#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qf9 h ALA 39 N 0.00 2.23 -0.67 0.00 0.00 -1.98 -2.25 119.26 116.59 2qf9 h ALA 39 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qf9 h ALA 39 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qf9 h ALA 39 CO 0.00 -0.33 0.00 -0.40 0.00 0.00 0.00 179.25 178.52 2qf9 n ASP 40 N -4.45 4.45 -4.80 0.00 5.75 -1.26 -4.52 116.55 111.72 2qf9 n ASP 40 Ca 0.06 -2.31 -0.30 0.00 -0.01 0.00 0.00 54.79 52.22 2qf9 n ASP 40 Cb 0.39 -0.55 0.07 0.00 -1.03 0.00 0.00 41.12 40.00 2qf9 n ASP 40 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2qf9 s SER 41 N -0.91 4.85 0.23 -1.12 1.04 -0.85 -4.87 113.70 112.07 2qf9 s SER 41 Ca 0.50 1.49 -0.07 0.00 0.48 0.00 0.00 55.95 58.35 2qf9 s SER 41 Cb 0.30 -2.29 0.25 0.00 0.10 0.00 0.00 66.02 64.38 2qf9 s SER 41 CO 0.27 -1.77 1.89 0.00 0.98 0.00 0.00 173.24 174.61 2qf9 h ALA 42 N -0.94 1.14 -0.34 5.32 0.00 -1.86 -1.05 119.26 121.52 2qf9 h ALA 42 Ca -0.45 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.42 2qf9 h ALA 42 Cb 1.24 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2qf9 h ALA 42 CO 0.57 0.45 0.20 -0.44 0.00 0.00 0.00 179.25 180.03 2qf9 h ASP 43 N 1.14 0.31 -0.19 0.00 3.32 -1.92 0.17 116.42 119.25 2qf9 h ASP 43 Ca 0.34 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.33 2qf9 h ASP 43 Cb -0.05 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 2qf9 h ASP 43 CO -0.10 0.23 -0.11 0.00 -1.72 0.00 0.00 179.24 177.54 2qf9 h ALA 44 N 1.15 0.27 -0.51 3.45 0.00 -1.77 -2.46 119.26 119.39 2qf9 h ALA 44 Ca 0.13 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2qf9 h ALA 44 Cb 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2qf9 h ALA 44 CO -0.07 0.11 0.17 0.78 0.00 0.00 0.00 179.25 180.25 2qf9 h GLY 45 N 0.09 0.84 0.94 0.00 0.00 -1.06 -0.91 103.07 102.97 2qf9 h GLY 45 Ca 0.04 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 2qf9 h GLY 45 CO 0.03 0.46 0.16 -2.75 0.00 0.00 0.00 176.54 174.44 2qf9 h PHE 46 N 0.69 0.62 -0.58 5.60 3.57 -1.01 -0.09 116.94 125.74 2qf9 h PHE 46 Ca 0.17 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.67 2qf9 h PHE 46 Cb 0.26 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.76 2qf9 h PHE 46 CO 0.01 0.55 0.31 0.00 -2.23 0.00 0.00 178.31 176.95 2qf9 h ALA 47 N 1.01 0.76 0.05 2.41 0.00 -1.18 -2.98 119.26 119.33 2qf9 h ALA 47 Ca 0.14 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2qf9 h ALA 47 Cb 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2qf9 h ALA 47 CO -0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 179.25 179.19 2qf9 h ARG 48 N 0.58 -0.07 -0.87 0.00 3.08 -0.95 -2.29 114.38 113.86 2qf9 h ARG 48 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 2qf9 h ARG 48 Cb 0.16 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.22 2qf9 h ARG 48 CO -0.17 0.21 0.00 -0.25 -1.07 0.00 0.00 179.97 178.69 2qf9 n ASP 49 N -4.99 0.89 0.00 7.04 8.00 -0.07 -2.47 116.55 124.96 2qf9 n ASP 49 Ca -0.08 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.38 2qf9 n ASP 49 Cb 0.17 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 2qf9 n ASP 49 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2qf9 n SER 51 N 0.42 0.00 -0.27 -2.24 7.64 -0.86 -1.50 113.62 116.81 2qf9 n SER 