4 | 0 | 0 | 0 | 0 | 111.1 | A48 | T36-A48 HydrophobicContact CG2-CB 3.84Å |
| 37 | G | 71.9 | Confident | 72 | Confident | 11 Ų | 11 | 112.1 Ų | 112.1 | 11% | 0.113 | 58% | 0.581 | C | S | . | * | S | Bend | trans | 86.1 | 176.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | R47 A48 | G37-R47 PolarHBondContact O-NE 3.43Å; G37-A48 PolarHBondContact N-O 3.23Å |
| 38 | F | 72 | Confident | 72.9 | Confident | 156 Ų | 156 | 111.9 Ų | 111.9 | 68% | 0.684 | 58% | 0.575 | S | S | * | * | S | Bend | trans | -88.2 | -40.2 | -177.8 | -170.5 | -110 | 0 | 0 | 0 | 112.4 | K40 R47 | F38-K40 PolarHBondContact O-N 2.87Å; F38-R47 VanDerWaalsContact CA-NH2 3.34Å |
| 39 | M | 75.8 | Confident | 73.7 | Confident | 151 Ų | 151 | 110.6 Ų | 110.6 | 74% | 0.744 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | 124.8 | -171 | -59.3 | -119.3 | 76.5 | 0 | 0 | 109.7 | H41 | M39-H41 VanDerWaalsContact C-N 3.31Å; M39-H41 PolarHBondContact O-N 3.04Å |
| 40 | K | 76.4 | Confident | 74.7 | Confident | 182 Ų | 182 | 104.4 Ų | 104.4 | 79% | 0.791 | 55% | 0.552 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 62.5 | 28 | 176.8 | -53.7 | 178.9 | 178.6 | 178.1 | 0 | 115 | P33 P34 F38 | P33-K40 VanDerWaalsContact CB-O 3.24Å; P33-K40 WeakPolarHBondContact CB-O 3.17Å; P34-K40 WeakPolarHBondContact CD-O 2.98Å; F38-K40 PolarHBondContact O-N 2.87Å |
| 41 | H | 80.9 | Confident | 75.2 | Confident | 38 Ų | 38 | 104.7 Ų | 104.7 | 18% | 0.176 | 55% | 0.553 | C | S | . | * | trans | -71 | 141.4 | 174.8 | 173.5 | -76.6 | 0 | 0 | 0 | 111.9 | P34 T35 M39 K45 L46 R47 | P34-H41 WeakPolarHBondContact O-CA 3.38Å; T35-H41 PolarHBondContact O-CD2 3.26Å; T35-H41 VanDerWaalsContact O-CD2 3.29Å; M39-H41 VanDerWaalsContact C-N 3.31Å; M39-H41 PolarHBondContact O-N 3.04Å; H41-K45 PolarHBondContact CE1-O 2.76Å; H41-L46 PolarHBondContact NE2-O 3.36Å; H41-R47 VanDerWaalsContact NE2-CA 3.35Å; H41-R47 WeakPolarHBondContact NE2-CA 3.35Å | ||
| 42 | T | 78.2 | Confident | 75.4 | Confident | 15 Ų | 15 | 101.9 Ų | 101.9 | 9% | 0.092 | 55% | 0.548 | C | S | . | . | trans | -69.7 | 117.1 | 177.1 | 52.3 | 0 | 0 | 0 | 0 | 112.1 | P33 T44 K45 | P33-T42 HydrophobicContact CB-CG2 3.52Å; P33-T42 HydrophobicContact CG-CG2 3.65Å; T42-T44 PolarHBondContact O-N 2.67Å; T42-K45 PolarHBondContact O-N 3.2Å | ||
| 43 | P | 76.9 | Confident | 75.4 | Confident | 129 Ų | 129 | 104.6 Ų | 104.6 | 84% | 0.838 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.5 | -15 | -175.3 | 26.8 | -35.4 | 0 | 0 | 0 | 114.4 | ||
| 44 | T | 81.3 | Confident | 74.9 | Confident | 126 Ų | 126 | 113 Ų | 113 | 77% | 0.773 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | -8.3 | -178.8 | 56.8 | 0 | 0 | 0 | 0 | 114.4 | T42 | T42-T44 PolarHBondContact O-N 2.67Š|
| 45 | K | 81.3 | Confident | 74.7 | Confident | 118 Ų | 118 | 113 Ų | 113 | 51% | 0.513 | 59% | 0.589 | S | S | . | * | S | Bend | trans | -119.6 | 158.7 | -176.6 | -65.4 | -177.7 | 177.6 | -179.7 | 0 | 111.4 | T35 H41 T42 | T35-K45 HydrophobicContact CG2-CD 3.76Å; H41-K45 PolarHBondContact CE1-O 2.76Å; T42-K45 PolarHBondContact O-N 3.2Å |
| 46 | L | 79.4 | Confident | 74.2 | Confident | 170 Ų | 170 | 114.5 Ų | 114.5 | 89% | 0.89 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 146.1 | 171.2 | -65.3 | 174.9 | 0 | 0 | 0 | 110.4 | H41 | H41-L46 PolarHBondContact NE2-O 3.36Š|
| 47 | R | 80.1 | Confident | 73.6 | Confident | 137 Ų | 137 | 116 Ų | 116 | 52% | 0.517 | 62% | 0.619 | S | S | . | * | P | Polyproline II helix | trans | -91.6 | 123.7 | -176.2 | -178.3 | 176 | 174.5 | -140 | -10.1 | 111.4 | G37 F38 H41 | G37-R47 PolarHBondContact O-NE 3.43Å; F38-R47 VanDerWaalsContact CA-NH2 3.34Å; H41-R47 VanDerWaalsContact NE2-CA 3.35Å; H41-R47 WeakPolarHBondContact NE2-CA 3.35Å |
| 48 | A | 76.2 | Confident | 73.1 | Confident | 37 Ų | 37 | 123.9 Ų | 123.9 | 31% | 0.306 | 66% | 0.655 | S | S | . | * | B | Isolated β-bridge | trans | -85.4 | 143.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | T35 T36 G37 | T35-A48 PolarHBondContact O-N 2.52Å; T36-A48 HydrophobicContact CG2-CB 3.84Å; G37-A48 PolarHBondContact N-O 3.23Å |
| 49 | P | 73.9 | Confident | 72.5 | Confident | 90 Ų | 90 | 123.8 Ų | 123.8 | 58% | 0.584 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 142.5 | 177.2 | 26.5 | -33.7 | 0 | 0 | 0 | 111.2 | Y51 | P49-Y51 HydrophobicContact CB-CE2 4.06Å; P49-Y51 HydrophobicContact CG-CE2 4.06Å |
| 50 | A | 72.9 | Confident | 71.7 | Confident | 66 Ų | 66 | 123.1 Ų | 123.1 | 55% | 0.545 | 66% | 0.66 | S | S | . | * | trans | -111.9 | 115.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 51 | Y | 71.1 | Confident | 70.7 | Confident | 197 Ų | 197 | 118.9 Ų | 118.9 | 77% | 0.773 | 66% | 0.658 | S | S | * | * | trans | -93.3 | 114.3 | 173.9 | -62.2 | -81.9 | 0 | 0 | 0 | 108.6 | P49 | P49-Y51 HydrophobicContact CB-CE2 4.06Å; P49-Y51 HydrophobicContact CG-CE2 4.06Å | ||
| 52 | S | 69.5 | Low | 69.7 | Low | 112 Ų | 112 | 123.8 Ų | 123.8 | 78% | 0.783 | 68% | 0.682 | S | S | * | * | trans | -93.4 | 119.2 | 167.5 | 58.5 | 0 | 0 | 0 | 0 | 108.8 | R54 | S52-R54 PolarHBondContact O-N 3.12Š| ||
| 53 | F | 71 | Confident | 68.8 | Low | 199 Ų | 199 | 128.4 Ų | 128.4 | 87% | 0.873 | 71% | 0.706 | S | S | * | * | trans | -70.6 | 121.7 | 160.7 | -63.6 | -76.3 | 0 | 0 | 0 | 107.3 | G55 | F53-G55 PolarHBondContact O-N 2.92Š| ||
| 54 | R | 61.2 | Low | 67.8 | Low | 238 Ų | 238 | 128.6 Ų | 128.6 | 90% | 0.898 | 71% | 0.709 | S | S | * | * | trans | -59.1 | 111 | 175.8 | -179.6 | -175.8 | -71.3 | -91.2 | 2.7 | 107.4 | S52 | S52-R54 PolarHBondContact O-N 3.12Š| ||
| 55 | G | 68.5 | Low | 66.9 | Low | 60 Ų | 60 | 126.8 Ų | 126.8 | 62% | 0.619 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 146 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | F53 | F53-G55 PolarHBondContact O-N 2.92Š|
| 56 | A | 64.6 | Low | 66.2 | Low | 94 Ų | 94 | 128.4 Ų | 128.4 | 78% | 0.777 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 135.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | M58 | A56-M58 PolarHBondContact O-N 3.36Š|
| 57 | P | 63.7 | Low | 65.6 | Low | 110 Ų | 110 | 122.2 Ų | 122.2 | 71% | 0.714 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 134.5 | 174.6 | 25.2 | -32.3 | 0 | 0 | 0 | 109.2 | L59 | P57-L59 PolarHBondContact O-N 2.95Š|
| 58 | M | 60.3 | Low | 65.1 | Low | 176 Ų | 176 | 120.2 Ų | 120.2 | 87% | 0.867 | 71% | 0.706 | S | S | * | * | trans | -55.9 | 113.7 | 169.7 | -99.2 | -167.8 | 77.4 | 0 | 0 | 108 | A56 L60 | A56-M58 PolarHBondContact O-N 3.36Å; M58-L60 PolarHBondContact O-N 2.83Å; M58-L60 VanDerWaalsContact O-N 3.11Å | ||
| 59 | L | 59.4 | Low | 64.6 | Low | 154 Ų | 154 | 126.3 Ų | 126.3 | 81% | 0.806 | 72% | 0.721 | S | S | * | * | trans | -67.9 | 109.1 | 166.2 | -64.9 | 179.5 | 0 | 0 | 0 | 106.4 | P57 A61 | P57-L59 PolarHBondContact O-N 2.95Å; L59-A61 VanDerWaalsContact C-N 3.27Å; L59-A61 PolarHBondContact O-N 2.76Å | ||
| 60 | L | 58 | Low | 64.4 | Low | 138 Ų | 138 | 130.8 Ų | 130.8 | 72% | 0.723 | 73% | 0.727 | S | S | * | * | trans | -66 | 93.2 | 170.5 | -157.1 | 81 | 0 | 0 | 0 | 107.1 | M58 E62 | M58-L60 PolarHBondContact O-N 2.83Å; M58-L60 VanDerWaalsContact O-N 3.11Å; L60-E62 HydrophobicContact CG-CG 4.44Å; L60-E62 PolarHBondContact O-N 3.01Å | ||
| 61 | A | 57.5 | Low | 64.3 | Low | 92 Ų | 92 | 134.2 Ų | 134.2 | 76% | 0.76 | 74% | 0.737 | S | S | * | * | trans | -78.5 | 56.7 | -173.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L59 | L59-A61 VanDerWaalsContact C-N 3.27Å; L59-A61 PolarHBondContact O-N 2.76Å | ||
| 62 | E | 58.7 | Low | 64.4 | Low | 142 Ų | 142 | 129.8 Ų | 129.8 | 66% | 0.664 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -98.9 | -15.6 | -177.9 | -76.7 | -168.5 | 165 | 0 | 0 | 114.8 | L60 | L60-E62 HydrophobicContact CG-CG 4.44Å; L60-E62 PolarHBondContact O-N 3.01Å |
| 63 | N | 59.3 | Low | 64.7 | Low | 112 Ų | 112 | 128.9 Ų | 128.9 | 60% | 0.599 | 72% | 0.716 | S | S | * | * | trans | -152.7 | 66.3 | -169.7 | -65.9 | -70.8 | 0 | 0 | 0 | 114.3 | ||||
| 64 | C | 56.6 | Low | 64.9 | Low | 133 Ų | 133 | 125 Ų | 125 | 90% | 0.899 | 71% | 0.711 | S | S | * | * | trans | -100.1 | 93.4 | 170.8 | -65.6 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 65 | S | 61.1 | Low | 65.6 | Low | 88 Ų | 88 | 120.3 Ų | 120.3 | 62% | 0.615 | 70% | 0.697 | S | S | * | * | trans | -102.8 | 149.4 | 158.3 | 57.4 | 0 | 0 | 0 | 0 | 109.1 | G67 | S65-G67 PolarHBondContact O-N 2.74Š| ||
| 66 | P | 66.8 | Low | 66.3 | Low | 151 Ų | 151 | 121.7 Ų | 121.7 | 98% | 0.981 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -73.3 | 14.8 | -170.6 | 29.9 | -35.2 | 0 | 0 | 0 | 114.3 | ||
| 67 | G | 67.5 | Low | 67.1 | Low | 40 Ų | 40 | 121.5 Ų | 121.5 | 41% | 0.412 | 68% | 0.675 | S | S | . | * | S | Bend | trans | -118.8 | 155.8 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113 | S65 R69 | S65-G67 PolarHBondContact O-N 2.74Å; G67-R69 PolarHBondContact O-N 2.71Å; G67-R69 VanDerWaalsContact O-N 3.11Å |
| 68 | P | 69.5 | Low | 67.8 | Low | 96 Ų | 96 | 127.7 Ų | 127.7 | 62% | 0.623 | 68% | 0.684 | S | S | * | * | trans | -60.7 | 115.7 | 173.5 | 24.5 | -31.7 | 0 | 0 | 0 | 110.1 | Y70 | P68-Y70 HydrophobicContact CB-CE2 3.98Å; P68-Y70 HydrophobicContact CG-CE2 3.83Å; P68-Y70 WeakPolarHBondContact O-CD2 3.27Å; P68-Y70 PolarHBondContact O-N 3.35Å | ||
