| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 43.2 | Very low | 62.4 | Low | 224 Ų | 224 | 115.5 Ų | 115.5 | 100% | 1.103 | 60% | 0.603 | S | S | * | * | 0 | 88 | 0 | -71.7 | -77.2 | -159.9 | 0 | 0 | 107.1 | K3 | M1-K3 PolarHBondContact O-N 3.34Š| |||
| 2 | N | 50.7 | Low | 62.4 | Low | 171 Ų | 171 | 109.9 Ų | 109.9 | 91% | 0.914 | 58% | 0.575 | S | S | * | * | trans | -85.3 | 92.1 | 178.9 | -66.4 | -5.8 | 0 | 0 | 0 | 107.5 | ||||
| 3 | K | 70.8 | Confident | 62.9 | Low | 189 Ų | 189 | 108 Ų | 108 | 82% | 0.822 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -77.7 | 135.5 | 170.1 | -68.2 | -174.5 | 178.2 | -179 | 0 | 107.9 | M1 | M1-K3 PolarHBondContact O-N 3.34Š|
| 4 | E | 69.3 | Low | 63 | Low | 174 Ų | 174 | 108.1 Ų | 108.1 | 81% | 0.813 | 56% | 0.557 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 138.5 | 170.1 | -71.8 | -175.9 | 159.5 | 0 | 0 | 109.3 | T6 | E4-T6 PolarHBondContact O-N 3.17Š|
| 5 | P | 65 | Low | 62.8 | Low | 80 Ų | 80 | 102.5 Ų | 102.5 | 52% | 0.519 | 53% | 0.529 | S | S | . | . | P | Polyproline II helix | trans | -63.2 | 122.2 | 177.7 | 25.5 | -32.2 | 0 | 0 | 0 | 109.1 | D9 K10 | P5-D9 WeakPolarHBondContact CA-OD2 3.42Å; P5-D9 HydrophobicContact CB-CB 3.74Å; P5-K10 HydrophobicContact CB-CG 4.42Å |
| 6 | T | 66.3 | Low | 62.9 | Low | 75 Ų | 75 | 107 Ų | 107 | 46% | 0.46 | 54% | 0.537 | S | S | . | . | P | Polyproline II helix | trans | -62.7 | 164 | 171.7 | 62.9 | 0 | 0 | 0 | 0 | 110.2 | E4 V8 D9 K10 | E4-T6 PolarHBondContact O-N 3.17Å; T6-V8 PolarHBondContact O-N 3.01Å; T6-V8 VanDerWaalsContact O-N 3.13Å; T6-D9 WeakPolarHBondContact CB-OD2 3.43Å; T6-D9 PolarHBondContact N-OD2 3.1Å; T6-D9 WeakPolarHBondContact O-CB 3.29Å; T6-D9 PolarHBondContact O-N 2.96Å; T6-D9 PolarHBondContact OG1-N 3.34Å; T6-D9 PolarHBondContact OG1-OD2 3.36Å; T6-K10 PolarHBondContact O-N 2.84Å; T6-K10 VanDerWaalsContact O-N 3.07Å |
| 7 | S | 66.7 | Low | 62.9 | Low | 100 Ų | 100 | 108.7 Ų | 108.7 | 70% | 0.699 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -55.7 | -29 | 173.2 | 53.2 | 0 | 0 | 0 | 0 | 112.3 | A11 | S7-A11 PolarHBondContact O-N 2.92Å; S7-A11 VanDerWaalsContact O-N 3.14Å |
| 8 | V | 59.5 | Low | 62.4 | Low | 49 Ų | 49 | 105.2 Ų | 105.2 | 30% | 0.297 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -69.5 | -46 | 174.6 | 179.2 | 0 | 0 | 0 | 0 | 110.7 | T6 K10 A11 L12 I39 | T6-V8 PolarHBondContact O-N 3.01Å; T6-V8 VanDerWaalsContact O-N 3.13Å; V8-K10 VanDerWaalsContact C-N 3.25Å; V8-K10 PolarHBondContact O-N 3.31Å; V8-A11 PolarHBondContact O-N 3.11Å; V8-A11 VanDerWaalsContact O-N 3.1Å; V8-L12 HydrophobicContact CG1-CD1 4.08Å; V8-L12 HydrophobicContact CG1-CG 4.39Å; V8-L12 WeakPolarHBondContact O-CG 3.26Å; V8-L12 PolarHBondContact O-N 2.62Å; V8-I39 HydrophobicContact CG1-CD1 3.92Å; V8-I39 HydrophobicContact CG1-CG1 4.11Å; V8-I39 HydrophobicContact CG2-CG1 4.45Å |
| 9 | D | 64.5 | Low | 61.9 | Low | 74 Ų | 74 | 102.4 Ų | 102.4 | 40% | 0.396 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.5 | -38.7 | 177.2 | -61.1 | -45.1 | 0 | 0 | 0 | 111.7 | P5 T6 L12 E13 | P5-D9 WeakPolarHBondContact CA-OD2 3.42Å; P5-D9 HydrophobicContact CB-CB 3.74Å; T6-D9 WeakPolarHBondContact CB-OD2 3.43Å; T6-D9 PolarHBondContact N-OD2 3.1Å; T6-D9 WeakPolarHBondContact O-CB 3.29Å; T6-D9 PolarHBondContact O-N 2.96Å; T6-D9 PolarHBondContact OG1-N 3.34Å; T6-D9 PolarHBondContact OG1-OD2 3.36Å; D9-L12 PolarHBondContact O-N 3.14Å; D9-E13 WeakPolarHBondContact O-CB 3.3Å; D9-E13 PolarHBondContact O-N 3.26Å |
| 10 | K | 69.4 | Low | 61.4 | Low | 126 Ų | 126 | 100.5 Ų | 100.5 | 55% | 0.548 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65 | -43.6 | 174.8 | -66.6 | -179.3 | -176.8 | 179.3 | 0 | 112.1 | P5 T6 V8 E13 E14 | P5-K10 HydrophobicContact CB-CG 4.42Å; T6-K10 PolarHBondContact O-N 2.84Å; T6-K10 VanDerWaalsContact O-N 3.07Å; V8-K10 VanDerWaalsContact C-N 3.25Å; V8-K10 PolarHBondContact O-N 3.31Å; K10-E13 PolarHBondContact O-N 3.19Å; K10-E14 WeakPolarHBondContact O-CG 3.49Å; K10-E14 PolarHBondContact O-N 3.31Å |
| 11 | A | 61.1 | Low | 60.6 | Low | 8 Ų | 8 | 101.9 Ų | 101.9 | 7% | 0.066 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -66 | -37.1 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | S7 V8 L15 A35 | S7-A11 PolarHBondContact O-N 2.92Å; S7-A11 VanDerWaalsContact O-N 3.14Å; V8-A11 PolarHBondContact O-N 3.11Å; V8-A11 VanDerWaalsContact O-N 3.1Å; A11-L15 WeakPolarHBondContact O-CB 3.44Å; A11-L15 WeakPolarHBondContact O-CG 3.43Å; A11-L15 PolarHBondContact O-N 3.22Å; A11-A35 HydrophobicContact CB-CB 3.88Å |
| 12 | L | 61.8 | Low | 60.9 | Low | 49 Ų | 49 | 95.9 Ų | 95.9 | 26% | 0.257 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -67.9 | -39.6 | 175.2 | -71.3 | 174.4 | 0 | 0 | 0 | 111.9 | V8 D9 L15 R16 | V8-L12 HydrophobicContact CG1-CD1 4.08Å; V8-L12 HydrophobicContact CG1-CG 4.39Å; V8-L12 WeakPolarHBondContact O-CG 3.26Å; V8-L12 PolarHBondContact O-N 2.62Å; D9-L12 PolarHBondContact O-N 3.14Å; L12-L15 PolarHBondContact O-N 3.33Å; L12-R16 WeakPolarHBondContact O-CB 3.47Å; L12-R16 PolarHBondContact O-N 3.1Å |
| 13 | E | 68.7 | Low | 60.8 | Low | 85 Ų | 85 | 88.3 Ų | 88.3 | 40% | 0.397 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -68.6 | -38.3 | 176.2 | -168.3 | 58.6 | -148.2 | 0 | 0 | 111.6 | D9 K10 R16 Q17 | D9-E13 WeakPolarHBondContact O-CB 3.3Å; D9-E13 PolarHBondContact O-N 3.26Å; K10-E13 PolarHBondContact O-N 3.19Å; E13-R16 WeakPolarHBondContact O-CB 3.47Å; E13-R16 PolarHBondContact O-N 3.48Å; E13-Q17 WeakPolarHBondContact O-CG 3.43Å; E13-Q17 PolarHBondContact O-N 2.96Å; E13-Q17 PolarHBondContact OE1-NE2 3.31Å |
| 14 | E | 65.2 | Low | 59.7 | Low | 109 Ų | 109 | 87.4 Ų | 87.4 | 51% | 0.509 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -62.6 | -41.9 | 171.3 | -76.5 | 179.8 | -163.9 | 0 | 0 | 112 | K10 R16 Q17 F18 L32 | K10-E14 WeakPolarHBondContact O-CG 3.49Å; K10-E14 PolarHBondContact O-N 3.31Å; E14-R16 VanDerWaalsContact C-N 3.3Å; E14-R16 PolarHBondContact O-N 2.94Å; E14-Q17 PolarHBondContact O-N 2.91Å; E14-F18 PolarHBondContact O-N 3.46Å; E14-L32 HydrophobicContact CB-CD1 4.38Å |
| 15 | L | 59.4 | Low | 58.9 | Low | 25 Ų | 25 | 87.4 Ų | 87.4 | 13% | 0.131 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -63 | -36.6 | 174.2 | -84.7 | 165.7 | 0 | 0 | 0 | 112.9 | A11 L12 Q17 F18 L32 I36 | A11-L15 WeakPolarHBondContact O-CB 3.44Å; A11-L15 WeakPolarHBondContact O-CG 3.43Å; A11-L15 PolarHBondContact O-N 3.22Å; L12-L15 PolarHBondContact O-N 3.33Å; L15-Q17 VanDerWaalsContact C-N 3.31Å; L15-F18 PolarHBondContact O-N 2.89Å; L15-L32 HydrophobicContact CD2-CD1 4.46Å; L15-L32 HydrophobicContact CD2-CD2 3.99Å; L15-L32 HydrophobicContact CD2-CG 4.31Å; L15-L32 HydrophobicContact CG-CD1 3.98Å; L15-L32 HydrophobicContact CG-CD2 4.33Å; L15-L32 HydrophobicContact CG-CG 4.37Å; L15-I36 HydrophobicContact CD1-CD1 4.14Å; L15-I36 HydrophobicContact CD1-CG1 3.91Å; L15-I36 HydrophobicContact CD2-CD1 4Å |
| 16 | R | 64.2 | Low | 58.3 | Low | 174 Ų | 174 | 89.6 Ų | 89.6 | 66% | 0.657 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -66 | -37.9 | 177.3 | -170.3 | -178.6 | -173.6 | 171 | 3.4 | 111.7 | L12 E13 E14 | L12-R16 WeakPolarHBondContact O-CB 3.47Å; L12-R16 PolarHBondContact O-N 3.1Å; E13-R16 WeakPolarHBondContact O-CB 3.47Å; E13-R16 PolarHBondContact O-N 3.48Å; E14-R16 VanDerWaalsContact C-N 3.3Å; E14-R16 PolarHBondContact O-N 2.94Å |
| 17 | Q | 63.3 | Low | 57.9 | Low | 136 Ų | 136 | 89.9 Ų | 89.9 | 64% | 0.636 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -80 | -18.9 | 178.7 | -67.6 | 176.8 | 21.2 | 0 | 0 | 112.8 | E13 E14 L15 P19 | E13-Q17 WeakPolarHBondContact O-CG 3.43Å; E13-Q17 PolarHBondContact O-N 2.96Å; E13-Q17 PolarHBondContact OE1-NE2 3.31Å; E14-Q17 PolarHBondContact O-N 2.91Å; L15-Q17 VanDerWaalsContact C-N 3.31Å; Q17-P19 VanDerWaalsContact O-CD 3.26Å; Q17-P19 WeakPolarHBondContact O-CD 3.21Å |
| 18 | F | 53.5 | Low | 57.5 | Low | 46 Ų | 46 | 86.7 Ų | 86.7 | 20% | 0.202 | 41% | 0.413 | C | S | . | . | S | Bend | trans | -63.4 | 117.1 | -179.9 | -155.6 | -89.9 | 0 | 0 | 0 | 110.8 | E14 L15 I20 E22 V23 L28 R73 | E14-F18 PolarHBondContact O-N 3.46Å; L15-F18 PolarHBondContact O-N 2.89Å; F18-I20 PolarHBondContact O-N 3.07Å; F18-E22 HydrophobicContact CE1-CB 4.37Å; F18-V23 HydrophobicContact CD1-CG2 3.52Å; F18-V23 HydrophobicContact CE1-CB 4.23Å; F18-V23 HydrophobicContact CE1-CG2 3.42Å; F18-V23 VanDerWaalsContact CE1-CG2 3.42Å; F18-L28 HydrophobicContact CD1-CD2 4.28Å; F18-L28 HydrophobicContact CE1-CD2 4.03Å; F18-L28 HydrophobicContact CE2-CD2 4.29Å; F18-L28 HydrophobicContact CZ-CD2 4.03Å; F18-R73 PolarHBondContact O-NH1 3.13Å; F18-R73 VanDerWaalsContact O-NH1 3.07Å |
| 19 | P | 54.2 | Low | 57.8 | Low | 51 Ų | 51 | 87.1 Ų | 87.1 | 33% | 0.331 | 42% | 0.418 | S | S | . | . | trans | -67.8 | 120.2 | 178.1 | 24.9 | -30 | 0 | 0 | 0 | 109.2 | Q17 D21 E22 | Q17-P19 VanDerWaalsContact O-CD 3.26Å; Q17-P19 WeakPolarHBondContact O-CD 3.21Å; P19-D21 PolarHBondContact O-N 3.14Å; P19-E22 HydrophobicContact CB-CG 4.22Å; P19-E22 HydrophobicContact CG-CB 3.88Å; P19-E22 HydrophobicContact CG-CG 3.56Å; P19-E22 WeakPolarHBondContact CG-OE2 3.41Å; P19-E22 PolarHBondContact O-N 3.21Å | ||
| 20 | I | 51.5 | Low | 57.7 | Low | 64 Ų | 64 | 86.2 Ų | 86.2 | 33% | 0.328 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -54.8 | -31.6 | 179.8 | -63.4 | 160.3 | 0 | 0 | 0 | 110.5 | F18 E22 V23 I70 R73 | F18-I20 PolarHBondContact O-N 3.07Å; I20-E22 VanDerWaalsContact C-N 3.26Å; I20-E22 PolarHBondContact O-N 3.02Å; I20-V23 WeakPolarHBondContact O-CB 3.48Å; I20-V23 WeakPolarHBondContact O-CG2 3.47Å; I20-V23 PolarHBondContact O-N 2.7Å; I20-I70 HydrophobicContact CG2-CG1 4.25Å; I20-R73 VanDerWaalsContact CG1-NH1 3.34Å |
| 21 | D | 44.7 | Very low | 57.4 | Low | 131 Ų | 131 | 86.4 Ų | 86.4 | 70% | 0.701 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -66.9 | -23.9 | 179.1 | -62.5 | -34.2 | 0 | 0 | 0 | 113.5 | P19 | P19-D21 PolarHBondContact O-N 3.14Å |
| 22 | E | 48.2 | Very low | 57.3 | Low | 97 Ų | 97 | 86.3 Ų | 86.3 | 45% | 0.453 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -88.3 | -18.9 | 177.5 | -66.8 | -178.5 | 179.1 | 0 | 0 | 113.1 | F18 P19 I20 R24 K25 E26 | F18-E22 HydrophobicContact CE1-CB 4.37Å; P19-E22 HydrophobicContact CB-CG 4.22Å; P19-E22 HydrophobicContact CG-CB 3.88Å; P19-E22 HydrophobicContact CG-CG 3.56Å; P19-E22 WeakPolarHBondContact CG-OE2 3.41Å; P19-E22 PolarHBondContact O-N 3.21Å; I20-E22 VanDerWaalsContact C-N 3.26Å; I20-E22 PolarHBondContact O-N 3.02Å; E22-R24 PolarHBondContact O-N 2.75Å; E22-R24 VanDerWaalsContact O-N 3.13Å; E22-K25 WeakPolarHBondContact O-CA 3.34Å; E22-K25 PolarHBondContact O-N 2.72Å; E22-E26 PolarHBondContact O-N 2.92Å |
| 23 | V | 49.5 | Very low | 57.2 | Low | 13 Ų | 13 | 89.7 Ų | 89.7 | 8% | 0.079 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -59.8 | -28.4 | 175.7 | -172 | 0 | 0 | 0 | 0 | 111.2 | F18 I20 K25 R65 A69 | F18-V23 HydrophobicContact CD1-CG2 3.52Å; F18-V23 HydrophobicContact CE1-CB 4.23Å; F18-V23 HydrophobicContact CE1-CG2 3.42Å; F18-V23 VanDerWaalsContact CE1-CG2 3.42Å; I20-V23 WeakPolarHBondContact O-CB 3.48Å; I20-V23 WeakPolarHBondContact O-CG2 3.47Å; I20-V23 PolarHBondContact O-N 2.7Å; V23-K25 VanDerWaalsContact C-N 3.26Å; V23-K25 PolarHBondContact O-N 2.9Å; V23-R65 WeakPolarHBondContact CG1-O 3.35Å; V23-A69 HydrophobicContact CB-CB 4.33Å; V23-A69 HydrophobicContact CG1-CB 3.61Å; V23-A69 HydrophobicContact CG2-CB 4.01Å |
| 24 | R | 47 | Very low | 56.9 | Low | 170 Ų | 170 | 90.7 Ų | 90.7 | 64% | 0.642 | 44% | 0.443 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.2 | -24.5 | 173.9 | -73.8 | -175.1 | 179.2 | -162.7 | -0.8 | 113.5 | E22 I66 | E22-R24 PolarHBondContact O-N 2.75Å; E22-R24 VanDerWaalsContact O-N 3.13Å; R24-I66 HydrophobicContact CG-CD1 3.65Å; R24-I66 HydrophobicContact CG-CG1 3.58Å |
