#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qfv s PRO 3 N 0.00 3.02 0.35 -1.09 0.02 -1.26 -4.90 135.00 131.13 1qfv s PRO 3 Ca 0.00 2.19 0.06 0.00 0.02 0.00 0.00 61.00 63.27 1qfv s PRO 3 Cb 0.00 -2.16 0.74 0.00 0.02 0.00 0.00 34.50 33.10 1qfv s PRO 3 CO 0.00 -1.27 1.90 -0.44 -0.33 0.00 0.00 177.00 176.86 1qfv h ASP 4 N 1.25 0.71 0.17 2.53 3.32 -2.04 -1.03 116.42 121.33 1qfv h ASP 4 Ca -0.51 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1qfv h ASP 4 Cb 1.31 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1qfv h ASP 4 CO 0.56 0.40 0.00 -2.67 -1.72 0.00 0.00 179.24 175.82 1qfv n TRP 5 N -4.53 0.00 -2.03 4.55 4.27 -1.26 -4.34 117.44 114.10 1qfv n TRP 5 Ca 0.15 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.34 1qfv n TRP 5 Cb 0.36 -0.11 0.00 0.00 -1.36 0.00 0.00 31.31 30.20 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 -1.11 5.43 -3.59 -1.67 0.00 -0.39 -4.74 120.51 114.44 1qfv n ALA 6 Ca 0.16 -4.09 -0.29 0.00 0.00 0.00 0.00 53.44 49.22 1qfv n ALA 6 Cb 0.13 -3.27 -0.14 0.00 0.00 0.00 0.00 19.45 16.16 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 2.11 3.57 0.16 0.00 -1.08 -1.26 -4.94 116.67 115.23 1qfv s ASP 7 Ca 0.44 -1.68 -0.14 0.00 -0.52 0.00 0.00 52.55 50.64 1qfv s ASP 7 Cb 0.12 -0.56 0.05 0.00 -1.46 0.00 0.00 42.92 41.07 1qfv s ASP 7 CO -0.04 -0.39 1.81 -0.08 0.52 0.00 0.00 175.17 176.98 1qfv h GLU 8 N 7.90 0.67 -0.71 4.34 4.81 -1.94 0.22 114.58 129.87 1qfv h GLU 8 Ca -0.11 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.10 1qfv h GLU 8 Cb 1.00 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 30.19 1qfv h GLU 8 CO 0.42 0.48 0.47 0.00 -0.73 0.00 0.00 179.01 179.65 1qfv h ALA 9 N 1.15 1.61 0.17 2.92 0.00 -1.99 0.20 119.26 123.33 1qfv h ALA 9 Ca 0.18 -0.03 -0.35 0.00 0.00 0.00 0.00 54.91 54.70 1qfv h ALA 9 Cb -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1qfv h ALA 9 CO -0.03 0.31 -1.82 0.00 0.00 0.00 0.00 179.25 177.71 1qfv h ALA 10 N 1.59 0.24 -0.00 0.00 0.00 -1.88 -3.42 119.26 115.79 1qfv h ALA 10 Ca 0.29 -1.22 0.00 0.00 0.00 0.00 0.00 54.91 53.98 1qfv h ALA 10 Cb 0.09 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1qfv h ALA 10 CO -0.08 1.11 -0.07 0.09 0.00 0.00 0.00 179.25 180.29 1qfv n ASN 11 N -3.58 0.90 -0.29 0.00 3.02 0.73 -4.77 115.26 111.28 1qfv n ASN 11 Ca -0.27 -0.95 0.24 0.00 -0.03 0.00 0.00 54.58 53.57 1qfv n ASN 11 Cb 1.06 0.39 0.56 0.00 -0.61 0.00 0.00 39.78 41.18 1qfv n ASN 11 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1qfv h GLY 12 N 0.89 0.86 2.00 7.41 0.00 -0.69 0.06 103.07 113.59 1qfv h GLY 12 Ca 0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1qfv h GLY 12 CO 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 176.54 176.45 1qfv h ALA 13 N 1.58 1.57 -0.66 3.60 0.00 -1.86 -0.23 119.26 123.27 1qfv h ALA 13 Ca 0.54 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1qfv h ALA 13 Cb 1.53 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1qfv h ALA 13 CO -0.20 0.02 0.00 0.72 0.00 0.00 0.00 179.25 179.79 1qfv n HIS 14 N -3.94 1.36 -2.51 0.00 -0.00 0.00 -4.41 115.22 105.72 1qfv n HIS 14 Ca -0.03 -0.57 -0.02 0.00 -0.00 0.00 0.00 57.72 57.11 1qfv n HIS 14 Cb 0.10 -0.19 0.05 0.00 -0.00 0.00 0.00 29.99 29.96 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 1.25 1.50 -2.71 -0.41 6.02 -0.10 0.16 117.38 123.09 1qfv n GLN 15 Ca 0.25 -3.16 -0.42 0.00 -0.01 0.00 0.00 57.00 53.67 1qfv n GLN 15 Cb 0.82 -1.25 -0.03 0.00 1.02 0.00 0.00 30.24 30.80 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 -3.20 6.34 0.18 1.08 -1.08 -1.23 -4.09 116.67 114.68 1qfv s ASP 16 Ca 0.34 -1.17 -0.09 0.00 -0.52 0.00 0.00 52.55 51.10 1qfv s ASP 16 Cb 0.36 -2.49 0.08 0.00 -1.46 0.00 0.00 42.92 39.41 1qfv s ASP 16 CO -0.07 -1.49 1.67 0.00 0.52 0.00 0.00 175.17 175.80 1qfv h ALA 17 N 9.61 0.86 -0.53 3.66 0.00 -1.50 -1.75 119.26 129.60 1qfv h ALA 17 Ca -0.07 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 1qfv h ALA 17 Cb 1.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1qfv h ALA 17 CO 1.26 0.63 0.15 2.35 0.00 0.00 0.00 179.25 183.63 1qfv h TRP 18 N 0.99 0.87 -0.52 0.00 -0.00 -1.90 0.12 115.95 115.51 1qfv h TRP 18 Ca 0.19 -0.10 0.01 0.00 -0.00 0.00 0.00 58.89 59.00 1qfv h TRP 18 Cb 0.46 -0.25 -0.03 0.00 -0.00 0.00 0.00 29.16 29.34 1qfv h TRP 18 CO 0.03 0.75 0.33 -0.22 -0.00 0.00 0.00 178.44 179.33 1qfv h LYS 19 N 0.73 0.64 -0.50 2.65 3.64 -1.90 -0.14 116.57 121.70 1qfv h LYS 19 Ca 0.17 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1qfv h LYS 19 Cb 0.31 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1qfv h LYS 19 CO -0.00 0.42 0.16 1.03 -2.27 0.00 0.00 179.45 178.79 1qfv h SER 20 N 0.66 0.72 -0.50 4.20 0.87 -0.93 -2.61 113.55 115.95 1qfv h SER 20 Ca 0.20 -0.20 -0.07 0.00 -1.23 0.00 0.00 61.79 60.48 1qfv h SER 20 Cb -0.03 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 1qfv h SER 20 CO -0.07 0.73 0.04 0.25 -0.53 0.00 0.00 176.83 177.25 1qfv h LEU 21 N 0.67 0.84 -2.17 2.23 5.85 -0.46 -2.72 115.31 119.54 1qfv h LEU 21 Ca 0.16 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1qfv h LEU 21 Cb 0.27 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 1qfv h LEU 21 CO -0.01 0.92 -0.07 0.50 -0.34 0.00 0.00 178.44 179.44 1qfv h LYS 22 N 0.73 0.00 0.00 1.25 3.64 -0.94 -1.10 116.57 120.14 1qfv h LYS 22 Ca 0.15 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1qfv h LYS 22 Cb 0.47 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1qfv h LYS 22 CO 0.02 0.07 0.00 0.00 -2.27 0.00 0.00 179.45 177.27 1qfv h ALA 23 N 1.93 1.00 0.00 5.00 0.00 -1.13 -2.43 119.26 123.64 1qfv h ALA 23 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1qfv