| 69 | R | 65.6 | Low | 68.8 | Low | 165 Ų | 165 | 125 Ų | 125 | 62% | 0.623 | 68% | 0.678 | S | S | * | * | trans | -80.5 | 105.1 | 173.3 | -177.4 | 179.9 | 174.6 | 165.6 | 5.5 | 109.2 | G67 N71 | G67-R69 PolarHBondContact O-N 2.71Å; G67-R69 VanDerWaalsContact O-N 3.11Å; R69-N71 PolarHBondContact NE-OD1 3.31Å; R69-N71 PolarHBondContact O-N 3.16Å | ||
| 70 | Y | 69.4 | Low | 69.9 | Low | 183 Ų | 183 | 119.4 Ų | 119.4 | 72% | 0.718 | 66% | 0.657 | S | S | * | * | trans | -81.6 | 108 | 170.8 | -58.6 | -76.7 | 0 | 0 | 0 | 109.2 | P68 V72 | P68-Y70 HydrophobicContact CB-CE2 3.98Å; P68-Y70 HydrophobicContact CG-CE2 3.83Å; P68-Y70 WeakPolarHBondContact O-CD2 3.27Å; P68-Y70 PolarHBondContact O-N 3.35Å; Y70-V72 PolarHBondContact O-N 2.97Å | ||
| 71 | N | 71.5 | Confident | 71 | Confident | 139 Ų | 139 | 120 Ų | 120 | 74% | 0.743 | 65% | 0.654 | S | S | * | * | trans | -74.2 | 78.5 | 170.1 | -79.3 | -12.5 | 0 | 0 | 0 | 109.3 | R69 | R69-N71 PolarHBondContact NE-OD1 3.31Å; R69-N71 PolarHBondContact O-N 3.16Å | ||
| 72 | V | 72.9 | Confident | 72 | Confident | 103 Ų | 103 | 120.5 Ų | 120.5 | 62% | 0.624 | 64% | 0.643 | S | S | * | * | trans | -75.5 | 127.3 | 173.2 | -165.8 | 0 | 0 | 0 | 0 | 108 | Y70 | Y70-V72 PolarHBondContact O-N 2.97Š| ||
| 73 | N | 75.1 | Confident | 72.7 | Confident | 93 Ų | 93 | 120.1 Ų | 120.1 | 50% | 0.497 | 65% | 0.645 | S | S | . | * | trans | -64.5 | 125.6 | 179.4 | -162.8 | -48.9 | 0 | 0 | 0 | 108.7 | K75 I76 | N73-K75 PolarHBondContact O-N 2.83Å; N73-K75 PolarHBondContact OD1-N 3.38Å; N73-I76 HydrophobicContact CB-CD1 3.83Å; N73-I76 HydrophobicContact CB-CG1 4.15Å; N73-I76 PolarHBondContact O-N 2.92Å | ||
| 74 | P | 75.6 | Confident | 73.4 | Confident | 119 Ų | 119 | 117.4 Ų | 117.4 | 77% | 0.773 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -13.9 | -174.2 | 24.9 | -35.3 | 0 | 0 | 0 | 113.5 | I76 | P74-I76 VanDerWaalsContact C-N 3.27Å; P74-I76 PolarHBondContact O-N 3.46Å |
| 75 | K | 77.1 | Confident | 74.3 | Confident | 139 Ų | 139 | 115.9 Ų | 115.9 | 60% | 0.604 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | 9.7 | 175.1 | -61 | -176.2 | 178.2 | -176.5 | 0 | 113.8 | N73 K81 D82 | N73-K75 PolarHBondContact O-N 2.83Å; N73-K75 PolarHBondContact OD1-N 3.38Å; K75-K81 CarbonylContact O-C 3.48Å; K75-K81 VanDerWaalsContact O-CA 3.25Å; K75-K81 WeakPolarHBondContact O-CA 3.27Å; K75-D82 PolarHBondContact O-N 2.96Å |
| 76 | I | 81.6 | Confident | 74.4 | Confident | 88 Ų | 88 | 116.4 Ų | 116.4 | 45% | 0.451 | 64% | 0.641 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -105.2 | 108.9 | 177.2 | -61.1 | 171 | 0 | 0 | 0 | 108.4 | N73 P74 K81 | N73-I76 HydrophobicContact CB-CD1 3.83Å; N73-I76 HydrophobicContact CB-CG1 4.15Å; N73-I76 PolarHBondContact O-N 2.92Å; P74-I76 VanDerWaalsContact C-N 3.27Å; P74-I76 PolarHBondContact O-N 3.46Å; I76-K81 HydrophobicContact CG1-CG 4.2Å |
| 77 | L | 81.1 | Confident | 74.5 | Confident | 90 Ų | 90 | 118.9 Ų | 118.9 | 47% | 0.471 | 63% | 0.633 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -97.5 | 166.7 | 174.8 | -57.7 | 175.2 | 0 | 0 | 0 | 110.2 | T79 G80 D82 | L77-T79 PolarHBondContact O-N 3.3Å; L77-G80 CarbonylContact C-O 3.59Å; L77-G80 WeakPolarHBondContact CA-O 3.37Å; L77-G80 PolarHBondContact N-O 3.17Å; L77-G80 PolarHBondContact O-N 3.11Å; L77-G80 VanDerWaalsContact O-O 3.08Å; L77-D82 HydrophobicContact CD1-CB 3.76Å; L77-D82 HydrophobicContact CG-CB 4.12Å |
| 78 | R | 79.8 | Confident | 74.5 | Confident | 240 Ų | 240 | 122 Ų | 122 | 91% | 0.906 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.5 | -28.6 | 176.9 | -172.1 | -175.8 | 69 | 82 | -0.3 | 113.2 | ||
| 79 | T | 81.1 | Confident | 74.6 | Confident | 121 Ų | 121 | 125.3 Ų | 125.3 | 74% | 0.742 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -2.4 | -177.1 | 48.4 | 0 | 0 | 0 | 0 | 113.9 | L77 | L77-T79 PolarHBondContact O-N 3.3Š|
| 80 | G | 81.4 | Confident | 74.8 | Confident | 35 Ų | 35 | 124.9 Ų | 124.9 | 36% | 0.361 | 67% | 0.668 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | 132.9 | -167.8 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | L77 | L77-G80 CarbonylContact C-O 3.59Å; L77-G80 WeakPolarHBondContact CA-O 3.37Å; L77-G80 PolarHBondContact N-O 3.17Å; L77-G80 PolarHBondContact O-N 3.11Å; L77-G80 VanDerWaalsContact O-O 3.08Å |
| 81 | K | 82.3 | Confident | 74.9 | Confident | 152 Ų | 152 | 119 Ų | 119 | 66% | 0.661 | 66% | 0.662 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -75.6 | 131.2 | 175.9 | -69.8 | 175.9 | -178.7 | 175.5 | 0 | 109.8 | K75 I76 L83 | K75-K81 CarbonylContact O-C 3.48Å; K75-K81 VanDerWaalsContact O-CA 3.25Å; K75-K81 WeakPolarHBondContact O-CA 3.27Å; I76-K81 HydrophobicContact CG1-CG 4.2Å; K81-L83 VanDerWaalsContact C-N 3.29Å; K81-L83 HydrophobicContact CB-CD1 4.43Å; K81-L83 HydrophobicContact CB-CG 4.07Å; K81-L83 PolarHBondContact O-N 3.1Å |
| 82 | D | 77.5 | Confident | 74.8 | Confident | 101 Ų | 101 | 123.9 Ų | 123.9 | 54% | 0.54 | 67% | 0.671 | S | S | . | * | trans | -71.2 | 88.3 | 170.2 | -167.3 | 15.3 | 0 | 0 | 0 | 108.9 | K75 L77 | K75-D82 PolarHBondContact O-N 2.96Å; L77-D82 HydrophobicContact CD1-CB 3.76Å; L77-D82 HydrophobicContact CG-CB 4.12Å | ||
| 83 | L | 72.9 | Confident | 74.5 | Confident | 135 Ų | 135 | 129 Ų | 129 | 71% | 0.707 | 68% | 0.68 | S | S | * | * | trans | -103.8 | 122.9 | 172.6 | -61.9 | 173.5 | 0 | 0 | 0 | 106 | K81 | K81-L83 VanDerWaalsContact C-N 3.29Å; K81-L83 HydrophobicContact CB-CD1 4.43Å; K81-L83 HydrophobicContact CB-CG 4.07Å; K81-L83 PolarHBondContact O-N 3.1Å | ||
| 84 | G | 75.6 | Confident | 74.1 | Confident | 55 Ų | 55 | 131.9 Ų | 131.9 | 57% | 0.567 | 69% | 0.69 | S | S | * | * | trans | -54.2 | 164.3 | 169.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | A86 | G84-A86 PolarHBondContact O-N 3.29Š| ||
| 85 | P | 73.9 | Confident | 73.8 | Confident | 101 Ų | 101 | 130.4 Ų | 130.4 | 66% | 0.656 | 68% | 0.683 | S | S | * | * | trans | -53.1 | 115 | -174.1 | 21.2 | -32.5 | 0 | 0 | 0 | 111.3 | Y87 | P85-Y87 HydrophobicContact CB-CE2 3.91Å; P85-Y87 HydrophobicContact CG-CE2 4Å; P85-Y87 PolarHBondContact O-N 3.3Å | ||
| 86 | A | 63.9 | Low | 73.5 | Confident | 98 Ų | 98 | 131.8 Ų | 131.8 | 81% | 0.81 | 69% | 0.689 | S | S | * | * | trans | -87.8 | 97.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | G84 S88 | G84-A86 PolarHBondContact O-N 3.29Å; A86-S88 PolarHBondContact O-N 3.13Å | ||
| 87 | Y | 69.5 | Low | 73 | Confident | 204 Ų | 204 | 133.3 Ų | 133.3 | 80% | 0.8 | 70% | 0.703 | S | S | * | * | trans | -76.2 | 105.5 | 172.1 | -58.5 | -80 | 0 | 0 | 0 | 109 | P85 I89 | P85-Y87 HydrophobicContact CB-CE2 3.91Å; P85-Y87 HydrophobicContact CG-CE2 4Å; P85-Y87 PolarHBondContact O-N 3.3Å; Y87-I89 PolarHBondContact O-N 2.82Å | ||
| 88 | S | 68.1 | Low | 72.5 | Confident | 104 Ų | 104 | 136.6 Ų | 136.6 | 73% | 0.727 | 72% | 0.72 | S | S | * | * | trans | -80.4 | 113.3 | 165.8 | 52.7 | 0 | 0 | 0 | 0 | 108.3 | A86 L90 | A86-S88 PolarHBondContact O-N 3.13Å; S88-L90 PolarHBondContact O-N 2.97Å | ||
| 89 | I | 70.9 | Confident | 72.4 | Confident | 167 Ų | 167 | 133 Ų | 133 | 86% | 0.856 | 72% | 0.717 | S | S | * | * | trans | -71.2 | 87.4 | 160.3 | -56.5 | 171.8 | 0 | 0 | 0 | 104.8 | Y87 G91 | Y87-I89 PolarHBondContact O-N 2.82Å; I89-G91 PolarHBondContact O-N 3.39Å | ||
| 90 | L | 69.9 | Low | 72.3 | Confident | 156 Ų | 156 | 132.6 Ų | 132.6 | 82% | 0.817 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 116.1 | 173.5 | -167 | 78.3 | 0 | 0 | 0 | 106.6 | S88 | S88-L90 PolarHBondContact O-N 2.97Š|
| 91 | G | 71.1 | Confident | 72.4 | Confident | 58 Ų | 58 | 134 Ų | 134 | 60% | 0.598 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 147.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | I89 Y93 | I89-G91 PolarHBondContact O-N 3.39Å; G91-Y93 PolarHBondContact O-N 3.25Å |
| 92 | R | 68.9 | Low | 72.4 | Confident | 242 Ų | 242 | 128 Ų | 128 | 91% | 0.913 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 136.2 | 176.1 | -65.8 | -173.5 | -66.8 | -138 | 0.4 | 109.7 | H94 | R92-H94 PolarHBondContact O-N 3.37Š|
| 93 | Y | 67.9 | Low | 72.6 | Confident | 211 Ų | 211 | 129.4 Ų | 129.4 | 83% | 0.827 | 71% | 0.714 | S | S | * | * | trans | -50.8 | 114.7 | 178 | -172.4 | -97.2 | 0 | 0 | 0 | 109.2 | G91 S95 | G91-Y93 PolarHBondContact O-N 3.25Å; Y93-S95 PolarHBondContact O-N 3.35Å | ||
| 94 | H | 66.1 | Low | 73 | Confident | 153 Ų | 153 | 125.9 Ų | 125.9 | 71% | 0.708 | 71% | 0.71 | S | S | * | * | trans | -70.1 | 104 | 174.6 | -167.3 | 73.3 | 0 | 0 | 0 | 106.5 | R92 K96 | R92-H94 PolarHBondContact O-N 3.37Å; H94-K96 VanDerWaalsContact C-N 3.32Å; H94-K96 PolarHBondContact O-N 3.34Å | ||
| 95 | S | 69.9 | Low | 73.4 | Confident | 88 Ų | 88 | 128.2 Ų | 128.2 | 62% | 0.615 | 71% | 0.71 | S | S | * | * | trans | -60.4 | 100.1 | 170.1 | 55.5 | 0 | 0 | 0 | 0 | 107.1 | Y93 T97 | Y93-S95 PolarHBondContact O-N 3.35Å; S95-T97 PolarHBondContact O-N 3.4Å | ||
| 96 | K | 70.6 | Confident | 73.9 | Confident | 169 Ų | 169 | 129.6 Ų | 129.6 | 74% | 0.735 | 70% | 0.703 | S | S | * | * | trans | -62.3 | 105.9 | 172 | -64.7 | -178.4 | -178.4 | 179.2 | 0 | 106.3 | H94 L98 | H94-K96 VanDerWaalsContact C-N 3.32Å; H94-K96 PolarHBondContact O-N 3.34Å; K96-L98 PolarHBondContact O-N 2.77Å | ||