| 25 | K | 52.7 | Low | 56.5 | Low | 173 Ų | 173 | 86.7 Ų | 86.7 | 75% | 0.752 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.9 | -36.5 | -167.8 | -64 | -178.4 | -178.3 | 174.7 | 0 | 112.4 | E22 V23 | E22-K25 WeakPolarHBondContact O-CA 3.34Å; E22-K25 PolarHBondContact O-N 2.72Å; V23-K25 VanDerWaalsContact C-N 3.26Å; V23-K25 PolarHBondContact O-N 2.9Å |
| 26 | E | 53 | Low | 56.4 | Low | 127 Ų | 127 | 85.9 Ų | 85.9 | 59% | 0.593 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -125.6 | 134.5 | -176.3 | -63.9 | -164 | 169.8 | 0 | 0 | 111.9 | E22 L28 | E22-E26 PolarHBondContact O-N 2.92Å; E26-L28 PolarHBondContact O-N 3.28Å |
| 27 | P | 57 | Low | 56.2 | Low | 80 Ų | 80 | 78.8 Ų | 78.8 | 52% | 0.519 | 40% | 0.402 | S | S | . | . | P | Polyproline II helix | trans | -63.3 | 137.5 | 170.7 | 28.4 | -32.4 | 0 | 0 | 0 | 109.3 | S29 | P27-S29 PolarHBondContact O-N 3.2Š|
| 28 | L | 58.7 | Low | 55.9 | Low | 34 Ų | 34 | 78 Ų | 78 | 18% | 0.178 | 40% | 0.398 | C | S | . | . | P | Polyproline II helix | trans | -46.5 | 141.2 | 173 | -66 | 171 | 0 | 0 | 0 | 110.6 | F18 E26 L32 R33 I36 | F18-L28 HydrophobicContact CD1-CD2 4.28Å; F18-L28 HydrophobicContact CE1-CD2 4.03Å; F18-L28 HydrophobicContact CE2-CD2 4.29Å; F18-L28 HydrophobicContact CZ-CD2 4.03Å; E26-L28 PolarHBondContact O-N 3.28Å; L28-L32 HydrophobicContact CD2-CD2 3.97Å; L28-R33 HydrophobicContact CB-CG 3.76Å; L28-R33 HydrophobicContact CD1-CG 4.48Å; L28-R33 PolarHBondContact O-NE 3.02Å; L28-R33 PolarHBondContact O-NH2 3.24Å; L28-I36 HydrophobicContact CD1-CD1 4.2Å |
| 29 | S | 66 | Low | 56 | Low | 57 Ų | 57 | 76.1 Ų | 76.1 | 40% | 0.399 | 39% | 0.39 | S | S | . | . | P | Polyproline II helix | trans | -56 | 147.2 | 179.4 | 78.7 | 0 | 0 | 0 | 0 | 110.4 | P27 N31 L32 R33 | P27-S29 PolarHBondContact O-N 3.2Å; S29-N31 PolarHBondContact O-N 3.35Å; S29-L32 PolarHBondContact O-N 3.27Å; S29-L32 VanDerWaalsContact O-N 3.14Å; S29-L32 VanDerWaalsContact OG-CB 3.27Å; S29-L32 WeakPolarHBondContact OG-CB 3.31Å; S29-L32 PolarHBondContact OG-N 2.91Å; S29-R33 PolarHBondContact O-N 3.1Å |
| 30 | A | 63.2 | Low | 56.2 | Low | 55 Ų | 55 | 74 Ų | 74 | 46% | 0.455 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -59 | -35.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | R33 N34 | A30-R33 PolarHBondContact O-N 3.34Å; A30-N34 WeakPolarHBondContact O-CB 3.39Å; A30-N34 PolarHBondContact O-N 3.47Å; A30-N34 PolarHBondContact O-ND2 2.86Å |
| 31 | N | 62.5 | Low | 56.5 | Low | 130 Ų | 130 | 80.1 Ų | 80.1 | 70% | 0.695 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -63.5 | -44.8 | 176.2 | -66.1 | -14.3 | 0 | 0 | 0 | 111.6 | S29 N34 A35 | S29-N31 PolarHBondContact O-N 3.35Å; N31-N34 PolarHBondContact O-N 2.89Å; N31-A35 WeakPolarHBondContact O-CB 3.43Å; N31-A35 PolarHBondContact O-N 2.83Å |
| 32 | L | 58.1 | Low | 57.1 | Low | 6 Ų | 6 | 79 Ų | 79 | 3% | 0.031 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -67.6 | -41.3 | 179.5 | -165.3 | 61.2 | 0 | 0 | 0 | 111.5 | E14 L15 L28 S29 N34 A35 I36 | E14-L32 HydrophobicContact CB-CD1 4.38Å; L15-L32 HydrophobicContact CD2-CD1 4.46Å; L15-L32 HydrophobicContact CD2-CD2 3.99Å; L15-L32 HydrophobicContact CD2-CG 4.31Å; L15-L32 HydrophobicContact CG-CD1 3.98Å; L15-L32 HydrophobicContact CG-CD2 4.33Å; L15-L32 HydrophobicContact CG-CG 4.37Å; L28-L32 HydrophobicContact CD2-CD2 3.97Å; S29-L32 PolarHBondContact O-N 3.27Å; S29-L32 VanDerWaalsContact O-N 3.14Å; S29-L32 VanDerWaalsContact OG-CB 3.27Å; S29-L32 WeakPolarHBondContact OG-CB 3.31Å; S29-L32 PolarHBondContact OG-N 2.91Å; L32-N34 VanDerWaalsContact C-N 3.34Å; L32-N34 PolarHBondContact O-N 3.46Å; L32-A35 PolarHBondContact O-N 3.49Å; L32-I36 HydrophobicContact CG-CD1 4.12Å; L32-I36 WeakPolarHBondContact O-CB 3.28Å; L32-I36 WeakPolarHBondContact O-CD1 3.41Å; L32-I36 WeakPolarHBondContact O-CG1 3.27Å; L32-I36 PolarHBondContact O-N 3.23Å |
| 33 | R | 61 | Low | 57.1 | Low | 120 Ų | 120 | 78.4 Ų | 78.4 | 45% | 0.453 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -59.9 | -42.9 | 173.1 | -76.7 | -176.3 | -80.6 | 176.6 | -7.5 | 112.4 | L28 S29 A30 S37 | L28-R33 HydrophobicContact CB-CG 3.76Å; L28-R33 HydrophobicContact CD1-CG 4.48Å; L28-R33 PolarHBondContact O-NE 3.02Å; L28-R33 PolarHBondContact O-NH2 3.24Å; S29-R33 PolarHBondContact O-N 3.1Å; A30-R33 PolarHBondContact O-N 3.34Å; R33-S37 VanDerWaalsContact O-CB 3.31Å; R33-S37 WeakPolarHBondContact O-CB 3.33Å; R33-S37 PolarHBondContact O-N 2.92Å; R33-S37 PolarHBondContact O-OG 3.39Å |
| 34 | N | 61.8 | Low | 57 | Low | 106 Ų | 106 | 78.5 Ų | 78.5 | 57% | 0.567 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -66.2 | -41.4 | 177.5 | -71.8 | -17.1 | 0 | 0 | 0 | 111.6 | A30 N31 L32 S37 Q38 | A30-N34 WeakPolarHBondContact O-CB 3.39Å; A30-N34 PolarHBondContact O-N 3.47Å; A30-N34 PolarHBondContact O-ND2 2.86Å; N31-N34 PolarHBondContact O-N 2.89Å; L32-N34 VanDerWaalsContact C-N 3.34Å; L32-N34 PolarHBondContact O-N 3.46Å; N34-S37 PolarHBondContact O-N 3.33Å; N34-Q38 WeakPolarHBondContact O-CB 3.42Å; N34-Q38 PolarHBondContact O-N 3.3Å |
| 35 | A | 57.1 | Low | 57 | Low | 26 Ų | 26 | 79.7 Ų | 79.7 | 22% | 0.215 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -63.7 | -46.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A11 N31 L32 S37 Q38 I39 | A11-A35 HydrophobicContact CB-CB 3.88Å; N31-A35 WeakPolarHBondContact O-CB 3.43Å; N31-A35 PolarHBondContact O-N 2.83Å; L32-A35 PolarHBondContact O-N 3.49Å; A35-S37 VanDerWaalsContact C-N 3.34Å; A35-S37 PolarHBondContact O-N 3.28Å; A35-Q38 PolarHBondContact O-N 2.76Å; A35-I39 VanDerWaalsContact O-CG1 3.28Å; A35-I39 WeakPolarHBondContact O-CG1 3.18Å; A35-I39 PolarHBondContact O-N 3.34Å |
| 36 | I | 57.6 | Low | 56.8 | Low | 7 Ų | 7 | 76.7 Ų | 76.7 | 4% | 0.036 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -60.4 | -45.2 | 174.6 | -66.5 | 163.1 | 0 | 0 | 0 | 110.5 | L15 L28 L32 Q38 I39 L40 | L15-I36 HydrophobicContact CD1-CD1 4.14Å; L15-I36 HydrophobicContact CD1-CG1 3.91Å; L15-I36 HydrophobicContact CD2-CD1 4Å; L28-I36 HydrophobicContact CD1-CD1 4.2Å; L32-I36 HydrophobicContact CG-CD1 4.12Å; L32-I36 WeakPolarHBondContact O-CB 3.28Å; L32-I36 WeakPolarHBondContact O-CD1 3.41Å; L32-I36 WeakPolarHBondContact O-CG1 3.27Å; L32-I36 PolarHBondContact O-N 3.23Å; I36-Q38 VanDerWaalsContact C-N 3.26Å; I36-Q38 PolarHBondContact O-N 3.38Å; I36-I39 PolarHBondContact O-N 3.24Å; I36-L40 HydrophobicContact CG2-CD1 3.62Å; I36-L40 HydrophobicContact CG2-CG 4.3Å; I36-L40 WeakPolarHBondContact O-CB 3.09Å; I36-L40 VanDerWaalsContact O-CG 3.27Å; I36-L40 WeakPolarHBondContact O-CG 3.41Å; I36-L40 PolarHBondContact O-N 2.95Å |
| 37 | S | 58.8 | Low | 56.3 | Low | 26 Ų | 26 | 73.5 Ų | 73.5 | 18% | 0.182 | 38% | 0.377 | C | S | . | . | H | α-helix | trans | -61.1 | -36.4 | 177.9 | -59.5 | 0 | 0 | 0 | 0 | 112.2 | R33 N34 A35 R41 L49 | R33-S37 VanDerWaalsContact O-CB 3.31Å; R33-S37 WeakPolarHBondContact O-CB 3.33Å; R33-S37 PolarHBondContact O-N 2.92Å; R33-S37 PolarHBondContact O-OG 3.39Å; N34-S37 PolarHBondContact O-N 3.33Å; A35-S37 VanDerWaalsContact C-N 3.34Å; A35-S37 PolarHBondContact O-N 3.28Å; S37-R41 VanDerWaalsContact O-CG 3.29Å; S37-R41 WeakPolarHBondContact O-CG 3.44Å; S37-R41 PolarHBondContact O-N 3.02Å; S37-R41 VanDerWaalsContact O-N 3.1Å; S37-L49 WeakPolarHBondContact OG-CD1 3.26Å |
| 38 | Q | 57.5 | Low | 55.7 | Low | 119 Ų | 119 | 72.7 Ų | 72.7 | 56% | 0.556 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -70.4 | -46.4 | 176.6 | -173.7 | 172.7 | -2.6 | 0 | 0 | 111.4 | N34 A35 I36 L40 R41 D42 | N34-Q38 WeakPolarHBondContact O-CB 3.42Å; N34-Q38 PolarHBondContact O-N 3.3Å; A35-Q38 PolarHBondContact O-N 2.76Å; I36-Q38 VanDerWaalsContact C-N 3.26Å; I36-Q38 PolarHBondContact O-N 3.38Å; Q38-L40 VanDerWaalsContact C-N 3.28Å; Q38-L40 PolarHBondContact O-N 3.28Å; Q38-R41 PolarHBondContact O-N 2.79Å; Q38-R41 VanDerWaalsContact O-N 3.17Å; Q38-D42 WeakPolarHBondContact O-CB 2.96Å; Q38-D42 VanDerWaalsContact O-CG 3.25Å; Q38-D42 PolarHBondContact O-N 3Å |
| 39 | I | 56.5 | Low | 55 | Low | 6 Ų | 6 | 75.7 Ų | 75.7 | 3% | 0.031 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -57.6 | -43.8 | 175.8 | -67.1 | 164 | 0 | 0 | 0 | 110.5 | V8 A35 I36 D42 H43 L76 I80 | V8-I39 HydrophobicContact CG1-CD1 3.92Å; V8-I39 HydrophobicContact CG1-CG1 4.11Å; V8-I39 HydrophobicContact CG2-CG1 4.45Å; A35-I39 VanDerWaalsContact O-CG1 3.28Å; A35-I39 WeakPolarHBondContact O-CG1 3.18Å; A35-I39 PolarHBondContact O-N 3.34Å; I36-I39 PolarHBondContact O-N 3.24Å; I39-D42 PolarHBondContact O-N 2.96Å; I39-H43 WeakPolarHBondContact O-CB 3.47Å; I39-H43 PolarHBondContact O-CD2 3.48Å; I39-H43 VanDerWaalsContact O-CD2 3.27Å; I39-H43 PolarHBondContact O-N 3.46Å; I39-L76 HydrophobicContact CG2-CD2 4.23Å; I39-I80 HydrophobicContact CG2-CD1 4.23Å |
| 40 | L | 57.3 | Low | 53.8 | Low | 8 Ų | 8 | 77.8 Ų | 77.8 | 4% | 0.042 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -64.4 | -41.2 | 178.1 | -72.1 | 165.5 | 0 | 0 | 0 | 112 | I36 Q38 C44 F47 L49 L76 | I36-L40 HydrophobicContact CG2-CD1 3.62Å; I36-L40 HydrophobicContact CG2-CG 4.3Å; I36-L40 WeakPolarHBondContact O-CB 3.09Å; I36-L40 VanDerWaalsContact O-CG 3.27Å; I36-L40 WeakPolarHBondContact O-CG 3.41Å; I36-L40 PolarHBondContact O-N 2.95Å; Q38-L40 VanDerWaalsContact C-N 3.28Å; Q38-L40 PolarHBondContact O-N 3.28Å; L40-C44 CarbonylContact O-C 3.57Å; L40-C44 WeakPolarHBondContact O-CA 3.27Å; L40-C44 WeakPolarHBondContact O-CB 3.43Å; L40-C44 PolarHBondContact O-N 3.36Å; L40-C44 VanDerWaalsContact O-O 3.08Å; L40-F47 HydrophobicContact CB-CB 4.3Å; L40-F47 HydrophobicContact CB-CD1 4.1Å; L40-F47 HydrophobicContact CB-CG 4.46Å; L40-F47 HydrophobicContact CD1-CD1 3.65Å; L40-F47 HydrophobicContact CD1-CE1 3.72Å; L40-F47 HydrophobicContact CD2-CB 4.5Å; L40-F47 HydrophobicContact CD2-CD1 3.96Å; L40-F47 HydrophobicContact CD2-CE1 4.29Å; L40-F47 HydrophobicContact CD2-CG 4.09Å; L40-F47 HydrophobicContact CG-CD1 4.12Å; L40-L49 HydrophobicContact CD1-CD1 3.7Å; L40-L49 HydrophobicContact CD1-CG 4.22Å; L40-L76 HydrophobicContact CD2-CD1 3.8Å |
| 41 | R | 58 | Low | 52.7 | Low | 192 Ų | 192 | 78 Ų | 78 | 73% | 0.725 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -65.7 | -37 | 174.6 | -72.8 | 175.8 | -158.2 | -177.1 | 5.3 | 113.2 | S37 Q38 | S37-R41 VanDerWaalsContact O-CG 3.29Å; S37-R41 WeakPolarHBondContact O-CG 3.44Å; S37-R41 PolarHBondContact O-N 3.02Å; S37-R41 VanDerWaalsContact O-N 3.1Å; Q38-R41 PolarHBondContact O-N 2.79Å; Q38-R41 VanDerWaalsContact O-N 3.17Å |
| 42 | D | 56.8 | Low | 51.7 | Low | 108 Ų | 108 | 76.1 Ų | 76.1 | 58% | 0.578 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -78.1 | -25.7 | -175.3 | -68.8 | -15.3 | 0 | 0 | 0 | 112.2 | Q38 I39 | Q38-D42 WeakPolarHBondContact O-CB 2.96Å; Q38-D42 VanDerWaalsContact O-CG 3.25Å; Q38-D42 PolarHBondContact O-N 3Å; I39-D42 PolarHBondContact O-N 2.96Å |
| 43 | H | 49.6 | Very low | 50.6 | Low | 83 Ų | 83 | 80.9 Ų | 80.9 | 38% | 0.384 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -120.6 | -16.7 | -172.6 | -65.6 | -73.3 | 0 | 0 | 0 | 115.6 | I39 N83 | I39-H43 WeakPolarHBondContact O-CB 3.47Å; I39-H43 PolarHBondContact O-CD2 3.48Å; I39-H43 VanDerWaalsContact O-CD2 3.27Å; I39-H43 PolarHBondContact O-N 3.46Å; H43-N83 PolarHBondContact O-ND2 2.99Å |
| 44 | C | 47.3 | Very low | 49.6 | Very low | 15 Ų | 15 | 76.3 Ų | 76.3 | 10% | 0.101 | 40% | 0.4 | C | S | . | . | trans | -120.3 | 101.9 | 178.9 | -53.7 | 0 | 0 | 0 | 0 | 108.5 | L40 D46 F47 | L40-C44 CarbonylContact O-C 3.57Å; L40-C44 WeakPolarHBondContact O-CA 3.27Å; L40-C44 WeakPolarHBondContact O-CB 3.43Å; L40-C44 PolarHBondContact O-N 3.36Å; L40-C44 VanDerWaalsContact O-O 3.08Å; C44-D46 PolarHBondContact O-N 2.97Å; C44-F47 HydrophobicContact CB-CB 3.64Å; C44-F47 PolarHBondContact O-N 2.9Å | ||