51 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 2qf9 n SER 51 Cb 0.18 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.43 2qf9 n SER 51 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2qf9 h VAL 52 N 0.00 1.25 -0.13 0.44 2.07 -1.76 -1.06 116.25 117.07 2qf9 h VAL 52 Ca 0.00 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 2qf9 h VAL 52 Cb 0.00 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 2qf9 h VAL 52 CO 0.00 0.32 0.07 -0.74 0.02 0.00 0.00 177.57 177.24 2qf9 h HIS 53 N 1.06 0.19 -0.57 1.57 2.76 -1.56 -2.82 115.15 115.79 2qf9 h HIS 53 Ca 0.24 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.44 2qf9 h HIS 53 Cb 0.22 -0.06 -0.04 0.00 1.55 0.00 0.00 27.41 29.08 2qf9 h HIS 53 CO 0.02 0.23 0.32 0.45 -1.30 0.00 0.00 177.93 177.65 2qf9 h HIS 54 N 0.10 0.60 -0.76 5.26 3.86 -1.81 -2.32 115.15 120.08 2qf9 h HIS 54 Ca 0.05 0.02 0.15 0.00 -1.16 0.00 0.00 60.37 59.43 2qf9 h HIS 54 Cb 0.11 -0.19 -0.10 0.00 1.06 0.00 0.00 27.41 28.29 2qf9 h HIS 54 CO -0.03 0.31 0.28 0.37 0.86 0.00 0.00 177.93 179.72 2qf9 h GLN 55 N 0.62 0.39 -0.47 2.45 4.15 -0.96 -0.76 115.11 120.53 2qf9 h GLN 55 Ca 0.24 -0.02 -0.11 0.00 0.77 0.00 0.00 58.65 59.53 2qf9 h GLN 55 Cb 0.09 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 2qf9 h GLN 55 CO -0.13 0.26 -0.14 0.37 -1.93 0.00 0.00 178.83 177.26 2qf9 h GLN 56 N 0.40 0.89 -0.38 1.69 4.15 -1.18 -1.79 115.11 118.90 2qf9 h GLN 56 Ca 0.43 -0.33 0.00 0.00 0.77 0.00 0.00 58.65 59.52 2qf9 h GLN 56 Cb 0.68 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.29 2qf9 h GLN 56 CO -0.44 0.97 0.25 0.00 -1.93 0.00 0.00 178.83 177.68 2qf9 h ALA 57 N 1.04 0.48 -0.24 3.38 0.00 -0.95 -2.69 119.26 120.28 2qf9 h ALA 57 Ca 0.12 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.06 2qf9 h ALA 57 Cb 0.66 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2qf9 h ALA 57 CO 0.05 -0.07 -0.05 0.28 0.00 0.00 0.00 179.25 179.46 2qf9 h VAL 58 N 0.51 0.77 0.00 0.00 2.07 -1.06 -1.04 116.25 117.50 2qf9 h VAL 58 Ca 0.14 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.65 2qf9 h VAL 58 Cb -0.06 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2qf9 h VAL 58 CO -0.03 0.00 0.00 1.21 0.02 0.00 0.00 177.57 178.77 2qf9 n GLU 59 N -5.21 0.00 0.00 1.57 4.07 -0.68 -1.39 120.64 119.00 2qf9 n GLU 59 Ca -0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.09 2qf9 n GLU 59 Cb 0.14 -1.27 0.00 0.00 -0.06 0.00 0.00 31.44 30.25 2qf9 n GLU 59 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2qf9 n SER 61 N 0.80 0.00 -0.28 4.31 7.64 -0.39 -1.45 113.62 124.25 2qf9 n SER 61 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 2qf9 n SER 61 Cb 0.00 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.27 2qf9 n SER 61 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 2qf9 h TYR 62 N 0.00 0.99 0.12 1.43 -1.99 -1.50 -2.47 116.97 113.55 2qf9 h TYR 62 Ca 0.00 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.74 2qf9 h TYR 62 Cb 0.00 -0.33 0.00 0.00 2.00 0.00 0.00 36.73 38.40 2qf9 h TYR 62 CO 0.00 0.64 -0.06 0.82 -0.00 0.00 0.00 178.16 179.56 2qf9 h ILE 63 N 1.05 1.04 -0.48 -2.88 2.04 -1.52 -3.13 117.51 113.63 2qf9 h ILE 63 Ca 0.28 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 2qf9 h ILE 63 Cb -0.09 