| 97 | T | 69.8 | Low | 74.8 | Confident | 120 Ų | 120 | 131.1 Ų | 131.1 | 74% | 0.736 | 69% | 0.691 | S | S | * | * | trans | -59 | 106.9 | 164.6 | 27.8 | 0 | 0 | 0 | 0 | 106.8 | S95 L99 | S95-T97 PolarHBondContact O-N 3.4Å; T97-L99 PolarHBondContact O-N 3.2Å | ||
| 98 | L | 72.4 | Confident | 75.4 | Confident | 159 Ų | 159 | 125.9 Ų | 125.9 | 83% | 0.832 | 68% | 0.682 | S | S | * | * | trans | -65.6 | 101.6 | 172.1 | -67.1 | 173.5 | 0 | 0 | 0 | 106.4 | K96 T100 | K96-L98 PolarHBondContact O-N 2.77Å; L98-T100 PolarHBondContact O-N 3.31Å | ||
| 99 | L | 76.2 | Confident | 76.3 | Confident | 163 Ų | 163 | 129.4 Ų | 129.4 | 85% | 0.853 | 69% | 0.687 | S | S | * | * | trans | -67.4 | 100.6 | 170.6 | -69.9 | 167.7 | 0 | 0 | 0 | 106.5 | T97 | T97-L99 PolarHBondContact O-N 3.2Š| ||
| 100 | T | 79.3 | Confident | 76.8 | Confident | 114 Ų | 114 | 128 Ų | 128 | 70% | 0.699 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 130.4 | 169.3 | 42.1 | 0 | 0 | 0 | 0 | 108.2 | L98 | L98-T100 PolarHBondContact O-N 3.31Š|
| 101 | P | 83.8 | Confident | 77.3 | Confident | 63 Ų | 63 | 122.8 Ų | 122.8 | 41% | 0.409 | 65% | 0.651 | S | S | . | * | P | Polyproline II helix | trans | -55.1 | 145.8 | 177 | 15.4 | -23.2 | 0 | 0 | 0 | 110.6 | D105 Y106 | P101-D105 HydrophobicContact CB-CB 3.67Å; P101-Y106 HydrophobicContact CB-CE2 4.43Å; P101-Y106 HydrophobicContact CG-CD1 4.29Å; P101-Y106 HydrophobicContact CG-CE1 3.74Å; P101-Y106 HydrophobicContact CG-CE2 4.33Å; P101-Y106 VanDerWaalsContact O-CE2 3.24Å; P101-Y106 WeakPolarHBondContact O-CE2 3.45Å; P101-Y106 PolarHBondContact O-OH 3.4Å; P101-Y106 VanDerWaalsContact O-OH 3.1Å |
| 102 | G | 82.9 | Confident | 77.8 | Confident | 27 Ų | 27 | 123.6 Ų | 123.6 | 28% | 0.278 | 65% | 0.645 | S | S | . | * | P | Polyproline II helix | trans | -64.2 | 163.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111 | G104 D105 Y106 | G102-G104 PolarHBondContact O-N 2.96Å; G102-D105 PolarHBondContact N-OD2 3.17Å; G102-D105 PolarHBondContact O-N 3Å; G102-Y106 WeakPolarHBondContact O-CD2 3.42Å; G102-Y106 WeakPolarHBondContact O-CE2 3.32Å |
| 103 | P | 80.3 | Confident | 78.3 | Confident | 130 Ų | 130 | 119.5 Ų | 119.5 | 84% | 0.844 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.1 | -23.5 | -177 | 21.8 | -32.6 | 0 | 0 | 0 | 114.3 | ||
| 104 | G | 83 | Confident | 78.8 | Confident | 61 Ų | 61 | 119.4 Ų | 119.4 | 63% | 0.629 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | -7.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | G102 | G102-G104 PolarHBondContact O-N 2.96Š|
| 105 | D | 84 | Confident | 79.8 | Confident | 105 Ų | 105 | 116.7 Ų | 116.7 | 56% | 0.561 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | -5.9 | -179.2 | -61.9 | -38.7 | 0 | 0 | 0 | 112.2 | P101 G102 F107 | P101-D105 HydrophobicContact CB-CB 3.67Å; G102-D105 PolarHBondContact N-OD2 3.17Å; G102-D105 PolarHBondContact O-N 3Å; D105-F107 WeakPolarHBondContact O-CD2 3.24Å; D105-F107 PolarHBondContact O-N 3.13Å |
| 106 | Y | 83.1 | Confident | 80.6 | Confident | 129 Ų | 129 | 119.1 Ų | 119.1 | 51% | 0.506 | 63% | 0.627 | S | S | . | * | trans | -75.2 | 119 | 173.4 | -64.9 | -86 | 0 | 0 | 0 | 109.9 | P101 G102 P108 | P101-Y106 HydrophobicContact CB-CE2 4.43Å; P101-Y106 HydrophobicContact CG-CD1 4.29Å; P101-Y106 HydrophobicContact CG-CE1 3.74Å; P101-Y106 HydrophobicContact CG-CE2 4.33Å; P101-Y106 VanDerWaalsContact O-CE2 3.24Å; P101-Y106 WeakPolarHBondContact O-CE2 3.45Å; P101-Y106 PolarHBondContact O-OH 3.4Å; P101-Y106 VanDerWaalsContact O-OH 3.1Å; G102-Y106 WeakPolarHBondContact O-CD2 3.42Å; G102-Y106 WeakPolarHBondContact O-CE2 3.32Å; Y106-P108 VanDerWaalsContact C-CD 3.45Å; Y106-P108 WeakPolarHBondContact O-CD 3.44Å | ||
| 107 | F | 83.9 | Confident | 81.3 | Confident | 131 Ų | 131 | 119.7 Ų | 119.7 | 58% | 0.575 | 64% | 0.638 | S | S | * | * | trans | -109.3 | 77.8 | 170.8 | -63.6 | -77.8 | 0 | 0 | 0 | 110.1 | D105 E109 K110 | D105-F107 WeakPolarHBondContact O-CD2 3.24Å; D105-F107 PolarHBondContact O-N 3.13Å; F107-E109 PolarHBondContact O-N 3.15Å; F107-K110 HydrophobicContact CB-CB 4.34Å; F107-K110 HydrophobicContact CB-CD 3.96Å; F107-K110 HydrophobicContact CB-CG 4.22Å; F107-K110 HydrophobicContact CG-CD 4.4Å; F107-K110 PolarHBondContact O-N 3.19Å | ||
| 108 | P | 82.2 | Confident | 81.9 | Confident | 93 Ų | 93 | 117.7 Ų | 117.7 | 60% | 0.604 | 63% | 0.629 | S | S | * | * | G | 310 helix | trans | -61.7 | -27.1 | -176.3 | 26.2 | -35.1 | 0 | 0 | 0 | 112.4 | Y106 K110 S111 | Y106-P108 VanDerWaalsContact C-CD 3.45Å; Y106-P108 WeakPolarHBondContact O-CD 3.44Å; P108-K110 PolarHBondContact O-N 3.16Å; P108-S111 WeakPolarHBondContact O-CB 3.35Å; P108-S111 PolarHBondContact O-N 3Å; P108-S111 PolarHBondContact O-OG 3.45Å |
| 109 | E | 85.1 | Confident | 82.6 | Confident | 178 Ų | 178 | 114.3 Ų | 114.3 | 83% | 0.832 | 62% | 0.624 | S | S | * | * | G | 310 helix | trans | -62.5 | -26.8 | 176.1 | -59.4 | -177.6 | -178.2 | 0 | 0 | 113.1 | F107 S111 | F107-E109 PolarHBondContact O-N 3.15Å; E109-S111 VanDerWaalsContact C-N 3.34Å |
| 110 | K | 81.8 | Confident | 83 | Confident | 137 Ų | 137 | 111.5 Ų | 111.5 | 60% | 0.596 | 62% | 0.616 | S | S | * | * | G | 310 helix | trans | -90.7 | -0.9 | 177.8 | -61.2 | 177.5 | -175.1 | 168 | 0 | 112.5 | F107 P108 T112 | F107-K110 HydrophobicContact CB-CB 4.34Å; F107-K110 HydrophobicContact CB-CD 3.96Å; F107-K110 HydrophobicContact CB-CG 4.22Å; F107-K110 HydrophobicContact CG-CD 4.4Å; F107-K110 PolarHBondContact O-N 3.19Å; P108-K110 PolarHBondContact O-N 3.16Å; K110-T112 VanDerWaalsContact C-N 3.28Å; K110-T112 PolarHBondContact O-N 2.93Å |
| 111 | S | 81.1 | Confident | 83.1 | Confident | 47 Ų | 47 | 111.6 Ų | 111.6 | 33% | 0.329 | 62% | 0.621 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.4 | -17.9 | -175.5 | 73.2 | 0 | 0 | 0 | 0 | 113.5 | P108 E109 K113 Y114 V115 | P108-S111 WeakPolarHBondContact O-CB 3.35Å; P108-S111 PolarHBondContact O-N 3Å; P108-S111 PolarHBondContact O-OG 3.45Å; E109-S111 VanDerWaalsContact C-N 3.34Å; S111-K113 PolarHBondContact O-N 3.24Å; S111-K113 VanDerWaalsContact O-N 3.11Å; S111-Y114 WeakPolarHBondContact O-CA 3.39Å; S111-Y114 WeakPolarHBondContact O-CB 3.29Å; S111-Y114 PolarHBondContact O-N 3.45Å; S111-V115 WeakPolarHBondContact O-CG2 3.38Å; S111-V115 PolarHBondContact O-N 3.35Å |
| 112 | T | 81.7 | Confident | 83.1 | Confident | 76 Ų | 76 | 116.5 Ų | 116.5 | 47% | 0.466 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -53.1 | -36.5 | -177.2 | 53 | 0 | 0 | 0 | 0 | 113.6 | K110 Y114 V115 F116 | K110-T112 VanDerWaalsContact C-N 3.28Å; K110-T112 PolarHBondContact O-N 2.93Å; T112-Y114 VanDerWaalsContact C-N 3.25Å; T112-Y114 PolarHBondContact O-N 2.88Å; T112-V115 PolarHBondContact O-N 3.05Å; T112-F116 PolarHBondContact O-N 2.99Å; T112-F116 VanDerWaalsContact O-N 3.1Å |
| 113 | K | 78.8 | Confident | 83 | Confident | 156 Ų | 156 | 120.4 Ų | 120.4 | 68% | 0.678 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -69 | -19.5 | 177.2 | -59.2 | -174.3 | -179.9 | -176.2 | 0 | 114.4 | S111 | S111-K113 PolarHBondContact O-N 3.24Å; S111-K113 VanDerWaalsContact O-N 3.11Å |
| 114 | Y | 79.8 | Confident | 83 | Confident | 208 Ų | 208 | 122.2 Ų | 122.2 | 82% | 0.816 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -102.5 | -24.1 | 180 | -59.3 | -78 | 0 | 0 | 0 | 112.3 | S111 T112 | S111-Y114 WeakPolarHBondContact O-CA 3.39Å; S111-Y114 WeakPolarHBondContact O-CB 3.29Å; S111-Y114 PolarHBondContact O-N 3.45Å; T112-Y114 VanDerWaalsContact C-N 3.25Å; T112-Y114 PolarHBondContact O-N 2.88Å |
| 115 | V | 86.4 | Confident | 82.7 | Confident | 96 Ų | 96 | 124 Ų | 124 | 58% | 0.582 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -86 | -34.5 | 179.6 | 176.7 | 0 | 0 | 0 | 0 | 111.8 | S111 T112 | S111-V115 WeakPolarHBondContact O-CG2 3.38Å; S111-V115 PolarHBondContact O-N 3.35Å; T112-V115 PolarHBondContact O-N 3.05Å |
| 116 | F | 87.1 | Confident | 82.3 | Confident | 139 Ų | 139 | 123.2 Ų | 123.2 | 61% | 0.61 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -119.8 | 145.4 | -178.3 | -55.8 | -72.5 | 0 | 0 | 0 | 111 | T112 S118 | T112-F116 PolarHBondContact O-N 2.99Å; T112-F116 VanDerWaalsContact O-N 3.1Å; F116-S118 PolarHBondContact O-N 3.14Å |
| 117 | D | 84.9 | Confident | 81.9 | Confident | 181 Ų | 181 | 128.8 Ų | 128.8 | 97% | 0.968 | 69% | 0.694 | S | S | * | * | trans | -60.5 | 126.1 | 172.7 | -78.1 | -29.1 | 0 | 0 | 0 | 109.9 | ||||
| 118 | S | 82.1 | Confident | 81.2 | Confident | 78 Ų | 78 | 128.2 Ų | 128.2 | 55% | 0.545 | 70% | 0.701 | S | S | . | * | trans | -125.9 | 145.9 | 177.6 | 59.8 | 0 | 0 | 0 | 0 | 110 | F116 | F116-S118 PolarHBondContact O-N 3.14Š| ||
| 119 | A | 86.8 | Confident | 80.7 | Confident | 88 Ų | 88 | 132.1 Ų | 132.1 | 73% | 0.727 | 71% | 0.709 | S | S | * | * | trans | -60.6 | 143.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | S121 | A119-S121 PolarHBondContact O-N 2.77Š| ||
| 120 | P | 84.4 | Confident | 79.9 | Confident | 104 Ų | 104 | 130.2 Ų | 130.2 | 68% | 0.675 | 71% | 0.709 | S | S | * | * | trans | -59 | 128 | -179.3 | 23.3 | -32.9 | 0 | 0 | 0 | 111.1 | ||||
