#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qfv s GLN 2 N 0.00 1.15 0.55 3.52 -2.07 -1.26 -5.09 119.66 116.46 1qfv s GLN 2 Ca 0.00 -0.42 -0.20 0.00 -1.82 0.00 0.00 55.36 52.92 1qfv s GLN 2 Cb 0.00 0.53 -0.06 0.00 -1.09 0.00 0.00 33.01 32.39 1qfv s GLN 2 CO 0.00 -0.50 1.03 -2.30 -1.32 0.00 0.00 175.29 172.20 1qfv n PRO 3 N -0.33 1.14 0.29 9.60 -0.02 -1.26 -4.88 135.00 139.53 1qfv n PRO 3 Ca -0.15 0.43 0.17 0.00 -2.02 0.00 0.00 63.50 61.93 1qfv n PRO 3 Cb 0.64 -2.20 0.82 0.00 -0.02 0.00 0.00 33.50 32.74 1qfv n PRO 3 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1qfv h ASP 4 N 0.90 0.00 0.66 2.55 3.04 -2.03 -0.95 116.42 120.59 1qfv h ASP 4 Ca -0.48 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.31 1qfv h ASP 4 Cb 1.35 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.64 1qfv h ASP 4 CO 0.53 0.04 -0.05 -2.67 -2.04 0.00 0.00 179.24 175.06 1qfv n TRP 5 N -3.22 0.00 -2.05 4.15 4.27 -1.26 -4.24 117.44 115.08 1qfv n TRP 5 Ca -0.01 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.19 1qfv n TRP 5 Cb 0.24 -0.33 -0.00 0.00 -1.36 0.00 0.00 31.31 29.86 1qfv n TRP 5 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1qfv n ALA 6 N -1.31 5.97 -3.89 -1.67 0.00 -0.36 -4.77 120.51 114.48 1qfv n ALA 6 Ca 0.12 -4.11 -0.30 0.00 0.00 0.00 0.00 53.44 49.14 1qfv n ALA 6 Cb 0.28 -3.06 -0.15 0.00 0.00 0.00 0.00 19.45 16.52 1qfv n ALA 6 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1qfv s ASP 7 N 1.23 4.34 0.19 0.00 -1.08 -1.26 -4.90 116.67 115.20 1qfv s ASP 7 Ca 0.47 -1.81 -0.12 0.00 -0.52 0.00 0.00 52.55 50.58 1qfv s ASP 7 Cb 0.13 -1.25 0.12 0.00 -1.46 0.00 0.00 42.92 40.46 1qfv s ASP 7 CO -0.04 -0.37 1.84 -0.08 0.52 0.00 0.00 175.17 177.03 1qfv h GLU 8 N 7.85 0.90 -0.16 4.34 4.81 -1.94 0.38 114.58 130.77 1qfv h GLU 8 Ca -0.10 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1qfv h GLU 8 Cb 1.03 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 1qfv h GLU 8 CO 0.48 0.64 0.09 0.00 -0.73 0.00 0.00 179.01 179.50 1qfv h ALA 9 N 1.21 0.19 -0.13 2.92 0.00 -1.99 0.17 119.26 121.63 1qfv h ALA 9 Ca 0.24 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 1qfv h ALA 9 Cb -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1qfv h ALA 9 CO -0.05 -0.34 -0.36 0.00 0.00 0.00 0.00 179.25 178.51 1qfv h ALA 10 N 1.07 0.22 -0.00 0.00 0.00 -1.91 -3.41 119.26 115.23 1qfv h ALA 10 Ca 0.06 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1qfv h ALA 10 Cb -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1qfv h ALA 10 CO -0.02 0.29 -0.05 0.09 0.00 0.00 0.00 179.25 179.56 1qfv n ASN 11 N -4.34 0.72 -0.17 0.00 5.03 0.13 -4.77 115.26 111.86 1qfv n ASN 11 Ca -0.07 -0.86 0.21 0.00 0.87 0.00 0.00 54.58 54.73 1qfv n ASN 11 Cb 0.52 0.45 0.60 0.00 -1.02 0.00 0.00 39.78 40.32 1qfv n ASN 11 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1qfv h GLY 12 N 0.50 0.45 1.89 7.41 0.00 -0.74 -0.03 103.07 112.55 1qfv h GLY 12 Ca 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.24 1qfv h GLY 12 CO 0.00 0.01 0.05 0.00 0.00 0.00 0.00 176.54 176.60 1qfv h ALA 13 N 1.63 1.47 -0.34 3.60 0.00 -1.86 -1.48 119.26 122.28 1qfv h ALA 13 Ca 0.40 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.21 1qfv h ALA 13 Cb 1.22 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 1qfv h ALA 13 CO -0.09 -0.06 0.01 0.72 0.00 0.00 0.00 179.25 179.82 1qfv n HIS 14 N -3.66 1.12 -2.68 0.00 -0.00 -0.03 -4.60 115.22 105.37 1qfv n HIS 14 Ca -0.02 -1.21 -0.07 0.00 -0.00 0.00 0.00 57.72 56.42 1qfv n HIS 14 Cb 0.13 -0.42 0.04 0.00 -0.00 0.00 0.00 29.99 29.74 1qfv n HIS 14 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 1qfv n GLN 15 N -0.78 1.83 -2.87 -0.41 6.02 -0.56 0.46 117.38 121.06 1qfv n GLN 15 Ca 0.28 -3.55 -0.43 0.00 -0.01 0.00 0.00 57.00 53.28 1qfv n GLN 15 Cb 0.99 -1.60 -0.03 0.00 1.02 0.00 0.00 30.24 30.63 1qfv n GLN 15 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1qfv s ASP 16 N -3.55 6.51 0.17 1.08 -1.08 -1.25 -4.22 116.67 114.32 1qfv s ASP 16 Ca 0.31 -1.73 -0.13 0.00 -0.52 0.00 0.00 52.55 50.48 1qfv s ASP 16 Cb 0.38 -2.42 0.06 0.00 -1.46 0.00 0.00 42.92 39.48 1qfv s ASP 16 CO -0.02 -1.20 1.74 0.00 0.52 0.00 0.00 175.17 176.21 1qfv h ALA 17 N 9.11 0.73 -0.58 3.66 0.00 -1.63 -1.91 119.26 128.63 1qfv h ALA 17 Ca 0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1qfv h ALA 17 Cb 1.03 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1qfv h ALA 17 CO 1.16 0.31 0.23 2.35 0.00 0.00 0.00 179.25 183.30 1qfv h TRP 18 N 0.76 0.89 -0.45 0.00 -0.00 -1.90 0.72 115.95 115.98 1qfv h TRP 18 Ca 0.19 -0.07 0.01 0.00 -0.00 0.00 0.00 58.89 59.02 1qfv h TRP 18 Cb 0.16 -0.27 -0.02 0.00 -0.00 0.00 0.00 29.16 29.03 1qfv h TRP 18 CO 0.00 0.72 0.28 -0.22 -0.00 0.00 0.00 178.44 179.23 1qfv h LYS 19 N 0.80 0.56 -0.75 2.65 3.64 -1.92 -1.64 116.57 119.92 1qfv h LYS 19 Ca 0.19 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1qfv h LYS 19 Cb 0.21 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 1qfv h LYS 19 CO -0.01 0.37 0.35 1.03 -2.27 0.00 0.00 179.45 178.92 1qfv h SER 20 N 0.58 0.98 -0.39 4.20 0.87 -0.79 -1.81 113.55 117.19 1qfv h SER 20 Ca 0.17 -0.14 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 1qfv h SER 20 Cb -0.04 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.65 1qfv h SER 20 CO -0.05 0.84 0.14 -0.07 -0.53 0.00 0.00 176.83 177.16 1qfv h LEU 21 N 1.05 0.56 -1.96 2.23 3.38 -0.57 -2.59 115.31 117.41 1qfv h LEU 21 Ca 0.26 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1qfv h LEU 21 Cb 0.12 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1qfv h LEU 21 CO -0.03 0.60 -0.08 0.11 0.09 0.00 0.00 178.44 179.12 1qfv h LYS 22 N 0.49 0.00 0.00 1.13 1.57 -1.10 -1.21 116.57 117.45 1qfv h LYS 22 Ca 0.13 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 1qfv h LYS 22 Cb 0.23 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 