h ALA 23 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1qfv h ALA 23 CO 0.01 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.01 1qfv n ASP 24 N -2.71 0.05 0.02 0.00 8.00 -0.42 -2.65 116.55 118.84 1qfv n ASP 24 Ca 0.00 0.51 -0.12 0.00 0.71 0.00 0.00 54.79 55.89 1qfv n ASP 24 Cb 0.21 -0.52 -0.09 0.00 -0.02 0.00 0.00 41.12 40.70 1qfv n ASP 24 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1qfv h VAL 25 N 0.00 1.16 0.00 2.53 2.07 -1.62 0.24 116.25 120.63 1qfv h VAL 25 Ca 0.00 -1.17 -0.21 0.00 0.82 0.00 0.00 66.70 66.14 1qfv h VAL 25 Cb 0.32 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1qfv h VAL 25 CO 0.00 0.27 -1.06 -0.33 0.02 0.00 0.00 177.57 176.47 1qfv h GLU 26 N -0.68 0.00 -4.49 1.57 5.08 -1.75 -3.44 114.58 110.87 1qfv h GLU 26 Ca -0.01 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.08 1qfv h GLU 26 Cb 0.54 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 29.57 1qfv h GLU 26 CO 0.02 0.89 -0.73 -0.80 -1.00 0.00 0.00 179.01 177.38 1qfv s ASN 27 N -6.60 0.78 0.11 1.42 0.01 -1.08 -5.13 114.94 104.46 1qfv s ASN 27 Ca 0.00 -0.50 -0.30 0.00 -0.71 0.00 0.00 52.86 51.35 1qfv s ASN 27 Cb 0.10 0.03 -0.06 0.00 0.41 0.00 0.00 41.25 41.73 1qfv s ASN 27 CO 0.81 -0.19 1.04 -0.69 -1.51 0.00 0.00 177.10 176.56 1qfv s VAL 28 N -1.27 4.30 -0.13 1.60 1.01 -1.26 -4.32 120.40 120.33 1qfv s VAL 28 Ca -0.09 1.85 -0.05 0.00 0.00 0.00 0.00 61.98 63.69 1qfv s VAL 28 Cb -0.09 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 1qfv s VAL 28 CO 0.00 0.26 0.04 -0.31 0.00 0.00 0.00 175.10 175.09 1qfv s TYR 29 N 0.19 3.23 -0.07 5.22 1.51 -0.77 -4.36 117.35 122.31 1qfv s TYR 29 Ca 0.50 0.13 0.01 0.00 -1.01 0.00 0.00 57.07 56.70 1qfv s TYR 29 Cb -0.26 -1.93 -0.03 0.00 -0.11 0.00 0.00 41.96 39.63 1qfv s TYR 29 CO 0.31 0.33 -0.07 0.71 -1.11 0.00 0.00 175.55 175.72 1qfv s TYR 30 N -0.31 2.92 -0.69 2.71 2.02 0.18 -0.64 117.35 123.54 1qfv s TYR 30 Ca 0.08 0.00 -0.22 0.00 -0.37 0.00 0.00 57.07 56.56 1qfv s TYR 30 Cb -0.12 -1.71 0.08 0.00 -0.40 0.00 0.00 41.96 39.80 1qfv s TYR 30 CO 0.02 0.31 0.99 1.41 -1.57 0.00 0.00 175.55 176.71 1qfv s MET 31 N -0.78 3.17 0.14 -0.62 -2.45 0.02 -0.81 119.30 117.97 1qfv s MET 31 Ca 0.12 -0.92 0.04 0.00 -1.25 0.00 0.00 55.69 53.67 1qfv s MET 31 Cb -0.11 -4.32 -0.09 0.00 1.25 0.00 0.00 34.83 31.56 1qfv s MET 31 CO 0.01 -1.82 1.32 -0.39 1.05 0.00 0.00 175.02 175.19 1qfv h VAL 32 N 5.98 1.57 -4.07 10.11 -1.51 -0.96 0.17 116.25 127.53 1qfv h VAL 32 Ca -0.24 -2.94 -0.11 0.00 -1.23 0.00 0.00 66.70 62.18 1qfv h VAL 32 Cb 1.06 2.65 -0.14 0.00 -2.13 0.00 0.00 31.29 32.74 1qfv h VAL 32 CO 1.18 0.85 -0.52 -0.54 -1.23 0.00 0.00 177.57 177.31 1qfv s LYS 33 N -2.97 0.80 0.24 5.19 1.02 -1.15 -0.66 119.74 122.20 1qfv s LYS 33 Ca -0.02 -1.15 -0.20 0.00 0.02 0.00 0.00 55.97 54.63 1qfv s LYS 33 Cb 0.10 0.28 0.03 0.00 -0.52 0.00 0.00 37.83 37.72 1qfv s LYS 33 CO 0.83 -0.22 0.63 0.00 -0.92 0.00 0.00 175.35 175.67 1qfv s ALA 34 N -3.92 -1.16 -0.55 5.17 0.00 -0.85 -0.75 121.76 119.70 1qfv s ALA 34 Ca 0.10 -0.18 0.12 0.00 0.00 0.00 0.00 51.96 52.00 1qfv s ALA 34 Cb 0.06 0.88 0.36 0.00 0.00 0.00 0.00 23.12 24.42 1qfv s ALA 34 CO -0.08 -0.92 1.29 0.25 0.00 0.00 0.00 175.76 176.30 1qfv n THR 35 N -0.41 1.49 -4.03 0.00 -2.24 -0.41 -1.06 114.28 107.62 1qfv n THR 35 Ca -0.08 -1.37 -0.08 0.00 -2.27 0.00 0.00 64.05 60.26 1qfv n THR 35 Cb 0.61 0.20 -0.10 0.00 -2.10 0.00 0.00 70.33 68.95 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 -1.72 0.40 -0.03 4.78 1.13 -1.26 -4.48 117.35 116.16 1qfv s TYR 36 Ca 0.28 -0.86 0.20 0.00 -1.41 0.00 0.00 57.07 55.28 1qfv s TYR 36 Cb 0.19 -0.29 -0.31 0.00 -1.10 0.00 0.00 41.96 40.45 1qfv s TYR 36 CO 0.11 -0.36 0.43 1.63 -2.51 0.00 0.00 175.55 174.85 1qfv n LYS 37 N 0.43 0.60 -4.55 -3.49 5.02 -1.26 -4.98 118.16 109.93 1qfv n LYS 37 Ca -0.16 -0.18 -0.26 0.00 -2.02 0.00 0.00 58.31 55.69 1qfv n LYS 37 Cb 0.60 -1.47 -0.14 0.00 -0.02 0.00 0.00 35.03 34.00 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 -4.29 2.60 0.00 4.39 0.01 -1.26 -0.00 114.94 116.39 1qfv s ASN 38 Ca -0.07 -0.59 0.01 0.00 -0.71 0.00 0.00 52.86 51.50 1qfv s ASN 38 Cb 0.13 -0.19 -0.00 0.00 0.41 0.00 0.00 41.25 41.59 1qfv s ASN 38 CO 0.82 0.14 -0.03 -0.62 -1.51 0.00 0.00 177.10 175.90 1qfv s ASP 39 N -1.45 0.39 0.34 -1.22 2.15 -0.60 -4.58 116.67 111.70 1qfv s ASP 39 Ca 0.08 -0.10 0.06 0.00 0.43 0.00 0.00 52.55 53.02 1qfv s ASP 39 Cb -0.09 -0.03 0.73 0.00 -0.30 0.00 0.00 42.92 43.22 1qfv s ASP 39 CO 0.03 0.01 1.90 -0.65 -0.17 0.00 0.00 175.17 176.29 1qfv h PRO 40 N 5.92 0.77 0.03 4.34 0.11 -1.87 0.16 132.00 141.46 1qfv h PRO 40 Ca -0.27 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 65.63 1qfv h PRO 40 Cb 1.20 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1qfv h PRO 40 CO 0.50 0.51 -0.86 0.28 -0.21 0.00 0.00 178.00 178.21 1qfv h VAL 41 N 0.79 1.25 0.00 3.15 2.07 -2.00 -3.37 116.25 118.14 1qfv h VAL 41 Ca 0.40 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.63 1qfv h VAL 41 Cb 0.47 2.