| 121 | S | 82.8 | Confident | 79.2 | Confident | 117 Ų | 117 | 130.1 Ų | 130.1 | 82% | 0.818 | 71% | 0.709 | S | S | * | * | trans | -94.1 | 109.5 | 174.7 | -175.4 | 0 | 0 | 0 | 0 | 109.5 | A119 | A119-S121 PolarHBondContact O-N 2.77Š| ||
| 122 | H | 83.3 | Confident | 78.5 | Confident | 165 Ų | 165 | 138.1 Ų | 138.1 | 76% | 0.764 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -91.6 | 116.3 | 175.1 | -61 | -69.7 | 0 | 0 | 0 | 109.7 | ||
| 123 | S | 81 | Confident | 77.9 | Confident | 110 Ų | 110 | 138.9 Ų | 138.9 | 77% | 0.769 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -96 | 130.5 | 165.3 | 59.7 | 0 | 0 | 0 | 0 | 109.2 | S125 | S123-S125 PolarHBondContact O-N 2.65Š|
| 124 | I | 80 | Confident | 77.5 | Confident | 167 Ų | 167 | 136.4 Ų | 136.4 | 86% | 0.856 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -74.6 | 118.1 | 167.1 | -60.1 | 171.7 | 0 | 0 | 0 | 105.4 | A126 | I124-A126 PolarHBondContact O-N 3.27Š|
| 125 | S | 76.7 | Confident | 77.1 | Confident | 98 Ų | 98 | 132.2 Ų | 132.2 | 69% | 0.685 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 140.5 | 178.2 | 62.8 | 0 | 0 | 0 | 0 | 110.3 | S123 R127 | S123-S125 PolarHBondContact O-N 2.65Å; S125-R127 PolarHBondContact O-N 2.96Å |
| 126 | A | 76.4 | Confident | 76.5 | Confident | 90 Ų | 90 | 132.5 Ų | 132.5 | 74% | 0.744 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 140 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | I124 T128 | I124-A126 PolarHBondContact O-N 3.27Å; A126-T128 PolarHBondContact O-N 3.4Å; A126-T128 VanDerWaalsContact O-N 3.1Å |
| 127 | R | 74.8 | Confident | 76.2 | Confident | 245 Ų | 245 | 128.8 Ų | 128.8 | 93% | 0.925 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 122.5 | 179.3 | -71 | -177.4 | -144.4 | -119.9 | 0.4 | 109 | S125 K129 | S125-R127 PolarHBondContact O-N 2.96Å; R127-K129 PolarHBondContact O-N 3.01Å |
| 128 | T | 69.1 | Low | 76 | Confident | 119 Ų | 119 | 122 Ų | 122 | 73% | 0.73 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 131.5 | 167.4 | 44.6 | 0 | 0 | 0 | 0 | 107.6 | A126 T130 | A126-T128 PolarHBondContact O-N 3.4Å; A126-T128 VanDerWaalsContact O-N 3.1Å; T128-T130 PolarHBondContact O-N 3.37Å |
| 129 | K | 70.1 | Confident | 75.6 | Confident | 176 Ų | 176 | 124.3 Ų | 124.3 | 77% | 0.765 | 71% | 0.709 | S | S | * | * | trans | -57.2 | 113 | 173.3 | -72.4 | -178.4 | 178.6 | -179.7 | 0 | 106.9 | R127 F131 | R127-K129 PolarHBondContact O-N 3.01Å; K129-F131 PolarHBondContact O-N 3.08Å | ||
| 130 | T | 68.8 | Low | 75.1 | Confident | 137 Ų | 137 | 124.9 Ų | 124.9 | 84% | 0.84 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -72.5 | -11.1 | -173.5 | 47.8 | 0 | 0 | 0 | 0 | 113.1 | T128 | T128-T130 PolarHBondContact O-N 3.37Š|
| 131 | F | 66.8 | Low | 74.8 | Confident | 136 Ų | 136 | 122.7 Ų | 122.7 | 60% | 0.596 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -121.6 | 138.8 | -179.9 | 67.4 | -80.6 | 0 | 0 | 0 | 110.6 | K129 V133 | K129-F131 PolarHBondContact O-N 3.08Å; F131-V133 HydrophobicContact CD2-CG2 4.16Å; F131-V133 HydrophobicContact CE2-CG2 3.64Å; F131-V133 HydrophobicContact CZ-CG2 4.25Å; F131-V133 PolarHBondContact O-N 3.25Å |
| 132 | R | 67.4 | Low | 74.5 | Confident | 215 Ų | 215 | 124.6 Ų | 124.6 | 81% | 0.811 | 70% | 0.695 | S | S | * | * | trans | -61.8 | 121.2 | 163.9 | -78.5 | -175.4 | 173.4 | 167.9 | -1.4 | 107.3 | D134 | R132-D134 PolarHBondContact O-N 3.19Š| ||
| 133 | V | 67.9 | Low | 73.8 | Confident | 91 Ų | 91 | 124 Ų | 124 | 55% | 0.552 | 70% | 0.695 | S | S | * | * | trans | -76.7 | 77.2 | 159.1 | -173.4 | 0 | 0 | 0 | 0 | 104.9 | F131 S135 | F131-V133 HydrophobicContact CD2-CG2 4.16Å; F131-V133 HydrophobicContact CE2-CG2 3.64Å; F131-V133 HydrophobicContact CZ-CG2 4.25Å; F131-V133 PolarHBondContact O-N 3.25Å; V133-S135 PolarHBondContact O-N 2.98Å | ||
| 134 | D | 70.1 | Confident | 73.1 | Confident | 104 Ų | 104 | 126 Ų | 126 | 56% | 0.556 | 70% | 0.696 | S | S | * | * | trans | -57.2 | 117.2 | 166.9 | -69.8 | -28.6 | 0 | 0 | 0 | 105.1 | R132 T136 | R132-D134 PolarHBondContact O-N 3.19Å; D134-T136 HydrophobicContact CB-CG2 4.18Å; D134-T136 PolarHBondContact O-N 2.85Å; D134-T136 PolarHBondContact O-OG1 3.37Å | ||
| 135 | S | 71.6 | Confident | 72.3 | Confident | 120 Ų | 120 | 123.2 Ų | 123.2 | 84% | 0.839 | 69% | 0.688 | S | S | * | * | trans | -69.7 | 69.6 | 176.4 | -70.4 | 0 | 0 | 0 | 0 | 108.2 | V133 | V133-S135 PolarHBondContact O-N 2.98Š| ||
| 136 | T | 74.9 | Confident | 71.5 | Confident | 103 Ų | 103 | 125.4 Ų | 125.4 | 63% | 0.632 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 124.1 | 171.8 | 47.6 | 0 | 0 | 0 | 0 | 106.4 | D134 G138 | D134-T136 HydrophobicContact CB-CG2 4.18Å; D134-T136 PolarHBondContact O-N 2.85Å; D134-T136 PolarHBondContact O-OG1 3.37Å; T136-G138 PolarHBondContact O-N 3Å |
| 137 | P | 80.6 | Confident | 70.5 | Confident | 61 Ų | 61 | 126.9 Ų | 126.9 | 40% | 0.396 | 69% | 0.689 | S | S | . | * | P | Polyproline II helix | trans | -55.5 | 134.4 | 172.7 | 21.1 | -28.7 | 0 | 0 | 0 | 108.1 | A141 Y142 | P137-A141 HydrophobicContact CB-CB 3.46Å; P137-A141 VanDerWaalsContact CB-CB 3.46Å; P137-Y142 HydrophobicContact CG-CD1 4.46Å; P137-Y142 HydrophobicContact CG-CE1 3.98Å; P137-Y142 HydrophobicContact CG-CE2 4.35Å; P137-Y142 WeakPolarHBondContact O-CE2 3.38Å |
| 138 | G | 81.3 | Confident | 69.6 | Low | 38 Ų | 38 | 121.3 Ų | 121.3 | 39% | 0.392 | 68% | 0.675 | S | S | . | * | P | Polyproline II helix | trans | -56.1 | 164.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | T136 A140 A141 | T136-G138 PolarHBondContact O-N 3Å; G138-A140 PolarHBondContact O-N 2.87Å; G138-A141 WeakPolarHBondContact O-CB 3.32Å; G138-A141 PolarHBondContact O-N 3.11Å |
| 139 | P | 73.9 | Confident | 69.1 | Low | 127 Ų | 127 | 116.7 Ų | 116.7 | 83% | 0.825 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.6 | -28 | -175 | 20.3 | -32.2 | 0 | 0 | 0 | 113.9 | ||
| 140 | A | 75.8 | Confident | 68.5 | Low | 100 Ų | 100 | 113.7 Ų | 113.7 | 83% | 0.826 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | -6.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | G138 | G138-A140 PolarHBondContact O-N 2.87Š|
| 141 | A | 77.7 | Confident | 67.8 | Low | 57 Ų | 57 | 114.3 Ų | 114.3 | 47% | 0.471 | 65% | 0.647 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.2 | -4.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | P137 G138 M143 | P137-A141 HydrophobicContact CB-CB 3.46Å; P137-A141 VanDerWaalsContact CB-CB 3.46Å; G138-A141 WeakPolarHBondContact O-CB 3.32Å; G138-A141 PolarHBondContact O-N 3.11Å; A141-M143 VanDerWaalsContact C-N 3.33Å; A141-M143 PolarHBondContact O-N 2.93Å |
| 142 | Y | 75.6 | Confident | 67.4 | Low | 157 Ų | 157 | 109.4 Ų | 109.4 | 62% | 0.616 | 63% | 0.629 | S | S | * | * | trans | -73.2 | 89.5 | 166.2 | -64.5 | -84 | 0 | 0 | 0 | 109.6 | P137 L144 | P137-Y142 HydrophobicContact CG-CD1 4.46Å; P137-Y142 HydrophobicContact CG-CE1 3.98Å; P137-Y142 HydrophobicContact CG-CE2 4.35Å; P137-Y142 WeakPolarHBondContact O-CE2 3.38Å; Y142-L144 PolarHBondContact O-N 3.21Å | ||
| 143 | M | 70 | Confident | 67.2 | Low | 154 Ų | 154 | 106.9 Ų | 106.9 | 76% | 0.759 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 117.8 | 165.8 | -74.1 | -77.2 | -51.8 | 0 | 0 | 108.5 | A141 | A141-M143 VanDerWaalsContact C-N 3.33Å; A141-M143 PolarHBondContact O-N 2.93Å |
| 144 | L | 66.8 | Low | 67.1 | Low | 152 Ų | 152 | 106.2 Ų | 106.2 | 80% | 0.796 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 135.6 | 163.9 | -69.9 | 166.9 | 0 | 0 | 0 | 107.9 | Y142 M146 | Y142-L144 PolarHBondContact O-N 3.21Å; L144-M146 PolarHBondContact O-N 3.21Å; L144-M146 VanDerWaalsContact O-N 3.16Å |
| 145 | P | 62.1 | Low | 66.8 | Low | 108 Ų | 108 | 109.5 Ų | 109.5 | 70% | 0.701 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 127.2 | 173.6 | 21.2 | -29.7 | 0 | 0 | 0 | 108.5 | V147 | P145-V147 PolarHBondContact O-N 3.01Å; P145-V147 VanDerWaalsContact O-N 3.08Å |
| 146 | M | 59.1 | Low | 66.2 | Low | 143 Ų | 143 | 110.9 Ų | 110.9 | 70% | 0.704 | 66% | 0.661 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 118.3 | -176.6 | -70.3 | -110.1 | -69.6 | 0 | 0 | 109.7 | L144 M148 | L144-M146 PolarHBondContact O-N 3.21Å; L144-M146 VanDerWaalsContact O-N 3.16Å; M146-M148 PolarHBondContact O-N 3.22Å |
| 147 | V | 56.7 | Low | 65.5 | Low | 121 Ų | 121 | 107.7 Ų | 107.7 | 73% | 0.733 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -80.1 | 38.5 | 174.8 | -165.2 | 0 | 0 | 0 | 0 | 110.1 | P145 T152 | P145-V147 PolarHBondContact O-N 3.01Å; P145-V147 VanDerWaalsContact O-N 3.08Å; V147-T152 HydrophobicContact CG1-CG2 4.33Å |
| 148 | M | 56.5 | Low | 64.2 | Low | 129 Ų | 129 | 113 Ų | 113 | 64% | 0.635 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -137.5 | 111 | 173.9 | -112.9 | -163.9 | -169.9 | 0 | 0 | 106.9 | M146 S160 | M146-M148 PolarHBondContact O-N 3.22Å; M148-S160 PolarHBondContact SD-OG 3.09Å |
| 149 | G | 58.3 | Low | 63.3 | Low | 22 Ų | 22 | 115.9 Ų | 115.9 | 23% | 0.227 | 67% | 0.674 | C | S | . | * | S | Bend | trans | 130.9 | 161.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | N151 S157 | G149-N151 PolarHBondContact O-N 2.98Å; G149-S157 WeakPolarHBondContact O-CB 3.38Å; G149-S157 PolarHBondContact O-OG 2.95Å |