1qfv h LYS 22 CO -0.01 0.08 -0.10 0.00 -0.57 0.00 0.00 179.45 178.86 1qfv h ALA 23 N 1.92 1.59 0.00 3.86 0.00 -0.92 -1.11 119.26 124.60 1qfv h ALA 23 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1qfv h ALA 23 Cb 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1qfv h ALA 23 CO 0.01 0.12 0.00 -0.44 0.00 0.00 0.00 179.25 178.94 1qfv h ASP 24 N 0.00 0.00 0.14 0.00 3.32 -1.18 -2.71 116.42 115.99 1qfv h ASP 24 Ca -0.00 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.82 1qfv h ASP 24 Cb 0.21 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.76 1qfv h ASP 24 CO 0.01 0.00 -0.88 0.58 -1.72 0.00 0.00 179.24 177.23 1qfv h VAL 25 N 0.00 1.34 0.15 -1.35 2.07 -1.33 -0.81 116.25 116.33 1qfv h VAL 25 Ca 0.00 -2.23 -0.30 0.00 0.82 0.00 0.00 66.70 64.99 1qfv h VAL 25 Cb 0.27 2.24 0.01 0.00 -1.52 0.00 0.00 31.29 32.29 1qfv h VAL 25 CO 0.00 0.68 -1.40 -0.33 0.02 0.00 0.00 177.57 176.54 1qfv h GLU 26 N 0.34 0.33 -3.83 1.57 3.07 -1.61 -3.44 114.58 111.02 1qfv h GLU 26 Ca -0.07 -0.56 -0.19 0.00 -0.50 0.00 0.00 59.36 58.04 1qfv h GLU 26 Cb 1.50 0.21 -0.24 0.00 -0.84 0.00 0.00 28.75 29.38 1qfv h GLU 26 CO 0.16 1.24 -0.68 -0.80 -1.40 0.00 0.00 179.01 177.53 1qfv s ASN 27 N -7.20 0.12 0.29 1.42 0.01 -1.08 -5.13 114.94 103.37 1qfv s ASN 27 Ca -0.07 -0.26 -0.29 0.00 -0.71 0.00 0.00 52.86 51.53 1qfv s ASN 27 Cb 0.06 0.08 -0.10 0.00 0.41 0.00 0.00 41.25 41.70 1qfv s ASN 27 CO 0.89 -0.18 1.34 -0.69 -1.51 0.00 0.00 177.10 176.95 1qfv s VAL 28 N -0.84 2.77 -0.13 1.60 1.01 -1.26 -4.37 120.40 119.17 1qfv s VAL 28 Ca -0.09 0.72 -0.02 0.00 0.00 0.00 0.00 61.98 62.59 1qfv s VAL 28 Cb -0.06 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 1qfv s VAL 28 CO -0.00 0.15 -0.08 -0.31 0.00 0.00 0.00 175.10 174.85 1qfv s TYR 29 N -0.66 2.92 -0.14 5.22 1.51 -0.39 -4.38 117.35 121.42 1qfv s TYR 29 Ca 0.53 -0.39 -0.04 0.00 -1.01 0.00 0.00 57.07 56.16 1qfv s TYR 29 Cb -0.40 -1.87 -0.03 0.00 -0.11 0.00 0.00 41.96 39.55 1qfv s TYR 29 CO 0.48 -0.05 -0.01 0.71 -1.11 0.00 0.00 175.55 175.57 1qfv s TYR 30 N 0.18 3.09 -0.65 2.71 2.02 0.51 -0.55 117.35 124.67 1qfv s TYR 30 Ca -0.04 -0.10 -0.26 0.00 -0.37 0.00 0.00 57.07 56.30 1qfv s TYR 30 Cb -0.14 -1.93 0.04 0.00 -0.40 0.00 0.00 41.96 39.53 1qfv s TYR 30 CO 0.04 0.13 1.13 1.41 -1.57 0.00 0.00 175.55 176.69 1qfv s MET 31 N 0.02 3.29 0.16 -0.62 -2.45 0.12 -0.84 119.30 118.98 1qfv s MET 31 Ca 0.02 -0.23 0.11 0.00 -1.25 0.00 0.00 55.69 54.33 1qfv s MET 31 Cb -0.13 -4.12 -0.11 0.00 1.25 0.00 0.00 34.83 31.72 1qfv s MET 31 CO 0.02 -1.83 1.28 -0.39 1.05 0.00 0.00 175.02 175.14 1qfv h VAL 32 N 6.05 1.28 -3.80 10.11 -1.51 -0.99 0.19 116.25 127.59 1qfv h VAL 32 Ca -0.27 -2.86 -0.09 0.00 -1.23 0.00 0.00 66.70 62.25 1qfv h VAL 32 Cb 1.06 2.62 -0.14 0.00 -2.13 0.00 0.00 31.29 32.70 1qfv h VAL 32 CO 1.20 0.73 -0.35 -0.54 -1.23 0.00 0.00 177.57 177.38 1qfv s LYS 33 N -2.81 0.90 0.26 5.19 1.02 -1.15 -1.07 119.74 122.09 1qfv s LYS 33 Ca 0.02 -0.98 -0.17 0.00 0.02 0.00 0.00 55.97 54.86 1qfv s LYS 33 Cb 0.09 0.35 0.01 0.00 -0.52 0.00 0.00 37.83 37.76 1qfv s LYS 33 CO 0.79 -0.30 0.58 0.00 -0.92 0.00 0.00 175.35 175.50 1qfv s ALA 34 N -3.87 -0.70 -1.20 5.17 0.00 -0.63 -0.90 121.76 119.63 1qfv s ALA 34 Ca 0.07 -0.60 0.11 0.00 0.00 0.00 0.00 51.96 51.54 1qfv s ALA 34 Cb 0.04 0.96 0.19 0.00 0.00 0.00 0.00 23.12 24.32 1qfv s ALA 34 CO -0.09 -0.93 1.05 0.25 0.00 0.00 0.00 175.76 176.04 1qfv n THR 35 N -0.41 0.47 -4.22 0.00 -2.24 -0.43 -0.88 114.28 106.57 1qfv n THR 35 Ca -0.03 -0.73 -0.14 0.00 -2.27 0.00 0.00 64.05 60.87 1qfv n THR 35 Cb 0.61 0.89 -0.10 0.00 -2.10 0.00 0.00 70.33 69.63 1qfv n THR 35 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1qfv s TYR 36 N -0.97 1.18 -0.10 4.78 1.13 -1.26 -4.54 117.35 117.56 1qfv s TYR 36 Ca 0.18 -0.73 0.20 0.00 -1.41 0.00 0.00 57.07 55.31 1qfv s TYR 36 Cb 0.11 -0.62 -0.30 0.00 -1.10 0.00 0.00 41.96 40.05 1qfv s TYR 36 CO 0.15 0.04 0.30 1.63 -2.51 0.00 0.00 175.55 175.16 1qfv n LYS 37 N 0.07 0.69 -4.83 -3.49 5.02 -1.26 -4.93 118.16 109.42 1qfv n LYS 37 Ca -0.12 -0.12 -0.27 0.00 -2.02 0.00 0.00 58.31 55.78 1qfv n LYS 37 Cb 0.60 -1.51 -0.15 0.00 -0.02 0.00 0.00 35.03 33.95 1qfv n LYS 37 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1qfv s ASN 38 N -4.90 2.68 -0.01 4.39 0.01 -1.26 0.44 114.94 116.29 1qfv s ASN 38 Ca -0.09 -0.51 0.03 0.00 -0.71 0.00 0.00 52.86 51.59 1qfv s ASN 38 Cb 0.10 -0.25 -0.01 0.00 0.41 0.00 0.00 41.25 41.51 1qfv s ASN 38 CO 0.86 0.21 -0.11 -0.62 -1.51 0.00 0.00 177.10 175.94 1qfv s ASP 39 N -1.02 1.31 0.54 -1.22 2.15 -0.34 -4.57 116.67 113.51 1qfv s ASP 39 Ca 0.09 -0.20 0.23 0.00 0.43 0.00 0.00 52.55 53.10 1qfv s ASP 39 Cb -0.09 -0.20 1.41 0.00 -0.30 0.00 0.00 42.92 43.73 1qfv s ASP 39 CO 0.01 0.12 2.07 -0.65 -0.17 0.00 0.00 175.17 176.55 1qfv h PRO 40 N 6.01 0.00 0.00 4.34 0.11 -1.88 -0.03 132.00 140.55 1qfv h PRO 40 Ca -0.32 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.33 1qfv h PRO 40 Cb 1.17 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.21 1qfv h PRO 40 CO 0.49 0.00 -2.53 0.28 -0.21 0.00 0.00 178.00 176.03 1qfv n VAL 41 N -4.32 1.52 0.53 3.15 0.31 -1.26 -4.53 118.33 113.73 1qfv n VAL 41 Ca 0.04 -0.42 0.13 0.00 -0.01 0.00 0.00 64.34 64.07 1qfv n VAL 41 Cb 0.39 -1.79 0.45 0.00 -0.91 0.00 0.00 33.84 31.97 1qfv n VAL 41 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1qfv n TRP 42 N -4.06 0.86 -0.46 3.52 8.01 -1.20 -5.01 117.44 119.09 1qfv n TRP 42 Ca -0.53 0.29 0.00 0.00 -1.31 0.00 0.00 57.50 55.95 1qfv n TRP 42 Cb 0.91 -0.96 0.00 0.00 -2.01 0.00 0.00 31.31 29.24 1qfv n TRP 42 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1qfv n GLY 43 N 0.73 -2.16 3.81 6.99 0.00 -0.03 -4.40 105.19 110.13 1qfv n GLY 43 Ca 0.04 -1.98 -0.38 0.00 0.00 0.00 0.00 46.02 43.69 1qfv n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qfv s ASN 44 N -3.33 6.91 -1.56 