| 45 | E | 46.6 | Very low | 48.6 | Very low | 196 Ų | 196 | 73.9 Ų | 73.9 | 92% | 0.916 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -6.3 | -173.9 | -77.4 | -177.5 | 154.7 | 0 | 0 | 115.1 | ||
| 46 | D | 47.7 | Very low | 47.8 | Very low | 110 Ų | 110 | 77.1 Ų | 77.1 | 59% | 0.588 | 40% | 0.397 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -130.7 | 1.7 | -178.9 | -69 | -50.7 | 0 | 0 | 0 | 114.6 | C44 D48 P55 | C44-D46 PolarHBondContact O-N 2.97Å; D46-D48 PolarHBondContact O-N 3.45Å; D46-P55 HydrophobicContact CB-CB 3.94Å; D46-P55 HydrophobicContact CB-CG 4.31Å; D46-P55 WeakPolarHBondContact O-CB 3.29Å; D46-P55 WeakPolarHBondContact O-CD 3.16Å; D46-P55 WeakPolarHBondContact O-CG 2.99Å |
| 47 | F | 44 | Very low | 46.6 | Very low | 60 Ų | 60 | 79.3 Ų | 79.3 | 26% | 0.263 | 42% | 0.422 | S | S | . | . | trans | -83.9 | 92.3 | -168.1 | -151.2 | -85.6 | 0 | 0 | 0 | 113.8 | L40 C44 L49 | L40-F47 HydrophobicContact CB-CB 4.3Å; L40-F47 HydrophobicContact CB-CD1 4.1Å; L40-F47 HydrophobicContact CB-CG 4.46Å; L40-F47 HydrophobicContact CD1-CD1 3.65Å; L40-F47 HydrophobicContact CD1-CE1 3.72Å; L40-F47 HydrophobicContact CD2-CB 4.5Å; L40-F47 HydrophobicContact CD2-CD1 3.96Å; L40-F47 HydrophobicContact CD2-CE1 4.29Å; L40-F47 HydrophobicContact CD2-CG 4.09Å; L40-F47 HydrophobicContact CG-CD1 4.12Å; C44-F47 HydrophobicContact CB-CB 3.64Å; C44-F47 PolarHBondContact O-N 2.9Å; F47-L49 HydrophobicContact CD1-CD2 4.42Å; F47-L49 HydrophobicContact CD1-CG 4.05Å; F47-L49 HydrophobicContact CE1-CD2 3.68Å; F47-L49 HydrophobicContact CE1-CG 3.81Å | ||
| 48 | D | 43.8 | Very low | 45.5 | Very low | 63 Ų | 63 | 82.5 Ų | 82.5 | 34% | 0.337 | 44% | 0.44 | S | S | . | . | trans | -93.4 | 111.5 | 170.6 | -177.6 | 21.5 | 0 | 0 | 0 | 112 | D46 S50 T51 | D46-D48 PolarHBondContact O-N 3.45Å; D48-S50 VanDerWaalsContact C-N 3.29Å; D48-S50 VanDerWaalsContact CG-OG 3.25Å; D48-S50 WeakPolarHBondContact OD1-CA 3.02Å; D48-S50 VanDerWaalsContact OD1-CB 3.26Å; D48-S50 WeakPolarHBondContact OD1-CB 3.15Å; D48-S50 PolarHBondContact OD1-N 3.44Å; D48-S50 PolarHBondContact OD1-OG 3.43Å; D48-S50 PolarHBondContact OD2-OG 3.14Å; D48-S50 VanDerWaalsContact OD2-OG 3.11Å; D48-T51 PolarHBondContact O-OG1 3.27Å; D48-T51 VanDerWaalsContact OD2-CG2 3.3Å; D48-T51 WeakPolarHBondContact OD2-CG2 3.39Å; D48-T51 PolarHBondContact OD2-N 3.09Å; D48-T51 PolarHBondContact OD2-OG1 3.28Å | ||
| 49 | L | 43.2 | Very low | 44.5 | Very low | 97 Ų | 97 | 87.5 Ų | 87.5 | 51% | 0.508 | 45% | 0.454 | S | S | . | . | S | Bend | trans | -78.2 | -10 | 173 | -80.7 | 167 | 0 | 0 | 0 | 113.5 | S37 L40 F47 | S37-L49 WeakPolarHBondContact OG-CD1 3.26Å; L40-L49 HydrophobicContact CD1-CD1 3.7Å; L40-L49 HydrophobicContact CD1-CG 4.22Å; F47-L49 HydrophobicContact CD1-CD2 4.42Å; F47-L49 HydrophobicContact CD1-CG 4.05Å; F47-L49 HydrophobicContact CE1-CD2 3.68Å; F47-L49 HydrophobicContact CE1-CG 3.81Å |
| 50 | S | 42.1 | Very low | 43.2 | Very low | 101 Ų | 101 | 88.6 Ų | 88.6 | 71% | 0.706 | 47% | 0.466 | S | S | * | . | S | Bend | trans | -90.6 | -16.8 | -175.7 | 76.2 | 0 | 0 | 0 | 0 | 113.6 | D48 | D48-S50 VanDerWaalsContact C-N 3.29Å; D48-S50 VanDerWaalsContact CG-OG 3.25Å; D48-S50 WeakPolarHBondContact OD1-CA 3.02Å; D48-S50 VanDerWaalsContact OD1-CB 3.26Å; D48-S50 WeakPolarHBondContact OD1-CB 3.15Å; D48-S50 PolarHBondContact OD1-N 3.44Å; D48-S50 PolarHBondContact OD1-OG 3.43Å; D48-S50 PolarHBondContact OD2-OG 3.14Å; D48-S50 VanDerWaalsContact OD2-OG 3.11Å |
| 51 | T | 39.5 | Very low | 41.8 | Very low | 59 Ų | 59 | 96.4 Ų | 96.4 | 36% | 0.362 | 50% | 0.502 | S | S | . | . | S | Bend | trans | -82 | 128.8 | 168.9 | 31.9 | 0 | 0 | 0 | 0 | 108.9 | D48 F53 G54 | D48-T51 PolarHBondContact O-OG1 3.27Å; D48-T51 VanDerWaalsContact OD2-CG2 3.3Å; D48-T51 WeakPolarHBondContact OD2-CG2 3.39Å; D48-T51 PolarHBondContact OD2-N 3.09Å; D48-T51 PolarHBondContact OD2-OG1 3.28Å; T51-F53 PolarHBondContact O-N 3.41Å; T51-G54 PolarHBondContact O-N 2.83Å; T51-G54 VanDerWaalsContact O-N 3.1Å; T51-G54 WeakPolarHBondContact OG1-CA 3.37Å; T51-G54 PolarHBondContact OG1-N 2.9Å |
| 52 | P | 40.9 | Very low | 40.5 | Very low | 90 Ų | 90 | 90 Ų | 90 | 58% | 0.584 | 50% | 0.496 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.1 | -10.4 | 174 | 23.2 | -28.9 | 0 | 0 | 0 | 112.1 | G60 | P52-G60 WeakPolarHBondContact O-CA 3.31Å; P52-G60 PolarHBondContact O-N 2.92Å |
| 53 | F | 35.6 | Very low | 39.4 | Very low | 106 Ų | 106 | 91.4 Ų | 91.4 | 47% | 0.465 | 50% | 0.502 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.4 | -1.6 | 179 | -62.5 | -90.5 | 0 | 0 | 0 | 116.4 | T51 G57 V58 | T51-F53 PolarHBondContact O-N 3.41Å; F53-G57 CarbonylContact O-C 3.59Å; F53-G57 WeakPolarHBondContact O-CA 3.17Å; F53-G57 PolarHBondContact O-N 2.99Å; F53-V58 WeakPolarHBondContact CA-O 3.36Å; F53-V58 WeakPolarHBondContact CD1-O 3.33Å; F53-V58 PolarHBondContact O-N 2.87Å |
| 54 | G | 39.1 | Very low | 38.7 | Very low | 25 Ų | 25 | 94.2 Ų | 94.2 | 26% | 0.258 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 48.5 | -173.6 | -169.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | T51 Y56 | T51-G54 PolarHBondContact O-N 2.83Å; T51-G54 VanDerWaalsContact O-N 3.1Å; T51-G54 WeakPolarHBondContact OG1-CA 3.37Å; T51-G54 PolarHBondContact OG1-N 2.9Å; G54-Y56 PolarHBondContact O-N 2.99Å |
| 55 | P | 41.9 | Very low | 38.4 | Very low | 54 Ų | 54 | 99.1 Ų | 99.1 | 35% | 0.351 | 53% | 0.532 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.2 | -10.5 | 168.8 | 29.6 | -40.6 | 0 | 0 | 0 | 114.6 | D46 | D46-P55 HydrophobicContact CB-CB 3.94Å; D46-P55 HydrophobicContact CB-CG 4.31Å; D46-P55 WeakPolarHBondContact O-CB 3.29Å; D46-P55 WeakPolarHBondContact O-CD 3.16Å; D46-P55 WeakPolarHBondContact O-CG 2.99Å |
| 56 | Y | 40.8 | Very low | 38 | Very low | 95 Ų | 95 | 92.4 Ų | 92.4 | 37% | 0.373 | 50% | 0.502 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -120.7 | 14.2 | -168.9 | -60.2 | -63 | 0 | 0 | 0 | 115.2 | G54 L92 | G54-Y56 PolarHBondContact O-N 2.99Å; Y56-L92 HydrophobicContact CD2-CD1 4.08Å; Y56-L92 HydrophobicContact CE2-CB 4.27Å; Y56-L92 HydrophobicContact CE2-CD1 3.42Å; Y56-L92 VanDerWaalsContact CE2-CD1 3.42Å; Y56-L92 HydrophobicContact CE2-CG 4.45Å |
| 57 | G | 32.3 | Very low | 37.7 | Very low | 53 Ų | 53 | 90.6 Ų | 90.6 | 55% | 0.546 | 49% | 0.492 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.8 | 30.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | F53 R59 | F53-G57 CarbonylContact O-C 3.59Å; F53-G57 WeakPolarHBondContact O-CA 3.17Å; F53-G57 PolarHBondContact O-N 2.99Å; G57-R59 PolarHBondContact O-N 3.48Å |
| 58 | V | 35.7 | Very low | 37.8 | Very low | 93 Ų | 93 | 92.2 Ų | 92.2 | 56% | 0.564 | 50% | 0.503 | S | S | * | . | trans | -63.4 | 124 | 172 | -176.2 | 0 | 0 | 0 | 0 | 108.1 | F53 G60 | F53-V58 WeakPolarHBondContact CA-O 3.36Å; F53-V58 WeakPolarHBondContact CD1-O 3.33Å; F53-V58 PolarHBondContact O-N 2.87Å; V58-G60 PolarHBondContact O-N 3.11Å | ||
| 59 | R | 35.5 | Very low | 37.8 | Very low | 224 Ų | 224 | 90.1 Ų | 90.1 | 85% | 0.845 | 50% | 0.495 | S | S | * | . | trans | -55 | 118.1 | -177 | -73.6 | 179.9 | -157.9 | -150.9 | 1 | 111.6 | G57 E61 | G57-R59 PolarHBondContact O-N 3.48Å; R59-E61 PolarHBondContact O-N 3.25Å | ||
| 60 | G | 28.6 | Very low | 37.9 | Very low | 28 Ų | 28 | 88.4 Ų | 88.4 | 29% | 0.289 | 49% | 0.485 | S | S | . | . | S | Bend | trans | -68.3 | 50.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | P52 V58 | P52-G60 WeakPolarHBondContact O-CA 3.31Å; P52-G60 PolarHBondContact O-N 2.92Å; V58-G60 PolarHBondContact O-N 3.11Å |
| 61 | E | 29.3 | Very low | 38.3 | Very low | 173 Ų | 173 | 87.6 Ų | 87.6 | 81% | 0.808 | 47% | 0.469 | S | S | * | . | S | Bend | trans | -133.7 | 95.4 | 166.7 | -74.8 | -169 | 156.9 | 0 | 0 | 109.4 | R59 | R59-E61 PolarHBondContact O-N 3.25Š|
| 62 | G | 30.4 | Very low | 38.9 | Very low | 58 Ų | 58 | 86.4 Ų | 86.4 | 60% | 0.598 | 46% | 0.46 | S | S | * | . | S | Bend | trans | 83.9 | 99 | 163.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | H64 | G62-H64 PolarHBondContact O-CD2 3.06Å; G62-H64 PolarHBondContact O-N 3.49Å |
| 63 | I | 34 | Very low | 39.3 | Very low | 136 Ų | 136 | 87.1 Ų | 87.1 | 70% | 0.697 | 45% | 0.452 | S | S | * | . | trans | -11.4 | 85.6 | 150.3 | -43.2 | 173.7 | 0 | 0 | 0 | 113.6 | R65 | I63-R65 VanDerWaalsContact C-N 3.26Å; I63-R65 HydrophobicContact CB-CG 4.37Å; I63-R65 HydrophobicContact CG2-CG 3.37Å; I63-R65 PolarHBondContact O-N 3.26Å | ||
| 64 | H | 34.9 | Very low | 40.3 | Very low | 143 Ų | 143 | 88.6 Ų | 88.6 | 66% | 0.662 | 46% | 0.46 | S | S | * | . | trans | -86 | 74.2 | 172.6 | -88.4 | -82 | 0 | 0 | 0 | 109 | G62 I66 | G62-H64 PolarHBondContact O-CD2 3.06Å; G62-H64 PolarHBondContact O-N 3.49Å; H64-I66 PolarHBondContact O-N 2.96Å | ||
| 65 | R | 40.2 | Very low | 40.9 | Very low | 117 Ų | 117 | 89.3 Ų | 89.3 | 44% | 0.442 | 46% | 0.456 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -49.4 | -5.7 | -172.2 | -62.8 | -179.4 | -172.7 | -169.1 | 0.9 | 117.7 | V23 I63 | V23-R65 WeakPolarHBondContact CG1-O 3.35Å; I63-R65 VanDerWaalsContact C-N 3.26Å; I63-R65 HydrophobicContact CB-CG 4.37Å; I63-R65 HydrophobicContact CG2-CG 3.37Å; I63-R65 PolarHBondContact O-N 3.26Å |
| 66 | I | 38 | Very low | 41.4 | Very low | 56 Ų | 56 | 87.1 Ų | 87.1 | 29% | 0.287 | 44% | 0.442 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -108.1 | -43.1 | -165.9 | -61.6 | 162.3 | 0 | 0 | 0 | 111.5 | R24 H64 I70 | R24-I66 HydrophobicContact CG-CD1 3.65Å; R24-I66 HydrophobicContact CG-CG1 3.58Å; H64-I66 PolarHBondContact O-N 2.96Å; I66-I70 HydrophobicContact CG2-CD1 4.41Å; I66-I70 WeakPolarHBondContact O-CG1 3.42Å; I66-I70 PolarHBondContact O-N 3.28Å |
| 67 | D | 42.7 | Very low | 42.1 | Very low | 72 Ų | 72 | 85.7 Ų | 85.7 | 39% | 0.385 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -75.5 | -34.9 | -177.4 | -72.4 | -70.6 | 0 | 0 | 0 | 111.1 | A69 I70 F71 R97 | D67-A69 PolarHBondContact O-N 3.37Å; D67-I70 PolarHBondContact O-N 3.44Å; D67-F71 VanDerWaalsContact O-CB 3.29Å; D67-F71 WeakPolarHBondContact O-CB 3.44Å; D67-F71 PolarHBondContact O-N 2.94Å; D67-R97 IonicContact OD1-CZ 3.87Å; D67-R97 IonicContact OD1-NH1 3.92Å; D67-R97 IonicContact OD1-NH2 2.87Å; D67-R97 PolarHBondContact OD1-NH2 3.37Å |
| 68 | D | 44.9 | Very low | 43.2 | Very low | 93 Ų | 93 | 85.3 Ų | 85.3 | 50% | 0.497 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -64.5 | -37.2 | 176.6 | -66.3 | -18.4 | 0 | 0 | 0 | 112.4 | F71 I72 | D68-F71 PolarHBondContact O-N 3.36Å; D68-I72 VanDerWaalsContact O-CB 3.27Å; D68-I72 WeakPolarHBondContact O-CB 3.28Å; D68-I72 VanDerWaalsContact O-CD1 3.28Å; D68-I72 WeakPolarHBondContact O-CD1 3.19Å; D68-I72 WeakPolarHBondContact O-CG1 3.32Å; D68-I72 PolarHBondContact O-N 3.44Å |
| 69 | A | 43.7 | Very low | 44 | Very low | 20 Ų | 20 | 83.2 Ų | 83.2 | 17% | 0.165 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -72.8 | -33 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | V23 D67 R73 | V23-A69 HydrophobicContact CB-CB 4.33Å; V23-A69 HydrophobicContact CG1-CB 3.61Å; V23-A69 HydrophobicContact CG2-CB 4.01Å; D67-A69 PolarHBondContact O-N 3.37Å; A69-R73 WeakPolarHBondContact O-CB 3.28Å; A69-R73 PolarHBondContact O-N 3.05Å |
| 70 | I | 46.9 | Very low | 44.7 | Very low | 60 Ų | 60 | 74.3 Ų | 74.3 | 31% | 0.308 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -71.4 | -43.2 | 173.5 | -63.7 | 168.3 | 0 | 0 | 0 | 109.4 | I20 I66 D67 R73 E74 | I20-I70 HydrophobicContact CG2-CG1 4.25Å; I66-I70 HydrophobicContact CG2-CD1 4.41Å; I66-I70 WeakPolarHBondContact O-CG1 3.42Å; I66-I70 PolarHBondContact O-N 3.28Å; D67-I70 PolarHBondContact O-N 3.44Å; I70-R73 PolarHBondContact O-N 2.83Å; I70-E74 HydrophobicContact CG2-CG 4.43Å; I70-E74 WeakPolarHBondContact O-CB 3.07Å; I70-E74 PolarHBondContact O-N 2.8Å |