| 150 | P | 56.2 | Low | 62.6 | Low | 112 Ų | 112 | 112.4 Ų | 112.4 | 73% | 0.727 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -69 | -6.3 | -163.2 | 25 | -34.4 | 0 | 0 | 0 | 116.3 | ||
| 151 | N | 53.8 | Low | 61.9 | Low | 150 Ų | 150 | 116.5 Ų | 116.5 | 80% | 0.802 | 65% | 0.652 | S | S | * | * | trans | -131.5 | 66.7 | -167.8 | -66.3 | -24.3 | 0 | 0 | 0 | 112.7 | G149 | G149-N151 PolarHBondContact O-N 2.98Š| ||
| 152 | T | 58.5 | Low | 61.3 | Low | 34 Ų | 34 | 118.3 Ų | 118.3 | 21% | 0.209 | 66% | 0.662 | C | S | . | * | trans | -96.2 | 131.5 | 166.1 | 49.3 | 0 | 0 | 0 | 0 | 110.6 | V147 G154 K155 | V147-T152 HydrophobicContact CG1-CG2 4.33Å; T152-G154 PolarHBondContact O-N 3.42Å; T152-G154 VanDerWaalsContact O-N 3.1Å; T152-K155 PolarHBondContact OG1-O 2.79Å; T152-K155 VanDerWaalsContact OG1-O 3.09Å | ||
| 153 | V | 63.2 | Low | 60.9 | Low | 161 Ų | 161 | 119 Ų | 119 | 98% | 0.976 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | 108.7 | 178.6 | -178.8 | 0 | 0 | 0 | 0 | 108.5 | ||
| 154 | G | 66.4 | Low | 60.4 | Low | 77 Ų | 77 | 120.8 Ų | 120.8 | 79% | 0.794 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 102.3 | 1.2 | 168 | 0 | 0 | 0 | 0 | 0 | 117.5 | T152 | T152-G154 PolarHBondContact O-N 3.42Å; T152-G154 VanDerWaalsContact O-N 3.1Å |
| 155 | K | 63.5 | Low | 60.3 | Low | 174 Ų | 174 | 116.5 Ų | 116.5 | 76% | 0.757 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -144.8 | 149.2 | 172.1 | -65.5 | -172.4 | -179.5 | -175.4 | 0 | 111.3 | T152 S157 | T152-K155 PolarHBondContact OG1-O 2.79Å; T152-K155 VanDerWaalsContact OG1-O 3.09Å; K155-S157 PolarHBondContact O-N 2.79Å |
| 156 | V | 59.2 | Low | 60.2 | Low | 148 Ų | 148 | 123.1 Ų | 123.1 | 90% | 0.897 | 68% | 0.681 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 121.9 | 171.9 | -174.8 | 0 | 0 | 0 | 0 | 108.4 | ||
| 157 | S | 59.7 | Low | 60.2 | Low | 36 Ų | 36 | 120.1 Ų | 120.1 | 25% | 0.252 | 67% | 0.674 | S | S | . | * | P | Polyproline II helix | trans | -73.7 | 136.4 | 179.2 | 65.3 | 0 | 0 | 0 | 0 | 111.5 | G149 K155 | G149-S157 WeakPolarHBondContact O-CB 3.38Å; G149-S157 PolarHBondContact O-OG 2.95Å; K155-S157 PolarHBondContact O-N 2.79Å |
| 158 | Q | 55 | Low | 60.3 | Low | 172 Ų | 172 | 122.9 Ų | 122.9 | 80% | 0.804 | 68% | 0.676 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 148.5 | 167.5 | -72.5 | -173.8 | -25.2 | 0 | 0 | 110.8 | S160 | Q158-S160 PolarHBondContact O-N 2.86Å; Q158-S160 VanDerWaalsContact O-N 3.13Å |
| 159 | P | 62 | Low | 60.4 | Low | 100 Ų | 100 | 124.3 Ų | 124.3 | 65% | 0.649 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 117.1 | 178.9 | 23.2 | -31.7 | 0 | 0 | 0 | 110.7 | F161 | P159-F161 HydrophobicContact CB-CE2 3.89Å; P159-F161 HydrophobicContact CB-CZ 4.02Å; P159-F161 HydrophobicContact CG-CE2 4.07Å; P159-F161 HydrophobicContact CG-CZ 4.42Å |
| 160 | S | 57.7 | Low | 60.5 | Low | 53 Ų | 53 | 124.6 Ų | 124.6 | 37% | 0.371 | 69% | 0.688 | S | S | . | * | trans | -91.6 | 100 | 173.6 | -178.6 | 0 | 0 | 0 | 0 | 108.7 | M148 Q158 S162 | M148-S160 PolarHBondContact SD-OG 3.09Å; Q158-S160 PolarHBondContact O-N 2.86Å; Q158-S160 VanDerWaalsContact O-N 3.13Å; S160-S162 PolarHBondContact O-N 3Å | ||
| 161 | F | 62.7 | Low | 60.7 | Low | 187 Ų | 187 | 122.7 Ų | 122.7 | 82% | 0.82 | 68% | 0.678 | S | S | * | * | trans | -79 | 103.2 | 170.9 | -60.5 | -77.9 | 0 | 0 | 0 | 108.3 | P159 | P159-F161 HydrophobicContact CB-CE2 3.89Å; P159-F161 HydrophobicContact CB-CZ 4.02Å; P159-F161 HydrophobicContact CG-CE2 4.07Å; P159-F161 HydrophobicContact CG-CZ 4.42Å | ||
| 162 | S | 64.3 | Low | 61.1 | Low | 95 Ų | 95 | 121.1 Ų | 121.1 | 66% | 0.664 | 66% | 0.664 | S | S | * | * | trans | -93.3 | 124.5 | 165.3 | 55 | 0 | 0 | 0 | 0 | 108.4 | S160 K164 | S160-S162 PolarHBondContact O-N 3Å; S162-K164 VanDerWaalsContact C-N 3.31Å; S162-K164 PolarHBondContact O-N 3.46Å | ||
| 163 | I | 67.6 | Low | 61.4 | Low | 170 Ų | 170 | 123.8 Ų | 123.8 | 87% | 0.872 | 68% | 0.684 | S | S | * | * | trans | -67.9 | 101.5 | 158.5 | -61.3 | 170 | 0 | 0 | 0 | 104 | G165 | I163-G165 PolarHBondContact O-N 3.14Š| ||
| 164 | K | 59.2 | Low | 61.6 | Low | 193 Ų | 193 | 121.9 Ų | 121.9 | 84% | 0.839 | 67% | 0.669 | S | S | * | * | trans | -52.7 | 109 | 169.9 | -105 | -178.4 | 174.4 | 178.8 | 0 | 106.5 | S162 | S162-K164 VanDerWaalsContact C-N 3.31Å; S162-K164 PolarHBondContact O-N 3.46Å | ||
| 165 | G | 65.4 | Low | 61.7 | Low | 61 Ų | 61 | 119.7 Ų | 119.7 | 63% | 0.629 | 64% | 0.639 | S | S | * | * | trans | -52.3 | 146.9 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.9 | I163 S167 | I163-G165 PolarHBondContact O-N 3.14Å; G165-S167 PolarHBondContact O-N 3.13Å; G165-S167 VanDerWaalsContact O-N 3.11Å | ||
| 166 | R | 58.9 | Low | 61.8 | Low | 247 Ų | 247 | 118.5 Ų | 118.5 | 93% | 0.932 | 64% | 0.64 | S | S | * | * | trans | -36 | 118.9 | -178.6 | -71.3 | -174.9 | -83.7 | -139.1 | -1.5 | 110.3 | K168 | R166-K168 PolarHBondContact O-N 3.26Š| ||
| 167 | S | 59.8 | Low | 62.1 | Low | 81 Ų | 81 | 118.1 Ų | 118.1 | 57% | 0.566 | 63% | 0.628 | S | S | * | * | trans | -57.2 | 131.1 | -177.6 | 55.7 | 0 | 0 | 0 | 0 | 109.7 | G165 L169 | G165-S167 PolarHBondContact O-N 3.13Å; G165-S167 VanDerWaalsContact O-N 3.11Å; S167-L169 PolarHBondContact O-N 3.28Å | ||
| 168 | K | 58.5 | Low | 62.6 | Low | 178 Ų | 178 | 120 Ų | 120 | 77% | 0.774 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -66.7 | 7.7 | 168.2 | -66.6 | -173.9 | 178.7 | -175.6 | 0 | 113.6 | R166 G170 K178 | R166-K168 PolarHBondContact O-N 3.26Å; K168-G170 PolarHBondContact O-N 3.1Å; K168-G170 VanDerWaalsContact O-N 3.08Å; K168-K178 PolarHBondContact O-NZ 3.01Å |
| 169 | L | 58.8 | Low | 63.5 | Low | 159 Ų | 159 | 114.3 Ų | 114.3 | 83% | 0.832 | 61% | 0.609 | S | S | * | * | trans | -78.4 | 54.2 | 164.9 | -72.2 | 158.2 | 0 | 0 | 0 | 108.9 | S167 | S167-L169 PolarHBondContact O-N 3.28Š| ||
| 170 | G | 60.1 | Low | 64.3 | Low | 28 Ų | 28 | 111.9 Ų | 111.9 | 29% | 0.289 | 59% | 0.592 | S | S | . | * | trans | -86.8 | 151.1 | 163.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | K168 | K168-G170 PolarHBondContact O-N 3.1Å; K168-G170 VanDerWaalsContact O-N 3.08Å | ||
| 171 | S | 61.3 | Low | 65.3 | Low | 73 Ų | 73 | 111.1 Ų | 111.1 | 51% | 0.51 | 59% | 0.593 | S | S | . | * | trans | -55.4 | 157.5 | 166.1 | 174.6 | 0 | 0 | 0 | 0 | 109.1 | S173 D174 | S171-S173 VanDerWaalsContact CB-OG 3.29Å; S171-S173 WeakPolarHBondContact CB-OG 2.81Å; S171-S173 PolarHBondContact O-N 3.05Å; S171-S173 PolarHBondContact OG-OG 2.87Å; S171-D174 PolarHBondContact N-OD2 3.31Å; S171-D174 PolarHBondContact O-N 3.11Å | ||
| 172 | F | 61.1 | Low | 65.9 | Low | 117 Ų | 117 | 108.2 Ų | 108.2 | 51% | 0.513 | 59% | 0.593 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -55.8 | -21.8 | 176 | -154.9 | -102 | 0 | 0 | 0 | 112.4 | K178 T179 | F172-K178 HydrophobicContact CD2-CB 3.86Å; F172-K178 WeakPolarHBondContact CE1-O 3.49Å; F172-K178 HydrophobicContact CE2-CB 3.72Å; F172-K178 VanDerWaalsContact CE2-O 3.29Å; F172-K178 WeakPolarHBondContact CE2-O 3.25Å; F172-K178 VanDerWaalsContact CZ-C 3.48Å; F172-K178 HydrophobicContact CZ-CB 4.3Å; F172-K178 WeakPolarHBondContact CZ-O 3.44Å; F172-T179 HydrophobicContact CD1-CG2 3.77Å; F172-T179 HydrophobicContact CE1-CG2 3.93Å; F172-T179 WeakPolarHBondContact O-CG2 3.29Å |
| 173 | S | 63.9 | Low | 66.6 | Low | 89 Ų | 89 | 108.8 Ų | 108.8 | 62% | 0.622 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | -27.5 | 172.6 | 53.8 | 0 | 0 | 0 | 0 | 114.9 | S171 D175 | S171-S173 VanDerWaalsContact CB-OG 3.29Å; S171-S173 WeakPolarHBondContact CB-OG 2.81Å; S171-S173 PolarHBondContact O-N 3.05Å; S171-S173 PolarHBondContact OG-OG 2.87Å; S173-D175 VanDerWaalsContact C-N 3.35Å |
| 174 | D | 67.6 | Low | 67.2 | Low | 122 Ų | 122 | 103.3 Ų | 103.3 | 65% | 0.652 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85 | -15.6 | -177.9 | -65.4 | -37.3 | 0 | 0 | 0 | 112.2 | S171 | S171-D174 PolarHBondContact N-OD2 3.31Å; S171-D174 PolarHBondContact O-N 3.11Å |
| 175 | D | 69.4 | Low | 68.2 | Low | 31 Ų | 31 | 101.5 Ų | 101.5 | 17% | 0.166 | 57% | 0.573 | C | S | . | * | trans | -123.1 | 83 | -168.3 | -154 | 4.8 | 0 | 0 | 0 | 111.6 | S173 H177 K178 | S173-D175 VanDerWaalsContact C-N 3.35Å; D175-H177 VanDerWaalsContact CG-ND1 3.25Å; D175-H177 PolarHBondContact O-N 3.5Å; D175-H177 IonicContact OD1-CE1 2.87Å; D175-H177 PolarHBondContact OD1-CE1 2.86Å; D175-H177 IonicContact OD1-CG 3.72Å; D175-H177 IonicContact OD1-ND1 2.59Å; D175-H177 PolarHBondContact OD1-ND1 2.71Å; D175-H177 IonicContact OD2-CE1 2.86Å; D175-H177 PolarHBondContact OD2-CE1 2.87Å; D175-H177 IonicContact OD2-ND1 3.5Å; D175-H177 PolarHBondContact OD2-ND1 2.59Å; D175-H177 IonicContact OD2-NE2 3.6Å; D175-K178 HydrophobicContact CB-CB 4.46Å; D175-K178 HydrophobicContact CB-CD 4.05Å; D175-K178 HydrophobicContact CB-CG 4.19Å; D175-K178 WeakPolarHBondContact O-CB 3.04Å; D175-K178 PolarHBondContact O-N 2.99Å; D175-K178 WeakPolarHBondContact OD2-CD 3.05Å; D175-K178 WeakPolarHBondContact OD2-CE 3.38Å; D175-K178 IonicContact OD2-NZ 2.71Å; D175-K178 PolarHBondContact OD2-NZ 2.85Å | ||