1.61 0.02 -1.26 -1.20 114.94 116.12 1qfv s ASN 44 Ca 0.00 1.08 -0.13 0.00 -1.02 0.00 0.00 52.86 52.79 1qfv s ASN 44 Cb 0.00 -2.30 0.09 0.00 0.02 0.00 0.00 41.25 39.06 1qfv s ASN 44 CO 0.00 0.27 0.85 0.47 0.02 0.00 0.00 177.10 178.71 1qfv n ASP 45 N 1.97 -3.62 -4.76 -1.22 8.00 0.17 -1.52 116.55 115.56 1qfv n ASP 45 Ca -0.12 -0.87 -0.39 0.00 0.71 0.00 0.00 54.79 54.11 1qfv n ASP 45 Cb 0.52 -3.48 0.02 0.00 -0.02 0.00 0.00 41.12 38.15 1qfv n ASP 45 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1qfv s PHE 46 N -3.39 2.48 0.28 1.24 -0.12 -0.97 -4.28 117.98 113.22 1qfv s PHE 46 Ca 0.57 1.30 0.01 0.00 -0.05 0.00 0.00 56.93 58.76 1qfv s PHE 46 Cb -0.29 -3.86 -0.03 0.00 -0.63 0.00 0.00 43.02 38.21 1qfv s PHE 46 CO 0.86 -2.80 0.28 0.95 -0.05 0.00 0.00 175.22 174.46 1qfv s THR 47 N -1.23 0.00 -1.41 -4.49 -4.23 -0.04 -4.85 115.64 99.38 1qfv s THR 47 Ca 0.62 -1.88 -0.09 0.00 -1.18 0.00 0.00 61.69 59.16 1qfv s THR 47 Cb -0.42 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 70.96 1qfv s THR 47 CO 0.54 0.00 1.04 0.00 -0.54 0.00 0.00 174.62 175.66 1qfv s VAL 49 N -3.35 5.08 0.07 0.00 1.01 -1.26 -3.44 120.40 118.51 1qfv s VAL 49 Ca 0.52 1.33 -0.04 0.00 0.00 0.00 0.00 61.98 63.79 1qfv s VAL 49 Cb -0.24 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1qfv s VAL 49 CO 0.78 0.27 0.06 -0.83 0.00 0.00 0.00 175.10 175.38 1qfv s GLY 50 N 0.76 0.36 -0.04 4.51 0.00 -0.46 -0.70 107.32 111.75 1qfv s GLY 50 Ca 0.35 -1.01 -0.12 0.00 0.00 0.00 0.00 44.72 43.94 1qfv s GLY 50 CO 0.16 -1.13 0.27 0.54 0.00 0.00 0.00 173.10 172.94 1qfv s VAL 51 N -3.91 0.05 0.01 1.40 0.11 0.29 -1.50 120.40 116.85 1qfv s VAL 51 Ca 0.07 -0.38 -0.03 0.00 -2.93 0.00 0.00 61.98 58.72 1qfv s VAL 51 Cb 0.07 -0.51 -0.01 0.00 -1.53 0.00 0.00 36.38 34.39 1qfv s VAL 51 CO -0.10 -0.21 0.04 0.00 -3.33 0.00 0.00 175.10 171.51 1qfv s MET 52 N -0.89 0.37 0.31 1.54 0.23 -0.64 -1.26 119.30 118.95 1qfv s MET 52 Ca -0.10 -0.50 0.05 0.00 -1.03 0.00 0.00 55.69 54.11 1qfv s MET 52 Cb -0.05 0.14 -0.06 0.00 -1.53 0.00 0.00 34.83 33.33 1qfv s MET 52 CO 0.03 -0.07 0.02 0.00 -2.03 0.00 0.00 175.02 172.96 1qfv s ALA 53 N -1.37 2.35 0.31 3.16 0.00 -0.31 -0.27 121.76 125.63 1qfv s ALA 53 Ca -0.15 -2.01 -0.19 0.00 0.00 0.00 0.00 51.96 49.62 1qfv s ALA 53 Cb -0.09 0.50 0.05 0.00 0.00 0.00 0.00 23.12 23.59 1qfv s ALA 53 CO 0.00 -0.24 0.83 0.54 0.00 0.00 0.00 175.76 176.89 1qfv s ASN 54 N -3.47 -0.07 -1.09 0.00 4.22 -0.64 -4.24 114.94 109.65 1qfv s ASN 54 Ca 0.34 -0.90 -0.01 0.00 -2.14 0.00 0.00 52.86 50.15 1qfv s ASN 54 Cb 0.07 0.74 -0.01 0.00 1.28 0.00 0.00 41.25 43.33 1qfv s ASN 54 CO 0.14 -1.44 0.91 -0.67 -2.04 0.00 0.00 177.10 174.00 1qfv n ASP 55 N -1.10 -2.78 -4.72 3.54 2.03 -1.26 -1.22 116.55 111.04 1qfv n ASP 55 Ca -0.06 -0.59 -0.42 0.00 0.52 0.00 0.00 54.79 54.24 1qfv n ASP 55 Cb 0.60 -4.80 -0.03 0.00 -0.72 0.00 0.00 41.12 36.17 1qfv n ASP 55 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1qfv s VAL 56 N -3.34 2.04 -0.33 5.18 1.01 -1.26 -4.23 120.40 119.47 1qfv s VAL 56 Ca 0.07 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.11 1qfv s VAL 56 Cb -0.01 -3.02 0.10 0.00 0.00 0.00 0.00 36.38 33.45 1qfv s VAL 56 CO 0.68 0.00 0.06 0.21 0.00 0.00 0.00 175.10 176.05 1qfv s ASN 57 N 1.09 4.55 0.34 3.32 3.84 0.12 -4.99 114.94 123.22 1qfv s ASN 57 Ca 0.73 -1.99 0.05 0.00 0.21 0.00 0.00 52.86 51.86 1qfv s ASN 57 Cb -0.49 -1.41 0.63 0.00 -0.55 0.00 0.00 41.25 39.42 1qfv s ASN 57 CO 0.34 -0.39 1.88 -0.33 -2.79 0.00 0.00 177.10 175.81 1qfv h GLU 58 N 7.75 0.48 -0.22 0.43 4.39 -1.93 0.35 114.58 125.82 1qfv h GLU 58 Ca -0.07 -0.10 -0.05 0.00 0.34 0.00 0.00 59.36 59.48 1qfv h GLU 58 Cb 1.02 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.59 1qfv h GLU 58 CO 0.50 0.53 -0.07 -0.44 -1.16 0.00 0.00 179.01 178.37 1qfv h ASP 59 N 0.46 0.33 -0.00 1.42 3.32 -1.97 -3.08 116.42 116.90 1qfv h ASP 59 Ca 0.10 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1qfv h ASP 59 Cb 0.34 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1qfv h ASP 59 CO 0.01 0.44 -0.76 -0.62 -1.72 0.00 0.00 179.24 176.60 1qfv n GLU 60 N -4.28 1.12 -3.74 3.56 1.02 -1.00 -4.98 120.64 112.34 1qfv n GLU 60 Ca 0.00 -0.18 -0.23 0.00 -0.02 0.00 0.00 57.16 56.73 1qfv n GLU 60 Cb 0.25 -1.36 0.03 0.00 -0.02 0.00 0.00 31.44 30.35 1qfv n GLU 60 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1qfv n LYS 61 N -1.15 -5.13 -4.23 3.49 5.02 0.12 -4.69 118.16 111.58 1qfv n LYS 61 Ca 0.04 0.62 -0.15 0.00 -2.02 0.00 0.00 58.31 56.80 1qfv n LYS 61 Cb 0.31 -5.27 -0.10 0.00 -0.02 0.00 0.00 35.03 29.95 1qfv n LYS 61 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1qfv s SER 62 N -4.12 1.79 0.17 4.39 1.04 -0.98 -0.48 113.70 115.52 1qfv s SER 62 Ca 0.16 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.67 1qfv s SER 62 Cb -0.08 -0.02 -0.04 0.00 0.10 0.00 0.00 66.02 65.98 1qfv s SER 62 CO 0.81 -0.27 0.05 0.27 0.98 0.00 0.00 173.24 175.09 1qfv s ILE 63 N -2.83 0.33 -0.23 -1.02 -4.36 -0.19 -0.70 121.20 112.21 1qfv s ILE 63 Ca 0.12 -1.96 -0.08 0.00 -0.26 0.00 0.00 60.65 58.48 1qfv s ILE 63 Cb -0.01 -2.20 -0.04 0.00 1.25 0.00 0.00 42.46 41.46 1qfv s ILE 63 CO 0.01 -0.35 0.08 -1.10 0.24 0.00 0.00 174.94 173.83 1qfv s GLN 64 N -4.02 3.83 -0.11 0.37 -1.52 -0.36 -1.51 119.66 116.34 1qfv s GLN 64 Ca 0.28 -0.40 -0.01 0.00 -1.95 0.00 0.00 55.36 53.28 1qfv s GLN 64 Cb 0.07 -3.33 -0.02 0.00 -0.22 0.00 0.00 33.01 29.51 1qfv s GLN 64 CO 0.05 0.01 -0.08 0.00 -0.25 0.00 0.00 175.29 175.02 1qfv s ALA 65 N 1.12 2.88 -0.24 6.09 0.00 0.67 -1.63 121.76 130.64 1qfv s ALA 65 Ca 0.05 -0.87 -0.05 0.00 0.00 0.00 0.00 51.96 51.08 1qfv s ALA 65 Cb -0.14 -1.31 -0.01 0.00 0.00 0.00 0.00 23.12 21.65 1qfv s ALA 65 CO 0.04 0.37 0.01 -1.21 0.00 0.00 0.00 175.76 174.97 1qfv s GLU 66 N -0.13 3.38 0.14 0.00 2.02 0.62 -1.17 118.70 123.56 1qfv s GLU 66 Ca 0.01 -0.64 0.04 0.00 0.02 0.00 