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.97 1qfv h VAL 41 CO -0.16 0.50 0.00 -0.50 0.02 0.00 0.00 177.57 177.43 1qfv h TRP 42 N -0.84 0.00 0.00 1.57 6.55 -1.97 -3.50 115.95 117.76 1qfv h TRP 42 Ca -0.22 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.62 1qfv h TRP 42 Cb 1.31 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.61 1qfv h TRP 42 CO 0.17 0.00 0.00 0.41 -1.05 0.00 0.00 178.44 177.97 1qfv n GLY 43 N 1.16 -2.09 3.78 1.49 0.00 0.57 -4.60 105.19 105.50 1qfv n GLY 43 Ca 0.05 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 43.92 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 -3.58 7.36 -1.42 1.61 0.02 -1.26 -1.56 114.94 116.10 1qfv s ASN 44 Ca 0.00 1.68 -0.09 0.00 -1.02 0.00 0.00 52.86 53.42 1qfv s ASN 44 Cb 0.00 -2.51 0.04 0.00 0.02 0.00 0.00 41.25 38.80 1qfv s ASN 44 CO 0.00 0.12 1.01 0.47 0.02 0.00 0.00 177.10 178.72 1qfv n ASP 45 N 1.23 -4.59 -4.78 -1.22 8.00 1.00 -4.47 116.55 111.73 1qfv n ASP 45 Ca -0.03 -0.70 -0.34 0.00 0.71 0.00 0.00 54.79 54.43 1qfv n ASP 45 Cb 0.49 -4.37 0.01 0.00 -0.02 0.00 0.00 41.12 37.23 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 -3.36 2.69 0.23 1.24 -0.12 -1.04 -4.75 117.98 112.86 1qfv s PHE 46 Ca 0.50 1.55 -0.06 0.00 -0.05 0.00 0.00 56.93 58.87 1qfv s PHE 46 Cb -0.24 -3.23 -0.02 0.00 -0.63 0.00 0.00 43.02 38.89 1qfv s PHE 46 CO 0.79 -1.54 0.28 0.95 -0.05 0.00 0.00 175.22 175.65 1qfv s THR 47 N -1.96 0.00 -1.43 -4.49 -4.23 -0.46 -4.88 115.64 98.19 1qfv s THR 47 Ca 0.71 -1.75 -0.10 0.00 -1.18 0.00 0.00 61.69 59.36 1qfv s THR 47 Cb -0.22 -2.39 0.05 0.00 1.34 0.00 0.00 72.50 71.28 1qfv s THR 47 CO 0.31 0.00 1.03 0.00 -0.54 0.00 0.00 174.62 175.42 1qfv s VAL 49 N -3.35 4.76 0.05 0.00 1.01 -1.26 -3.89 120.40 117.72 1qfv s VAL 49 Ca 0.54 1.86 -0.04 0.00 0.00 0.00 0.00 61.98 64.34 1qfv s VAL 49 Cb -0.26 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 31.88 1qfv s VAL 49 CO 0.79 0.27 0.06 -0.83 0.00 0.00 0.00 175.10 175.38 1qfv s GLY 50 N 0.42 0.28 0.01 4.51 0.00 -0.54 -0.80 107.32 111.21 1qfv s GLY 50 Ca 0.45 -0.84 -0.01 0.00 0.00 0.00 0.00 44.72 44.32 1qfv s GLY 50 CO 0.26 -0.97 -0.00 0.54 0.00 0.00 0.00 173.10 172.93 1qfv s VAL 51 N -3.33 0.07 -0.06 1.40 0.11 0.19 -1.36 120.40 117.42 1qfv s VAL 51 Ca 0.01 -0.54 -0.10 0.00 -2.93 0.00 0.00 61.98 58.42 1qfv s VAL 51 Cb 0.03 -0.18 0.02 0.00 -1.53 0.00 0.00 36.38 34.72 1qfv s VAL 51 CO -0.08 -0.30 0.24 0.00 -3.33 0.00 0.00 175.10 171.63 1qfv s MET 52 N -0.89 0.41 0.24 1.54 0.23 -0.50 -1.84 119.30 118.49 1qfv s MET 52 Ca -0.10 0.08 -0.29 0.00 -1.03 0.00 0.00 55.69 54.35 1qfv s MET 52 Cb -0.06 0.19 -0.09 0.00 -1.53 0.00 0.00 34.83 33.34 1qfv s MET 52 CO -0.00 -0.08 0.91 0.00 -2.03 0.00 0.00 175.02 173.82 1qfv s ALA 53 N -0.48 3.35 -0.11 3.16 0.00 0.07 -0.84 121.76 126.91 1qfv s ALA 53 Ca -0.06 0.57 -0.08 0.00 0.00 0.00 0.00 51.96 52.39 1qfv s ALA 53 Cb -0.04 -3.17 -0.27 0.00 0.00 0.00 0.00 23.12 19.65 1qfv s ALA 53 CO 0.01 0.22 0.43 -0.91 0.00 0.00 0.00 175.76 175.51 1qfv h ASN 54 N 4.09 0.45 -5.26 0.00 2.35 -0.22 -3.45 115.58 113.54 1qfv h ASN 54 Ca -0.45 -0.95 -0.08 0.00 -0.55 0.00 0.00 56.30 54.27 1qfv h ASN 54 Cb 1.20 -0.15 -0.10 0.00 0.05 0.00 0.00 38.32 39.32 1qfv h ASN 54 CO 0.67 1.84 -0.19 1.51 -1.65 0.00 0.00 177.43 179.61 1qfv s ASP 55 N -7.10 -0.06 -0.01 5.81 1.47 -1.16 -4.98 116.67 110.64 1qfv s ASP 55 Ca -0.21 -0.92 0.01 0.00 1.18 0.00 0.00 52.55 52.61 1qfv s ASP 55 Cb 0.06 0.54 0.00 0.00 -0.34 0.00 0.00 42.92 43.18 1qfv s ASP 55 CO 0.78 -1.06 -0.03 0.54 0.68 0.00 0.00 175.17 176.08 1qfv s VAL 56 N -4.01 0.29 -0.43 2.11 0.11 -1.26 -2.31 120.40 114.90 1qfv s VAL 56 Ca 0.22 -0.13 0.03 0.00 -2.93 0.00 0.00 61.98 59.17 1qfv s VAL 56 Cb 0.01 -0.26 0.12 0.00 -1.53 0.00 0.00 36.38 34.71 1qfv s VAL 56 CO 0.06 0.09 0.16 0.21 -3.33 0.00 0.00 175.10 172.30 1qfv s ASN 57 N 0.06 4.40 0.17 3.54 3.84 0.29 -5.00 114.94 122.23 1qfv s ASN 57 Ca -0.00 -2.54 -0.15 0.00 0.21 0.00 0.00 52.86 50.39 1qfv s ASN 57 Cb -0.03 -1.51 0.12 0.00 -0.55 0.00 0.00 41.25 39.28 1qfv s ASN 57 CO -0.00 -0.31 1.74 -0.08 -2.79 0.00 0.00 177.10 175.66 1qfv h GLU 58 N 7.08 0.28 -0.87 0.43 4.57 -1.97 -0.16 114.58 123.93 1qfv h GLU 58 Ca -0.06 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1qfv h GLU 58 Cb 0.95 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.44 1qfv h GLU 58 CO 0.58 0.19 0.57 -0.44 -1.18 0.00 0.00 179.01 178.73 1qfv h ASP 59 N 0.29 1.01 0.43 1.04 3.32 -1.95 -2.36 116.42 118.20 1qfv h ASP 59 Ca 0.20 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1qfv h ASP 59 Cb 0.21 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1qfv h ASP 59 CO -0.22 0.74 -0.31 -0.62 -1.72 0.00 0.00 179.24 177.11 1qfv n GLU 60 N -4.39 0.40 -3.71 3.56 -0.58 -1.07 -4.95 120.64 109.90 1qfv n GLU 60 Ca 0.10 -0.21 -0.22 0.00 -0.42 0.00 0.00 57.16 56.41 1qfv n GLU 60 Cb 0.03 -1.50 0.04 0.00 -0.57 0.00 0.00 31.44 29.44 1qfv n GLU 60 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1qfv n LYS 61 N -1.12 -5.28 -4.22 3.49 5.02 -0.13 -4.62 118.16 111.30 1qfv n LYS 61 Ca 0.09 0.64 -0.13 0.00 -2.02 0.00 0.00 58.31 56.90 1qfv n LYS 61 Cb 0.33 -5.31 -0.10 0.00 -0.02 0.00 0.00 35.03 29.93 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 -4.16 0.90 0.05 4.39 1.04 -0.85 -0.48 113.70 114.60 1qfv s SER 62 Ca 0.13 -1.21 -0.03 0.00 0.48 0.00 0.00 55.95 55.32 1qfv s SER 62 Cb -0.06 0.18 -0.03 0.00 0.10 0.00 0.00 66.02 66.21 1qfv s SER 62 CO 0.80 -0.64 0.02 0.27 0.98 0.00 0.00 173.24 174.67 1qfv s ILE 63 N -3.80 0.18 -0.28 -1.02 -4.36 -0.18 -0.55 121.20 111.20 1qfv s ILE 63 Ca 0.26 -1.49 -0.11 0.00 -0.26 0.00 0.00 60.65 59.05 1qfv s ILE 63 Cb 0.07 -1.23 -0.05 0.00 1.25 0.00 0.00 42.46 42.50 1qfv s ILE 63 CO 0.04 -0.82 0.19 -1.10 0.24 0.00 0.00 174.94 173.49 1qfv s GLN 64 N -3.37 3.96 0.08 0.37 -1.52 -0.98 -1.07 119.66 117.13 1qfv s GLN 64 Ca 0.02 -0.31 0.07 0.00 -1.95 0.00 0.00 55.36 53.18 1qfv s GLN 64 Cb 0.04 -3.65 -0.04 0.00 -0.22 0.00 0.00 33.01 29.14 1qfv s GLN 64 CO -0.08 -0.16 -0.11 0.00 -0.25 0.00 0.00 175.29 174.68 1qfv s ALA 65 N 1.71 2.89 -0.18 6.09 0.00 0.48 0.56 121.76 133.31 1qfv s ALA 65 Ca 0.07 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 50.79 1qfv s ALA 65 Cb -0.16 