| 71 | F | 49.2 | Very low | 46 | Very low | 84 Ų | 84 | 75.6 Ų | 75.6 | 37% | 0.368 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -58.2 | -49.3 | 175.1 | -176 | -96.1 | 0 | 0 | 0 | 111.7 | D67 D68 R73 Q75 L92 | D67-F71 VanDerWaalsContact O-CB 3.29Å; D67-F71 WeakPolarHBondContact O-CB 3.44Å; D67-F71 PolarHBondContact O-N 2.94Å; D68-F71 PolarHBondContact O-N 3.36Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.43Å; F71-Q75 HydrophobicContact CD2-CB 4.33Å; F71-Q75 HydrophobicContact CD2-CG 3.89Å; F71-Q75 HydrophobicContact CE2-CB 4.13Å; F71-Q75 HydrophobicContact CE2-CG 3.83Å; F71-Q75 HydrophobicContact CZ-CB 4.27Å; F71-Q75 HydrophobicContact CZ-CG 4.45Å; F71-Q75 VanDerWaalsContact O-CB 3.28Å; F71-Q75 WeakPolarHBondContact O-CB 3.27Å; F71-Q75 PolarHBondContact O-N 2.89Å; F71-L92 HydrophobicContact CE1-CD2 4.49Å; F71-L92 HydrophobicContact CE2-CD2 4.48Å; F71-L92 HydrophobicContact CZ-CD2 3.66Å |
| 72 | I | 52 | Low | 47.1 | Very low | 34 Ų | 34 | 69.9 Ų | 69.9 | 17% | 0.174 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -63.7 | -35.6 | 177.4 | -69.1 | 163.5 | 0 | 0 | 0 | 111.5 | D68 L76 | D68-I72 VanDerWaalsContact O-CB 3.27Å; D68-I72 WeakPolarHBondContact O-CB 3.28Å; D68-I72 VanDerWaalsContact O-CD1 3.28Å; D68-I72 WeakPolarHBondContact O-CD1 3.19Å; D68-I72 WeakPolarHBondContact O-CG1 3.32Å; D68-I72 PolarHBondContact O-N 3.44Å; I72-L76 HydrophobicContact CG2-CD2 4.38Å; I72-L76 WeakPolarHBondContact O-CB 3.26Å |
| 73 | R | 49.5 | Very low | 47.9 | Very low | 106 Ų | 106 | 69.3 Ų | 69.3 | 40% | 0.4 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -78.6 | -34.3 | -177.4 | -176.4 | 173 | 165.8 | 154.3 | -1.5 | 113.5 | F18 I20 A69 I70 F71 | F18-R73 PolarHBondContact O-NH1 3.13Å; F18-R73 VanDerWaalsContact O-NH1 3.07Å; I20-R73 VanDerWaalsContact CG1-NH1 3.34Å; A69-R73 WeakPolarHBondContact O-CB 3.28Å; A69-R73 PolarHBondContact O-N 3.05Å; I70-R73 PolarHBondContact O-N 2.83Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.43Å |
| 74 | E | 56.1 | Low | 48.7 | Very low | 137 Ų | 137 | 70.8 Ų | 70.8 | 64% | 0.64 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -98.4 | -39.2 | -175.2 | -65.3 | -169.2 | 168.3 | 0 | 0 | 113.4 | I70 | I70-E74 HydrophobicContact CG2-CG 4.43Å; I70-E74 WeakPolarHBondContact O-CB 3.07Å; I70-E74 PolarHBondContact O-N 2.8Å |
| 75 | Q | 52.6 | Low | 49.3 | Very low | 39 Ų | 39 | 71 Ų | 71 | 18% | 0.182 | 37% | 0.371 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90.9 | -39.5 | -175 | -63.1 | -70.9 | 4.6 | 0 | 0 | 112.3 | F71 A78 E79 | F71-Q75 HydrophobicContact CD2-CB 4.33Å; F71-Q75 HydrophobicContact CD2-CG 3.89Å; F71-Q75 HydrophobicContact CE2-CB 4.13Å; F71-Q75 HydrophobicContact CE2-CG 3.83Å; F71-Q75 HydrophobicContact CZ-CB 4.27Å; F71-Q75 HydrophobicContact CZ-CG 4.45Å; F71-Q75 VanDerWaalsContact O-CB 3.28Å; F71-Q75 WeakPolarHBondContact O-CB 3.27Å; F71-Q75 PolarHBondContact O-N 2.89Å; Q75-A78 PolarHBondContact O-N 3.11Å; Q75-A78 VanDerWaalsContact O-N 3.1Å; Q75-E79 WeakPolarHBondContact O-CB 3.49Å; Q75-E79 VanDerWaalsContact O-CG 3.32Å; Q75-E79 WeakPolarHBondContact O-CG 3.49Å; Q75-E79 PolarHBondContact O-N 3.38Å |
| 76 | L | 52.7 | Low | 49.2 | Very low | 9 Ų | 9 | 71 Ų | 71 | 5% | 0.047 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -58.7 | -45.4 | -175.3 | -155.6 | 87.2 | 0 | 0 | 0 | 113 | I39 L40 I72 A78 E79 I80 | I39-L76 HydrophobicContact CG2-CD2 4.23Å; L40-L76 HydrophobicContact CD2-CD1 3.8Å; I72-L76 HydrophobicContact CG2-CD2 4.38Å; I72-L76 WeakPolarHBondContact O-CB 3.26Å; L76-A78 VanDerWaalsContact C-N 3.34Å; L76-A78 PolarHBondContact O-N 3.22Å; L76-E79 PolarHBondContact O-N 3.1Å; L76-I80 HydrophobicContact CD2-CD1 4.09Å; L76-I80 HydrophobicContact CG-CD1 3.93Å; L76-I80 WeakPolarHBondContact O-CB 3.45Å; L76-I80 WeakPolarHBondContact O-CD1 3.16Å; L76-I80 WeakPolarHBondContact O-CG1 3.1Å; L76-I80 PolarHBondContact O-N 3.31Å |
| 77 | P | 55.8 | Low | 49.3 | Very low | 65 Ų | 65 | 77.1 Ų | 77.1 | 42% | 0.422 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -68.5 | -32.6 | 177.9 | -19.7 | 34.3 | 0 | 0 | 0 | 113 | A81 | P77-A81 VanDerWaalsContact O-CB 3.31Å; P77-A81 WeakPolarHBondContact O-CB 3.29Å; P77-A81 PolarHBondContact O-N 3.42Å; P77-A81 VanDerWaalsContact O-N 3.09Å |
| 78 | A | 55.4 | Low | 48.9 | Very low | 45 Ų | 45 | 82 Ų | 82 | 37% | 0.372 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -73 | -37.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q75 L76 A82 | Q75-A78 PolarHBondContact O-N 3.11Å; Q75-A78 VanDerWaalsContact O-N 3.1Å; L76-A78 VanDerWaalsContact C-N 3.34Å; L76-A78 PolarHBondContact O-N 3.22Å; A78-A82 VanDerWaalsContact O-CB 3.29Å; A78-A82 WeakPolarHBondContact O-CB 3.45Å; A78-A82 PolarHBondContact O-N 3.13Å |
| 79 | E | 51 | Low | 48.3 | Very low | 48 Ų | 48 | 88.5 Ų | 88.5 | 22% | 0.224 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -71.9 | -39.7 | 176.4 | -74 | 179.4 | 177.8 | 0 | 0 | 111.8 | Q75 L76 A82 N83 | Q75-E79 WeakPolarHBondContact O-CB 3.49Å; Q75-E79 VanDerWaalsContact O-CG 3.32Å; Q75-E79 WeakPolarHBondContact O-CG 3.49Å; Q75-E79 PolarHBondContact O-N 3.38Å; L76-E79 PolarHBondContact O-N 3.1Å; E79-A82 PolarHBondContact O-N 2.85Å; E79-N83 VanDerWaalsContact O-CB 3.26Å; E79-N83 WeakPolarHBondContact O-CB 3.48Å; E79-N83 PolarHBondContact O-N 2.78Å |
| 80 | I | 51.2 | Low | 47.9 | Very low | 38 Ų | 38 | 91 Ų | 91 | 20% | 0.195 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -62.2 | -45.2 | 172.5 | -69.3 | 164.8 | 0 | 0 | 0 | 110.3 | I39 L76 A82 N83 E84 | I39-I80 HydrophobicContact CG2-CD1 4.23Å; L76-I80 HydrophobicContact CD2-CD1 4.09Å; L76-I80 HydrophobicContact CG-CD1 3.93Å; L76-I80 WeakPolarHBondContact O-CB 3.45Å; L76-I80 WeakPolarHBondContact O-CD1 3.16Å; L76-I80 WeakPolarHBondContact O-CG1 3.1Å; L76-I80 PolarHBondContact O-N 3.31Å; I80-A82 VanDerWaalsContact C-N 3.31Å; I80-A82 PolarHBondContact O-N 3.02Å; I80-N83 PolarHBondContact O-N 2.91Å; I80-E84 PolarHBondContact O-N 2.84Å; I80-E84 VanDerWaalsContact O-N 3.14Å |
| 81 | A | 55.6 | Low | 47.4 | Very low | 54 Ų | 54 | 94.5 Ų | 94.5 | 45% | 0.446 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.9 | -33.7 | 176 | 0 | 0 | 0 | 0 | 0 | 112.9 | P77 | P77-A81 VanDerWaalsContact O-CB 3.31Å; P77-A81 WeakPolarHBondContact O-CB 3.29Å; P77-A81 PolarHBondContact O-N 3.42Å; P77-A81 VanDerWaalsContact O-N 3.09Å |
| 82 | A | 52.7 | Low | 46.9 | Very low | 53 Ų | 53 | 92.6 Ų | 92.6 | 44% | 0.438 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -73.7 | -33.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | A78 E79 I80 L85 N86 | A78-A82 VanDerWaalsContact O-CB 3.29Å; A78-A82 WeakPolarHBondContact O-CB 3.45Å; A78-A82 PolarHBondContact O-N 3.13Å; E79-A82 PolarHBondContact O-N 2.85Å; I80-A82 VanDerWaalsContact C-N 3.31Å; I80-A82 PolarHBondContact O-N 3.02Å; A82-L85 PolarHBondContact O-N 2.91Å; A82-N86 PolarHBondContact O-N 3.29Å |
| 83 | N | 47 | Very low | 46.1 | Very low | 47 Ų | 47 | 94.9 Ų | 94.9 | 25% | 0.251 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -71 | -34.3 | 178.8 | -164.7 | -4 | 0 | 0 | 0 | 112 | H43 E79 I80 L85 N86 | H43-N83 PolarHBondContact O-ND2 2.99Å; E79-N83 VanDerWaalsContact O-CB 3.26Å; E79-N83 WeakPolarHBondContact O-CB 3.48Å; E79-N83 PolarHBondContact O-N 2.78Å; I80-N83 PolarHBondContact O-N 2.91Å; N83-L85 PolarHBondContact O-N 3.07Å; N83-N86 CarbonylContact O-C 3.46Å; N83-N86 PolarHBondContact O-N 3.35Å |
| 84 | E | 50.2 | Low | 45.2 | Very low | 167 Ų | 167 | 94.9 Ų | 94.9 | 78% | 0.78 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -62.7 | -30.8 | 171.8 | -72.7 | -161.6 | 158.8 | 0 | 0 | 112.8 | I80 | I80-E84 PolarHBondContact O-N 2.84Å; I80-E84 VanDerWaalsContact O-N 3.14Å |
| 85 | L | 48.6 | Very low | 44.3 | Very low | 146 Ų | 146 | 95.3 Ų | 95.3 | 76% | 0.764 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -87.7 | -29.9 | 177.4 | -101.4 | 127.2 | 0 | 0 | 0 | 113.6 | A82 N83 | A82-L85 PolarHBondContact O-N 2.91Å; N83-L85 PolarHBondContact O-N 3.07Å |
| 86 | N | 38.6 | Very low | 43.5 | Very low | 118 Ų | 118 | 97.4 Ų | 97.4 | 63% | 0.631 | 50% | 0.504 | S | S | * | . | trans | -137.2 | 88.2 | -174.8 | -73.8 | -47.1 | 0 | 0 | 0 | 110.9 | A82 N83 K88 | A82-N86 PolarHBondContact O-N 3.29Å; N83-N86 CarbonylContact O-C 3.46Å; N83-N86 PolarHBondContact O-N 3.35Å; N86-K88 PolarHBondContact O-N 3.22Å | ||
| 87 | K | 39.3 | Very low | 42.9 | Very low | 185 Ų | 185 | 106.2 Ų | 106.2 | 80% | 0.804 | 54% | 0.536 | S | S | * | . | trans | -59.6 | 12.9 | 178.6 | -67.2 | -173.6 | 174 | -174.6 | 0 | 116.4 | ||||
| 88 | K | 34.1 | Very low | 42.1 | Very low | 174 Ų | 174 | 107.4 Ų | 107.4 | 76% | 0.757 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -150.7 | 118.5 | -171.1 | -62.3 | -173.2 | -179.7 | -176.9 | 0 | 109.8 | N86 | N86-K88 PolarHBondContact O-N 3.22Š|
| 89 | R | 32.8 | Very low | 41.2 | Very low | 230 Ų | 230 | 107.5 Ų | 107.5 | 87% | 0.868 | 55% | 0.545 | S | S | * | . | trans | 91 | 85.4 | 167.2 | -54.2 | 174.1 | 169.8 | -162.1 | -5.8 | 115.3 | I91 | R89-I91 PolarHBondContact O-N 3.07Š| ||
| 90 | L | 35.2 | Very low | 40.7 | Very low | 71 Ų | 71 | 106.9 Ų | 106.9 | 37% | 0.372 | 55% | 0.545 | S | S | . | . | trans | -69.2 | 117.4 | 147.8 | -114.2 | 89.7 | 0 | 0 | 0 | 107.5 | L92 | L90-L92 HydrophobicContact CD2-CD1 3.83Å; L90-L92 HydrophobicContact CD2-CG 4.31Å | ||
| 91 | I | 36.9 | Very low | 40.1 | Very low | 135 Ų | 135 | 110.2 Ų | 110.2 | 69% | 0.692 | 56% | 0.562 | S | S | * | * | trans | -114.8 | 97.1 | 159.6 | -60.8 | 175.6 | 0 | 0 | 0 | 104.4 | R89 V93 | R89-I91 PolarHBondContact O-N 3.07Å; I91-V93 HydrophobicContact CG2-CG2 4.26Å; I91-V93 PolarHBondContact O-N 3.03Å; I91-V93 VanDerWaalsContact O-N 3.11Å | ||
| 92 | L | 37.6 | Very low | 39.2 | Very low | 44 Ų | 44 | 113.9 Ų | 113.9 | 23% | 0.23 | 57% | 0.57 | C | S | . | * | trans | -67.9 | 103.8 | 168.4 | -91.5 | 147.2 | 0 | 0 | 0 | 107.2 | Y56 F71 L90 D94 | Y56-L92 HydrophobicContact CD2-CD1 4.08Å; Y56-L92 HydrophobicContact CE2-CB 4.27Å; Y56-L92 HydrophobicContact CE2-CD1 3.42Å; Y56-L92 VanDerWaalsContact CE2-CD1 3.42Å; Y56-L92 HydrophobicContact CE2-CG 4.45Å; F71-L92 HydrophobicContact CE1-CD2 4.49Å; F71-L92 HydrophobicContact CE2-CD2 4.48Å; F71-L92 HydrophobicContact CZ-CD2 3.66Å; L90-L92 HydrophobicContact CD2-CD1 3.83Å; L90-L92 HydrophobicContact CD2-CG 4.31Å; L92-D94 VanDerWaalsContact C-N 3.31Å; L92-D94 PolarHBondContact O-N 2.77Å | ||
| 93 | V | 34.8 | Very low | 38.3 | Very low | 82 Ų | 82 | 116.1 Ų | 116.1 | 50% | 0.497 | 57% | 0.574 | S | S | . | * | trans | -76.2 | 88.7 | 175.4 | 179.4 | 0 | 0 | 0 | 0 | 107.7 | I91 | I91-V93 HydrophobicContact CG2-CG2 4.26Å; I91-V93 PolarHBondContact O-N 3.03Å; I91-V93 VanDerWaalsContact O-N 3.11Å | ||
| 94 | D | 31.9 | Very low | 37.9 | Very low | 105 Ų | 105 | 117 Ų | 117 | 56% | 0.561 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | 143.8 | 159.2 | -134.7 | -14.7 | 0 | 0 | 0 | 108.8 | L92 | L92-D94 VanDerWaalsContact C-N 3.31Å; L92-D94 PolarHBondContact O-N 2.77Å |
| 95 | D | 35.7 | Very low | 37.3 | Very low | 146 Ų | 146 | 114.8 Ų | 114.8 | 78% | 0.781 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 83.4 | 7 | 172.3 | -66.6 | -27 | 0 | 0 | 0 | 122.7 | ||
| 96 | N | 37.2 | Very low | 36.5 | Very low | 84 Ų | 84 | 110.9 Ų | 110.9 | 45% | 0.449 | 55% | 0.548 | S | S | . | . | trans | -139.5 | 73.9 | 176 | -85.9 | -53.6 | 0 | 0 | 0 | 116.2 | P98 A99 V100 | N96-P98 VanDerWaalsContact O-N 3.13Å; N96-A99 HydrophobicContact CB-CB 3.53Å; N96-A99 PolarHBondContact O-N 2.91Å; N96-V100 WeakPolarHBondContact O-CG2 3.33Å; N96-V100 PolarHBondContact O-N 3.49Å | ||