0.00 54.97 54.41 1qfv s GLU 66 Cb -0.13 -3.16 -0.04 0.00 0.10 0.00 0.00 34.13 30.90 1qfv s GLU 66 CO 0.03 -0.25 0.11 -0.06 0.02 0.00 0.00 175.26 175.12 1qfv s PHE 67 N 1.51 3.16 0.05 1.61 0.40 0.86 -1.62 117.98 123.94 1qfv s PHE 67 Ca 0.05 0.01 0.04 0.00 -0.60 0.00 0.00 56.93 56.44 1qfv s PHE 67 Cb -0.15 -1.55 -0.02 0.00 0.51 0.00 0.00 43.02 41.81 1qfv s PHE 67 CO -0.00 0.52 -0.13 -0.48 0.70 0.00 0.00 175.22 175.83 1qfv s LEU 68 N -2.85 2.22 0.04 -0.37 0.05 -0.56 -1.71 118.68 115.50 1qfv s LEU 68 Ca 0.30 -0.51 -0.28 0.00 0.05 0.00 0.00 54.13 53.68 1qfv s LEU 68 Cb -0.11 -0.48 0.10 0.00 -2.05 0.00 0.00 46.19 43.65 1qfv s LEU 68 CO 0.23 -0.04 1.13 0.72 -0.55 0.00 0.00 176.35 177.83 1qfv s PHE 69 N -1.06 -0.10 0.05 3.48 -0.71 0.00 -1.36 117.98 118.29 1qfv s PHE 69 Ca -0.02 -0.08 0.00 0.00 -1.04 0.00 0.00 56.93 55.80 1qfv s PHE 69 Cb -0.09 0.58 -0.03 0.00 -1.21 0.00 0.00 43.02 42.27 1qfv s PHE 69 CO 0.01 -0.51 -0.05 -1.64 -1.34 0.00 0.00 175.22 171.70 1qfv s MET 70 N -2.81 0.58 0.31 1.99 -1.94 -0.01 0.53 119.30 117.95 1qfv s MET 70 Ca 0.12 -1.04 -0.03 0.00 -1.71 0.00 0.00 55.69 53.04 1qfv s MET 70 Cb 0.02 0.01 -0.01 0.00 2.01 0.00 0.00 34.83 36.86 1qfv s MET 70 CO -0.02 -0.05 0.40 0.54 -0.01 0.00 0.00 175.02 175.89 1qfv s ASN 71 N -2.42 0.73 0.00 3.03 2.20 -1.26 -0.86 114.94 116.36 1qfv s ASN 71 Ca 0.00 -1.41 0.23 0.00 -0.94 0.00 0.00 52.86 50.75 1qfv s ASN 71 Cb 0.01 0.60 1.39 0.00 -2.00 0.00 0.00 41.25 41.24 1qfv s ASN 71 CO -0.05 -1.18 1.77 -0.46 -2.94 0.00 0.00 177.10 174.24 1qfv n ASN 72 N -1.09 0.00 -0.00 3.54 0.23 -0.57 -3.41 115.26 113.95 1qfv n ASN 72 Ca 0.01 -0.83 0.10 0.00 -0.53 0.00 0.00 54.58 53.34 1qfv n ASN 72 Cb 0.62 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.20 1qfv n ASN 72 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1qfv n ALA 73 N -0.97 4.71 -3.13 -2.53 0.00 -1.26 -4.93 120.51 112.40 1qfv n ALA 73 Ca 0.17 -0.60 -0.13 0.00 0.00 0.00 0.00 53.44 52.89 1qfv n ALA 73 Cb 0.08 -0.77 -0.13 0.00 0.00 0.00 0.00 19.45 18.63 1qfv n ALA 73 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1qfv s ASP 74 N -3.04 -0.17 0.01 0.00 -1.08 -1.22 -5.04 116.67 106.14 1qfv s ASP 74 Ca 0.08 0.33 0.28 0.00 -0.52 0.00 0.00 52.55 52.71 1qfv s ASP 74 Cb 0.16 0.32 1.01 0.00 -1.46 0.00 0.00 42.92 42.95 1qfv s ASP 74 CO 0.87 -0.07 1.78 0.35 0.52 0.00 0.00 175.17 178.62 1qfv n THR 75 N 3.16 0.04 -3.84 1.71 -2.24 -1.26 -4.39 114.28 107.45 1qfv n THR 75 Ca -0.14 -0.02 -0.28 0.00 -2.27 0.00 0.00 64.05 61.34 1qfv n THR 75 Cb 0.58 -0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 1qfv n THR 75 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1qfv s ASN 76 N -3.10 6.37 0.34 3.42 0.02 -1.26 -5.06 114.94 115.67 1qfv s ASN 76 Ca 0.13 0.30 -0.29 0.00 -1.02 0.00 0.00 52.86 51.98 1qfv s ASN 76 Cb 0.18 -1.97 -0.11 0.00 0.02 0.00 0.00 41.25 39.37 1qfv s ASN 76 CO 0.58 0.05 1.47 -0.32 0.02 0.00 0.00 177.10 178.90 1qfv s MET 77 N -3.03 4.17 0.23 -0.60 -2.45 -1.26 -4.80 119.30 111.56 1qfv s MET 77 Ca 0.36 2.49 0.09 0.00 -1.25 0.00 0.00 55.69 57.38 1qfv s MET 77 Cb -0.12 -3.01 -0.04 0.00 1.25 0.00 0.00 34.83 32.91 1qfv s MET 77 CO 0.28 -0.48 -0.01 -0.65 1.05 0.00 0.00 175.02 175.22 1qfv s GLN 78 N -1.59 2.32 0.03 4.11 -0.21 0.19 -4.95 119.66 119.55 1qfv s GLN 78 Ca 0.55 -1.30 0.00 0.00 0.02 0.00 0.00 55.36 54.63 1qfv s GLN 78 Cb -0.45 -2.23 -0.02 0.00 1.00 0.00 0.00 33.01 31.30 1qfv s GLN 78 CO 0.57 0.40 -0.04 -0.06 -2.12 0.00 0.00 175.29 174.04 1qfv s PHE 79 N -2.07 0.35 -0.01 0.91 0.40 -1.26 -0.82 117.98 115.48 1qfv s PHE 79 Ca 0.29 -0.57 -0.28 0.00 -0.60 0.00 0.00 56.93 55.78 1qfv s PHE 79 Cb -0.08 -0.24 0.06 0.00 0.51 0.00 0.00 43.02 43.28 1qfv s PHE 79 CO 0.19 -0.19 0.62 0.00 0.70 0.00 0.00 175.22 176.54 1qfv s ALA 80 N -1.64 -1.61 -0.07 5.36 0.00 -0.69 -4.99 121.76 118.12 1qfv s ALA 80 Ca -0.13 1.04 0.05 0.00 0.00 0.00 0.00 51.96 52.92 1qfv s ALA 80 Cb -0.09 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 1qfv s ALA 80 CO -0.01 -0.43 -0.23 0.99 0.00 0.00 0.00 175.76 176.08 1qfv s THR 81 N -1.67 2.26 0.03 0.00 2.01 -1.26 -0.10 115.64 116.91 1qfv s THR 81 Ca -0.09 -0.98 -0.01 0.00 0.31 0.00 0.00 61.69 60.91 1qfv s THR 81 Cb -0.01 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.63 1qfv s THR 81 CO 0.05 0.57 -0.00 -1.61 -0.69 0.00 0.00 174.62 172.93 1qfv s GLU 82 N -0.07 0.46 0.10 4.92 2.02 -0.32 -4.20 118.70 121.63 1qfv s GLU 82 Ca -0.06 -0.83 -0.18 0.00 0.02 0.00 0.00 54.97 53.92 1qfv s GLU 82 Cb -0.14 0.17 -0.07 0.00 0.10 0.00 0.00 34.13 34.18 1qfv s GLU 82 CO 0.05 -0.09 0.57 0.21 0.02 0.00 0.00 175.26 176.01 1qfv s LYS 83 N -2.48 4.12 -0.04 1.61 2.20 -0.52 -0.24 119.74 124.38 1qfv s LYS 83 Ca -0.06 0.66 0.02 0.00 -0.36 0.00 0.00 55.97 56.22 1qfv s LYS 83 Cb -0.02 -3.12 0.01 0.00 -1.51 0.00 0.00 37.83 33.19 1qfv s LYS 83 CO -0.05 0.58 -0.09 0.08 -0.36 0.00 0.00 175.35 175.51 1qfv s VAL 84 N -1.25 0.86 -0.06 4.02 1.01 -0.57 -0.50 120.40 123.91 1qfv s VAL 84 Ca 0.32 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 62.01 1qfv s VAL 84 Cb -0.18 -0.80 -0.00 0.00 0.00 0.00 0.00 36.38 35.40 1qfv s VAL 84 CO 0.19 0.28 -0.21 -0.89 0.00 0.00 0.00 175.10 174.47 1qfv s THR 85 N 0.55 1.75 -0.04 3.92 2.01 0.33 -1.02 115.64 123.14 1qfv s THR 85 Ca -0.10 -0.88 -0.30 0.00 0.31 0.00 0.00 61.69 60.72 1qfv s THR 85 Cb -0.13 -1.50 -0.04 0.00 0.01 0.00 0.00 72.50 70.85 1qfv s THR 85 CO 0.02 0.49 1.27 0.00 -0.69 0.00 0.00 174.62 175.70 1qfv s ALA 86 N 0.03 3.53 0.30 7.40 0.00 0.37 -0.51 121.76 132.88 1qfv s ALA 86 Ca -0.06 0.70 0.03 0.00 0.00 0.00 0.00 51.96 52.62 1qfv s ALA 86 Cb -0.14 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.40 1qfv s ALA 86 CO 0.04 -0.82 0.12 0.14 0.00 0.00 0.00 175.76 175.24 1qfv s VAL 87 N 2.31 0.56 -0.11 0.00 -7.23 -0.60 -4.91 120.40 110.41 1qfv s VAL 87 Ca 0.58 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.67 