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 22.04 1qfv s ALA 65 CO 0.11 0.62 -0.03 -2.00 0.00 0.00 0.00 175.76 174.46 1qfv s GLU 66 N -1.95 3.60 -0.09 0.00 2.12 -0.02 -1.16 118.70 121.20 1qfv s GLU 66 Ca 0.19 -0.54 0.00 0.00 0.36 0.00 0.00 54.97 54.99 1qfv s GLU 66 Cb -0.11 -2.97 -0.03 0.00 0.26 0.00 0.00 34.13 31.28 1qfv s GLU 66 CO 0.11 0.10 -0.09 -0.06 -0.54 0.00 0.00 175.26 174.78 1qfv s PHE 67 N 0.73 2.88 -0.01 5.30 0.40 0.78 -1.40 117.98 126.66 1qfv s PHE 67 Ca -0.01 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 1qfv s PHE 67 Cb -0.14 -1.77 -0.03 0.00 0.51 0.00 0.00 43.02 41.59 1qfv s PHE 67 CO 0.02 0.12 -0.04 -0.51 0.70 0.00 0.00 175.22 175.51 1qfv s LEU 68 N -0.34 3.29 0.23 -0.37 1.02 -0.47 -0.45 118.68 121.60 1qfv s LEU 68 Ca 0.04 -0.08 -0.22 0.00 0.02 0.00 0.00 54.13 53.89 1qfv s LEU 68 Cb -0.13 -1.86 0.04 0.00 0.02 0.00 0.00 46.19 44.26 1qfv s LEU 68 CO 0.02 0.29 0.76 0.72 0.02 0.00 0.00 176.35 178.17 1qfv s PHE 69 N -1.00 -0.22 0.04 0.29 -0.71 -0.37 -1.46 117.98 114.54 1qfv s PHE 69 Ca 0.17 -0.17 0.01 0.00 -1.04 0.00 0.00 56.93 55.90 1qfv s PHE 69 Cb -0.11 0.67 -0.03 0.00 -1.21 0.00 0.00 43.02 42.35 1qfv s PHE 69 CO 0.08 -1.09 -0.06 -1.64 -1.34 0.00 0.00 175.22 171.16 1qfv s MET 70 N -3.75 0.50 0.26 1.99 -1.94 -0.25 -0.23 119.30 115.88 1qfv s MET 70 Ca 0.10 -0.80 -0.05 0.00 -1.71 0.00 0.00 55.69 53.23 1qfv s MET 70 Cb -0.04 -0.15 0.02 0.00 2.01 0.00 0.00 34.83 36.67 1qfv s MET 70 CO 0.03 0.01 0.43 0.27 -0.01 0.00 0.00 175.02 175.75 1qfv n ASN 71 N 1.28 -1.22 0.00 3.03 0.23 -1.26 -1.35 115.26 115.96 1qfv n ASN 71 Ca -0.22 -2.25 0.09 0.00 -0.53 0.00 0.00 54.58 51.68 1qfv n ASN 71 Cb 0.56 2.15 0.49 0.00 -2.08 0.00 0.00 39.78 40.90 1qfv n ASN 71 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1qfv n ASN 72 N -1.61 0.00 0.24 0.53 5.03 -1.26 -3.27 115.26 114.92 1qfv n ASN 72 Ca -0.02 -0.04 0.16 0.00 0.87 0.00 0.00 54.58 55.55 1qfv n ASN 72 Cb 0.41 -0.26 0.69 0.00 -1.02 0.00 0.00 39.78 39.61 1qfv n ASN 72 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1qfv h ALA 73 N 2.93 1.00 -2.09 5.41 0.00 -1.96 -3.45 119.26 121.10 1qfv h ALA 73 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1qfv h ALA 73 Cb 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 17.78 1qfv h ALA 73 CO 0.00 0.00 0.47 0.34 0.00 0.00 0.00 179.25 180.06 1qfv s ASP 74 N -5.14 -0.40 0.00 0.00 2.15 -1.20 -5.02 116.67 107.05 1qfv s ASP 74 Ca 0.01 0.18 0.28 0.00 0.43 0.00 0.00 52.55 53.44 1qfv s ASP 74 Cb 0.09 0.39 1.00 0.00 -0.30 0.00 0.00 42.92 44.10 1qfv s ASP 74 CO 0.47 -0.56 1.72 0.35 -0.17 0.00 0.00 175.17 176.98 1qfv n THR 75 N 0.12 0.00 -3.69 1.71 -2.24 -1.26 -4.53 114.28 104.39 1qfv n THR 75 Ca -0.11 -0.09 -0.23 0.00 -2.27 0.00 0.00 64.05 61.35 1qfv n THR 75 Cb 0.60 0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.95 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 -2.50 6.32 0.35 3.42 0.01 -1.26 -5.08 114.94 116.21 1qfv s ASN 76 Ca 0.26 0.29 -0.28 0.00 -0.71 0.00 0.00 52.86 52.42 1qfv s ASN 76 Cb 0.20 -1.96 -0.09 0.00 0.41 0.00 0.00 41.25 39.80 1qfv s ASN 76 CO 0.50 -0.15 1.24 -0.04 -1.51 0.00 0.00 177.10 177.13 1qfv s MET 77 N -3.96 4.28 0.40 -0.60 -1.94 -1.26 -4.83 119.30 111.39 1qfv s MET 77 Ca 0.37 2.04 0.08 0.00 -1.71 0.00 0.00 55.69 56.47 1qfv s MET 77 Cb -0.10 -2.95 -0.05 0.00 2.01 0.00 0.00 34.83 33.75 1qfv s MET 77 CO 0.32 -0.19 0.20 -0.65 -0.01 0.00 0.00 175.02 174.68 1qfv s GLN 78 N -1.92 2.27 0.08 2.03 -0.21 0.68 -4.95 119.66 117.65 1qfv s GLN 78 Ca 0.51 -1.77 -0.09 0.00 0.02 0.00 0.00 55.36 54.03 1qfv s GLN 78 Cb -0.36 -2.05 -0.00 0.00 1.00 0.00 0.00 33.01 31.60 1qfv s GLN 78 CO 0.47 -0.09 0.19 -0.59 -2.12 0.00 0.00 175.29 173.14 1qfv s PHE 79 N -2.56 0.13 0.01 0.91 -0.71 -1.26 -1.24 117.98 113.26 1qfv s PHE 79 Ca 0.41 -0.53 -0.03 0.00 -1.04 0.00 0.00 56.93 55.74 1qfv s PHE 79 Cb 0.02 -0.05 -0.01 0.00 -1.21 0.00 0.00 43.02 41.77 1qfv s PHE 79 CO 0.23 -0.52 0.05 0.00 -1.34 0.00 0.00 175.22 173.63 1qfv s ALA 80 N -3.64 -0.08 -0.14 1.99 0.00 0.41 -4.97 121.76 115.32 1qfv s ALA 80 Ca 0.03 -0.35 0.01 0.00 0.00 0.00 0.00 51.96 51.65 1qfv s ALA 80 Cb 0.04 0.12 -0.00 0.00 0.00 0.00 0.00 23.12 23.27 1qfv s ALA 80 CO -0.10 -0.17 -0.16 0.99 0.00 0.00 0.00 175.76 176.32 1qfv s THR 81 N -1.34 2.68 0.04 0.00 2.01 -1.26 -0.15 115.64 117.62 1qfv s THR 81 Ca -0.15 -0.78 -0.04 0.00 0.31 0.00 0.00 61.69 61.04 1qfv s THR 81 Cb -0.08 -2.12 -0.02 0.00 0.01 0.00 0.00 72.50 70.29 1qfv s THR 81 CO 0.00 0.52 0.06 -1.61 -0.69 0.00 0.00 174.62 172.91 1qfv s GLU 82 N 0.63 0.56 0.10 4.92 2.02 -0.31 -4.21 118.70 122.40 1qfv s GLU 82 Ca -0.09 -0.81 -0.17 0.00 0.02 0.00 0.00 54.97 53.92 1qfv s GLU 82 Cb -0.16 0.21 -0.07 0.00 0.10 0.00 0.00 34.13 34.22 1qfv s GLU 82 CO 0.03 -0.13 0.56 0.21 0.02 0.00 0.00 175.26 175.94 1qfv s LYS 83 N -2.68 4.10 -0.08 1.61 2.20 -0.58 -0.39 119.74 123.92 1qfv s LYS 83 Ca -0.04 0.63 0.02 0.00 -0.36 0.00 0.00 55.97 56.21 1qfv s LYS 83 Cb -0.01 -3.11 0.02 0.00 -1.51 0.00 0.00 37.83 33.22 1qfv s LYS 83 CO -0.05 0.57 -0.12 0.08 -0.36 0.00 0.00 175.35 175.47 1qfv s VAL 84 N -1.26 1.19 -0.04 4.02 1.01 -0.23 -0.49 120.40 124.61 1qfv s VAL 84 Ca 0.32 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1qfv s VAL 84 Cb -0.18 -1.11 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 1qfv s VAL 84 CO 0.19 0.38 -0.21 -0.89 0.00 0.00 0.00 175.10 174.56 1qfv s THR 85 N 0.90 1.70 -0.04 3.92 2.01 0.17 -1.01 115.64 123.28 1qfv s THR 85 Ca -0.10 -0.89 -0.30 0.00 0.31 0.00 0.00 61.69 60.72 1qfv s THR 85 Cb -0.15 -1.43 -0.03 0.00 0.01 0.00 0.00 72.50 70.89 1qfv s THR 85 CO 0.01 0.48 1.16 0.00 -0.69 0.00 