| 176 | L | 64.7 | Low | 68.9 | Low | 149 Ų | 149 | 107.2 Ų | 107.2 | 78% | 0.78 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.2 | -19.8 | -174.9 | -73.9 | 154 | 0 | 0 | 0 | 114.5 | K178 T179 | L176-K178 VanDerWaalsContact C-N 3.33Å; L176-T179 PolarHBondContact O-OG1 2.85Å |
| 177 | H | 66.9 | Low | 69.9 | Low | 139 Ų | 139 | 104.6 Ų | 104.6 | 64% | 0.644 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -16.9 | 174.9 | 78.9 | -98.2 | 0 | 0 | 0 | 113.4 | D175 | D175-H177 VanDerWaalsContact CG-ND1 3.25Å; D175-H177 PolarHBondContact O-N 3.5Å; D175-H177 IonicContact OD1-CE1 2.87Å; D175-H177 PolarHBondContact OD1-CE1 2.86Å; D175-H177 IonicContact OD1-CG 3.72Å; D175-H177 IonicContact OD1-ND1 2.59Å; D175-H177 PolarHBondContact OD1-ND1 2.71Å; D175-H177 IonicContact OD2-CE1 2.86Å; D175-H177 PolarHBondContact OD2-CE1 2.87Å; D175-H177 IonicContact OD2-ND1 3.5Å; D175-H177 PolarHBondContact OD2-ND1 2.59Å; D175-H177 IonicContact OD2-NE2 3.6Å |
| 178 | K | 69.4 | Low | 70.9 | Confident | 77 Ų | 77 | 106 Ų | 106 | 34% | 0.335 | 59% | 0.587 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.4 | -26 | 176.8 | -65.4 | -175.6 | 179.1 | 137 | 0 | 111.5 | K168 F172 D175 L176 P180 | K168-K178 PolarHBondContact O-NZ 3.01Å; F172-K178 HydrophobicContact CD2-CB 3.86Å; F172-K178 WeakPolarHBondContact CE1-O 3.49Å; F172-K178 HydrophobicContact CE2-CB 3.72Å; F172-K178 VanDerWaalsContact CE2-O 3.29Å; F172-K178 WeakPolarHBondContact CE2-O 3.25Å; F172-K178 VanDerWaalsContact CZ-C 3.48Å; F172-K178 HydrophobicContact CZ-CB 4.3Å; F172-K178 WeakPolarHBondContact CZ-O 3.44Å; D175-K178 HydrophobicContact CB-CB 4.46Å; D175-K178 HydrophobicContact CB-CD 4.05Å; D175-K178 HydrophobicContact CB-CG 4.19Å; D175-K178 WeakPolarHBondContact O-CB 3.04Å; D175-K178 PolarHBondContact O-N 2.99Å; D175-K178 WeakPolarHBondContact OD2-CD 3.05Å; D175-K178 WeakPolarHBondContact OD2-CE 3.38Å; D175-K178 IonicContact OD2-NZ 2.71Å; D175-K178 PolarHBondContact OD2-NZ 2.85Å; L176-K178 VanDerWaalsContact C-N 3.33Å; K178-P180 WeakPolarHBondContact O-CD 3.43Å |
| 179 | T | 74.5 | Confident | 72 | Confident | 52 Ų | 52 | 101.8 Ų | 101.8 | 32% | 0.319 | 57% | 0.573 | S | S | . | * | S | Bend | trans | -65.4 | 119.7 | 175 | 51.8 | 0 | 0 | 0 | 0 | 110.4 | F172 L176 G181 | F172-T179 HydrophobicContact CD1-CG2 3.77Å; F172-T179 HydrophobicContact CE1-CG2 3.93Å; F172-T179 WeakPolarHBondContact O-CG2 3.29Å; L176-T179 PolarHBondContact O-OG1 2.85Å; T179-G181 PolarHBondContact O-N 3.26Å |
| 180 | P | 79.3 | Confident | 73.1 | Confident | 48 Ų | 48 | 97.7 Ų | 97.7 | 31% | 0.312 | 55% | 0.554 | S | S | . | * | P | Polyproline II helix | trans | -59.5 | 129.9 | 176.4 | 24.6 | -30.8 | 0 | 0 | 0 | 108 | K178 A184 Y185 | K178-P180 WeakPolarHBondContact O-CD 3.43Å; P180-A184 HydrophobicContact CB-CB 3.65Å; P180-Y185 HydrophobicContact CG-CE1 4.01Å; P180-Y185 HydrophobicContact CG-CE2 4.46Å |
| 181 | G | 78 | Confident | 74 | Confident | 38 Ų | 38 | 100.1 Ų | 100.1 | 39% | 0.392 | 56% | 0.558 | S | S | . | * | P | Polyproline II helix | trans | -59.4 | 163.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | T179 A183 A184 Y185 | T179-G181 PolarHBondContact O-N 3.26Å; G181-A183 PolarHBondContact O-N 3.4Å; G181-A184 WeakPolarHBondContact O-CB 3.47Å; G181-A184 PolarHBondContact O-N 3Å; G181-Y185 WeakPolarHBondContact O-CD2 3.41Å |
| 182 | P | 75.6 | Confident | 74.9 | Confident | 126 Ų | 126 | 102.2 Ų | 102.2 | 82% | 0.818 | 57% | 0.567 | S | S | * | * | G | 310 helix | trans | -55.6 | -26.6 | -178.3 | 20 | -31.4 | 0 | 0 | 0 | 113.7 | ||
| 183 | A | 77.6 | Confident | 75.8 | Confident | 106 Ų | 106 | 102 Ų | 102 | 88% | 0.876 | 58% | 0.576 | S | S | * | * | G | 310 helix | trans | -83.9 | -8.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | G181 | G181-A183 PolarHBondContact O-N 3.4Š|
| 184 | A | 80.3 | Confident | 76.8 | Confident | 56 Ų | 56 | 104.5 Ų | 104.5 | 46% | 0.463 | 58% | 0.575 | S | S | . | * | G | 310 helix | trans | -93.3 | -6.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | P180 G181 H186 | P180-A184 HydrophobicContact CB-CB 3.65Å; G181-A184 WeakPolarHBondContact O-CB 3.47Å; G181-A184 PolarHBondContact O-N 3Å; A184-H186 PolarHBondContact O-N 2.83Å |
| 185 | Y | 80.3 | Confident | 77.6 | Confident | 155 Ų | 155 | 108.7 Ų | 108.7 | 61% | 0.608 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -73.8 | 120.1 | 170.6 | -63.4 | -82.6 | 0 | 0 | 0 | 109.5 | P180 G181 | P180-Y185 HydrophobicContact CG-CE1 4.01Å; P180-Y185 HydrophobicContact CG-CE2 4.46Å; G181-Y185 WeakPolarHBondContact O-CD2 3.41Å |
| 186 | H | 81.2 | Confident | 78.2 | Confident | 180 Ų | 180 | 112 Ų | 112 | 83% | 0.833 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -67.8 | 142.4 | 170.7 | -67.8 | -62.9 | 0 | 0 | 0 | 110.2 | A184 T188 | A184-H186 PolarHBondContact O-N 2.83Å; H186-T188 PolarHBondContact O-N 2.91Å |
| 187 | Q | 79.6 | Confident | 79.3 | Confident | 192 Ų | 192 | 108.5 Ų | 108.5 | 90% | 0.897 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 121 | 171 | -67.4 | 178.3 | -3.1 | 0 | 0 | 108.6 | ||
| 188 | T | 81.4 | Confident | 80.1 | Confident | 112 Ų | 112 | 106.2 Ų | 106.2 | 69% | 0.687 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 140.4 | 172.7 | 51.9 | 0 | 0 | 0 | 0 | 109.6 | H186 V190 | H186-T188 PolarHBondContact O-N 2.91Å; T188-V190 PolarHBondContact O-N 3.11Å |
| 189 | D | 81.1 | Confident | 80.8 | Confident | 89 Ų | 89 | 109.2 Ų | 109.2 | 48% | 0.476 | 61% | 0.606 | S | S | . | * | P | Polyproline II helix | trans | -56.2 | 125.4 | 173 | -177.2 | 5.3 | 0 | 0 | 0 | 109.7 | Q191 V192 | D189-Q191 PolarHBondContact O-N 3.37Å; D189-Q191 VanDerWaalsContact O-N 3.13Å; D189-Q191 WeakPolarHBondContact OD1-CG 3.48Å; D189-Q191 PolarHBondContact OD1-N 3.32Å; D189-Q191 VanDerWaalsContact OD1-N 3.16Å; D189-V192 HydrophobicContact CB-CG2 4.21Å; D189-V192 VanDerWaalsContact O-CB 3.32Å; D189-V192 WeakPolarHBondContact O-CB 3.45Å; D189-V192 WeakPolarHBondContact O-CG2 3.14Å; D189-V192 PolarHBondContact O-N 2.9Å |
| 190 | V | 81.3 | Confident | 81.3 | Confident | 73 Ų | 73 | 116.4 Ų | 116.4 | 44% | 0.442 | 63% | 0.629 | S | S | . | * | G | 310 helix | trans | -60 | -27.1 | -177.5 | -177.3 | 0 | 0 | 0 | 0 | 110.9 | T188 V192 T193 K194 | T188-V190 PolarHBondContact O-N 3.11Å; V190-V192 PolarHBondContact O-N 3.01Å; V190-T193 PolarHBondContact O-N 3.05Å; V190-T193 VanDerWaalsContact O-N 3.15Å; V190-T193 PolarHBondContact O-OG1 2.97Å; V190-K194 HydrophobicContact CG1-CB 4.47Å; V190-K194 HydrophobicContact CG1-CD 3.56Å; V190-K194 HydrophobicContact CG1-CG 3.9Å; V190-K194 PolarHBondContact O-N 2.97Å |
| 191 | Q | 78.4 | Confident | 81.4 | Confident | 79 Ų | 79 | 118 Ų | 118 | 37% | 0.369 | 64% | 0.638 | S | S | . | * | G | 310 helix | trans | -70 | -6.6 | 178 | -54.8 | -58.8 | -32.1 | 0 | 0 | 114 | D189 K196 | D189-Q191 PolarHBondContact O-N 3.37Å; D189-Q191 VanDerWaalsContact O-N 3.13Å; D189-Q191 WeakPolarHBondContact OD1-CG 3.48Å; D189-Q191 PolarHBondContact OD1-N 3.32Å; D189-Q191 VanDerWaalsContact OD1-N 3.16Å; Q191-K196 HydrophobicContact CB-CB 4.09Å; Q191-K196 HydrophobicContact CB-CD 3.8Å; Q191-K196 HydrophobicContact CB-CG 3.91Å; Q191-K196 HydrophobicContact CG-CD 4.29Å; Q191-K196 HydrophobicContact CG-CG 4.11Å; Q191-K196 VanDerWaalsContact OE1-CA 3.31Å |
| 192 | V | 80.9 | Confident | 81.8 | Confident | 117 Ų | 117 | 125.7 Ų | 125.7 | 71% | 0.709 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -77.6 | -32.2 | 171.3 | 177.3 | 0 | 0 | 0 | 0 | 111.2 | D189 V190 | D189-V192 HydrophobicContact CB-CG2 4.21Å; D189-V192 VanDerWaalsContact O-CB 3.32Å; D189-V192 WeakPolarHBondContact O-CB 3.45Å; D189-V192 WeakPolarHBondContact O-CG2 3.14Å; D189-V192 PolarHBondContact O-N 2.9Å; V190-V192 PolarHBondContact O-N 3.01Å |
| 193 | T | 80.1 | Confident | 82.1 | Confident | 112 Ų | 112 | 122.8 Ų | 122.8 | 69% | 0.687 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105 | -26.7 | -176.4 | 57 | 0 | 0 | 0 | 0 | 112.9 | V190 | V190-T193 PolarHBondContact O-N 3.05Å; V190-T193 VanDerWaalsContact O-N 3.15Å; V190-T193 PolarHBondContact O-OG1 2.97Å |
| 194 | K | 85.1 | Confident | 82.2 | Confident | 141 Ų | 141 | 122 Ų | 122 | 61% | 0.613 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -102 | 157.7 | 177.9 | -59.6 | -168.3 | -172.6 | 177 | 0 | 111 | V190 K196 | V190-K194 HydrophobicContact CG1-CB 4.47Å; V190-K194 HydrophobicContact CG1-CD 3.56Å; V190-K194 HydrophobicContact CG1-CG 3.9Å; V190-K194 PolarHBondContact O-N 2.97Å; K194-K196 PolarHBondContact O-N 3.08Å; K194-K196 VanDerWaalsContact O-N 3.13Å |
| 195 | F | 83.3 | Confident | 82 | Confident | 211 Ų | 211 | 128.8 Ų | 128.8 | 93% | 0.925 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 117.5 | 172.5 | -81.7 | -81.4 | 0 | 0 | 0 | 110.8 | ||
| 196 | K | 83.9 | Confident | 81.9 | Confident | 99 Ų | 99 | 127.1 Ų | 127.1 | 43% | 0.43 | 67% | 0.666 | S | S | . | * | P | Polyproline II helix | trans | -92.5 | 138.1 | 174.3 | -167 | -178.3 | -167.1 | 170.4 | 0 | 110.1 | Q191 K194 | Q191-K196 HydrophobicContact CB-CB 4.09Å; Q191-K196 HydrophobicContact CB-CD 3.8Å; Q191-K196 HydrophobicContact CB-CG 3.91Å; Q191-K196 HydrophobicContact CG-CD 4.29Å; Q191-K196 HydrophobicContact CG-CG 4.11Å; Q191-K196 VanDerWaalsContact OE1-CA 3.31Å; K194-K196 PolarHBondContact O-N 3.08Å; K194-K196 VanDerWaalsContact O-N 3.13Å |