1qfv s VAL 87 Cb -0.27 -2.57 -0.04 0.00 0.56 0.00 0.00 36.38 34.05 1qfv s VAL 87 CO 0.23 0.00 0.19 -0.54 -0.31 0.00 0.00 175.10 174.67 1qfv s LYS 88 N -3.89 3.59 0.05 4.82 1.02 -1.26 -1.38 119.74 122.69 1qfv s LYS 88 Ca 0.35 -0.04 0.01 0.00 0.02 0.00 0.00 55.97 56.30 1qfv s LYS 88 Cb 0.06 -3.22 -0.03 0.00 -0.52 0.00 0.00 37.83 34.12 1qfv s LYS 88 CO 0.15 0.71 -0.05 -1.64 -0.92 0.00 0.00 175.35 173.61 1qfv s MET 89 N -0.89 0.57 -1.64 1.68 -1.94 -1.26 -4.89 119.30 110.93 1qfv s MET 89 Ca 0.16 -1.00 -0.02 0.00 -1.71 0.00 0.00 55.69 53.12 1qfv s MET 89 Cb -0.13 -0.02 0.00 0.00 2.01 0.00 0.00 34.83 36.70 1qfv s MET 89 CO 0.05 -0.04 0.22 0.66 -0.01 0.00 0.00 175.02 175.90 1qfv n TYR 90 N 0.73 -1.39 -1.02 -0.03 4.01 -1.26 -2.31 117.16 115.88 1qfv n TYR 90 Ca -0.18 0.19 -0.01 0.00 -0.16 0.00 0.00 57.90 57.74 1qfv n TYR 90 Cb 0.58 -4.02 -0.00 0.00 -0.31 0.00 0.00 39.34 35.59 1qfv n TYR 90 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1qfv n GLY 91 N -1.17 0.46 3.76 2.72 0.00 -1.26 -5.00 105.19 104.70 1qfv n GLY 91 Ca -0.19 -0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 1qfv n GLY 91 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qfv s TYR 92 N -1.88 2.53 -0.06 1.61 1.51 -0.98 -4.97 117.35 115.12 1qfv s TYR 92 Ca 0.00 1.51 0.05 0.00 -1.01 0.00 0.00 57.07 57.62 1qfv s TYR 92 Cb 0.00 -3.46 -0.24 0.00 -0.11 0.00 0.00 41.96 38.15 1qfv s TYR 92 CO 0.00 -2.02 0.60 -0.91 -1.11 0.00 0.00 175.55 172.10 1qfv h ASN 93 N 1.25 0.17 -3.30 2.29 2.35 -1.95 -3.44 115.58 112.95 1qfv h ASN 93 Ca -0.50 -0.35 -0.63 0.00 -0.55 0.00 0.00 56.30 54.26 1qfv h ASN 93 Cb 1.28 -0.05 -0.21 0.00 0.05 0.00 0.00 38.32 39.39 1qfv h ASN 93 CO 0.57 1.31 -0.65 -0.60 -1.65 0.00 0.00 177.43 176.41 1qfv s ARG 94 N -2.59 3.70 -0.26 0.81 3.52 -1.26 -5.05 118.95 117.81 1qfv s ARG 94 Ca -0.11 -0.49 -0.43 0.00 -0.13 0.00 0.00 55.73 54.57 1qfv s ARG 94 Cb 0.07 -2.95 -0.20 0.00 -1.56 0.00 0.00 34.95 30.32 1qfv s ARG 94 CO 0.81 0.26 1.38 0.39 -0.81 0.00 0.00 175.30 177.33 1qfv n GLU 95 N 3.49 0.12 -0.14 5.12 4.71 -1.26 -4.88 120.64 127.80 1qfv n GLU 95 Ca -0.17 0.05 0.02 0.00 -0.01 0.00 0.00 57.16 57.04 1qfv n GLU 95 Cb 0.52 -1.56 0.03 0.00 -1.01 0.00 0.00 31.44 29.42 1qfv n GLU 95 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1qfv n ASN 96 N 3.00 0.98 -4.14 1.62 6.94 -0.69 -1.71 115.26 121.25 1qfv n ASN 96 Ca 0.26 -1.93 -0.09 0.00 -0.02 0.00 0.00 54.58 52.79 1qfv n ASN 96 Cb 0.02 -0.14 -0.10 0.00 -2.36 0.00 0.00 39.78 37.20 1qfv n ASN 96 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1qfv s ALA 97 N -0.84 0.82 -0.19 -2.53 0.00 -0.48 -0.42 121.76 118.12 1qfv s ALA 97 Ca 0.07 -1.41 -0.02 0.00 0.00 0.00 0.00 51.96 50.60 1qfv s ALA 97 Cb 0.06 0.64 -0.00 0.00 0.00 0.00 0.00 23.12 23.82 1qfv s ALA 97 CO 0.01 -0.43 -0.10 -0.06 0.00 0.00 0.00 175.76 175.17 1qfv s PHE 98 N -3.96 2.88 -0.42 0.00 0.08 0.12 -1.56 117.98 115.12 1qfv s PHE 98 Ca 0.19 -1.08 -0.11 0.00 0.12 0.00 0.00 56.93 56.06 1qfv s PHE 98 Cb 0.07 -2.00 0.07 0.00 -0.57 0.00 0.00 43.02 40.59 1qfv s PHE 98 CO -0.01 -0.56 0.28 0.50 -0.10 0.00 0.00 175.22 175.32 1qfv s ARG 99 N 1.21 2.71 0.07 0.44 3.52 0.33 -1.20 118.95 126.04 1qfv s ARG 99 Ca 0.02 -1.37 -0.17 0.00 -0.13 0.00 0.00 55.73 54.08 1qfv s ARG 99 Cb -0.14 -3.84 -0.07 0.00 -1.56 0.00 0.00 34.95 29.34 1qfv s ARG 99 CO -0.04 -0.92 0.53 0.71 -0.81 0.00 0.00 175.30 174.76 1qfv s TYR 100 N 1.49 3.75 -0.11 5.12 1.51 0.53 -0.51 117.35 129.13 1qfv s TYR 100 Ca 0.03 1.17 -0.01 0.00 -1.01 0.00 0.00 57.07 57.25 1qfv s TYR 100 Cb -0.23 -2.43 0.03 0.00 -0.11 0.00 0.00 41.96 39.23 1qfv s TYR 100 CO 0.04 0.57 -0.02 -2.00 -1.11 0.00 0.00 175.55 173.03 1qfv s GLU 101 N -1.28 0.92 0.87 -0.62 2.12 0.34 -1.44 118.70 119.61 1qfv s GLU 101 Ca 0.30 -0.13 -0.13 0.00 0.36 0.00 0.00 54.97 55.37 1qfv s GLU 101 Cb -0.18 -1.41 0.12 0.00 0.26 0.00 0.00 34.13 32.92 1qfv s GLU 101 CO 0.18 -0.36 1.17 0.95 -0.54 0.00 0.00 175.26 176.66 1qfv s THR 102 N 1.86 1.99 0.53 -1.70 -4.23 0.08 -1.45 115.64 112.72 1qfv s THR 102 Ca 0.04 0.00 0.22 0.00 -1.18 0.00 0.00 61.69 60.77 1qfv s THR 102 Cb -0.13 -2.88 0.29 0.00 1.34 0.00 0.00 72.50 71.12 1qfv s THR 102 CO -0.07 0.00 2.16 -0.33 -0.54 0.00 0.00 174.62 175.85 1qfv h GLU 103 N -1.33 0.00 -0.13 3.99 5.08 -1.91 -0.81 114.58 119.48 1qfv h GLU 103 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1qfv h GLU 103 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1qfv h GLU 103 CO 0.61 0.04 0.00 -0.25 -1.00 0.00 0.00 179.01 178.41 1qfv n ASP 104 N -4.15 1.13 0.00 1.42 8.00 -1.26 -4.90 116.55 116.79 1qfv n ASP 104 Ca -0.03 -1.66 0.00 0.00 0.71 0.00 0.00 54.79 53.81 1qfv n ASP 104 Cb 0.12 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 1qfv n ASP 104 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qfv n GLY 105 N 1.00 0.69 3.75 0.44 0.00 -0.31 -5.03 105.19 105.73 1qfv n GLY 105 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1qfv n GLY 105 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1qfv s GLN 106 N -0.30 4.67 -0.06 1.61 0.74 -1.26 -4.75 119.66 120.31 1qfv s GLN 106 Ca 0.00 1.73 0.04 0.00 0.05 0.00 0.00 55.36 57.18 1qfv s GLN 106 Cb 0.00 -3.23 -0.02 0.00 1.10 0.00 0.00 33.01 30.86 1qfv s GLN 106 CO 0.00 0.23 -0.19 0.08 -0.55 0.00 0.00 175.29 174.86 1qfv s VAL 107 N -0.93 2.58 -0.07 1.34 1.01 -1.26 -0.74 120.40 122.34 1qfv s VAL 107 Ca 0.45 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.57 1qfv s VAL 107 Cb -0.30 -1.99 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1qfv s VAL 107 CO 0.38 0.57 -0.12 -0.36 0.00 0.00 0.00 175.10 175.57 1qfv s PHE 108 N -0.36 1.46 -0.30 5.22 0.08 -0.52 -4.94 117.98 118.63 1qfv s PHE 108 Ca 0.03 -0.54 0.01 0.00 0.12 0.00 0.00 56.93 56.55 1qfv s PHE 108 Cb -0.12 -1.07 0.07 0.00 -0.57 0.00 0.00 43.02 41.32 1qfv s PHE 108 CO 0.02 -0.28 -0.02 0.99 -0.10 0.00 0.00 175.22 