0.00 174.62 175.58 1qfv s ALA 86 N -0.21 3.45 0.28 7.40 0.00 0.37 -0.50 121.76 132.53 1qfv s ALA 86 Ca 0.01 0.61 0.02 0.00 0.00 0.00 0.00 51.96 52.59 1qfv s ALA 86 Cb -0.11 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 1qfv s ALA 86 CO 0.02 -0.66 0.12 0.14 0.00 0.00 0.00 175.76 175.37 1qfv s VAL 87 N 1.96 0.49 -0.11 0.00 -7.23 -0.20 -4.92 120.40 110.39 1qfv s VAL 87 Ca 0.55 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.63 1qfv s VAL 87 Cb -0.24 -2.59 -0.04 0.00 0.56 0.00 0.00 36.38 34.06 1qfv s VAL 87 CO 0.23 0.00 0.20 -0.54 -0.31 0.00 0.00 175.10 174.68 1qfv s LYS 88 N -3.96 3.64 0.09 4.82 1.02 -1.26 -1.29 119.74 122.79 1qfv s LYS 88 Ca 0.37 -0.02 0.02 0.00 0.02 0.00 0.00 55.97 56.35 1qfv s LYS 88 Cb 0.07 -3.23 -0.04 0.00 -0.52 0.00 0.00 37.83 34.11 1qfv s LYS 88 CO 0.15 0.70 -0.07 -1.64 -0.92 0.00 0.00 175.35 173.57 1qfv s MET 89 N -0.85 0.79 -1.53 1.68 -1.94 -1.26 -4.86 119.30 111.33 1qfv s MET 89 Ca 0.16 -1.24 -0.02 0.00 -1.71 0.00 0.00 55.69 52.87 1qfv s MET 89 Cb -0.13 -0.22 0.01 0.00 2.01 0.00 0.00 34.83 36.50 1qfv s MET 89 CO 0.05 -0.01 0.23 0.66 -0.01 0.00 0.00 175.02 175.94 1qfv n TYR 90 N 0.19 -1.45 -1.10 -0.03 4.01 -1.26 -2.26 117.16 115.26 1qfv n TYR 90 Ca -0.14 0.20 -0.03 0.00 -0.16 0.00 0.00 57.90 57.77 1qfv n TYR 90 Cb 0.60 -3.79 -0.01 0.00 -0.31 0.00 0.00 39.34 35.82 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 -1.14 0.58 3.74 2.72 0.00 -1.26 -4.99 105.19 104.83 1qfv n GLY 91 Ca -0.17 -0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.86 2.19 0.05 1.61 1.51 -0.96 -4.95 117.35 114.93 1qfv s TYR 92 Ca 0.00 1.49 -0.07 0.00 -1.01 0.00 0.00 57.07 57.49 1qfv s TYR 92 Cb 0.00 -3.62 -0.30 0.00 -0.11 0.00 0.00 41.96 37.93 1qfv s TYR 92 CO 0.00 -2.68 1.03 -0.97 -1.11 0.00 0.00 175.55 171.82 1qfv h ASN 93 N 0.67 0.51 -3.82 2.29 -1.24 -1.94 -3.45 115.58 108.60 1qfv h ASN 93 Ca -0.51 -0.58 -0.68 0.00 0.71 0.00 0.00 56.30 55.24 1qfv h ASN 93 Cb 1.32 -0.17 -0.29 0.00 0.73 0.00 0.00 38.32 39.92 1qfv h ASN 93 CO 0.54 1.46 -0.84 -0.60 -1.29 0.00 0.00 177.43 176.70 1qfv s ARG 94 N -2.63 2.76 -0.22 6.67 3.52 -1.26 -5.07 118.95 122.71 1qfv s ARG 94 Ca -0.06 -0.81 -0.42 0.00 -0.13 0.00 0.00 55.73 54.30 1qfv s ARG 94 Cb 0.06 -2.32 -0.18 0.00 -1.56 0.00 0.00 34.95 30.95 1qfv s ARG 94 CO 0.89 0.38 1.46 0.39 -0.81 0.00 0.00 175.30 177.61 1qfv n GLU 95 N 2.99 0.46 0.00 5.12 4.71 -1.26 -4.87 120.64 127.79 1qfv n GLU 95 Ca -0.18 0.17 0.00 0.00 -0.01 0.00 0.00 57.16 57.14 1qfv n GLU 95 Cb 0.52 -1.74 0.00 0.00 -1.01 0.00 0.00 31.44 29.22 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 3.45 0.99 -4.21 1.62 6.94 -0.81 -1.35 115.26 121.90 1qfv n ASN 96 Ca 0.25 -1.49 -0.12 0.00 -0.02 0.00 0.00 54.58 53.20 1qfv n ASN 96 Cb 0.06 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.38 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 -0.49 1.17 -0.18 -2.53 0.00 -0.41 -0.34 121.76 118.99 1qfv s ALA 97 Ca 0.00 -1.47 -0.01 0.00 0.00 0.00 0.00 51.96 50.48 1qfv s ALA 97 Cb 0.00 0.33 -0.00 0.00 0.00 0.00 0.00 23.12 23.45 1qfv s ALA 97 CO 0.00 -0.26 -0.12 -0.06 0.00 0.00 0.00 175.76 175.32 1qfv s PHE 98 N -3.62 2.85 -0.35 0.00 0.08 0.66 -1.04 117.98 116.56 1qfv s PHE 98 Ca 0.18 -1.02 -0.09 0.00 0.12 0.00 0.00 56.93 56.12 1qfv s PHE 98 Cb 0.05 -1.96 0.02 0.00 -0.57 0.00 0.00 43.02 40.57 1qfv s PHE 98 CO -0.00 -0.49 0.15 0.50 -0.10 0.00 0.00 175.22 175.28 1qfv s ARG 99 N 1.01 2.87 -0.03 0.44 3.52 0.34 -1.10 118.95 126.01 1qfv s ARG 99 Ca -0.01 -1.03 -0.14 0.00 -0.13 0.00 0.00 55.73 54.42 1qfv s ARG 99 Cb -0.15 -3.59 -0.05 0.00 -1.56 0.00 0.00 34.95 29.60 1qfv s ARG 99 CO -0.02 -0.62 0.37 0.71 -0.81 0.00 0.00 175.30 174.93 1qfv s TYR 100 N 1.51 3.69 -0.10 5.12 1.51 0.11 -0.66 117.35 128.54 1qfv s TYR 100 Ca 0.01 0.92 -0.01 0.00 -1.01 0.00 0.00 57.07 56.98 1qfv s TYR 100 Cb -0.19 -2.26 0.03 0.00 -0.11 0.00 0.00 41.96 39.44 1qfv s TYR 100 CO 0.05 0.62 -0.01 -2.00 -1.11 0.00 0.00 175.55 173.10 1qfv s GLU 101 N -0.94 0.78 0.73 -0.62 2.12 0.36 -1.25 118.70 119.88 1qfv s GLU 101 Ca 0.22 -0.06 -0.12 0.00 0.36 0.00 0.00 54.97 55.38 1qfv s GLU 101 Cb -0.16 -1.30 0.03 0.00 0.26 0.00 0.00 34.13 32.96 1qfv s GLU 101 CO 0.12 -0.36 1.11 0.95 -0.54 0.00 0.00 175.26 176.54 1qfv s THR 102 N 1.90 3.21 0.43 -1.70 -4.23 0.12 -1.53 115.64 113.85 1qfv s THR 102 Ca 0.04 0.39 0.16 0.00 -1.18 0.00 0.00 61.69 61.10 1qfv s THR 102 Cb -0.13 -3.39 0.18 0.00 1.34 0.00 0.00 72.50 70.50 1qfv s THR 102 CO -0.06 -0.51 1.97 -0.33 -0.54 0.00 0.00 174.62 175.15 1qfv h GLU 103 N -0.73 0.00 -0.54 3.99 5.08 -1.90 -2.05 114.58 118.43 1qfv h GLU 103 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1qfv h GLU 103 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1qfv h GLU 103 CO 0.64 0.21 0.00 -0.40 -1.00 0.00 0.00 179.01 178.46 1qfv n ASP 104 N -4.19 2.49 0.00 1.42 5.68 -1.26 -4.91 116.55 115.77 1qfv n ASP 104 Ca -0.02 -2.18 0.00 0.00 -0.50 0.00 0.00 54.79 52.09 1qfv n ASP 104 Cb 0.27 -0.38 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 1qfv n ASP 104 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qfv n GLY 105 N 0.77 0.70 3.78 6.12 0.00 -0.77 -5.06 105.19 110.73 1qfv n GLY 105 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1qfv n GLY 105 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qfv s GLN 106 N -0.66 4.39 -0.04 1.61 -0.21 -1.26 -4.81 119.66 118.68 1qfv s GLN 106 Ca 0.00 1.43 0.05 0.00 0.02 0.00 0.00 55.36 56.86 1qfv s GLN 106 Cb 0.00 -2.68 -0.01 0.00 1.00 0.00 0.00 33.01 31.33 1qfv s GLN 106 CO 0.00 0.08 -0.19 0.08 -2.12 0.00 0.00 175.29 173.14 1qfv s VAL 107 N -1.64 1.56 -0.06 1.09 1.01 -1.26 -0.70 120.40 