| 97 | R | 39.5 | Very low | 36.4 | Very low | 193 Ų | 193 | 110.3 Ų | 110.3 | 73% | 0.728 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -46.5 | -35.6 | 164.2 | -77.5 | -174.3 | -177.2 | -152.6 | -0.2 | 113.6 | D67 L101 | D67-R97 IonicContact OD1-CZ 3.87Å; D67-R97 IonicContact OD1-NH1 3.92Å; D67-R97 IonicContact OD1-NH2 2.87Å; D67-R97 PolarHBondContact OD1-NH2 3.37Å; R97-L101 WeakPolarHBondContact O-CD1 3.24Å; R97-L101 WeakPolarHBondContact O-CG 3.24Å; R97-L101 PolarHBondContact O-N 3.19Å |
| 98 | P | 38.7 | Very low | 36.3 | Very low | 90 Ų | 90 | 107.3 Ų | 107.3 | 58% | 0.584 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -74.8 | -39.4 | 174.1 | -16.5 | 31.1 | 0 | 0 | 0 | 114 | N96 L101 Q102 | N96-P98 VanDerWaalsContact O-N 3.13Å; P98-L101 PolarHBondContact O-N 3.08Å; P98-Q102 WeakPolarHBondContact O-CB 3.32Å; P98-Q102 PolarHBondContact O-N 3.02Å |
| 99 | A | 37.3 | Very low | 36.3 | Very low | 47 Ų | 47 | 106.8 Ų | 106.8 | 39% | 0.388 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -76.3 | -30.4 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | N96 Q102 L103 | N96-A99 HydrophobicContact CB-CB 3.53Å; N96-A99 PolarHBondContact O-N 2.91Å; A99-Q102 CarbonylContact O-C 3.58Å; A99-Q102 PolarHBondContact O-N 2.82Å; A99-L103 VanDerWaalsContact O-CB 3.29Å; A99-L103 WeakPolarHBondContact O-CB 3.45Å; A99-L103 PolarHBondContact O-N 2.83Å |
| 100 | V | 39.7 | Very low | 36.7 | Very low | 36 Ų | 36 | 101.3 Ų | 101.3 | 22% | 0.218 | 52% | 0.522 | C | S | . | . | H | α-helix | trans | -67.8 | -39.4 | 172.3 | 175 | 0 | 0 | 0 | 0 | 110.8 | N96 Q102 L103 L104 | N96-V100 WeakPolarHBondContact O-CG2 3.33Å; N96-V100 PolarHBondContact O-N 3.49Å; V100-Q102 VanDerWaalsContact C-N 3.32Å; V100-Q102 PolarHBondContact O-N 2.92Å; V100-L103 PolarHBondContact O-N 2.97Å; V100-L104 HydrophobicContact CG1-CD1 4.05Å; V100-L104 WeakPolarHBondContact O-CB 3.28Å; V100-L104 VanDerWaalsContact O-CG 3.32Å; V100-L104 WeakPolarHBondContact O-CG 3.46Å; V100-L104 PolarHBondContact O-N 3.18Å |
| 101 | L | 39.3 | Very low | 36.8 | Very low | 108 Ų | 108 | 107.1 Ų | 107.1 | 57% | 0.565 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.3 | -34.8 | 170.9 | -79.3 | 167 | 0 | 0 | 0 | 112.3 | R97 P98 R105 | R97-L101 WeakPolarHBondContact O-CD1 3.24Å; R97-L101 WeakPolarHBondContact O-CG 3.24Å; R97-L101 PolarHBondContact O-N 3.19Å; P98-L101 PolarHBondContact O-N 3.08Å; L101-R105 WeakPolarHBondContact O-CB 3.39Å; L101-R105 VanDerWaalsContact O-CG 3.31Å; L101-R105 WeakPolarHBondContact O-CG 3.29Å; L101-R105 PolarHBondContact O-N 2.93Å |
| 102 | Q | 36.3 | Very low | 36.8 | Very low | 130 Ų | 130 | 102.8 Ų | 102.8 | 61% | 0.607 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -72.9 | -33.3 | 175.4 | -163.6 | 135.1 | -10.9 | 0 | 0 | 112.6 | P98 A99 V100 S106 | P98-Q102 WeakPolarHBondContact O-CB 3.32Å; P98-Q102 PolarHBondContact O-N 3.02Å; A99-Q102 CarbonylContact O-C 3.58Å; A99-Q102 PolarHBondContact O-N 2.82Å; V100-Q102 VanDerWaalsContact C-N 3.32Å; V100-Q102 PolarHBondContact O-N 2.92Å; Q102-S106 PolarHBondContact O-N 3.34Å; Q102-S106 PolarHBondContact O-OG 3.48Å |
| 103 | L | 34.7 | Very low | 36.6 | Very low | 100 Ų | 100 | 106.2 Ų | 106.2 | 52% | 0.524 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -71.2 | -41.9 | 173.1 | -165.6 | 68.9 | 0 | 0 | 0 | 110.9 | A99 V100 R105 S106 I107 | A99-L103 VanDerWaalsContact O-CB 3.29Å; A99-L103 WeakPolarHBondContact O-CB 3.45Å; A99-L103 PolarHBondContact O-N 2.83Å; V100-L103 PolarHBondContact O-N 2.97Å; L103-R105 VanDerWaalsContact C-N 3.34Å; L103-R105 PolarHBondContact O-N 3.16Å; L103-S106 VanDerWaalsContact CA-OG 3.24Å; L103-S106 WeakPolarHBondContact CA-OG 3.44Å; L103-S106 PolarHBondContact O-N 3.48Å; L103-S106 VanDerWaalsContact O-N 3.16Å; L103-S106 PolarHBondContact O-OG 3.04Å; L103-S106 VanDerWaalsContact O-OG 3.04Å; L103-I107 HydrophobicContact CD2-CD1 4.46Å; L103-I107 HydrophobicContact CG-CD1 3.91Å; L103-I107 WeakPolarHBondContact O-CB 3.47Å; L103-I107 VanDerWaalsContact O-CG1 3.24Å; L103-I107 WeakPolarHBondContact O-CG1 3.31Å; L103-I107 PolarHBondContact O-N 3.29Å |
| 104 | L | 36.8 | Very low | 36.8 | Very low | 66 Ų | 66 | 107.8 Ų | 107.8 | 35% | 0.346 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -63.7 | -37.2 | 171.8 | -78.3 | 163.4 | 0 | 0 | 0 | 112.2 | V100 K108 | V100-L104 HydrophobicContact CG1-CD1 4.05Å; V100-L104 WeakPolarHBondContact O-CB 3.28Å; V100-L104 VanDerWaalsContact O-CG 3.32Å; V100-L104 WeakPolarHBondContact O-CG 3.46Å; V100-L104 PolarHBondContact O-N 3.18Å; L104-K108 VanDerWaalsContact O-CB 3.28Å; L104-K108 WeakPolarHBondContact O-CB 3.4Å; L104-K108 WeakPolarHBondContact O-CG 3.46Å; L104-K108 PolarHBondContact O-N 2.78Å |
| 105 | R | 37.9 | Very low | 37 | Very low | 120 Ų | 120 | 108.4 Ų | 108.4 | 45% | 0.453 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -63.6 | -39.7 | 170.7 | -82.2 | 174.9 | -177.7 | 169.2 | -5.3 | 112 | L101 L103 H109 D120 | L101-R105 WeakPolarHBondContact O-CB 3.39Å; L101-R105 VanDerWaalsContact O-CG 3.31Å; L101-R105 WeakPolarHBondContact O-CG 3.29Å; L101-R105 PolarHBondContact O-N 2.93Å; L103-R105 VanDerWaalsContact C-N 3.34Å; L103-R105 PolarHBondContact O-N 3.16Å; R105-H109 PolarHBondContact O-CD2 2.87Å; R105-D120 IonicContact CZ-OD1 3.76Å; R105-D120 IonicContact CZ-OD2 3.68Å; R105-D120 IonicContact NH2-OD1 2.74Å; R105-D120 PolarHBondContact NH2-OD1 3.43Å; R105-D120 IonicContact NH2-OD2 2.84Å; R105-D120 PolarHBondContact NH2-OD2 2.74Å |
| 106 | S | 32.7 | Very low | 36.9 | Very low | 64 Ų | 64 | 107.4 Ų | 107.4 | 45% | 0.448 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -78.8 | -28.1 | -179.6 | 37.7 | 0 | 0 | 0 | 0 | 113.7 | Q102 L103 | Q102-S106 PolarHBondContact O-N 3.34Å; Q102-S106 PolarHBondContact O-OG 3.48Å; L103-S106 VanDerWaalsContact CA-OG 3.24Å; L103-S106 WeakPolarHBondContact CA-OG 3.44Å; L103-S106 PolarHBondContact O-N 3.48Å; L103-S106 VanDerWaalsContact O-N 3.16Å; L103-S106 PolarHBondContact O-OG 3.04Å; L103-S106 VanDerWaalsContact O-OG 3.04Å |
| 107 | I | 36.6 | Very low | 36.8 | Very low | 106 Ų | 106 | 107 Ų | 107 | 54% | 0.544 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -77.7 | -36 | 173.2 | -65.5 | 166.9 | 0 | 0 | 0 | 111.2 | L103 H109 V110 | L103-I107 HydrophobicContact CD2-CD1 4.46Å; L103-I107 HydrophobicContact CG-CD1 3.91Å; L103-I107 WeakPolarHBondContact O-CB 3.47Å; L103-I107 VanDerWaalsContact O-CG1 3.24Å; L103-I107 WeakPolarHBondContact O-CG1 3.31Å; L103-I107 PolarHBondContact O-N 3.29Å; I107-H109 PolarHBondContact O-N 3.46Å; I107-V110 PolarHBondContact O-N 3.44Å; I107-V110 VanDerWaalsContact O-N 3.08Å |
| 108 | K | 37.3 | Very low | 36.8 | Very low | 123 Ų | 123 | 103.6 Ų | 103.6 | 54% | 0.535 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.4 | -21.3 | 174.9 | -90 | -178.9 | 172.8 | 171.1 | 0 | 114 | L104 V110 G112 I115 | L104-K108 VanDerWaalsContact O-CB 3.28Å; L104-K108 WeakPolarHBondContact O-CB 3.4Å; L104-K108 WeakPolarHBondContact O-CG 3.46Å; L104-K108 PolarHBondContact O-N 2.78Å; K108-V110 PolarHBondContact O-N 2.73Å; K108-G112 PolarHBondContact O-N 3Å; K108-I115 HydrophobicContact CD-CD1 4.1Å; K108-I115 VanDerWaalsContact NZ-CD1 3.25Å |
| 109 | H | 34 | Very low | 36.8 | Very low | 163 Ų | 163 | 105 Ų | 105 | 76% | 0.755 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | -7.3 | 174.3 | -83.4 | -61.6 | 0 | 0 | 0 | 114.6 | R105 I107 | R105-H109 PolarHBondContact O-CD2 2.87Å; I107-H109 PolarHBondContact O-N 3.46Å |
| 110 | V | 40.6 | Very low | 36.9 | Very low | 114 Ų | 114 | 105.4 Ų | 105.4 | 69% | 0.691 | 56% | 0.56 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.8 | -23.3 | -176.5 | -172 | 0 | 0 | 0 | 0 | 112.5 | I107 K108 | I107-V110 PolarHBondContact O-N 3.44Å; I107-V110 VanDerWaalsContact O-N 3.08Å; K108-V110 PolarHBondContact O-N 2.73Å |
| 111 | Q | 36.9 | Very low | 37.1 | Very low | 194 Ų | 194 | 109 Ų | 109 | 91% | 0.907 | 57% | 0.574 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -151 | 11.5 | -175 | -71.6 | -167.7 | 0.7 | 0 | 0 | 118.4 | ||
| 112 | G | 36.3 | Very low | 37.1 | Very low | 44 Ų | 44 | 110.1 Ų | 110.1 | 45% | 0.454 | 58% | 0.58 | S | S | . | * | S | Bend | trans | -139.1 | 154.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | K108 | K108-G112 PolarHBondContact O-N 3Š|
| 113 | P | 35.4 | Very low | 37.4 | Very low | 116 Ų | 116 | 111.2 Ų | 111.2 | 75% | 0.753 | 59% | 0.586 | S | S | * | * | trans | -63.8 | 146.8 | 174.3 | 27.8 | -32.1 | 0 | 0 | 0 | 110.3 | I115 | P113-I115 PolarHBondContact O-N 3.27Š| ||
| 114 | P | 38.5 | Very low | 37.7 | Very low | 115 Ų | 115 | 111.4 Ų | 111.4 | 75% | 0.747 | 59% | 0.591 | S | S | * | * | trans | -62.8 | 119.6 | -174.1 | 25.2 | -33 | 0 | 0 | 0 | 110.5 | I116 | P114-I116 PolarHBondContact O-N 3Š| ||
| 115 | I | 34.6 | Very low | 38.1 | Very low | 117 Ų | 117 | 116.6 Ų | 116.6 | 60% | 0.6 | 61% | 0.613 | S | S | * | * | trans | -82.5 | 108.1 | 171 | -62.1 | 165.9 | 0 | 0 | 0 | 106.6 | K108 P113 N117 | K108-I115 HydrophobicContact CD-CD1 4.1Å; K108-I115 VanDerWaalsContact NZ-CD1 3.25Å; P113-I115 PolarHBondContact O-N 3.27Å; I115-N117 PolarHBondContact O-N 2.9Å | ||
| 116 | I | 34 | Very low | 38.3 | Very low | 126 Ų | 126 | 117 Ų | 117 | 65% | 0.646 | 63% | 0.629 | S | S | * | * | trans | -73.3 | 114.3 | 169.1 | -61.3 | 169.3 | 0 | 0 | 0 | 106.4 | P114 | P114-I116 PolarHBondContact O-N 3Š| ||
| 117 | N | 35.1 | Very low | 38.7 | Very low | 74 Ų | 74 | 117.9 Ų | 117.9 | 40% | 0.396 | 64% | 0.641 | S | S | . | * | trans | -87.3 | 121.9 | 172 | -143.7 | 9.1 | 0 | 0 | 0 | 107.4 | I115 L119 D120 | I115-N117 PolarHBondContact O-N 2.9Å; N117-L119 PolarHBondContact O-N 3.09Å; N117-D120 HydrophobicContact CB-CB 4.31Å; N117-D120 WeakPolarHBondContact CB-OD2 3.48Å; N117-D120 WeakPolarHBondContact O-CB 3.4Å; N117-D120 PolarHBondContact O-N 3.37Å | ||
| 118 | D | 40.6 | Very low | 39 | Very low | 122 Ų | 122 | 122.2 Ų | 122.2 | 65% | 0.652 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -61.9 | -15.8 | 176.9 | -73.3 | -26.8 | 0 | 0 | 0 | 112.6 | ||
| 119 | L | 37.9 | Very low | 39.3 | Very low | 121 Ų | 121 | 120.7 Ų | 120.7 | 63% | 0.634 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -75.6 | -23.5 | 170.5 | -76.5 | 156.8 | 0 | 0 | 0 | 113.8 | N117 | N117-L119 PolarHBondContact O-N 3.09Å |
| 120 | D | 40.2 | Very low | 39.9 | Very low | 55 Ų | 55 | 118.6 Ų | 118.6 | 29% | 0.294 | 67% | 0.667 | S | S | . | * | H | α-helix | trans | -84 | -16.6 | 176.6 | -71.8 | -37.6 | 0 | 0 | 0 | 112 | R105 N117 T124 | R105-D120 IonicContact CZ-OD1 3.76Å; R105-D120 IonicContact CZ-OD2 3.68Å; R105-D120 IonicContact NH2-OD1 2.74Å; R105-D120 PolarHBondContact NH2-OD1 3.43Å; R105-D120 IonicContact NH2-OD2 2.84Å; R105-D120 PolarHBondContact NH2-OD2 2.74Å; N117-D120 HydrophobicContact CB-CB 4.31Å; N117-D120 WeakPolarHBondContact CB-OD2 3.48Å; N117-D120 WeakPolarHBondContact O-CB 3.4Å; N117-D120 PolarHBondContact O-N 3.37Å; D120-T124 PolarHBondContact O-OG1 3.34Å |
| 121 | Q | 42.6 | Very low | 39.9 | Very low | 110 Ų | 110 | 123.1 Ų | 123.1 | 51% | 0.514 | 68% | 0.68 | S | S | . | * | H | α-helix | trans | -73.5 | -29.3 | 170.2 | -69.5 | -172.7 | 39.4 | 0 | 0 | 112.3 | Q123 | Q121-Q123 PolarHBondContact O-N 2.84Å |
| 122 | L | 40.5 | Very low | 40.5 | Very low | 132 Ų | 132 | 116.8 Ų | 116.8 | 69% | 0.691 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -77.8 | -18.1 | -177.7 | -80.3 | 162.9 | 0 | 0 | 0 | 114.6 | ||
| 123 | Q | 41.8 | Very low | 41.2 | Very low | 153 Ų | 153 | 123.1 Ų | 123.1 | 72% | 0.715 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -103.6 | -17.7 | 178.8 | -70 | -170 | -1.3 | 0 | 0 | 113.9 | Q121 | Q121-Q123 PolarHBondContact O-N 2.84Å |
| 124 | T | 41.8 | Very low | 41.3 | Very low | 104 Ų | 104 | 124.4 Ų | 124.4 | 64% | 0.638 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -89 | -16.3 | -173.2 | -46.1 | 0 | 0 | 0 | 0 | 113.2 | D120 | D120-T124 PolarHBondContact O-OG1 3.34Å |