175.83 1qfv s THR 109 N 0.67 2.57 0.22 0.64 2.01 -1.26 -0.34 115.64 120.14 1qfv s THR 109 Ca -0.15 -1.70 0.07 0.00 0.31 0.00 0.00 61.69 60.23 1qfv s THR 109 Cb -0.16 -2.58 -0.04 0.00 0.01 0.00 0.00 72.50 69.73 1qfv s THR 109 CO 0.04 -0.20 0.12 -1.81 -0.69 0.00 0.00 174.62 172.08 1qfv s ASP 110 N 1.19 5.27 -0.06 3.53 1.01 -0.34 -4.54 116.67 122.72 1qfv s ASP 110 Ca -0.03 -0.30 0.05 0.00 0.71 0.00 0.00 52.55 52.98 1qfv s ASP 110 Cb -0.20 -1.27 -0.02 0.00 1.01 0.00 0.00 42.92 42.44 1qfv s ASP 110 CO -0.04 0.01 -0.20 -0.69 0.21 0.00 0.00 175.17 174.46 1qfv s VAL 111 N -2.00 2.51 -0.40 -1.27 1.01 0.36 0.12 120.40 120.73 1qfv s VAL 111 Ca 0.31 -0.91 -0.29 0.00 0.00 0.00 0.00 61.98 61.10 1qfv s VAL 111 Cb -0.08 -1.95 0.02 0.00 0.00 0.00 0.00 36.38 34.36 1qfv s VAL 111 CO 0.23 0.57 1.19 -0.63 0.00 0.00 0.00 175.10 176.46 1qfv s ILE 112 N -0.34 4.22 0.03 2.22 -1.09 0.45 -0.01 121.20 126.68 1qfv s ILE 112 Ca 0.02 1.32 0.01 0.00 -2.23 0.00 0.00 60.65 59.78 1qfv s ILE 112 Cb -0.12 -4.42 -0.26 0.00 -1.58 0.00 0.00 42.46 36.08 1qfv s ILE 112 CO 0.02 -0.75 0.95 0.00 -1.23 0.00 0.00 174.94 173.93 1qfv h ALA 113 N 9.17 0.35 -1.81 9.38 0.00 -1.17 -3.46 119.26 131.72 1qfv h ALA 113 Ca -0.24 -1.10 0.01 0.00 0.00 0.00 0.00 54.91 53.59 1qfv h ALA 113 Cb 1.07 0.19 -0.23 0.00 0.00 0.00 0.00 17.79 18.82 1qfv h ALA 113 CO 1.08 1.22 0.27 -0.47 0.00 0.00 0.00 179.25 181.34 1qfv s TYR 114 N -2.64 -0.67 -0.12 0.00 5.04 -1.07 -4.84 117.35 113.05 1qfv s TYR 114 Ca -0.06 1.59 -0.10 0.00 -2.44 0.00 0.00 57.07 56.07 1qfv s TYR 114 Cb 0.08 0.34 0.04 0.00 0.35 0.00 0.00 41.96 42.76 1qfv s TYR 114 CO 0.84 -0.33 0.32 0.45 -1.34 0.00 0.00 175.55 175.49 1qfv s SER 115 N 0.47 -0.34 0.41 4.32 0.15 0.17 0.16 113.70 119.05 1qfv s SER 115 Ca 0.00 0.65 0.02 0.00 0.70 0.00 0.00 55.95 57.31 1qfv s SER 115 Cb -0.05 0.62 -0.01 0.00 -1.71 0.00 0.00 66.02 64.88 1qfv s SER 115 CO -0.04 -0.13 0.06 -0.67 1.20 0.00 0.00 173.24 173.66 1qfv n ASP 116 N 3.23 2.28 -0.30 5.45 -0.08 0.04 -4.61 116.55 122.55 1qfv n ASP 116 Ca -0.16 -2.96 0.17 0.00 -1.51 0.00 0.00 54.79 50.34 1qfv n ASP 116 Cb 0.57 0.60 0.43 0.00 2.34 0.00 0.00 41.12 45.06 1qfv n ASP 116 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1qfv h ASP 117 N 1.26 0.57 0.00 1.67 3.32 -2.01 -2.94 116.42 118.29 1qfv h ASP 117 Ca -0.33 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1qfv h ASP 117 Cb 1.11 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1qfv h ASP 117 CO 0.54 0.20 -0.10 -0.46 -1.72 0.00 0.00 179.24 177.70 1qfv n ASN 118 N -4.63 1.86 -3.51 6.45 0.23 -1.26 -5.05 115.26 109.35 1qfv n ASN 118 Ca 0.22 -2.85 -0.16 0.00 -0.53 0.00 0.00 54.58 51.25 1qfv n ASN 118 Cb 0.67 -0.38 -0.05 0.00 -2.08 0.00 0.00 39.78 37.94 1qfv n ASN 118 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1qfv s ASP 120 N -1.57 0.62 -0.28 0.00 1.01 0.24 -0.78 116.67 115.91 1qfv s ASP 120 Ca -0.08 -0.22 -0.02 0.00 0.71 0.00 0.00 52.55 52.94 1qfv s ASP 120 Cb -0.00 -0.03 0.04 0.00 1.01 0.00 0.00 42.92 43.93 1qfv s ASP 120 CO 0.04 -0.02 -0.02 -0.69 0.21 0.00 0.00 175.17 174.69 1qfv s VAL 121 N -0.48 3.02 -0.09 -1.27 1.01 0.12 -0.71 120.40 122.01 1qfv s VAL 121 Ca -0.02 -1.17 0.01 0.00 0.00 0.00 0.00 61.98 60.80 1qfv s VAL 121 Cb -0.04 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 1qfv s VAL 121 CO -0.00 0.04 -0.11 -0.63 0.00 0.00 0.00 175.10 174.40 1qfv s ILE 122 N 1.30 3.33 -0.17 2.22 1.01 -0.27 -0.61 121.20 128.02 1qfv s ILE 122 Ca -0.02 -0.60 -0.07 0.00 0.00 0.00 0.00 60.65 59.96 1qfv s ILE 122 Cb -0.18 -2.37 -0.04 0.00 0.01 0.00 0.00 42.46 39.88 1qfv s ILE 122 CO -0.02 0.56 0.08 -0.47 0.00 0.00 0.00 174.94 175.09 1qfv s TYR 123 N -0.32 3.33 -0.40 3.97 5.04 0.99 -0.57 117.35 129.39 1qfv s TYR 123 Ca 0.04 0.21 -0.10 0.00 -2.44 0.00 0.00 57.07 54.77 1qfv s TYR 123 Cb -0.13 -2.04 0.06 0.00 0.35 0.00 0.00 41.96 40.20 1qfv s TYR 123 CO 0.02 0.31 0.24 0.08 -1.34 0.00 0.00 175.55 174.86 1qfv s VAL 124 N 0.01 4.40 0.62 3.14 1.01 0.99 -0.49 120.40 130.08 1qfv s VAL 124 Ca 0.07 -1.16 0.33 0.00 0.00 0.00 0.00 61.98 61.22 1qfv s VAL 124 Cb -0.12 -3.59 0.37 0.00 0.00 0.00 0.00 36.38 33.05 1qfv s VAL 124 CO 0.00 -0.39 2.19 -0.65 0.00 0.00 0.00 175.10 176.25 1qfv h PRO 125 N 8.43 0.00 0.00 2.72 0.11 -1.83 -1.16 132.00 140.27 1qfv h PRO 125 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1qfv h PRO 125 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1qfv h PRO 125 CO 0.72 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.92 1qfv n GLY 126 N -1.28 0.45 0.14 -0.55 0.00 -1.26 -4.60 105.19 98.09 1qfv n GLY 126 Ca -0.01 -0.89 0.01 0.00 0.00 0.00 0.00 46.02 45.13 1qfv n GLY 126 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qfv n THR 127 N -3.61 0.85 -1.78 2.61 -2.24 -1.26 -4.49 114.28 104.35 1qfv n THR 127 Ca 0.00 -0.92 -0.29 0.00 -2.27 0.00 0.00 64.05 60.57 1qfv n THR 127 Cb 0.36 0.59 0.04 0.00 -2.10 0.00 0.00 70.33 69.21 1qfv n THR 127 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1qfv n ASP 128 N -0.20 6.08 -1.52 3.42 8.00 -1.26 -4.86 116.55 126.22 1qfv n ASP 128 Ca 0.03 -3.77 -0.13 0.00 0.71 0.00 0.00 54.79 51.63 1qfv n ASP 128 Cb 0.26 -0.62 -0.01 0.00 -0.02 0.00 0.00 41.12 40.73 1qfv n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qfv n GLY 129 N -0.77 -0.17 3.25 0.44 0.00 -1.26 -4.99 105.19 101.69 1qfv n GLY 129 Ca 0.51 -0.33 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 1qfv n GLY 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qfv s ASN 130 N -2.42 0.86 0.11 1.61 4.22 -1.26 -4.83 114.94 113.22 1qfv s ASN 130 Ca 0.01 -1.53 -0.29 0.00 -2.14 0.00 0.00 52.86 48.91 1qfv s ASN 130 Cb -0.00 0.43 -0.06 0.00 1.28 0.00 0.00 41.25 42.89 1qfv s ASN 130 CO 0.01 -0.91 0.92 -0.70 -2.04 0.00 0.00 177.10 174.37 1qfv s GLU 131 N -3.89 4.67 0.25 3.55 2.12 -1.26 -4.41 118.70 119.74 1qfv s GLU 131 Ca 0.39 1.37 -0.30 0.00 