120.41 1qfv s VAL 107 Ca 0.54 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1qfv s VAL 107 Cb -0.20 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 34.87 1qfv s VAL 107 CO 0.26 0.44 -0.06 -0.36 0.00 0.00 0.00 175.10 175.38 1qfv s PHE 108 N -0.10 0.96 -0.26 5.22 0.08 -0.38 -4.90 117.98 118.61 1qfv s PHE 108 Ca -0.02 -0.32 0.01 0.00 0.12 0.00 0.00 56.93 56.73 1qfv s PHE 108 Cb -0.11 -0.80 0.05 0.00 -0.57 0.00 0.00 43.02 41.58 1qfv s PHE 108 CO 0.02 -0.24 -0.09 0.99 -0.10 0.00 0.00 175.22 175.80 1qfv s THR 109 N 0.97 2.39 0.26 0.64 2.01 -1.26 0.09 115.64 120.74 1qfv s THR 109 Ca -0.10 -1.46 0.08 0.00 0.31 0.00 0.00 61.69 60.52 1qfv s THR 109 Cb -0.14 -2.34 -0.04 0.00 0.01 0.00 0.00 72.50 69.98 1qfv s THR 109 CO 0.00 0.03 0.13 -1.81 -0.69 0.00 0.00 174.62 172.28 1qfv s ASP 110 N 1.17 5.16 -0.01 3.53 1.01 -0.26 -4.55 116.67 122.73 1qfv s ASP 110 Ca -0.06 -0.41 0.07 0.00 0.71 0.00 0.00 52.55 52.86 1qfv s ASP 110 Cb -0.19 -1.18 -0.02 0.00 1.01 0.00 0.00 42.92 42.54 1qfv s ASP 110 CO -0.05 -0.04 -0.22 -0.69 0.21 0.00 0.00 175.17 174.38 1qfv s VAL 111 N -2.21 1.76 -0.28 -1.27 1.01 0.50 -0.24 120.40 119.67 1qfv s VAL 111 Ca 0.33 -0.99 -0.29 0.00 0.00 0.00 0.00 61.98 61.03 1qfv s VAL 111 Cb -0.07 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.85 1qfv s VAL 111 CO 0.23 0.46 1.21 -0.63 0.00 0.00 0.00 175.10 176.37 1qfv s ILE 112 N -0.56 4.31 -0.10 2.22 -1.09 0.54 0.08 121.20 126.60 1qfv s ILE 112 Ca 0.09 1.52 -0.14 0.00 -2.23 0.00 0.00 60.65 59.88 1qfv s ILE 112 Cb -0.09 -4.22 -0.27 0.00 -1.58 0.00 0.00 42.46 36.30 1qfv s ILE 112 CO -0.00 -0.40 0.54 0.00 -1.23 0.00 0.00 174.94 173.84 1qfv h ALA 113 N 8.62 0.21 -2.14 9.38 0.00 -1.03 -3.46 119.26 130.85 1qfv h ALA 113 Ca -0.24 -1.15 -0.01 0.00 0.00 0.00 0.00 54.91 53.51 1qfv h ALA 113 Cb 1.08 0.52 -0.22 0.00 0.00 0.00 0.00 17.79 19.17 1qfv h ALA 113 CO 1.02 0.94 -0.05 -0.47 0.00 0.00 0.00 179.25 180.69 1qfv s TYR 114 N -2.51 -0.97 -0.02 0.00 6.14 -0.84 -4.82 117.35 114.33 1qfv s TYR 114 Ca -0.20 1.96 -0.03 0.00 0.64 0.00 0.00 57.07 59.44 1qfv s TYR 114 Cb 0.05 0.56 0.00 0.00 0.42 0.00 0.00 41.96 42.99 1qfv s TYR 114 CO 0.78 -0.49 0.08 0.45 0.64 0.00 0.00 175.55 177.01 1qfv s SER 115 N 1.59 -0.04 0.51 4.32 0.15 0.12 0.10 113.70 120.46 1qfv s SER 115 Ca -0.10 0.05 0.01 0.00 0.70 0.00 0.00 55.95 56.61 1qfv s SER 115 Cb -0.06 0.17 -0.01 0.00 -1.71 0.00 0.00 66.02 64.42 1qfv s SER 115 CO -0.18 -0.11 0.03 -1.81 1.20 0.00 0.00 173.24 172.37 1qfv s ASP 116 N -0.31 3.95 0.45 5.45 1.01 -0.05 -4.53 116.67 122.63 1qfv s ASP 116 Ca -0.04 -1.71 0.19 0.00 0.71 0.00 0.00 52.55 51.70 1qfv s ASP 116 Cb -0.03 0.65 1.15 0.00 1.01 0.00 0.00 42.92 45.70 1qfv s ASP 116 CO 0.00 -0.93 1.93 0.44 0.21 0.00 0.00 175.17 176.82 1qfv h ASP 117 N 1.36 0.29 0.00 0.27 3.32 -2.01 -2.97 116.42 116.68 1qfv h ASP 117 Ca -0.42 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1qfv h ASP 117 Cb 1.32 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1qfv h ASP 117 CO 0.70 0.15 -0.09 -0.46 -1.72 0.00 0.00 179.24 177.81 1qfv n ASN 118 N -4.45 1.86 -3.53 6.45 2.04 -1.26 -5.05 115.26 111.32 1qfv n ASN 118 Ca 0.14 -2.79 -0.16 0.00 -0.44 0.00 0.00 54.58 51.33 1qfv n ASN 118 Cb 0.59 -0.35 -0.06 0.00 -2.53 0.00 0.00 39.78 37.43 1qfv n ASN 118 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1qfv s ASP 120 N -1.19 1.06 -0.29 0.00 1.01 0.20 -0.87 116.67 116.58 1qfv s ASP 120 Ca -0.09 -0.16 -0.03 0.00 0.71 0.00 0.00 52.55 52.98 1qfv s ASP 120 Cb -0.00 -0.12 0.04 0.00 1.01 0.00 0.00 42.92 43.84 1qfv s ASP 120 CO 0.08 0.11 0.01 -0.69 0.21 0.00 0.00 175.17 174.89 1qfv s VAL 121 N -0.21 3.22 -0.08 -1.27 1.01 0.28 -0.68 120.40 122.68 1qfv s VAL 121 Ca 0.03 -1.14 0.02 0.00 0.00 0.00 0.00 61.98 60.89 1qfv s VAL 121 Cb -0.04 -2.76 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 1qfv s VAL 121 CO -0.00 -0.00 -0.11 -0.63 0.00 0.00 0.00 175.10 174.35 1qfv s ILE 122 N 1.33 3.30 -0.19 2.22 1.01 -0.32 -0.38 121.20 128.17 1qfv s ILE 122 Ca -0.02 -0.62 -0.09 0.00 0.00 0.00 0.00 60.65 59.92 1qfv s ILE 122 Cb -0.18 -2.34 -0.05 0.00 0.01 0.00 0.00 42.46 39.90 1qfv s ILE 122 CO -0.01 0.57 0.10 -0.47 0.00 0.00 0.00 174.94 175.14 1qfv s TYR 123 N -0.47 3.35 -0.39 3.97 5.04 0.11 -0.67 117.35 128.30 1qfv s TYR 123 Ca 0.06 0.24 -0.09 0.00 -2.44 0.00 0.00 57.07 54.84 1qfv s TYR 123 Cb -0.12 -2.13 0.06 0.00 0.35 0.00 0.00 41.96 40.12 1qfv s TYR 123 CO 0.02 0.24 0.21 0.08 -1.34 0.00 0.00 175.55 174.76 1qfv s VAL 124 N 0.35 4.19 0.59 3.14 1.01 0.41 -0.37 120.40 129.72 1qfv s VAL 124 Ca 0.06 -1.20 0.37 0.00 0.00 0.00 0.00 61.98 61.21 1qfv s VAL 124 Cb -0.11 -3.46 0.40 0.00 0.00 0.00 0.00 36.38 33.20 1qfv s VAL 124 CO -0.01 -0.36 2.28 -0.65 0.00 0.00 0.00 175.10 176.37 1qfv h PRO 125 N 8.36 0.00 -0.20 2.72 0.11 -1.84 -1.41 132.00 139.75 1qfv h PRO 125 Ca -0.23 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.84 1qfv h PRO 125 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1qfv h PRO 125 CO 0.69 0.01 -0.04 0.41 -0.21 0.00 0.00 178.00 178.86 1qfv n GLY 126 N -1.07 0.37 0.35 -0.55 0.00 -1.26 -4.53 105.19 98.50 1qfv n GLY 126 Ca -0.03 -0.88 0.03 0.00 0.00 0.00 0.00 46.02 45.15 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 -3.63 0.75 -1.64 2.61 -2.24 -1.26 -4.43 114.28 104.43 1qfv n THR 127 Ca -0.02 -0.87 -0.29 0.00 -2.27 0.00 0.00 64.05 60.59 1qfv n THR 127 Cb 0.36 0.66 0.06 0.00 -2.10 0.00 0.00 70.33 69.30 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 0.17 6.32 -1.54 3.42 8.00 -1.26 -4.86 116.55 126.81 1qfv n ASP 128 Ca 0.06 -3.77 -0.13 0.00 0.71 0.00 0.00 54.79 51.66 1qfv n ASP 128 Cb 0.31 -0.68 -0.00 0.00 -0.02 0.00 0.00 41.12 40.72 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 -0.83 -0.14 3.13 0.44 0.00 -1.26 -4.96 105.19 101.57 1qfv n GLY 129 Ca 0.54 -0.33 -0.20 0.00 0.00 0.00 0.00 46.02 46.03 1qfv n GLY 129 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1qfv n ASN 130 N -0.51 -0.51 -4.79 1.61 6.94 -1.26 -4.81 115.26 111.93 1qfv n ASN 130 Ca -0.14 -3.13 -0.39 0.00 -0.02 0.00 0.00 54.58 50.90 1qfv n ASN 130 Cb 0.61 1.57 -0.06 0.00 -2.36 0.00 0.00 39.78 39.54 1qfv n ASN 130 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1qfv s GLU 131 N -3.34 4.26 0.36 -3.83 2.02 -1.26 -4.40 118.70 112.52 1qfv s GLU 131 Ca 0.37 0.77 -0.26 0.00 0.02 0.00 0.00 54.97 55.87 1qfv s GLU 131 Cb 0.02 -3.27 -0.09 0.00 0.10 0.00 0.00 34.13 30.89 1qfv s GLU 131 CO 0.26 0.56 1.08 -2.00 0.02 0.00 0.00 175.26 175.17 1qfv s GLU 132 N -0.84 4.31 0.00 1.61 2.12 -1.26 -4.22 118.70 120.42 1qfv s GLU 132 Ca 0.30 1.64 0.00 0.00 0.36 0.00 0.00 54.97 57.27 1qfv s GLU 132 Cb -0.19 -2.77 0.00 0.00 0.26 0.00 0.00 34.13 31.42 1qfv s GLU 132 CO 0.19 -0.04 0.00 0.41 -0.54 0.00 0.00 175.26 175.28 1qfv n GLY 133 N 0.66 -1.09 3.28 -1.50 0.00 -0.53 -4.80 105.19 101.22 1qfv n GLY 133 Ca 0.03 -0.98 -0.21 0.00 0.00 0.00 0.00 46.02 44.85 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 1.67 0.05 1.61 1.51 -1.26 -0.44 117.35 117.48 1qfv s TYR 134 Ca 0.00 -0.47 0.06 0.00 -1.01 0.00 0.00 57.07 55.65 1qfv s TYR 134 Cb 0.00 -0.88 -0.02 0.00 -0.11 0.00 0.00 41.96 40.95 1qfv s TYR 134 CO 0.00 0.23 -0.16 -1.21 -1.11 0.00 0.00 175.55 173.30 1qfv s GLU 135 N -2.37 1.04 -0.21 -0.62 2.02 0.16 -1.29 118.70 117.41 1qfv s GLU 135 Ca 0.10 -0.83 0.02 0.00 0.02 0.00 0.00 54.97 54.27 1qfv s GLU 135 Cb -0.07 -1.08 0.04 0.00 0.10 0.00 0.00 34.13 33.12 1qfv s GLU 135 CO 0.05 0.27 -0.14 -1.17 0.02 0.00 0.00 175.26 174.28 1qfv s LEU 136 N -1.22 2.64 0.01 1.80 2.96 0.07 -1.17 118.68 123.76 1qfv s LEU 136 Ca 0.03 -0.98 0.04 0.00 -0.22 0.00 0.00 54.13 53.00 1qfv s LEU 136 Cb -0.08 -1.44 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 1qfv s LEU 136 CO 0.02 -0.11 -0.11 0.26 -1.32 0.00 0.00 176.35 175.09 1qfv s TRP 137 N 1.25 2.78 0.07 5.38 0.52 0.14 -0.42 118.94 128.66 1qfv s TRP 137 Ca -0.02 -0.11 -0.22 0.00 0.02 0.00 0.00 56.10 55.78 1qfv s TRP 137 Cb -0.16 -1.57 0.05 0.00 -1.15 0.00 0.00 33.47 30.64 1qfv s TRP 137 CO -0.09 0.32 0.52 -0.08 0.02 0.00 0.00 176.95 177.64 1qfv s THR 138 N -0.95 0.03 -0.29 2.01 -1.32 0.01 -0.63 115.64 114.50 1qfv s THR 138 Ca 0.16 -0.25 0.21 0.00 -1.21 0.00 0.00 61.69 60.60 1qfv s THR 138 Cb -0.11 -1.01 0.25 0.00 -1.51 0.00 0.00 72.50 70.13 1qfv s THR 138 CO 0.06 -0.14 1.59 0.71 -2.21 0.00 0.00 174.62 174.63 1qfv h THR 139 N 2.61 0.29 -3.59 5.08 1.35 -1.63 0.54 112.91 117.57 1qfv h THR 139 Ca -0.32 -1.35 -0.65 0.00 -0.55 0.00 0.00 66.41 63.54 1qfv h THR 139 Cb 1.23 2.09 -0.40 0.00 -1.73 0.00 0.00 68.15 69.34 1qfv h THR 139 CO 0.42 0.16 -0.71 -0.62 -0.25 0.00 0.00 175.52 174.51 1qfv s ASP 140 N -6.26 4.62 0.34 5.36 2.15 -1.26 -4.86 116.67 116.76 1qfv s ASP 140 Ca 0.05 -2.24 0.26 0.00 0.43 0.00 0.00 52.55 51.06 1qfv s ASP 140 Cb 0.06 -1.55 1.14 0.00 -0.30 0.00 0.00 42.92 42.28 1qfv s ASP 140 CO 0.68 -0.36 1.78 0.10 -0.17 0.00 0.00 175.17 177.20 1qfv h TYR 141 N 7.49 0.00 0.00 -5.34 -0.00 -1.94 -2.32 116.97 114.85 1qfv h TYR 141 Ca -0.05 0.00 -0.07 0.00 0.00 0.00 0.00 58.73 58.60 1qfv h TYR 141 Cb 1.00 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.72 1qfv h TYR 141 CO 0.46 0.00 -1.09 -0.44 -0.00 0.00 0.00 178.16 177.09 1qfv h ASP 142 N 0.00 0.00 -2.63 0.10 3.32 -1.97 -3.42 116.42 111.83 1qfv h ASP 142 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 1qfv h ASP 142 Cb 0.31 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.47 1qfv h ASP 142 CO 0.00 0.26 -0.87 0.20 -1.72 0.00 0.00 179.24 177.11 1qfv s ASN 143 N -5.64 2.42 0.04 6.45 -0.87 -0.88 -5.10 114.94 111.36 1qfv s ASN 143 Ca -0.01 -3.06 -0.30 0.00 -1.57 0.00 0.00 52.86 47.92 1qfv s ASN 143 Cb 0.09 -0.70 -0.08 0.00 -0.02 0.00 0.00 41.25 40.54 1qfv s ASN 143 CO 0.79 -0.18 1.67 -0.63 -2.57 0.00 0.00 177.10 176.18 1qfv s ILE 144 N -0.06 3.15 0.34 0.60 1.01 -1.21 -4.69 121.20 120.35 1qfv s ILE 144 Ca 0.28 0.51 -0.28 0.00 0.00 0.00 0.00 60.65 61.16 1qfv s ILE 144 Cb -0.04 -3.33 -0.12 0.00 0.01 0.00 0.00 42.46 38.99 1qfv s ILE 144 CO -0.15 -0.01 1.35 -2.65 0.00 0.00 0.00 174.94 173.48 1qfv n PRO 145 N 6.03 2.27 -0.18 2.79 -0.02 -1.26 -4.87 135.00 139.76 1qfv n PRO 145 Ca 0.16 0.80 -0.08 0.00 -2.02 0.00 0.00 63.50 62.36 1qfv n PRO 145 Cb 0.41 -2.42 0.02 0.00 -0.02 0.00 0.00 33.50 31.48 1qfv n PRO 145 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qfv h ALA 146 N 2.81 0.66 -0.45 3.55 0.00 -1.98 -1.84 119.26 122.01 1qfv h ALA 146 Ca -0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 1qfv h ALA 146 Cb 1.27 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1qfv h ALA 146 CO 0.64 0.20 0.22 -0.91 0.00 0.00 0.00 179.25 179.40 1qfv h ASN 147 N 0.68 0.58 -0.46 0.00 -0.26 -1.99 0.27 115.58 114.41 1qfv h ASN 147 Ca 0.18 -0.12 -0.07 0.00 -0.56 0.00 0.00 56.30 55.73 1qfv h ASN 147 Cb 0.07 -0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 37.17 1qfv h ASN 147 CO -0.03 0.54 0.02 0.00 -1.06 0.00 0.00 177.43 176.90 1qfv h LEU 149 N 0.66 0.64 -0.53 0.00 5.85 -1.02 0.10 115.31 121.01 1qfv h LEU 149 Ca 0.13 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 1qfv h LEU 149 Cb 0.47 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1qfv h LEU 149 CO 0.02 0.46 0.21 0.78 -0.34 0.00 0.00 178.44 179.57 1qfv h ASN 150 N 0.76 0.74 -0.44 1.25 -0.26 -0.23 -0.60 115.58 