| 125 | E | 44 | Very low | 41.7 | Very low | 175 Ų | 175 | 127.2 Ų | 127.2 | 82% | 0.818 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -2 | 177.3 | -65.9 | -163.5 | 159.4 | 0 | 0 | 114.7 | ||
| 126 | V | 43.1 | Very low | 41.8 | Very low | 128 Ų | 128 | 132.8 Ų | 132.8 | 78% | 0.776 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -104.7 | -6.2 | -176.3 | -173.6 | 0 | 0 | 0 | 0 | 113.3 | ||
| 127 | A | 41.6 | Very low | 42.4 | Very low | 84 Ų | 84 | 137.9 Ų | 137.9 | 69% | 0.694 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -117.6 | 25.3 | -168.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 128 | K | 42.5 | Very low | 43.1 | Very low | 197 Ų | 197 | 143.6 Ų | 143.6 | 86% | 0.857 | 74% | 0.739 | S | S | * | * | trans | -120.2 | 74.7 | 166.3 | -78.8 | -175.5 | 178 | 177.7 | 0 | 110.5 | ||||
| 129 | A | 44.3 | Very low | 43.1 | Very low | 90 Ų | 90 | 143.1 Ų | 143.1 | 74% | 0.744 | 75% | 0.745 | S | S | * | * | trans | -68.7 | 125.4 | 157.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | E131 | A129-E131 PolarHBondContact O-N 2.86Å; A129-E131 VanDerWaalsContact O-N 3.17Å | ||
| 130 | P | 46.4 | Very low | 43.6 | Very low | 120 Ų | 120 | 143 Ų | 143 | 78% | 0.779 | 76% | 0.755 | S | S | * | * | trans | -70.9 | 112.1 | 173.2 | 28.6 | -29.6 | 0 | 0 | 0 | 107.8 | G132 | P130-G132 PolarHBondContact O-N 3.06Š| ||
| 131 | E | 40.3 | Very low | 44 | Very low | 209 Ų | 209 | 150.3 Ų | 150.3 | 98% | 0.977 | 78% | 0.784 | S | S | * | * | trans | -65.4 | 80 | 155.7 | -72.5 | -171 | 163 | 0 | 0 | 107.2 | A129 | A129-E131 PolarHBondContact O-N 2.86Å; A129-E131 VanDerWaalsContact O-N 3.17Å | ||
| 132 | G | 50.1 | Low | 43.8 | Very low | 61 Ų | 61 | 149.8 Ų | 149.8 | 63% | 0.629 | 80% | 0.798 | S | S | * | * | trans | -118.2 | 125.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | P130 | P130-G132 PolarHBondContact O-N 3.06Š| ||
| 133 | E | 49.2 | Very low | 44.2 | Very low | 177 Ų | 177 | 148.2 Ų | 148.2 | 83% | 0.827 | 81% | 0.805 | S | S | * | * | trans | -42.9 | 146.7 | -174.1 | -70.2 | 172.4 | 126.7 | 0 | 0 | 116.2 | Q135 | E133-Q135 PolarHBondContact O-N 3.25Š| ||
| 134 | V | 39.2 | Very low | 44.1 | Very low | 142 Ų | 142 | 150.5 Ų | 150.5 | 86% | 0.861 | 81% | 0.812 | S | S | * | * | trans | -49.1 | 94 | 162.5 | -176.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 135 | Q | 45.4 | Very low | 44.5 | Very low | 175 Ų | 175 | 155.4 Ų | 155.4 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | trans | -136.4 | 95.9 | 156.7 | -73.4 | -164.5 | 20 | 0 | 0 | 111.5 | E133 R137 | E133-Q135 PolarHBondContact O-N 3.25Å; Q135-R137 PolarHBondContact O-N 3.48Å | ||
| 136 | R | 37.1 | Very low | 44.3 | Very low | 234 Ų | 234 | 153.8 Ų | 153.8 | 88% | 0.883 | 83% | 0.826 | S | S | * | * | trans | -51.7 | 121.9 | 158.7 | -74.8 | 166.4 | 74.2 | 173.7 | 4 | 108.8 | ||||
| 137 | R | 46.2 | Very low | 44.6 | Very low | 233 Ų | 233 | 153 Ų | 153 | 88% | 0.879 | 83% | 0.826 | S | S | * | * | trans | -175.2 | 113.7 | 135.7 | -99.5 | 152 | -174.4 | -153.6 | 1.6 | 113.8 | Q135 | Q135-R137 PolarHBondContact O-N 3.48Š| ||
| 138 | K | 50.5 | Low | 44.8 | Very low | 194 Ų | 194 | 158 Ų | 158 | 84% | 0.843 | 83% | 0.832 | S | S | * | * | trans | 43.2 | 101.9 | 135.5 | -57.8 | -173.4 | 179.2 | -175.8 | 0 | 119.2 | ||||
| 139 | S | 40.5 | Very low | 45 | Very low | 111 Ų | 111 | 155.9 Ų | 155.9 | 78% | 0.776 | 84% | 0.836 | S | S | * | * | trans | 20.7 | 122.6 | 131.7 | 61.1 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 140 | S | 49.2 | Very low | 44.7 | Very low | 120 Ų | 120 | 155 Ų | 155 | 84% | 0.839 | 84% | 0.836 | S | S | * | * | -178 | 128.6 | 121.7 | 40.7 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 141 | K | 47.3 | Very low | 44.2 | Very low | 207 Ų | 207 | 153.6 Ų | 153.6 | 90% | 0.9 | 83% | 0.834 | S | S | * | * | trans | 12.1 | 118.9 | 147.6 | -113.3 | 166.4 | 176.6 | 173.9 | 0 | 120.9 | ||||
| 142 | A | 39 | Very low | 44.2 | Very low | 99 Ų | 99 | 152.9 Ų | 152.9 | 82% | 0.818 | 83% | 0.831 | S | S | * | * | trans | 50.8 | 120.1 | 130.9 | 0 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 143 | A | 48.4 | Very low | 43.8 | Very low | 100 Ų | 100 | 155 Ų | 155 | 83% | 0.826 | 84% | 0.837 | S | S | * | * | trans | -158.4 | 124.7 | 136.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 144 | K | 40.8 | Very low | 43.9 | Very low | 201 Ų | 201 | 154.1 Ų | 154.1 | 87% | 0.874 | 84% | 0.836 | S | S | * | * | trans | -47.8 | 132.5 | 161.8 | -82.1 | 171 | 168 | 173.4 | 0 | 110.8 | ||||
| 145 | K | 50.3 | Low | 43.9 | Very low | 207 Ų | 207 | 151.4 Ų | 151.4 | 90% | 0.9 | 84% | 0.837 | S | S | * | * | trans | -148.3 | 124.1 | 138.2 | -76.1 | -158.5 | 178.1 | 177.6 | 0 | 111 | ||||
| 146 | V | 40 | Very low | 44 | Very low | 141 Ų | 141 | 149 Ų | 149 | 86% | 0.855 | 84% | 0.835 | S | S | * | * | trans | -84.5 | 131.2 | 168.5 | 176.4 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 147 | S | 48.8 | Very low | 44.4 | Very low | 110 Ų | 110 | 143.1 Ų | 143.1 | 77% | 0.769 | 83% | 0.826 | S | S | * | * | trans | -147.2 | 100.8 | 157.5 | 56.8 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 148 | K | 44.8 | Very low | 44.8 | Very low | 189 Ų | 189 | 141.3 Ų | 141.3 | 82% | 0.822 | 83% | 0.825 | S | S | * | * | 38.1 | 99.4 | 89.5 | -78.2 | -169.5 | 178 | -177.7 | 0 | 112.7 | |||||
| 149 | T | 46.5 | Very low | 44.7 | Very low | 153 Ų | 153 | 139.1 Ų | 139.1 | 94% | 0.939 | 82% | 0.822 | S | S | * | * | trans | 177 | 144.3 | 132.5 | 30.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 150 | G | 39.5 | Very low | 44.9 | Very low | 72 Ų | 72 | 140.4 Ų | 140.4 | 74% | 0.742 | 83% | 0.825 | S | S | * | * | trans | 97.9 | 75.3 | 163.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 151 | A | 36.4 | Very low | 44.4 | Very low | 90 Ų | 90 | 141.9 Ų | 141.9 | 74% | 0.744 | 82% | 0.822 | S | S | * | * | 57.1 | 114.6 | 62.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 152 | E | 39.3 | Very low | 44 | Very low | 194 Ų | 194 | 138.3 Ų | 138.3 | 91% | 0.907 | 82% | 0.818 | S | S | * | * | trans | 76.8 | 98.7 | 151.5 | -61.2 | 178.5 | 175.8 | 0 | 0 | 118.6 | ||||
| 153 | S | 42.7 | Very low | 44.6 | Very low | 107 Ų | 107 | 137.5 Ų | 137.5 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | 178.2 | 148.9 | 124 | -175 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 154 | L | 50.5 | Low | 44.3 | Very low | 157 Ų | 157 | 138.6 Ų | 138.6 | 82% | 0.822 | 81% | 0.81 | S | S | * | * | trans | 88.1 | 82.3 | 173 | -44.4 | -177.4 | 0 | 0 | 0 | 115.3 | V156 | L154-V156 PolarHBondContact O-N 2.72Š| ||
| 155 | G | 38.5 | Very low | 44.7 | Very low | 85 Ų | 85 | 137.4 Ų | 137.4 | 88% | 0.876 | 81% | 0.812 | S | S | * | * | trans | -63.5 | 109.7 | 179 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 156 | V | 47.7 | Very low | 44.5 | Very low | 126 Ų | 126 | 132.2 Ų | 132.2 | 76% | 0.764 | 80% | 0.802 | S | S | * | * | trans | -116.2 | 126.6 | 163.7 | -176.9 | 0 | 0 | 0 | 0 | 108.5 | L154 | L154-V156 PolarHBondContact O-N 2.72Š| ||
| 157 | P | 46.8 | Very low | 44.7 | Very low | 109 Ų | 109 | 134.7 Ų | 134.7 | 71% | 0.708 | 80% | 0.804 | S | S | * | * | trans | -62.1 | 144.2 | -179.3 | -20.4 | 31.5 | 0 | 0 | 0 | 113.1 | D159 | P157-D159 VanDerWaalsContact C-N 3.25Å; P157-D159 PolarHBondContact O-N 3.15Å; P157-D159 VanDerWaalsContact O-N 3.15Å | ||
| 158 | K | 53.8 | Low | 44.4 | Very low | 196 Ų | 196 | 140.6 Ų | 140.6 | 85% | 0.852 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -76.6 | 11.5 | -170.5 | -77.3 | 178.1 | 174.9 | 174.8 | 0 | 116.2 | ||
| 159 | D | 48.2 | Very low | 44.5 | Very low | 148 Ų | 148 | 137.1 Ų | 137.1 | 79% | 0.791 | 81% | 0.809 | S | S | * | * | trans | -116.1 | 22.3 | -163.6 | -66.3 | -26.7 | 0 | 0 | 0 | 115.8 | P157 | P157-D159 VanDerWaalsContact C-N 3.25Å; P157-D159 PolarHBondContact O-N 3.15Å; P157-D159 VanDerWaalsContact O-N 3.15Å | ||
| 160 | V | 44.3 | Very low | 44.9 | Very low | 137 Ų | 137 | 135.7 Ų | 135.7 | 83% | 0.83 | 80% | 0.802 | S | S | * | * | trans | -119.6 | 77.6 | 172.9 | -168.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 161 | I | 38.1 | Very low | 45.2 | Very low | 151 Ų | 151 | 137.1 Ų | 137.1 | 77% | 0.774 | 80% | 0.801 | S | S | * | * | trans | -97.5 | 114.5 | 166 | -61.9 | 171.2 | 0 | 0 | 0 | 107.7 | ||||
| 162 | T | 40.5 | Very low | 45.7 | Very low | 133 Ų | 133 | 143 Ų | 143 | 82% | 0.816 | 81% | 0.81 | S | S | * | * | trans | 176.9 | 130.1 | 152.5 | 22.8 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 163 | A | 51.3 | Low | 46.4 | Very low | 81 Ų | 81 | 140.9 Ų | 140.9 | 67% | 0.669 | 80% | 0.804 | S | S | * | * | cis | -166.5 | 167.9 | -6.8 | 0 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 164 | P | 41.5 | Very low | 46.5 | Very low | 124 Ų | 124 | 142.5 Ų | 142.5 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | trans | -84.9 | 131.1 | -167.9 | 33.6 | -29.6 | 0 | 0 | 0 | 111.5 | ||||
| 165 | L | 50.2 | Low | 46.6 | Very low | 175 Ų | 175 | 145.9 Ų | 145.9 | 92% | 0.916 | 81% | 0.806 | S | S | * | * | trans | -115.2 | 96.8 | 170.3 | -76.5 | 172.7 | 0 | 0 | 0 | 111.2 | ||||
| 166 | S | 45.1 | Very low | 47.2 | Very low | 99 Ų | 99 | 152.5 Ų | 152.5 | 69% | 0.692 | 80% | 0.804 | S | S | * | * | trans | 61 | 104.5 | 133.3 | -163 | 0 | 0 | 0 | 0 | 119 | R168 | S166-R168 PolarHBondContact O-N 3.2Š| ||
| 167 | E | 44.1 | Very low | 47.3 | Very low | 193 Ų | 193 | 152.9 Ų | 152.9 | 90% | 0.902 | 81% | 0.807 | S | S | * | * | trans | -48.3 | 118.8 | 156.8 | -58 | 176.7 | 168.7 | 0 | 0 | 111.8 | ||||
| 168 | R | 42.9 | Very low | 47.7 | Very low | 234 Ų | 234 | 152.5 Ų | 152.5 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | -140.5 | 98.1 | 161.1 | -101.4 | -177 | 165.3 | 173.7 | -3.9 | 108.9 | S166 | S166-R168 PolarHBondContact O-N 3.2Š| ||
| 169 | S | 46.6 | Very low | 47.8 | Very low | 116 Ų | 116 | 153.3 Ų | 153.3 | 81% | 0.811 | 81% | 0.81 | S | S | * | * | trans | -63.7 | 130.6 | 171 | 43.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 170 | P | 54.6 | Low | 48 | Very low | 122 Ų | 122 | 157 Ų | 157 | 79% | 0.792 | 81% | 0.814 | S | S | * | * | trans | -88.4 | 111.6 | 158.2 | 18.1 | -3.3 | 0 | 0 | 0 | 108.5 | F172 | P170-F172 PolarHBondContact O-N 3.35Š| ||
| 171 | S | 45.3 | Very low | 48.3 | Very low | 103 Ų | 103 | 156 Ų | 156 | 72% | 0.72 | 81% | 0.813 | S | S | * | * | trans | -53.1 | 132.4 | 168 | 54.2 | 0 | 0 | 0 | 0 | 111.2 | I173 | S171-I173 PolarHBondContact O-N 3.26Å; S171-I173 VanDerWaalsContact O-N 3.15Å | ||
| 172 | F | 47 | Very low | 49.2 | Very low | 212 Ų | 212 | 154.6 Ų | 154.6 | 93% | 0.93 | 82% | 0.816 | S | S | * | * | trans | -54.5 | 113.9 | 171.3 | -74.2 | -94.1 | 0 | 0 | 0 | 110.9 | P170 D174 | P170-F172 PolarHBondContact O-N 3.35Å; F172-D174 PolarHBondContact O-N 3.15Å | ||
| 173 | I | 55.8 | Low | 50 | Low | 151 Ų | 151 | 157.5 Ų | 157.5 | 77% | 0.774 | 82% | 0.817 | S | S | * | * | trans | -82 | 109.4 | 167 | -63.4 | 173.8 | 0 | 0 | 0 | 107.5 | S171 R175 | S171-I173 PolarHBondContact O-N 3.26Å; S171-I173 VanDerWaalsContact O-N 3.15Å; I173-R175 PolarHBondContact O-N 3.5Å | ||
| 174 | D | 43 | Very low | 50.2 | Low | 140 Ų | 140 | 165 Ų | 165 | 75% | 0.749 | 83% | 0.828 | S | S | * | * | trans | -65.4 | 93.2 | 178.7 | -152 | 7.8 | 0 | 0 | 0 | 110.6 | F172 R176 | F172-D174 PolarHBondContact O-N 3.15Å; D174-R176 PolarHBondContact O-N 3.07Å | ||
| 175 | R | 52.4 | Low | 50.7 | Low | 228 Ų | 228 | 166.9 Ų | 166.9 | 86% | 0.86 | 83% | 0.831 | S | S | * | * | trans | -78.2 | 85.7 | 174.7 | -85.5 | -174.2 | 175.5 | 179.2 | -0.2 | 110.1 | I173 T177 | I173-R175 PolarHBondContact O-N 3.5Å; R175-T177 PolarHBondContact O-N 3.41Å; R175-T177 VanDerWaalsContact O-N 3.14Å | ||