| 197 | A | 86.1 | Confident | 81.7 | Confident | 76 Ų | 76 | 124.9 Ų | 124.9 | 63% | 0.628 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 146.6 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | Q199 | A197-Q199 PolarHBondContact O-N 2.94Š|
| 198 | P | 85 | Confident | 81.7 | Confident | 92 Ų | 92 | 120.7 Ų | 120.7 | 60% | 0.597 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -61 | 131.9 | 178.5 | 24.7 | -33.4 | 0 | 0 | 0 | 111 | Y200 | P198-Y200 HydrophobicContact CB-CE2 4.03Å; P198-Y200 HydrophobicContact CG-CE2 3.93Å |
| 199 | Q | 83.9 | Confident | 81.4 | Confident | 139 Ų | 139 | 122.1 Ų | 122.1 | 65% | 0.65 | 66% | 0.656 | S | S | * | * | P | Polyproline II helix | trans | -98.1 | 120.1 | 176.3 | -67.8 | -173.6 | -28.5 | 0 | 0 | 110.3 | A197 | A197-Q199 PolarHBondContact O-N 2.94Š|
| 200 | Y | 84.9 | Confident | 81.3 | Confident | 203 Ų | 203 | 120.2 Ų | 120.2 | 80% | 0.796 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -99.4 | 141.6 | 177.5 | -57.9 | -80.3 | 0 | 0 | 0 | 110.2 | P198 | P198-Y200 HydrophobicContact CB-CE2 4.03Å; P198-Y200 HydrophobicContact CG-CE2 3.93Å |
| 201 | T | 82.2 | Confident | 81.2 | Confident | 81 Ų | 81 | 121.7 Ų | 121.7 | 50% | 0.497 | 66% | 0.663 | S | S | . | * | trans | -132.2 | 137.9 | 173.6 | 178.8 | 0 | 0 | 0 | 0 | 108.8 | A203 R205 | T201-A203 VanDerWaalsContact C-N 3.28Å; T201-A203 PolarHBondContact OG1-N 3.16Å; T201-R205 HydrophobicContact CG2-CG 4.35Å | ||
| 202 | M | 85.3 | Confident | 81.1 | Confident | 200 Ų | 200 | 125.5 Ų | 125.5 | 99% | 0.985 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -81.6 | -10.8 | 175.2 | -62.6 | -61.9 | -71.8 | 0 | 0 | 112.1 | ||
| 203 | A | 82.7 | Confident | 81.2 | Confident | 65 Ų | 65 | 124 Ų | 124 | 54% | 0.537 | 67% | 0.67 | S | S | . | * | S | Bend | trans | -81.5 | 141.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | T201 R205 | T201-A203 VanDerWaalsContact C-N 3.28Å; T201-A203 PolarHBondContact OG1-N 3.16Å; A203-R205 PolarHBondContact O-N 3Å |
| 204 | A | 79.6 | Confident | 81.2 | Confident | 90 Ų | 90 | 126.9 Ų | 126.9 | 74% | 0.744 | 68% | 0.68 | S | S | * | * | trans | -58.9 | 128.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110 | V206 | A204-V206 VanDerWaalsContact C-N 3.3Å; A204-V206 HydrophobicContact CB-CG2 4.39Å; A204-V206 PolarHBondContact O-N 3.4Å | ||
| 205 | R | 76.3 | Confident | 81 | Confident | 199 Ų | 199 | 127.2 Ų | 127.2 | 75% | 0.751 | 68% | 0.682 | S | S | * | * | trans | -75.4 | 88.2 | 171.9 | -62.6 | -173 | -160.4 | -135.3 | 1.8 | 108.1 | T201 A203 E207 | T201-R205 HydrophobicContact CG2-CG 4.35Å; A203-R205 PolarHBondContact O-N 3Å; R205-E207 PolarHBondContact O-N 3.04Å | ||
| 206 | V | 78.4 | Confident | 81.1 | Confident | 120 Ų | 120 | 120.5 Ų | 120.5 | 73% | 0.727 | 66% | 0.659 | S | S | * | * | trans | -81.9 | 104.8 | 170.3 | -176.8 | 0 | 0 | 0 | 0 | 106.4 | A204 | A204-V206 VanDerWaalsContact C-N 3.3Å; A204-V206 HydrophobicContact CB-CG2 4.39Å; A204-V206 PolarHBondContact O-N 3.4Å | ||
| 207 | E | 76.3 | Confident | 81.1 | Confident | 132 Ų | 132 | 117.6 Ų | 117.6 | 62% | 0.617 | 66% | 0.657 | S | S | * | * | trans | -61.2 | 128.3 | 164.2 | -68.7 | -165.4 | 157.4 | 0 | 0 | 107.4 | R205 K212 | R205-E207 PolarHBondContact O-N 3.04Å; E207-K212 WeakPolarHBondContact OE2-CE 3.2Å; E207-K212 IonicContact OE2-NZ 2.83Å; E207-K212 PolarHBondContact OE2-NZ 2.99Å | ||
| 208 | P | 78.7 | Confident | 80.7 | Confident | 104 Ų | 104 | 120.2 Ų | 120.2 | 68% | 0.675 | 67% | 0.668 | S | S | * | * | trans | -55 | 144.8 | 173.1 | 25 | -32.9 | 0 | 0 | 0 | 108.3 | G210 | P208-G210 VanDerWaalsContact C-N 3.27Å; P208-G210 PolarHBondContact O-N 2.91Å | ||
| 209 | P | 76.2 | Confident | 80.5 | Confident | 142 Ų | 142 | 119.4 Ų | 119.4 | 92% | 0.922 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -59.9 | 96.5 | 174.6 | 25 | -32.5 | 0 | 0 | 0 | 108.5 | ||
| 210 | G | 78 | Confident | 80.6 | Confident | 50 Ų | 50 | 115.9 Ų | 115.9 | 52% | 0.515 | 67% | 0.671 | S | S | . | * | trans | -108.9 | 160.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | P208 K212 | P208-G210 VanDerWaalsContact C-N 3.27Å; P208-G210 PolarHBondContact O-N 2.91Å; G210-K212 PolarHBondContact O-N 3.1Å | ||
| 211 | D | 79 | Confident | 80.5 | Confident | 104 Ų | 104 | 111.9 Ų | 111.9 | 56% | 0.556 | 66% | 0.66 | S | S | * | * | trans | -69.5 | 95.4 | 176.7 | -171.8 | 3.7 | 0 | 0 | 0 | 109.7 | T213 K215 | D211-T213 PolarHBondContact O-N 2.68Å; D211-T213 VanDerWaalsContact OD1-CB 3.27Å; D211-T213 WeakPolarHBondContact OD1-CB 3.24Å; D211-T213 WeakPolarHBondContact OD1-CG2 3.33Å; D211-T213 PolarHBondContact OD1-N 3.01Å; D211-T213 VanDerWaalsContact OD1-N 3.12Å; D211-T213 PolarHBondContact OD1-OG1 3.43Å; D211-T213 PolarHBondContact OD2-OG1 2.8Å; D211-K215 WeakPolarHBondContact OD2-CE 3.45Å; D211-K215 IonicContact OD2-NZ 2.74Å; D211-K215 PolarHBondContact OD2-NZ 3.31Å | ||
| 212 | K | 77.1 | Confident | 80.4 | Confident | 158 Ų | 158 | 110.8 Ų | 110.8 | 69% | 0.687 | 66% | 0.655 | S | S | * | * | trans | -80.6 | 9.1 | 175.6 | -64.9 | -173.7 | 176.6 | -166.3 | 0 | 112.4 | E207 G210 L214 | E207-K212 WeakPolarHBondContact OE2-CE 3.2Å; E207-K212 IonicContact OE2-NZ 2.83Å; E207-K212 PolarHBondContact OE2-NZ 2.99Å; G210-K212 PolarHBondContact O-N 3.1Å; K212-L214 PolarHBondContact O-N 2.99Å | ||
| 213 | T | 82.8 | Confident | 79.9 | Confident | 87 Ų | 87 | 106 Ų | 106 | 53% | 0.534 | 64% | 0.639 | S | S | . | * | trans | -65.1 | 125.3 | 174.4 | 56 | 0 | 0 | 0 | 0 | 109.8 | D211 K215 | D211-T213 PolarHBondContact O-N 2.68Å; D211-T213 VanDerWaalsContact OD1-CB 3.27Å; D211-T213 WeakPolarHBondContact OD1-CB 3.24Å; D211-T213 WeakPolarHBondContact OD1-CG2 3.33Å; D211-T213 PolarHBondContact OD1-N 3.01Å; D211-T213 VanDerWaalsContact OD1-N 3.12Å; D211-T213 PolarHBondContact OD1-OG1 3.43Å; D211-T213 PolarHBondContact OD2-OG1 2.8Å; T213-K215 VanDerWaalsContact C-N 3.31Å; T213-K215 PolarHBondContact O-N 3.03Å; T213-K215 WeakPolarHBondContact OG1-CE 3.43Å | ||
| 214 | L | 79.9 | Confident | 79.5 | Confident | 172 Ų | 172 | 111.5 Ų | 111.5 | 90% | 0.901 | 65% | 0.654 | S | S | * | * | trans | -69.4 | 92.7 | 170.8 | -67.7 | 170.9 | 0 | 0 | 0 | 107.7 | K212 P216 | K212-L214 PolarHBondContact O-N 2.99Å; L214-P216 WeakPolarHBondContact O-CD 3.15Å | ||
| 215 | K | 81.6 | Confident | 79.3 | Confident | 147 Ų | 147 | 114.9 Ų | 114.9 | 64% | 0.639 | 65% | 0.652 | S | S | * | * | trans | -74.5 | 112.6 | 176.4 | -60.3 | -169.3 | -174 | 179.9 | 0 | 107.9 | D211 T213 G217 | D211-K215 WeakPolarHBondContact OD2-CE 3.45Å; D211-K215 IonicContact OD2-NZ 2.74Å; D211-K215 PolarHBondContact OD2-NZ 3.31Å; T213-K215 VanDerWaalsContact C-N 3.31Å; T213-K215 PolarHBondContact O-N 3.03Å; T213-K215 WeakPolarHBondContact OG1-CE 3.43Å; K215-G217 PolarHBondContact O-N 3.47Å | ||
| 216 | P | 85.4 | Confident | 79.4 | Confident | 70 Ų | 70 | 108.7 Ų | 108.7 | 46% | 0.455 | 64% | 0.636 | S | S | . | * | trans | -54.9 | 136 | 174.6 | 21.5 | -31.9 | 0 | 0 | 0 | 109.3 | L214 A220 H221 | L214-P216 WeakPolarHBondContact O-CD 3.15Å; P216-A220 HydrophobicContact CB-CB 3.61Å; P216-H221 WeakPolarHBondContact CG-CE1 3.16Å | ||
| 217 | G | 82.9 | Confident | 79.3 | Confident | 38 Ų | 38 | 107.7 Ų | 107.7 | 39% | 0.392 | 63% | 0.63 | S | S | . | * | trans | -63.6 | 166.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | K215 G219 A220 H221 | K215-G217 PolarHBondContact O-N 3.47Å; G217-G219 PolarHBondContact O-N 2.98Å; G217-A220 WeakPolarHBondContact O-CB 3.49Å; G217-A220 PolarHBondContact O-N 3.24Å; G217-H221 PolarHBondContact O-CD2 3.35Å | ||
| 218 | P | 78.8 | Confident | 79.3 | Confident | 131 Ų | 131 | 109.6 Ų | 109.6 | 85% | 0.851 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.5 | -29.6 | -177.9 | 20 | -31.4 | 0 | 0 | 0 | 113.7 | ||
| 219 | G | 81 | Confident | 79.3 | Confident | 75 Ų | 75 | 110.1 Ų | 110.1 | 77% | 0.773 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | -7.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | G217 H221 | G217-G219 PolarHBondContact O-N 2.98Å; G219-H221 VanDerWaalsContact C-N 3.35Å |
| 220 | A | 85.2 | Confident | 79.2 | Confident | 66 Ų | 66 | 110.6 Ų | 110.6 | 55% | 0.545 | 63% | 0.632 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87.4 | -7.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | P216 G217 | P216-A220 HydrophobicContact CB-CB 3.61Å; G217-A220 WeakPolarHBondContact O-CB 3.49Å; G217-A220 PolarHBondContact O-N 3.24Å |
| 221 | H | 82.3 | Confident | 79 | Confident | 119 Ų | 119 | 114.3 Ų | 114.3 | 55% | 0.551 | 65% | 0.648 | S | S | * | * | trans | -82.9 | 116 | 171.9 | -63.6 | -75.7 | 0 | 0 | 0 | 110.1 | P216 G217 G219 P223 | P216-H221 WeakPolarHBondContact CG-CE1 3.16Å; G217-H221 PolarHBondContact O-CD2 3.35Å; G219-H221 VanDerWaalsContact C-N 3.35Å; H221-P223 WeakPolarHBondContact O-CD 3.44Å | ||
| 222 | S | 80.8 | Confident | 78.7 | Confident | 58 Ų | 58 | 113.1 Ų | 113.1 | 41% | 0.406 | 65% | 0.647 | S | S | . | * | trans | -107.4 | 82.6 | 171.7 | -58.5 | 0 | 0 | 0 | 0 | 110.2 | E224 K225 | S222-E224 PolarHBondContact O-N 3.43Å; S222-E224 VanDerWaalsContact O-N 3.15Å; S222-K225 PolarHBondContact O-N 3.02Å; S222-K225 VanDerWaalsContact O-N 3.07Å | ||