0.36 0.00 0.00 54.97 56.80 1qfv s GLU 131 Cb 0.05 -3.36 -0.09 0.00 0.26 0.00 0.00 34.13 30.99 1qfv s GLU 131 CO 0.18 0.27 1.17 -2.00 -0.54 0.00 0.00 175.26 174.34 1qfv s GLU 132 N -0.16 4.54 0.00 4.30 -6.30 -1.26 -4.33 118.70 115.48 1qfv s GLU 132 Ca 0.44 1.90 0.00 0.00 -2.50 0.00 0.00 54.97 54.82 1qfv s GLU 132 Cb -0.23 -3.19 0.00 0.00 0.00 0.00 0.00 34.13 30.71 1qfv s GLU 132 CO 0.29 0.03 0.00 0.41 0.02 0.00 0.00 175.26 176.01 1qfv n GLY 133 N 1.49 -1.03 3.28 -1.50 0.00 -0.44 -4.87 105.19 102.13 1qfv n GLY 133 Ca 0.01 -0.90 -0.17 0.00 0.00 0.00 0.00 46.02 44.96 1qfv n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qfv s TYR 134 N -3.00 1.48 0.05 1.61 1.51 -1.26 -0.01 117.35 117.74 1qfv s TYR 134 Ca 0.00 -0.60 0.04 0.00 -1.01 0.00 0.00 57.07 55.50 1qfv s TYR 134 Cb 0.00 -0.74 -0.02 0.00 -0.11 0.00 0.00 41.96 41.09 1qfv s TYR 134 CO 0.00 0.20 -0.13 -1.21 -1.11 0.00 0.00 175.55 173.30 1qfv s GLU 135 N -3.21 0.80 -0.14 -0.62 2.02 0.27 -1.31 118.70 116.50 1qfv s GLU 135 Ca 0.15 -0.82 0.02 0.00 0.02 0.00 0.00 54.97 54.33 1qfv s GLU 135 Cb -0.02 -0.77 0.02 0.00 0.10 0.00 0.00 34.13 33.46 1qfv s GLU 135 CO 0.04 0.18 -0.18 -1.17 0.02 0.00 0.00 175.26 174.14 1qfv s LEU 136 N -1.44 1.91 0.01 1.80 2.96 -0.08 -1.11 118.68 122.73 1qfv s LEU 136 Ca -0.02 -0.54 0.08 0.00 -0.22 0.00 0.00 54.13 53.43 1qfv s LEU 136 Cb -0.09 -1.29 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 1qfv s LEU 136 CO 0.02 0.02 -0.24 0.26 -1.32 0.00 0.00 176.35 175.09 1qfv s TRP 137 N 1.07 2.14 0.16 5.38 0.52 0.12 -0.46 118.94 127.85 1qfv s TRP 137 Ca -0.03 -0.40 -0.13 0.00 0.02 0.00 0.00 56.10 55.57 1qfv s TRP 137 Cb -0.14 -1.33 0.01 0.00 -1.15 0.00 0.00 33.47 30.86 1qfv s TRP 137 CO -0.05 0.04 0.36 -0.08 0.02 0.00 0.00 176.95 177.24 1qfv s THR 138 N -0.68 0.06 -0.65 2.01 -1.32 -0.02 -0.59 115.64 114.45 1qfv s THR 138 Ca 0.10 -1.06 0.25 0.00 -1.21 0.00 0.00 61.69 59.77 1qfv s THR 138 Cb -0.09 -1.61 0.25 0.00 -1.51 0.00 0.00 72.50 69.54 1qfv s THR 138 CO 0.00 -0.28 1.66 0.71 -2.21 0.00 0.00 174.62 174.50 1qfv h THR 139 N 2.43 0.00 -3.48 5.08 1.35 -1.64 0.15 112.91 116.80 1qfv h THR 139 Ca -0.31 -0.59 -0.58 0.00 -0.55 0.00 0.00 66.41 64.38 1qfv h THR 139 Cb 1.24 1.51 -0.39 0.00 -1.73 0.00 0.00 68.15 68.78 1qfv h THR 139 CO 0.45 0.00 -0.77 -0.62 -0.25 0.00 0.00 175.52 174.33 1qfv s ASP 140 N -4.80 3.67 0.17 5.36 -1.08 -1.26 -4.82 116.67 113.91 1qfv s ASP 140 Ca 0.09 -1.20 0.18 0.00 -0.52 0.00 0.00 52.55 51.11 1qfv s ASP 140 Cb 0.11 -1.00 0.81 0.00 -1.46 0.00 0.00 42.92 41.37 1qfv s ASP 140 CO 0.63 -0.29 1.56 0.00 0.52 0.00 0.00 175.17 177.60 1qfv n TYR 141 N 4.77 0.49 -0.01 -5.34 0.18 -1.26 -2.80 117.16 113.18 1qfv n TYR 141 Ca -0.09 0.21 0.04 0.00 1.88 0.00 0.00 57.90 59.93 1qfv n TYR 141 Cb 0.44 -0.83 -0.13 0.00 -0.38 0.00 0.00 39.34 38.44 1qfv n TYR 141 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 1qfv n ASP 142 N -1.96 0.24 -3.92 9.48 8.00 -1.26 -4.77 116.55 122.36 1qfv n ASP 142 Ca 0.02 0.10 -0.30 0.00 0.71 0.00 0.00 54.79 55.31 1qfv n ASP 142 Cb 0.16 1.25 -0.15 0.00 -0.02 0.00 0.00 41.12 42.36 1qfv n ASP 142 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1qfv s ASN 143 N -5.09 4.44 -0.17 -2.24 0.01 -1.12 -5.10 114.94 105.67 1qfv s ASN 143 Ca -0.07 -2.22 -0.20 0.00 -0.71 0.00 0.00 52.86 49.66 1qfv s ASN 143 Cb 0.10 -1.41 -0.03 0.00 0.41 0.00 0.00 41.25 40.32 1qfv s ASN 143 CO 0.86 -0.35 0.58 -0.63 -1.51 0.00 0.00 177.10 176.04 1qfv s ILE 144 N 0.82 5.08 0.26 0.60 1.01 -1.26 -4.57 121.20 123.14 1qfv s ILE 144 Ca 0.12 1.11 -0.30 0.00 0.00 0.00 0.00 60.65 61.57 1qfv s ILE 144 Cb -0.20 -3.90 -0.11 0.00 0.01 0.00 0.00 42.46 38.25 1qfv s ILE 144 CO -0.10 0.18 1.60 -2.84 0.00 0.00 0.00 174.94 173.78 1qfv s PRO 145 N 1.51 4.15 0.26 2.79 0.02 -1.26 -4.91 135.00 137.55 1qfv s PRO 145 Ca 0.28 2.53 -0.03 0.00 0.02 0.00 0.00 61.00 63.80 1qfv s PRO 145 Cb -0.16 -3.05 0.33 0.00 0.02 0.00 0.00 34.50 31.64 1qfv s PRO 145 CO 0.11 -0.63 1.83 0.00 -0.33 0.00 0.00 177.00 177.98 1qfv h ALA 146 N 5.43 1.19 -0.12 -1.55 0.00 -1.98 -1.75 119.26 120.47 1qfv h ALA 146 Ca -0.46 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1qfv h ALA 146 Cb 1.21 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1qfv h ALA 146 CO 0.83 0.58 0.08 -2.95 0.00 0.00 0.00 179.25 177.80 1qfv h ASN 147 N 0.96 0.13 -0.36 0.00 -1.07 -1.99 0.12 115.58 113.37 1qfv h ASN 147 Ca 0.22 -0.00 -0.08 0.00 0.07 0.00 0.00 56.30 56.51 1qfv h ASN 147 Cb 0.21 -0.03 -0.01 0.00 -2.07 0.00 0.00 38.32 36.41 1qfv h ASN 147 CO -0.02 0.10 -0.10 0.00 0.07 0.00 0.00 177.43 177.48 1qfv h LEU 149 N 0.50 0.71 -0.52 0.00 5.85 -1.09 0.18 115.31 120.94 1qfv h LEU 149 Ca 0.09 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 1qfv h LEU 149 Cb 0.61 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1qfv h LEU 149 CO 0.04 0.49 0.07 0.78 -0.34 0.00 0.00 178.44 179.47 1qfv h ASN 150 N 0.85 0.84 -0.58 1.25 2.35 -0.64 -0.10 115.58 119.54 1qfv h ASN 150 Ca 0.29 -0.27 -0.05 0.00 -0.55 0.00 0.00 56.30 55.73 1qfv h ASN 150 Cb 0.05 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1qfv h ASN 150 CO -0.12 0.90 0.19 0.11 -1.65 0.00 0.00 177.43 176.85 1qfv h LYS 151 N 0.75 0.90 -0.09 0.81 1.79 -0.97 0.11 116.57 119.88 1qfv h LYS 151 Ca 0.16 -0.19 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1qfv h LYS 151 Cb 0.42 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.94 1qfv h LYS 151 CO 0.01 0.81 0.06 0.35 -1.08 0.00 0.00 179.45 179.59 1qfv h PHE 152 N 0.82 0.11 -0.36 -1.35 3.57 -0.38 -0.74 116.94 118.62 1qfv h PHE 152 Ca 0.19 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.64 1qfv h PHE 152 Cb 0.28 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 1qfv h PHE 152 CO 0.02 0.08 0.02 -0.91 -2.23 0.00 0.00 178.31 175.28 1qfv h ASN 153 N 0.11 0.51 0.01 0.41 2.35 -0.83 0.23 115.58 118.37 1qfv h ASN 153 Ca 0.03 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1qfv h ASN 153 Cb -0.00 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.24 1qfv h ASN 153 CO -0.01 0.57 -0.01 -0.08 -1.65 0.00 0.00 177.43 176.26 1qfv h GLU 154 N 0.53 -0.02 0.00 0.81 4.81 -0.42 -2.83 114.58 117.46 1qfv h GLU 154 Ca 0.11 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.21 1qfv h GLU 154 Cb 0.32 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 1qfv h GLU 154 CO 0.01 0.27 -0.65 1.88 -0.73 0.00 0.00 179.01 179.79 1qfv h TYR 155 N -0.30 0.00 -0.21 0.92 0.05 -0.92 -3.19 116.97 113.32 1qfv h TYR 155 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1qfv h TYR 155 Cb 0.