| 176 | R | 51.3 | Low | 51 | Low | 224 Ų | 224 | 163.8 Ų | 163.8 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | -58.4 | 110.3 | 164.4 | -79.5 | 179.7 | 170.6 | 173.8 | -3.3 | 110.6 | D174 S178 | D174-R176 PolarHBondContact O-N 3.07Å; R176-S178 PolarHBondContact O-N 3.14Å; R176-S178 VanDerWaalsContact O-N 3.11Å | ||
| 177 | T | 51.6 | Low | 51.3 | Low | 134 Ų | 134 | 165 Ų | 165 | 82% | 0.822 | 83% | 0.827 | S | S | * | * | trans | -77.2 | 84.6 | 166.7 | 47.3 | 0 | 0 | 0 | 0 | 109.7 | R175 K179 | R175-T177 PolarHBondContact O-N 3.41Å; R175-T177 VanDerWaalsContact O-N 3.14Å; T177-K179 PolarHBondContact O-N 3.06Å | ||
| 178 | S | 53.5 | Low | 51.5 | Low | 102 Ų | 102 | 162 Ų | 162 | 71% | 0.713 | 82% | 0.824 | S | S | * | * | trans | -79.3 | 100.5 | 169.2 | -174 | 0 | 0 | 0 | 0 | 109.8 | R176 R180 | R176-S178 PolarHBondContact O-N 3.14Å; R176-S178 VanDerWaalsContact O-N 3.11Å; S178-R180 PolarHBondContact O-N 3.11Å | ||
| 179 | K | 56.6 | Low | 52 | Low | 212 Ų | 212 | 157.9 Ų | 157.9 | 92% | 0.922 | 82% | 0.815 | S | S | * | * | trans | -72.1 | 99.7 | 164.6 | -68.2 | -170.6 | 178.9 | -177.8 | 0 | 108.6 | T177 | T177-K179 PolarHBondContact O-N 3.06Š| ||
| 180 | R | 51.6 | Low | 52.1 | Low | 227 Ų | 227 | 160.3 Ų | 160.3 | 86% | 0.857 | 81% | 0.81 | S | S | * | * | trans | -138.3 | 86.4 | 173.2 | -159 | 178.9 | -170.3 | 179 | 2.5 | 111.2 | S178 | S178-R180 PolarHBondContact O-N 3.11Š| ||
| 181 | S | 51.7 | Low | 51.9 | Low | 116 Ų | 116 | 164.5 Ų | 164.5 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | trans | -166.2 | 92.4 | 155.4 | 47 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 182 | S | 56.3 | Low | 51.9 | Low | 120 Ų | 120 | 164.4 Ų | 164.4 | 84% | 0.839 | 82% | 0.822 | S | S | * | * | trans | -118 | 94.3 | 158 | -154.9 | 0 | 0 | 0 | 0 | 106.3 | R184 | S182-R184 PolarHBondContact O-N 3.26Š| ||
| 183 | K | 56.5 | Low | 51.7 | Low | 194 Ų | 194 | 159.5 Ų | 159.5 | 84% | 0.843 | 82% | 0.82 | S | S | * | * | trans | -74.5 | 99.9 | 173 | -76.8 | 178.6 | 176.9 | 176.9 | 0 | 107.5 | ||||
| 184 | R | 55.5 | Low | 51.3 | Low | 240 Ų | 240 | 156.8 Ų | 156.8 | 91% | 0.906 | 82% | 0.821 | S | S | * | * | trans | -99.8 | 96.3 | 156.1 | -84.3 | -177.3 | 145.7 | -163.2 | -6.3 | 107 | S182 | S182-R184 PolarHBondContact O-N 3.26Š| ||
| 185 | L | 53 | Low | 51.7 | Low | 163 Ų | 163 | 159.9 Ų | 159.9 | 85% | 0.853 | 83% | 0.83 | S | S | * | * | trans | -101 | 103.7 | 165.9 | -87.7 | 160.1 | 0 | 0 | 0 | 107.1 | ||||
| 186 | S | 55.6 | Low | 51.9 | Low | 110 Ų | 110 | 157.7 Ų | 157.7 | 77% | 0.769 | 83% | 0.827 | S | S | * | * | trans | -81.4 | 123.5 | 167.9 | 48.2 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 187 | V | 51.4 | Low | 51.8 | Low | 125 Ų | 125 | 154 Ų | 154 | 76% | 0.758 | 82% | 0.824 | S | S | * | * | trans | 15.1 | 119.6 | 150.2 | -168.9 | 0 | 0 | 0 | 0 | 117.5 | E189 | V187-E189 HydrophobicContact CG1-CG 4.38Š| ||
| 188 | P | 48.9 | Very low | 51.9 | Low | 129 Ų | 129 | 152.6 Ų | 152.6 | 84% | 0.838 | 83% | 0.826 | S | S | * | * | trans | -102.8 | 114 | 158.1 | 33.1 | -20.4 | 0 | 0 | 0 | 110.3 | ||||
| 189 | E | 54.3 | Low | 52 | Low | 148 Ų | 148 | 156.7 Ų | 156.7 | 69% | 0.692 | 83% | 0.831 | S | S | * | * | trans | -105.7 | 131.4 | 162 | -87.3 | -158 | 140.5 | 0 | 0 | 110.8 | V187 | V187-E189 HydrophobicContact CG1-CG 4.38Š| ||
| 190 | K | 48.7 | Very low | 51.8 | Low | 166 Ų | 166 | 153.8 Ų | 153.8 | 72% | 0.722 | 83% | 0.826 | S | S | * | * | trans | 62.6 | 112.4 | 149.2 | -65.1 | 172.2 | 179.8 | 159.5 | 0 | 118.7 | ||||
| 191 | K | 50.9 | Low | 51.8 | Low | 210 Ų | 210 | 151.7 Ų | 151.7 | 91% | 0.913 | 83% | 0.831 | S | S | * | * | 177.6 | 132.2 | 100.6 | -93.7 | 172 | -176.6 | -178.8 | 0 | 111.6 | |||||
| 192 | A | 44.3 | Very low | 51.4 | Low | 102 Ų | 102 | 151 Ų | 151 | 84% | 0.843 | 83% | 0.826 | S | S | * | * | trans | -80.6 | 149 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 193 | A | 42 | Very low | 51.4 | Low | 108 Ų | 108 | 152.3 Ų | 152.3 | 89% | 0.893 | 83% | 0.829 | S | S | * | * | trans | -178.6 | 144.5 | 134.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 194 | A | 48.9 | Very low | 51 | Low | 95 Ų | 95 | 152 Ų | 152 | 79% | 0.785 | 83% | 0.828 | S | S | * | * | trans | -73.1 | 158.8 | -165.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 195 | E | 49.9 | Very low | 50.7 | Low | 204 Ų | 204 | 147.4 Ų | 147.4 | 95% | 0.953 | 83% | 0.826 | S | S | * | * | trans | -149.5 | 142.6 | 145.2 | -115.9 | 176.1 | -172.2 | 0 | 0 | 111.5 | ||||
| 196 | K | 56.9 | Low | 50.5 | Low | 183 Ų | 183 | 143.5 Ų | 143.5 | 80% | 0.796 | 82% | 0.818 | S | S | * | * | trans | -99.1 | 166.1 | -162.8 | -67.3 | 178.1 | 172.7 | 176.1 | 0 | 113.2 | ||||
| 197 | N | 49.5 | Very low | 50.2 | Low | 145 Ų | 145 | 147.1 Ų | 147.1 | 78% | 0.775 | 82% | 0.82 | S | S | * | * | trans | 82.1 | 118.9 | 143.4 | -70.8 | -31.9 | 0 | 0 | 0 | 120.4 | ||||
| 198 | A | 53.4 | Low | 50.3 | Low | 106 Ų | 106 | 151.1 Ų | 151.1 | 88% | 0.876 | 82% | 0.821 | S | S | * | * | -159.2 | 145.7 | 124.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 199 | K | 55.2 | Low | 50.3 | Low | 187 Ų | 187 | 152.4 Ų | 152.4 | 81% | 0.813 | 82% | 0.819 | S | S | * | * | trans | -94.2 | 148.6 | -158.5 | -68.7 | 167.2 | 171.3 | 172.8 | 0 | 114.4 | ||||
| 200 | N | 52.7 | Low | 50.1 | Low | 152 Ų | 152 | 149.6 Ų | 149.6 | 81% | 0.813 | 82% | 0.816 | S | S | * | * | trans | 37.1 | 123.4 | 135.3 | -57.8 | -12.1 | 0 | 0 | 0 | 121.1 | ||||
| 201 | L | 51.6 | Low | 50.3 | Low | 182 Ų | 182 | 150.6 Ų | 150.6 | 95% | 0.953 | 82% | 0.82 | S | S | * | * | trans | -143.3 | 113.8 | 141.8 | -94.7 | 160.8 | 0 | 0 | 0 | 108.9 | ||||
| 202 | S | 43.8 | Very low | 50.3 | Low | 101 Ų | 101 | 149.3 Ų | 149.3 | 71% | 0.706 | 82% | 0.817 | S | S | * | * | trans | -109.6 | 139.5 | 173.7 | 94.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 203 | T | 55.5 | Low | 50.3 | Low | 148 Ų | 148 | 153.7 Ų | 153.7 | 91% | 0.908 | 82% | 0.82 | S | S | * | * | trans | -134.3 | 123.2 | 152.6 | 42.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 204 | K | 49.6 | Very low | 50.6 | Low | 188 Ų | 188 | 156.1 Ų | 156.1 | 82% | 0.817 | 82% | 0.819 | S | S | * | * | trans | -83 | 151 | 175.9 | -73.3 | 174.1 | 171.5 | 176.3 | 0 | 110.2 | ||||
| 205 | T | 48.2 | Very low | 50.7 | Low | 143 Ų | 143 | 160.9 Ų | 160.9 | 88% | 0.877 | 82% | 0.824 | S | S | * | * | 152.9 | 141 | 129.8 | 44.2 | 0 | 0 | 0 | 0 | 109.4 | |||||
| 206 | A | 50.1 | Low | 50.9 | Low | 81 Ų | 81 | 159 Ų | 159 | 67% | 0.669 | 82% | 0.821 | S | S | * | * | cis | -172.6 | 153.2 | -8 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 207 | K | 48 | Very low | 51.2 | Low | 187 Ų | 187 | 157.3 Ų | 157.3 | 81% | 0.813 | 82% | 0.821 | S | S | * | * | trans | 62.7 | 137.4 | 151 | -75.3 | 174.6 | -177.8 | 173.9 | 0 | 117.6 | ||||
| 208 | R | 53.3 | Low | 51.7 | Low | 209 Ų | 209 | 156.9 Ų | 156.9 | 79% | 0.789 | 82% | 0.818 | S | S | * | * | cis | 179.2 | 158.9 | 4.7 | -133.9 | 177.9 | -175.8 | -178.8 | -0.9 | 106.3 | ||||
| 209 | I | 50.1 | Low | 51.9 | Low | 156 Ų | 156 | 159 Ų | 159 | 80% | 0.8 | 82% | 0.815 | S | S | * | * | trans | 85.5 | 130.3 | 161.9 | -52.7 | 148.4 | 0 | 0 | 0 | 114.4 | ||||
| 210 | S | 49.9 | Very low | 52.2 | Low | 89 Ų | 89 | 155.7 Ų | 155.7 | 62% | 0.622 | 81% | 0.811 | S | S | * | * | cis | -175.6 | 153 | -13.5 | 59.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 211 | K | 51.5 | Low | 52.3 | Low | 187 Ų | 187 | 157.9 Ų | 157.9 | 81% | 0.813 | 82% | 0.816 | S | S | * | * | trans | 73.6 | 102.2 | 162.8 | -61 | -177.2 | 177.6 | -173.4 | 0 | 115.4 | ||||
| 212 | Q | 51.5 | Low | 52.7 | Low | 182 Ų | 182 | 153.5 Ų | 153.5 | 85% | 0.85 | 80% | 0.801 | S | S | * | * | 78.5 | 92.2 | 67.2 | -167.4 | -179.9 | 3 | 0 | 0 | 110.9 | |||||
| 213 | E | 44.5 | Very low | 53.2 | Low | 194 Ų | 194 | 157.7 Ų | 157.7 | 91% | 0.907 | 81% | 0.809 | S | S | * | * | trans | -161.1 | 113.9 | 133.9 | -100.7 | 162.1 | -157.1 | 0 | 0 | 105.7 | ||||
| 214 | D | 49.4 | Very low | 53.4 | Low | 160 Ų | 160 | 158.3 Ų | 158.3 | 86% | 0.856 | 81% | 0.807 | S | S | * | * | trans | -76.2 | 134.6 | 167.7 | -87.1 | -38 | 0 | 0 | 0 | 107.1 | ||||
| 215 | E | 49.5 | Very low | 53.4 | Low | 194 Ų | 194 | 155.5 Ų | 155.5 | 91% | 0.907 | 80% | 0.801 | S | S | * | * | trans | -160.3 | 87.7 | 151.7 | -107.4 | 167.4 | -158.2 | 0 | 0 | 106.3 | ||||
| 216 | D | 55.4 | Low | 54.1 | Low | 164 Ų | 164 | 154.6 Ų | 154.6 | 88% | 0.877 | 80% | 0.8 | S | S | * | * | trans | -71.7 | 116.3 | 144.4 | -81.1 | -39.2 | 0 | 0 | 0 | 105.1 | ||||
| 217 | D | 62.4 | Low | 54.2 | Low | 148 Ų | 148 | 159.3 Ų | 159.3 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | -152.4 | 149.3 | 154.3 | -142.4 | -11.4 | 0 | 0 | 0 | 111.8 | ||||
| 218 | D | 59.1 | Low | 54.5 | Low | 136 Ų | 136 | 158.1 Ų | 158.1 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | -64.5 | 160.5 | -154.1 | -86.7 | -50.4 | 0 | 0 | 0 | 116.7 | T220 | D218-T220 PolarHBondContact O-N 3.17Š| ||
| 219 | D | 57.6 | Low | 54.5 | Low | 150 Ų | 150 | 153.1 Ų | 153.1 | 80% | 0.802 | 81% | 0.808 | S | S | * | * | trans | -12.9 | 121.5 | 141.9 | -89.9 | -40.2 | 0 | 0 | 0 | 113.6 | ||||
| 220 | T | 61.4 | Low | 54.2 | Low | 119 Ų | 119 | 149.8 Ų | 149.8 | 73% | 0.73 | 80% | 0.804 | S | S | * | * | trans | -164.3 | 100.7 | 134.7 | 29.6 | 0 | 0 | 0 | 0 | 109.9 | D218 S222 | D218-T220 PolarHBondContact O-N 3.17Å; T220-S222 PolarHBondContact O-N 2.82Å; T220-S222 PolarHBondContact O-OG 3.29Å | ||
| 221 | E | 54.8 | Low | 53.9 | Low | 197 Ų | 197 | 152.6 Ų | 152.6 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | trans | -47.2 | 106.3 | 144.1 | -78.7 | -89.4 | 140.8 | 0 | 0 | 107.6 | ||||
| 222 | S | 61.9 | Low | 53.7 | Low | 91 Ų | 91 | 149.6 Ų | 149.6 | 64% | 0.636 | 82% | 0.82 | S | S | * | * | trans | -120.3 | 94.6 | 176.1 | 35 | 0 | 0 | 0 | 0 | 108.4 | T220 N224 | T220-S222 PolarHBondContact O-N 2.82Å; T220-S222 PolarHBondContact O-OG 3.29Å; S222-N224 PolarHBondContact O-N 2.92Å | ||
| 223 | E | 53.9 | Low | 53.6 | Low | 189 Ų | 189 | 145.7 Ų | 145.7 | 88% | 0.883 | 82% | 0.819 | S | S | * | * | trans | -60.3 | 119.3 | 152.8 | -63.6 | -165.2 | 148.8 | 0 | 0 | 107 | ||||
| 224 | N | 58.2 | Low | 53.4 | Low | 160 Ų | 160 | 140.6 Ų | 140.6 | 86% | 0.856 | 81% | 0.81 | S | S | * | * | trans | -116.2 | 111.2 | 173.6 | -132.1 | 1.3 | 0 | 0 | 0 | 110.6 | S222 | S222-N224 PolarHBondContact O-N 2.92Š| ||
| 225 | D | 51.2 | Low | 53.3 | Low | 130 Ų | 130 | 138.8 Ų | 138.8 | 70% | 0.695 | 81% | 0.807 | S | S | * | * | trans | -64.3 | 152 | 167.5 | -162.2 | 1.3 | 0 | 0 | 0 | 111 | ||||
| 226 | S | 62 | Low | 52.8 | Low | 123 Ų | 123 | 134.6 Ų | 134.6 | 86% | 0.86 | 80% | 0.799 | S | S | * | * | trans | -174.8 | 103 | 152.7 | -83.5 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 227 | E | 52 | Low | 52.6 | Low | 180 Ų | 180 | 133.6 Ų | 133.6 | 84% | 0.841 | 80% | 0.798 | S | S | * | * | trans | -52.3 | 150.5 | 161.4 | -51.8 | -174.8 | 117.6 | 0 | 0 | 112.8 | ||||
| 228 | N | 54.9 | Low | 51.7 | Low | 163 Ų | 163 | 132 Ų | 132 | 87% | 0.872 | 80% | 0.797 | S | S | * | * | trans | -151.6 | 146.9 | 134.3 | -156.2 | 19.2 | 0 | 0 | 0 | 113.4 | ||||
| 229 | S | 53.6 | Low | 50.9 | Low | 104 Ų | 104 | 131.5 Ų | 131.5 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | trans | -78.8 | 151.3 | -160.1 | -82.8 | 0 | 0 | 0 | 0 | 118 | ||||