116.80 1qfv h ASN 150 Ca 0.22 -0.17 -0.03 0.00 -0.56 0.00 0.00 56.30 55.76 1qfv h ASN 150 Cb -0.05 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.00 1qfv h ASN 150 CO -0.07 0.71 0.14 0.11 -1.06 0.00 0.00 177.43 177.27 1qfv h LYS 151 N 0.72 0.68 -0.34 0.81 1.79 -0.88 -0.30 116.57 119.06 1qfv h LYS 151 Ca 0.18 -0.15 0.02 0.00 -2.18 0.00 0.00 60.65 58.52 1qfv h LYS 151 Cb 0.21 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.73 1qfv h LYS 151 CO -0.01 0.66 0.18 0.35 -1.08 0.00 0.00 179.45 179.55 1qfv h PHE 152 N 0.57 0.33 -0.84 -1.35 3.57 -0.56 -0.46 116.94 118.20 1qfv h PHE 152 Ca 0.14 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 1qfv h PHE 152 Cb 0.26 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 1qfv h PHE 152 CO 0.01 0.19 0.43 -0.91 -2.23 0.00 0.00 178.31 175.80 1qfv h ASN 153 N 0.37 1.08 0.13 0.41 2.35 -0.92 0.22 115.58 119.22 1qfv h ASN 153 Ca 0.14 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 1qfv h ASN 153 Cb 0.03 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.13 1qfv h ASN 153 CO -0.08 0.89 -0.06 -0.08 -1.65 0.00 0.00 177.43 176.44 1qfv h GLU 154 N 1.19 -0.17 0.00 0.81 4.81 -0.70 -2.82 114.58 117.69 1qfv h GLU 154 Ca 0.29 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.47 1qfv h GLU 154 Cb 0.07 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1qfv h GLU 154 CO -0.04 -0.04 -0.30 1.88 -0.73 0.00 0.00 179.01 179.79 1qfv h TYR 155 N -0.27 0.00 -0.00 0.92 0.05 -0.84 -3.05 116.97 113.77 1qfv h TYR 155 Ca -0.02 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.76 1qfv h TYR 155 Cb 0.22 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.96 1qfv h TYR 155 CO -0.04 0.30 -0.01 0.00 -1.05 0.00 0.00 178.16 177.36 1qfv n ALA 156 N -2.34 2.66 -1.79 3.88 0.00 0.75 -4.90 120.51 118.77 1qfv n ALA 156 Ca -0.01 -0.25 -0.42 0.00 0.00 0.00 0.00 53.44 52.76 1qfv n ALA 156 Cb 0.40 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 1qfv n ALA 156 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1qfv s VAL 157 N -2.08 2.21 0.00 0.00 1.01 -1.09 -1.05 120.40 119.40 1qfv s VAL 157 Ca 0.43 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.56 1qfv s VAL 157 Cb 0.22 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.50 1qfv s VAL 157 CO 0.38 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.10 1qfv n GLY 158 N 3.58 0.20 3.46 4.51 0.00 -1.26 -5.06 105.19 110.62 1qfv n GLY 158 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 1qfv n GLY 158 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qfv s ARG 159 N -0.98 1.63 -0.26 1.61 0.52 -0.21 -5.13 118.95 116.13 1qfv s ARG 159 Ca 0.00 -1.82 -0.09 0.00 -0.52 0.00 0.00 55.73 53.30 1qfv s ARG 159 Cb 0.00 -1.35 -0.04 0.00 0.52 0.00 0.00 34.95 34.08 1qfv s ARG 159 CO 0.00 0.09 0.13 -2.00 0.02 0.00 0.00 175.30 173.54 1qfv s GLU 160 N -3.68 3.82 0.23 3.54 2.12 -1.26 -5.02 118.70 118.45 1qfv s GLU 160 Ca 0.30 -0.39 -0.13 0.00 0.36 0.00 0.00 54.97 55.11 1qfv s GLU 160 Cb 0.03 -3.48 -0.08 0.00 0.26 0.00 0.00 34.13 30.86 1qfv s GLU 160 CO 0.13 -0.15 0.61 0.99 -0.54 0.00 0.00 175.26 176.29 1qfv s THR 161 N 1.61 4.82 0.06 -1.70 2.01 -1.26 -4.27 115.64 116.91 1qfv s THR 161 Ca 0.07 0.75 -0.08 0.00 0.31 0.00 0.00 61.69 62.74 1qfv s THR 161 Cb -0.15 -3.67 -0.01 0.00 0.01 0.00 0.00 72.50 68.68 1qfv s THR 161 CO 0.07 0.02 0.16 0.00 -0.69 0.00 0.00 174.62 174.18 1qfv s ARG 162 N -2.53 0.75 0.20 4.92 1.70 -0.22 -4.99 118.95 118.77 1qfv s ARG 162 Ca 0.46 -0.87 -0.24 0.00 -0.47 0.00 0.00 55.73 54.61 1qfv s ARG 162 Cb -0.13 0.30 -0.08 0.00 -0.57 0.00 0.00 34.95 34.47 1qfv s ARG 162 CO 0.20 -0.22 0.78 -0.51 -1.08 0.00 0.00 175.30 174.47 1qfv s ASP 163 N -2.55 7.29 0.00 -2.89 1.01 -1.26 -2.01 116.67 116.26 1qfv s ASP 163 Ca 0.01 1.61 0.00 0.00 0.71 0.00 0.00 52.55 54.88 1qfv s ASP 163 Cb 0.03 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.47 1qfv s ASP 163 CO -0.08 0.13 0.00 0.52 0.21 0.00 0.00 175.17 175.94 1qfv n VAL 164 N 1.22 0.00 -3.53 -1.27 0.31 0.17 -4.89 118.33 110.34 1qfv n VAL 164 Ca -0.04 0.12 -0.37 0.00 -0.01 0.00 0.00 64.34 64.04 1qfv n VAL 164 Cb 0.49 -1.07 -0.09 0.00 -0.91 0.00 0.00 33.84 32.27 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 -0.86 3.33 0.35 3.52 2.19 0.58 -1.09 117.98 126.00 1qfv s PHE 165 Ca 0.00 0.39 0.04 0.00 0.33 0.00 0.00 56.93 57.69 1qfv s PHE 165 Cb 0.00 -2.40 -0.03 0.00 -1.31 0.00 0.00 43.02 39.28 1qfv s PHE 165 CO 0.00 0.00 0.16 0.95 1.83 0.00 0.00 175.22 178.16 1qfv s THR 166 N 1.28 0.44 0.33 0.12 -4.23 -1.26 -4.48 115.64 107.85 1qfv s THR 166 Ca 0.13 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.72 1qfv s THR 166 Cb -0.14 -2.46 0.32 0.00 1.34 0.00 0.00 72.50 71.56 1qfv s THR 166 CO 0.07 0.00 1.82 0.28 -0.54 0.00 0.00 174.62 176.24 1qfv h SER 167 N 2.02 0.70 0.00 3.99 0.02 -1.97 0.30 113.55 118.61 1qfv h SER 167 Ca -0.33 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1qfv h SER 167 Cb 1.26 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1qfv h SER 167 CO 0.53 0.29 0.00 0.00 -1.14 0.00 0.00 176.83 176.51 1qfv n ALA 168 N -2.39 1.63 -0.08 3.77 0.00 -1.26 -3.50 120.51 118.67 1qfv n ALA 168 Ca 0.21 -0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.53 1qfv n ALA 168 Cb 0.56 -1.05 -0.05 0.00 0.00 0.00 0.00 19.45 18.91 1qfv n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qfv h LEU 170 N -1.00 0.09 0.00 0.00 3.38 -1.73 -3.51 115.31 112.54 1qfv h LEU 170 Ca -0.12 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1qfv h LEU 170 Cb 0.79 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1qfv h LEU 170 CO -0.07 0.10 0.00 1.21 0.09 0.00 0.00 178.44 179.76