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.03 1qfv h TYR 155 CO 0.02 0.65 0.00 0.00 -1.05 0.00 0.00 178.16 177.78 1qfv n ALA 156 N -2.33 2.50 -1.57 3.88 0.00 0.05 -4.98 120.51 118.06 1qfv n ALA 156 Ca 0.00 -0.51 -0.41 0.00 0.00 0.00 0.00 53.44 52.52 1qfv n ALA 156 Cb 0.71 -1.06 0.02 0.00 0.00 0.00 0.00 19.45 19.11 1qfv n ALA 156 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1qfv n VAL 157 N 0.30 2.42 -0.71 0.00 3.14 -1.07 -2.82 118.33 119.60 1qfv n VAL 157 Ca 0.14 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 61.02 1qfv n VAL 157 Cb 0.29 -1.01 0.00 0.00 -1.06 0.00 0.00 33.84 32.06 1qfv n VAL 157 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1qfv n GLY 158 N 1.34 0.78 2.70 7.55 0.00 -1.26 -5.04 105.19 111.26 1qfv n GLY 158 Ca 0.10 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 1qfv n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qfv n ARG 159 N -2.26 1.06 -3.67 1.61 1.74 -1.13 -5.11 116.66 108.90 1qfv n ARG 159 Ca 0.00 -2.69 -0.39 0.00 -0.77 0.00 0.00 57.85 54.00 1qfv n ARG 159 Cb 0.00 0.64 -0.12 0.00 -1.02 0.00 0.00 32.46 31.97 1qfv n ARG 159 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1qfv s GLU 160 N -3.41 3.08 0.20 5.56 0.41 -1.26 -5.08 118.70 118.19 1qfv s GLU 160 Ca 0.04 -0.89 -0.18 0.00 -0.41 0.00 0.00 54.97 53.53 1qfv s GLU 160 Cb -0.00 -3.56 -0.08 0.00 -1.78 0.00 0.00 34.13 28.71 1qfv s GLU 160 CO 0.03 -0.52 0.67 0.99 -0.49 0.00 0.00 175.26 175.93 1qfv s THR 161 N 1.55 4.66 0.06 3.63 2.01 -1.26 -4.39 115.64 121.90 1qfv s THR 161 Ca 0.03 1.13 -0.03 0.00 0.31 0.00 0.00 61.69 63.12 1qfv s THR 161 Cb -0.18 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 1qfv s THR 161 CO 0.05 0.21 0.04 0.00 -0.69 0.00 0.00 174.62 174.22 1qfv s ARG 162 N -2.00 0.68 0.33 4.92 1.70 -0.05 -5.00 118.95 119.53 1qfv s ARG 162 Ca 0.42 -1.14 -0.24 0.00 -0.47 0.00 0.00 55.73 54.30 1qfv s ARG 162 Cb -0.16 0.25 -0.10 0.00 -0.57 0.00 0.00 34.95 34.37 1qfv s ARG 162 CO 0.20 -0.16 0.91 -0.51 -1.08 0.00 0.00 175.30 174.67 1qfv s ASP 163 N -2.89 7.20 0.00 -2.89 1.01 -1.26 -1.60 116.67 116.23 1qfv s ASP 163 Ca 0.06 1.74 0.00 0.00 0.71 0.00 0.00 52.55 55.06 1qfv s ASP 163 Cb 0.07 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.45 1qfv s ASP 163 CO -0.10 -0.12 0.00 0.52 0.21 0.00 0.00 175.17 175.67 1qfv n VAL 164 N 0.28 0.00 -3.22 -1.27 0.31 -0.23 -4.86 118.33 109.35 1qfv n VAL 164 Ca 0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.95 1qfv n VAL 164 Cb 0.51 -0.58 -0.08 0.00 -0.91 0.00 0.00 33.84 32.79 1qfv n VAL 164 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1qfv s PHE 165 N -0.24 3.21 0.27 3.52 2.19 0.67 -1.04 117.98 126.56 1qfv s PHE 165 Ca 0.00 0.38 0.02 0.00 0.33 0.00 0.00 56.93 57.66 1qfv s PHE 165 Cb 0.00 -2.89 -0.04 0.00 -1.31 0.00 0.00 43.02 38.78 1qfv s PHE 165 CO 0.00 -0.46 0.13 0.95 1.83 0.00 0.00 175.22 177.67 1qfv s THR 166 N 2.42 0.41 0.61 0.12 -4.23 -1.26 -4.45 115.64 109.26 1qfv s THR 166 Ca 0.21 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 59.02 1qfv s THR 166 Cb -0.15 -2.57 0.36 0.00 1.34 0.00 0.00 72.50 71.48 1qfv s THR 166 CO 0.12 0.00 2.06 0.77 -0.54 0.00 0.00 174.62 177.03 1qfv h SER 167 N 2.32 0.00 0.18 3.99 4.64 -1.93 -0.22 113.55 122.53 1qfv h SER 167 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1qfv h SER 167 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1qfv h SER 167 CO 0.56 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.52 1qfv h ALA 168 N 1.66 1.00 0.00 5.18 0.00 -1.97 -1.65 119.26 123.47 1qfv h ALA 168 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1qfv h ALA 168 Cb 0.60 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1qfv h ALA 168 CO -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 179.25 179.20 1qfv s LEU 170 N -6.29 2.40 -0.59 0.00 1.43 -0.62 -5.08 118.68 109.93 1qfv s LEU 170 Ca 0.02 -0.82 -0.06 0.00 -1.03 0.00 0.00 54.13 52.24 1qfv s LEU 170 Cb 0.08 -0.89 0.15 0.00 0.03 0.00 0.00 46.19 45.57 1qfv s LEU 170 CO 0.59 0.01 0.43 -1.61 0.23 0.00 0.00 176.35 176.00 1qfv s GLU 171 N -2.57 2.62 0.32 1.70 0.41 -1.26 -4.98 118.70 114.94 1qfv s GLU 171 Ca 0.14 -2.23 -0.14 0.00 -0.41 0.00 0.00 54.97 52.34 1qfv s GLU 171 Cb -0.07 -3.86 -0.08 0.00 -1.78 0.00 0.00 34.13 28.33 1qfv s GLU 171 CO 0.06 -1.18 0.72 0.42 -0.49 0.00 0.00 175.26 174.79 1qfv s ILE 172 N 0.50 4.73 0.00 -1.63 -1.09 -1.26 -4.97 121.20 117.47 1qfv s ILE 172 Ca 0.13 0.84 0.00 0.00 -2.23 0.00 0.00 60.65 59.39 1qfv s ILE 172 Cb -0.21 -3.63 0.00 0.00 -1.58 0.00 0.00 42.46 37.05 1qfv s ILE 172 CO -0.04 -0.22 0.00 0.00 -1.23 0.00 0.00 174.94 173.46 1qfv n ALA 173 N -0.47 0.00 -3.63 9.38 0.00 -1.26 -5.06 120.51 119.48 1qfv n ALA 173 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.33 1qfv n ALA 173 Cb 0.53 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.91 1qfv n ALA 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qfv s ALA 174 N -1.59 -1.80 0.00 0.00 0.00 -1.26 -5.31 121.76 111.80 1qfv s ALA 174 Ca 0.00 2.01 0.00 0.00 0.00 0.00 0.00 51.96 53.97 1qfv s ALA 174 Cb 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.93 1qfv s ALA 174 CO 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 175.76 175.43