| 230 | A | 44.4 | Very low | 50 | Low | 86 Ų | 86 | 129.1 Ų | 129.1 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | 52.4 | 127.6 | 136.4 | 0 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 231 | T | 43.1 | Very low | 49.2 | Very low | 148 Ų | 148 | 130.3 Ų | 130.3 | 91% | 0.908 | 80% | 0.798 | S | S | * | * | -172.2 | 141.8 | 108.8 | 24.7 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 232 | S | 46.1 | Very low | 48.5 | Very low | 124 Ų | 124 | 125.5 Ų | 125.5 | 87% | 0.867 | 79% | 0.791 | S | S | * | * | trans | -69.2 | 145.9 | -174.5 | -46.9 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 233 | A | 49.1 | Very low | 47.6 | Very low | 100 Ų | 100 | 127 Ų | 127 | 83% | 0.826 | 80% | 0.799 | S | S | * | * | -180 | 117.1 | 126.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 234 | A | 41.5 | Very low | 46.9 | Very low | 87 Ų | 87 | 127.2 Ų | 127.2 | 72% | 0.719 | 80% | 0.797 | S | S | * | * | trans | -78.8 | 163.8 | 162 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 235 | P | 47.9 | Very low | 46.3 | Very low | 122 Ų | 122 | 128.8 Ų | 128.8 | 79% | 0.792 | 80% | 0.801 | S | S | * | * | -141.1 | 131.6 | 87.8 | 32.2 | -14.5 | 0 | 0 | 0 | 115.3 | |||||
| 236 | S | 38.3 | Very low | 45.7 | Very low | 106 Ų | 106 | 125.9 Ų | 125.9 | 74% | 0.741 | 80% | 0.803 | S | S | * | * | trans | 19.4 | 117.6 | 131.5 | -34.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 237 | V | 51.4 | Low | 44.5 | Very low | 142 Ų | 142 | 129.8 Ų | 129.8 | 86% | 0.861 | 81% | 0.807 | S | S | * | * | -157.5 | 138.5 | 129.7 | -179.7 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 238 | P | 43.7 | Very low | 43.8 | Very low | 116 Ų | 116 | 124 Ų | 124 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | trans | -95.5 | 176 | -162.9 | 4.5 | 18.7 | 0 | 0 | 0 | 115.2 | ||||
| 239 | P | 41.6 | Very low | 43.1 | Very low | 125 Ų | 125 | 123 Ų | 123 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | trans | -90.7 | 146.9 | -165.2 | 36.3 | -32.7 | 0 | 0 | 0 | 113.2 | ||||
| 240 | S | 39.2 | Very low | 42.7 | Very low | 100 Ų | 100 | 124.7 Ų | 124.7 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | trans | -170.5 | 135.8 | 164 | -148.3 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 241 | N | 44.5 | Very low | 42.9 | Very low | 144 Ų | 144 | 125.5 Ų | 125.5 | 77% | 0.77 | 80% | 0.797 | S | S | * | * | trans | 82.4 | 101.7 | 146.2 | -64.4 | -17.4 | 0 | 0 | 0 | 121.4 | ||||
| 242 | A | 39.5 | Very low | 42.8 | Very low | 95 Ų | 95 | 121.9 Ų | 121.9 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -54.4 | 154.8 | 137.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 243 | P | 42.9 | Very low | 43 | Very low | 123 Ų | 123 | 125.9 Ų | 125.9 | 80% | 0.799 | 79% | 0.791 | S | S | * | * | trans | -132.5 | 135.2 | 139.2 | 32 | -17.1 | 0 | 0 | 0 | 113.1 | ||||
| 244 | K | 40.5 | Very low | 42.9 | Very low | 194 Ų | 194 | 127.3 Ų | 127.3 | 84% | 0.843 | 79% | 0.789 | S | S | * | * | trans | -59.6 | 170.9 | 150.5 | -84 | 174.8 | 171.4 | 174.4 | 0 | 109.9 | ||||
| 245 | M | 45.7 | Very low | 43.6 | Very low | 192 Ų | 192 | 131.1 Ų | 131.1 | 95% | 0.946 | 80% | 0.796 | S | S | * | * | trans | 99 | 127.8 | 172.4 | -51 | -84 | -81.9 | 0 | 0 | 110.9 | ||||
| 246 | G | 37.5 | Very low | 43.5 | Very low | 70 Ų | 70 | 134.2 Ų | 134.2 | 72% | 0.722 | 80% | 0.797 | S | S | * | * | cis | 129.9 | 104.3 | 26.6 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 247 | Q | 37.7 | Very low | 43.9 | Very low | 204 Ų | 204 | 138.3 Ų | 138.3 | 95% | 0.953 | 80% | 0.801 | S | S | * | * | trans | 21.5 | 127.1 | 149.2 | -137.9 | 171.6 | 16.6 | 0 | 0 | 120.1 | ||||
| 248 | G | 37.4 | Very low | 43.7 | Very low | 60 Ų | 60 | 136.6 Ų | 136.6 | 62% | 0.619 | 80% | 0.802 | S | S | * | * | 109.5 | 118 | 127.9 | 0 | 0 | 0 | 0 | 0 | 118.1 | |||||
| 249 | V | 39.8 | Very low | 43.6 | Very low | 141 Ų | 141 | 137 Ų | 137 | 86% | 0.855 | 80% | 0.802 | S | S | * | * | trans | 59.9 | 137.4 | 151.4 | -63.7 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 250 | D | 44.1 | Very low | 44.1 | Very low | 140 Ų | 140 | 143 Ų | 143 | 75% | 0.749 | 81% | 0.809 | S | S | * | * | cis | -166.9 | 152.7 | 47.7 | -149.1 | -28.1 | 0 | 0 | 0 | 111.1 | ||||
| 251 | S | 49.2 | Very low | 44.3 | Very low | 102 Ų | 102 | 142.7 Ų | 142.7 | 71% | 0.713 | 81% | 0.807 | S | S | * | * | trans | 16.3 | 123 | 157.3 | 49.4 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 252 | G | 41.7 | Very low | 44.2 | Very low | 73 Ų | 73 | 144.6 Ų | 144.6 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | 87.1 | 107.1 | 109.4 | 0 | 0 | 0 | 0 | 0 | 118.9 | |||||
| 253 | K | 49.8 | Very low | 44.3 | Very low | 208 Ų | 208 | 146 Ų | 146 | 90% | 0.904 | 82% | 0.816 | S | S | * | * | trans | -156.3 | 124.1 | 133.6 | -112.7 | 168.4 | -171.3 | 179.9 | 0 | 112.6 | ||||
| 254 | V | 47.5 | Very low | 44.2 | Very low | 129 Ų | 129 | 143.7 Ų | 143.7 | 78% | 0.782 | 81% | 0.813 | S | S | * | * | trans | -72.1 | 131.4 | 179.1 | 178.8 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 255 | I | 54.9 | Low | 44.5 | Very low | 167 Ų | 167 | 143 Ų | 143 | 86% | 0.856 | 81% | 0.814 | S | S | * | * | trans | -126.8 | 122 | 159.9 | -54.3 | 179.1 | 0 | 0 | 0 | 108.5 | ||||
| 256 | K | 47.1 | Very low | 44.3 | Very low | 187 Ų | 187 | 143.4 Ų | 143.4 | 81% | 0.813 | 81% | 0.81 | S | S | * | * | trans | -77.9 | 139.8 | -175.7 | -73.8 | 174.4 | 174.3 | 174.3 | 0 | 112.1 | ||||
| 257 | K | 45.7 | Very low | 44.5 | Very low | 192 Ų | 192 | 143.8 Ų | 143.8 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | trans | 15 | 133.1 | 142.4 | -91 | 177.7 | 170.2 | 179.2 | 0 | 119.6 | ||||
| 258 | A | 47.6 | Very low | 44.9 | Very low | 107 Ų | 107 | 139.2 Ų | 139.2 | 88% | 0.884 | 81% | 0.811 | S | S | * | * | trans | -147 | 110 | 130 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 259 | T | 42.1 | Very low | 45 | Very low | 124 Ų | 124 | 145.8 Ų | 145.8 | 76% | 0.761 | 83% | 0.825 | S | S | * | * | trans | -89.8 | 137.5 | 162.5 | 38.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 260 | R | 51.9 | Low | 45.5 | Very low | 250 Ų | 250 | 143 Ų | 143 | 94% | 0.943 | 82% | 0.817 | S | S | * | * | trans | -132.7 | 123.3 | 162.4 | -166.7 | 174.4 | -174.9 | 178.1 | 1.2 | 109.1 | ||||
| 261 | S | 42.5 | Very low | 45.9 | Very low | 95 Ų | 95 | 143.9 Ų | 143.9 | 66% | 0.664 | 82% | 0.817 | S | S | * | * | trans | -95.2 | 159 | 179.4 | -47.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 262 | E | 42.4 | Very low | 46.3 | Very low | 184 Ų | 184 | 146.1 Ų | 146.1 | 86% | 0.86 | 81% | 0.814 | S | S | * | * | trans | 77.4 | 127.2 | 146.2 | -81.6 | -179.9 | 143.5 | 0 | 0 | 122.9 | ||||
| 263 | S | 42.5 | Very low | 47 | Very low | 125 Ų | 125 | 152.3 Ų | 152.3 | 87% | 0.874 | 82% | 0.82 | S | S | * | * | 116.7 | 137.6 | 126.6 | 71.7 | 0 | 0 | 0 | 0 | 118.8 | |||||
| 264 | G | 40.6 | Very low | 46.6 | Very low | 73 Ų | 73 | 145.6 Ų | 145.6 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | trans | 96.2 | 100.4 | 162.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 265 | E | 46.1 | Very low | 46.5 | Very low | 181 Ų | 181 | 148.8 Ų | 148.8 | 85% | 0.846 | 82% | 0.816 | S | S | * | * | 84.3 | 116 | 67.8 | -158.6 | 172.6 | -167.4 | 0 | 0 | 114.8 | |||||
| 266 | K | 43.4 | Very low | 46.1 | Very low | 200 Ų | 200 | 147.7 Ų | 147.7 | 87% | 0.87 | 82% | 0.817 | S | S | * | * | trans | 12.3 | 134.5 | 161.7 | -63.6 | 175.1 | 179.2 | 171.1 | 0 | 121.2 | ||||
| 267 | G | 40.1 | Very low | 47 | Very low | 78 Ų | 78 | 143.6 Ų | 143.6 | 80% | 0.804 | 82% | 0.818 | S | S | * | * | trans | 161.4 | 132.2 | 142.7 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 268 | A | 45.9 | Very low | 47.7 | Very low | 107 Ų | 107 | 144.5 Ų | 144.5 | 88% | 0.884 | 82% | 0.822 | S | S | * | * | trans | 88.6 | 100.4 | 147.4 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 269 | E | 39.4 | Very low | 48.6 | Very low | 198 Ų | 198 | 149.2 Ų | 149.2 | 93% | 0.925 | 82% | 0.822 | S | S | * | * | trans | -56.3 | 134.6 | 150.5 | -176.4 | -178.5 | -167.9 | 0 | 0 | 112.5 | ||||
| 270 | A | 51.1 | Low | 49.7 | Very low | 82 Ų | 82 | 153 Ų | 153 | 68% | 0.678 | 83% | 0.828 | S | S | * | * | trans | -159 | 115.5 | 161.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 271 | Q | 52.7 | Low | 50 | Low | 160 Ų | 160 | 150.7 Ų | 150.7 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | trans | 66.8 | 147.2 | 130.7 | -61.1 | -168.2 | -0.3 | 0 | 0 | 119.2 | ||||
| 272 | K | 57 | Low | 51.1 | Low | 149 Ų | 149 | 156 Ų | 156 | 65% | 0.648 | 84% | 0.836 | S | S | * | * | cis | -179.9 | 158 | -3.1 | -113.2 | 176 | -177.8 | 167.3 | 0 | 107.4 | ||||
| 273 | K | 56 | Low | 51.5 | Low | 203 Ų | 203 | 154.7 Ų | 154.7 | 88% | 0.883 | 83% | 0.83 | S | S | * | * | trans | 72.5 | 132.6 | 157 | -63.5 | 162.5 | -179.9 | -172.6 | 0 | 116.1 | ||||
| 274 | G | 42.9 | Very low | 52.4 | Low | 67 Ų | 67 | 158.7 Ų | 158.7 | 69% | 0.691 | 83% | 0.831 | S | S | * | * | cis | 136.9 | 121.2 | 8.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 275 | H | 43.9 | Very low | 53.1 | Low | 196 Ų | 196 | 159.2 Ų | 159.2 | 91% | 0.907 | 83% | 0.829 | S | S | * | * | trans | -166.9 | 111.9 | 151.6 | -117 | -72.7 | 0 | 0 | 0 | 110.9 | ||||
| 276 | T | 47.8 | Very low | 54 | Low | 143 Ų | 143 | 160.6 Ų | 160.6 | 88% | 0.877 | 83% | 0.832 | S | S | * | * | trans | -110.9 | 132.2 | 162.8 | 43.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 277 | A | 66.4 | Low | 54.7 | Low | 101 Ų | 101 | 161 Ų | 161 | 84% | 0.835 | 83% | 0.834 | S | S | * | * | trans | -114.7 | 114.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 278 | K | 60.7 | Low | 55.4 | Low | 211 Ų | 211 | 162.9 Ų | 162.9 | 92% | 0.917 | 84% | 0.835 | S | S | * | * | trans | -73.8 | 133.2 | 167.3 | -77.1 | 176.4 | 173 | 173.1 | 0 | 110 | ||||
| 279 | K | 66.4 | Low | 55.8 | Low | 207 Ų | 207 | 171 Ų | 171 | 90% | 0.9 | 85% | 0.85 | S | S | * | * | trans | -139.5 | 104.4 | 155.6 | -109.5 | 179.8 | -177.6 | 175.7 | 0 | 112.9 | ||||
| 280 | K | 64.8 | Low | 56.7 | Low | 204 Ų | 204 | 169.7 Ų | 169.7 | 89% | 0.887 | 85% | 0.846 | S | S | * | * | trans | 36.2 | 112.8 | 143.3 | -65 | -170.9 | 175.6 | -178.5 | 0 | 121.1 | ||||
| 281 | K | 57.3 | Low | 57 | Low | 200 Ų | 200 | 174.3 Ų | 174.3 | 87% | 0.87 | 86% | 0.855 | S | S | * | * | trans | -61.9 | 132.6 | 150.8 | -171.9 | 178.1 | -176.6 | -179.1 | 0 | 110.8 | ||||
| 282 | K | 65.2 | Low | 57.2 | Low | 207 Ų | 207 | 175.1 Ų | 175.1 | 90% | 0.9 | 86% | 0.861 | S | S | * | * | trans | -135.3 | 112.2 | 159.8 | -146.5 | 178.5 | -172.8 | -178.9 | 0 | 109.1 | ||||
| 283 | E | 51.6 | Low | 57.2 | Low | 157 Ų | 157 | 176.6 Ų | 176.6 | 73% | 0.734 | 87% | 0.874 | S | S | * | * | trans | -71.8 | 140.1 | 175.1 | 174.9 | -174 | 171.6 | 0 | 0 | 111.1 | ||||
| 284 | K | 62.3 | Low | 57.3 | Low | 208 Ų | 208 | 175 Ų | 175 | 90% | 0.904 | 87% | 0.873 | S | S | * | * | trans | -153.8 | 118.5 | 137.3 | -76.6 | -151.3 | 177.6 | 179.9 | 0 | 110.3 | ||||
| 285 | A | 54.6 | Low | 58.2 | Low | 85 Ų | 85 | 182.2 Ų | 182.2 | 70% | 0.702 | 89% | 0.885 | S | S | * | * | trans | -70.7 | 148.7 | 169 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 286 | K | 64.7 | Low | 59.3 | Low | 210 Ų | 210 | 181.2 Ų | 181.2 | 91% | 0.913 | 88% | 0.884 | S | S | * | * | trans | -142.3 | 115.5 | 137.6 | -77.2 | -164 | 177.9 | 178.3 | 0 | 109.6 | ||||
| 287 | K | 58.7 | Low | 60.1 | Low | 208 Ų | 208 | 184.2 Ų | 184.2 | 90% | 0.904 | 88% | 0.884 | S | S | * | * | trans | -60.2 | 144.4 | 164 | -70.5 | 171.4 | 171.6 | 176.5 | 0 | 109.9 | ||||
| 288 | S | 54.2 | Low | 59.6 | Low | 117 Ų | 117 | 191.1 Ų | 191.1 | 82% | 0.818 | 89% | 0.889 | S | S | * | * | -176.8 | 131.6 | 129.8 | 177.5 | 0 | 0 | 0 | 0 | 109 | |||||
| 289 | K | 55 | Low | 59.5 | Low | 279 Ų | 279 | 189.3 Ų | 189.3 | 100% | 1.213 | 89% | 0.886 | S | S | * | * | trans | -8.5 | 0 | 172.5 | -84.1 | 175.1 | 171.3 | 178 | 0 | 118.7 |
Retrieved 289 of 289 residues in 300.9 ms
(Link to these results)