| 223 | P | 74.9 | Confident | 78.4 | Confident | 100 Ų | 100 | 109.2 Ų | 109.2 | 65% | 0.649 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -61.5 | -23.7 | -178.1 | 26.6 | -35.2 | 0 | 0 | 0 | 112.8 | H221 K225 V226 | H221-P223 WeakPolarHBondContact O-CD 3.44Å; P223-K225 PolarHBondContact O-N 2.85Å; P223-V226 PolarHBondContact O-N 3.23Å |
| 224 | E | 74.9 | Confident | 78 | Confident | 179 Ų | 179 | 110.8 Ų | 110.8 | 84% | 0.836 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -64.1 | -22.5 | 176.6 | -57.8 | 174.7 | -163.8 | 0 | 0 | 113.3 | S222 | S222-E224 PolarHBondContact O-N 3.43Å; S222-E224 VanDerWaalsContact O-N 3.15Å |
| 225 | K | 74.5 | Confident | 77.7 | Confident | 162 Ų | 162 | 108.3 Ų | 108.3 | 70% | 0.704 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -94.3 | 2.3 | -178.4 | -61.8 | -178.3 | -179.2 | 174.3 | 0 | 113 | S222 P223 T227 | S222-K225 PolarHBondContact O-N 3.02Å; S222-K225 VanDerWaalsContact O-N 3.07Å; P223-K225 PolarHBondContact O-N 2.85Å; K225-T227 PolarHBondContact O-N 2.61Å |
| 226 | V | 79.3 | Confident | 77.4 | Confident | 69 Ų | 69 | 106.4 Ų | 106.4 | 42% | 0.418 | 65% | 0.648 | S | S | . | * | trans | -84.4 | 96.8 | -177.1 | -178.7 | 0 | 0 | 0 | 0 | 109.9 | P223 T229 | P223-V226 PolarHBondContact O-N 3.23Å; V226-T229 WeakPolarHBondContact CG1-OG1 3.47Å | ||
| 227 | T | 75.3 | Confident | 76.9 | Confident | 99 Ų | 99 | 108.5 Ų | 108.5 | 61% | 0.607 | 66% | 0.659 | S | S | * | * | trans | -95 | -11.2 | 178.3 | 56.3 | 0 | 0 | 0 | 0 | 114 | K225 C232 | K225-T227 PolarHBondContact O-N 2.61Å; T227-C232 HydrophobicContact CG2-CB 4.21Å | ||
| 228 | L | 76.5 | Confident | 76.4 | Confident | 171 Ų | 171 | 115.5 Ų | 115.5 | 90% | 0.895 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -72.6 | -37.5 | -177 | -92.1 | 152.8 | 0 | 0 | 0 | 113.8 | ||
| 229 | T | 79.7 | Confident | 75.8 | Confident | 115 Ų | 115 | 112.3 Ų | 112.3 | 71% | 0.706 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -112.9 | -15.1 | -174.8 | 52 | 0 | 0 | 0 | 0 | 113.6 | V226 | V226-T229 WeakPolarHBondContact CG1-OG1 3.47Š|
| 230 | K | 72.8 | Confident | 75.3 | Confident | 152 Ų | 152 | 115.5 Ų | 115.5 | 66% | 0.661 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -134.2 | 136.4 | -179.8 | -66.1 | -176.1 | 178.9 | 179.3 | 0 | 109.6 | C232 | K230-C232 PolarHBondContact O-N 3.03Š|
| 231 | P | 74.1 | Confident | 74.1 | Confident | 129 Ų | 129 | 122.1 Ų | 122.1 | 84% | 0.838 | 68% | 0.684 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 131.7 | 170.1 | 26.2 | -31.8 | 0 | 0 | 0 | 109.2 | ||
| 232 | C | 72.4 | Confident | 73.2 | Confident | 79 Ų | 79 | 122.5 Ų | 122.5 | 53% | 0.534 | 69% | 0.686 | S | S | . | * | P | Polyproline II helix | trans | -69.7 | 136.4 | 175.1 | -168.2 | 0 | 0 | 0 | 0 | 109.2 | T227 K230 | T227-C232 HydrophobicContact CG2-CB 4.21Å; K230-C232 PolarHBondContact O-N 3.03Å |
| 233 | A | 72 | Confident | 72.8 | Confident | 76 Ų | 76 | 123.5 Ų | 123.5 | 63% | 0.628 | 69% | 0.693 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 143.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | V235 | A233-V235 PolarHBondContact O-N 3.02Å; A233-V235 VanDerWaalsContact O-N 3.14Å |
| 234 | P | 73.9 | Confident | 72.3 | Confident | 120 Ų | 120 | 126.6 Ų | 126.6 | 78% | 0.779 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 121.3 | -179.5 | 23.6 | -32.6 | 0 | 0 | 0 | 110.3 | V236 | P234-V236 PolarHBondContact O-N 3.19Š|
| 235 | V | 73.5 | Confident | 71.6 | Confident | 120 Ų | 120 | 128.1 Ų | 128.1 | 73% | 0.727 | 70% | 0.704 | S | S | * | * | trans | -80.3 | 103.6 | 174 | -178.8 | 0 | 0 | 0 | 0 | 107.5 | A233 T237 | A233-V235 PolarHBondContact O-N 3.02Å; A233-V235 VanDerWaalsContact O-N 3.14Å; V235-T237 HydrophobicContact CG1-CG2 4.33Å; V235-T237 PolarHBondContact O-N 3.48Å | ||
| 236 | V | 74.3 | Confident | 70.9 | Confident | 107 Ų | 107 | 126.5 Ų | 126.5 | 65% | 0.648 | 70% | 0.7 | S | S | * | * | trans | -79.3 | 105.5 | 175.2 | -173.1 | 0 | 0 | 0 | 0 | 107.8 | P234 F238 | P234-V236 PolarHBondContact O-N 3.19Å; V236-F238 HydrophobicContact CG1-CE1 4.43Å; V236-F238 HydrophobicContact CG1-CZ 4.34Å | ||
| 237 | T | 75.3 | Confident | 70 | Confident | 114 Ų | 114 | 129.2 Ų | 129.2 | 70% | 0.699 | 72% | 0.717 | S | S | * | * | trans | -88.4 | 122.2 | 166.5 | 52.9 | 0 | 0 | 0 | 0 | 108.2 | V235 G239 | V235-T237 HydrophobicContact CG1-CG2 4.33Å; V235-T237 PolarHBondContact O-N 3.48Å; T237-G239 PolarHBondContact O-N 3.28Å; T237-G239 VanDerWaalsContact O-N 3.11Å | ||
| 238 | F | 72.4 | Confident | 69.4 | Low | 185 Ų | 185 | 129.8 Ų | 129.8 | 81% | 0.811 | 72% | 0.722 | S | S | * | * | trans | -74.7 | 100.7 | 162.9 | -59.3 | -78.1 | 0 | 0 | 0 | 105.8 | V236 I240 | V236-F238 HydrophobicContact CG1-CE1 4.43Å; V236-F238 HydrophobicContact CG1-CZ 4.34Å; F238-I240 PolarHBondContact O-N 2.95Å | ||
| 239 | G | 66.7 | Low | 68.5 | Low | 63 Ų | 63 | 129.5 Ų | 129.5 | 65% | 0.649 | 72% | 0.721 | S | S | * | * | trans | -50.2 | 129.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | T237 K241 | T237-G239 PolarHBondContact O-N 3.28Å; T237-G239 VanDerWaalsContact O-N 3.11Å; G239-K241 PolarHBondContact O-N 3.36Å | ||
| 240 | I | 70.3 | Confident | 67.6 | Low | 142 Ų | 142 | 129.4 Ų | 129.4 | 73% | 0.728 | 72% | 0.719 | S | S | * | * | trans | -63 | 113.6 | 173.9 | -61.8 | 169.5 | 0 | 0 | 0 | 106.2 | F238 H242 | F238-I240 PolarHBondContact O-N 2.95Å; I240-H242 PolarHBondContact O-N 3.1Å; I240-H242 PolarHBondContact O-ND1 3.42Å | ||
| 241 | K | 60.2 | Low | 66.9 | Low | 206 Ų | 206 | 127.8 Ų | 127.8 | 90% | 0.896 | 72% | 0.722 | S | S | * | * | trans | -67.7 | 102 | 169.5 | -72.3 | -170.9 | 175.1 | -172.5 | 0 | 107.2 | G239 | G239-K241 PolarHBondContact O-N 3.36Š| ||
| 242 | H | 64.4 | Low | 65.9 | Low | 127 Ų | 127 | 128.8 Ų | 128.8 | 59% | 0.588 | 72% | 0.721 | S | S | * | * | trans | -67.7 | 145.7 | 164.7 | -62.9 | 73.2 | 0 | 0 | 0 | 107.1 | I240 M246 | I240-H242 PolarHBondContact O-N 3.1Å; I240-H242 PolarHBondContact O-ND1 3.42Å; H242-M246 HydrophobicContact CB-SD 3.72Å | ||
| 243 | S | 71.8 | Confident | 65.1 | Low | 79 Ų | 79 | 131.4 Ų | 131.4 | 55% | 0.552 | 73% | 0.733 | S | S | * | * | trans | -54.9 | 151.5 | -173.8 | 57.1 | 0 | 0 | 0 | 0 | 111.9 | Y245 M246 | S243-Y245 PolarHBondContact O-N 3.46Å; S243-M246 PolarHBondContact O-N 3.35Å | ||
| 244 | D | 63.1 | Low | 63.9 | Low | 165 Ų | 165 | 140.4 Ų | 140.4 | 88% | 0.882 | 76% | 0.763 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.5 | -4.7 | -177.9 | -61.3 | -23.5 | 0 | 0 | 0 | 114.2 | ||
| 245 | Y | 61.8 | Low | 63.4 | Low | 211 Ų | 211 | 141.4 Ų | 141.4 | 83% | 0.827 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.6 | 11.5 | -178.3 | -60.4 | -73.5 | 0 | 0 | 0 | 114.1 | S243 V247 | S243-Y245 PolarHBondContact O-N 3.46Å; Y245-V247 PolarHBondContact O-N 3.28Å |
| 246 | M | 59.5 | Low | 62.9 | Low | 128 Ų | 128 | 142.5 Ų | 142.5 | 63% | 0.631 | 76% | 0.764 | S | S | * | * | trans | -79.9 | 112.8 | 171.8 | -83.8 | -163.6 | 65.2 | 0 | 0 | 111.3 | H242 S243 | H242-M246 HydrophobicContact CB-SD 3.72Å; S243-M246 PolarHBondContact O-N 3.35Å | ||
| 247 | V | 60.5 | Low | 62.2 | Low | 126 Ų | 126 | 144.5 Ų | 144.5 | 76% | 0.764 | 77% | 0.77 | S | S | * | * | trans | -62.3 | 123.5 | 174.5 | 175.5 | 0 | 0 | 0 | 0 | 109.7 | Y245 L249 | Y245-V247 PolarHBondContact O-N 3.28Å; V247-L249 PolarHBondContact O-N 3.28Å | ||
| 248 | P | 62.1 | Low | 61.5 | Low | 110 Ų | 110 | 146.3 Ų | 146.3 | 71% | 0.714 | 77% | 0.774 | S | S | * | * | trans | -68.5 | 121.3 | 172.1 | 26.7 | -31 | 0 | 0 | 0 | 109.5 | V250 | P248-V250 PolarHBondContact O-N 3.11Å; P248-V250 VanDerWaalsContact O-N 3.11Å | ||
| 249 | L | 58.5 | Low | 60.8 | Low | 166 Ų | 166 | 143.9 Ų | 143.9 | 87% | 0.869 | 77% | 0.772 | S | S | * | * | trans | -88 | 51.9 | 179.4 | -145.5 | 146.3 | 0 | 0 | 0 | 109.7 | V247 | V247-L249 PolarHBondContact O-N 3.28Š| ||
| 250 | V | 59.9 | Low | 60.4 | Low | 112 Ų | 112 | 149.3 Ų | 149.3 | 68% | 0.679 | 78% | 0.78 | S | S | * | * | trans | -111 | 100.7 | 171.6 | -174.5 | 0 | 0 | 0 | 0 | 106.8 | P248 | P248-V250 PolarHBondContact O-N 3.11Å; P248-V250 VanDerWaalsContact O-N 3.11Å | ||
| 251 | V | 57.8 | Low | 59.7 | Low | 119 Ų | 119 | 149.8 Ų | 149.8 | 72% | 0.721 | 78% | 0.784 | S | S | * | * | trans | -91.6 | 110.2 | 168.6 | -177.2 | 0 | 0 | 0 | 0 | 105.5 | V253 | V251-V253 PolarHBondContact O-N 3.1Š| ||
| 252 | D | 53.6 | Low | 59.6 | Low | 150 Ų | 150 | 145.5 Ų | 145.5 | 80% | 0.802 | 78% | 0.775 | S | S | * | * | trans | -67.9 | 118.4 | 166.9 | -72.4 | -35.2 | 0 | 0 | 0 | 107.5 | ||||
| 253 | V | 55.9 | Low | 59.2 | Low | 133 Ų | 133 | 147 Ų | 147 | 81% | 0.806 | 79% | 0.791 | S | S | * | * | trans | -93.6 | 118.5 | 174.3 | -179.7 | 0 | 0 | 0 | 0 | 106.7 | V251 | V251-V253 PolarHBondContact O-N 3.1Š| ||
| 254 | E | 46.6 | Very low | 58.1 | Low | 265 Ų | 265 | 153.2 Ų | 153.2 | 100% | 1.238 | 81% | 0.812 | S | S | * | * | trans | -63.7 | 0 | 167.9 | -72.8 | -175.8 | 156.1 | 0 | 0 | 112.3 |
Retrieved 254 of 254 residues in 354.3 ms
(Link to these results)