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 2qf9 h ILE 63 CO -0.06 0.16 0.25 1.62 0.00 0.00 0.00 178.15 180.12 2qf9 h VAL 64 N -0.48 1.15 0.00 1.67 3.04 -1.82 -1.75 116.25 118.06 2qf9 h VAL 64 Ca -0.02 -0.41 -0.02 0.00 -1.01 0.00 0.00 66.70 65.24 2qf9 h VAL 64 Cb 0.39 0.53 -0.00 0.00 -2.01 0.00 0.00 31.29 30.19 2qf9 h VAL 64 CO 0.03 0.17 -0.11 0.03 -1.01 0.00 0.00 177.57 176.68 2qf9 h ARG 65 N 0.66 0.00 -0.00 4.17 3.08 -1.39 -1.18 114.38 119.71 2qf9 h ARG 65 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2qf9 h ARG 65 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2qf9 h ARG 65 CO -0.03 0.11 -0.28 -0.25 -1.07 0.00 0.00 179.97 178.46 2qf9 n ASP 66 N -3.46 0.72 -0.00 7.04 9.92 -0.67 -4.18 116.55 125.92 2qf9 n ASP 66 Ca -0.01 -0.58 0.05 0.00 -0.53 0.00 0.00 54.79 53.72 2qf9 n ASP 66 Cb 0.27 0.09 -0.07 0.00 -0.64 0.00 0.00 41.12 40.77 2qf9 n ASP 66 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2qf9 n ARG 67 N -0.98 3.07 -3.95 -1.24 5.12 -0.46 -5.01 116.66 113.20 2qf9 n ARG 67 Ca 0.11 -0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.93 2qf9 n ARG 67 Cb 0.33 -1.05 -0.10 0.00 -1.16 0.00 0.00 32.46 30.48 2qf9 n ARG 67 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2qf9 s THR 68 N -2.12 0.14 -2.78 0.55 -1.32 -1.11 -0.64 115.64 108.36 2qf9 s THR 68 Ca 0.04 -1.17 0.26 0.00 -1.21 0.00 0.00 61.69 59.61 2qf9 s THR 68 Cb 0.09 -0.92 0.33 0.00 -1.51 0.00 0.00 72.50 70.49 2qf9 s THR 68 CO 0.47 -0.64 1.45 0.47 -2.21 0.00 0.00 174.62 174.16 2qf9 n ASP 69 N 0.75 2.38 -4.66 8.08 8.00 -1.26 -4.83 116.55 125.01 2qf9 n ASP 69 Ca -0.19 -1.79 -0.42 0.00 0.71 0.00 0.00 54.79 53.10 2qf9 n ASP 69 Cb 0.59 0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.67 2qf9 n ASP 69 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2qf9 s ASP 70 N -2.01 6.58 0.09 -2.24 2.15 -1.26 -4.91 116.67 115.07 2qf9 s ASP 70 Ca 0.32 2.43 -0.21 0.00 0.43 0.00 0.00 52.55 55.53 2qf9 s ASP 70 Cb 0.20 -2.54 -0.10 0.00 -0.30 0.00 0.00 42.92 40.19 2qf9 s ASP 70 CO 0.32 -0.97 1.66 -0.08 -0.17 0.00 0.00 175.17 175.93 2qf9 h GLU 71 N 9.79 0.24 -0.12 4.34 4.81 -1.98 -0.44 114.58 131.22 2qf9 h GLU 71 Ca -0.44 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2qf9 h GLU 71 Cb 1.20 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.53 2qf9 h GLU 71 CO 0.95 0.29 0.05 0.93 -0.73 0.00 0.00 179.01 180.50 2qf9 h GLU 72 N 0.14 0.12 -0.35 1.92 5.08 -1.99 0.26 114.58 119.76 2qf9 h GLU 72 Ca 0.06 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 2qf9 h GLU 72 Cb 0.13 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2qf9 h GLU 72 CO -0.01 0.08 -0.34 0.28 -1.00 0.00 0.00 179.01 178.02 2qf9 h VAL 73 N 0.12 1.28 -0.90 3.13 2.07 -1.97 -0.92 116.25 119.06 2qf9 h VAL 73 Ca 0.05 -1.51 0.02 0.00 0.82 0.00 0.00 66.70 66.08 2qf9 h VAL 73 Cb 0.02 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 2qf9 h VAL 73 CO -0.04 0.50 0.59 0.03 0.02 0.00 0.00 177.57 178.67 2qf9 h ARG 74 N 0.64 1.16 -0.27 1.57 3.08 -0.80 0.26 114.38 120.01 2qf9 h ARG 74 Ca 0.06 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2qf9 h ARG 74 Cb 0.92 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 2qf9 h ARG 74 CO 0.08 0.77 -0.14 -0.09 -1.07 0.00 0.00 179.97 179.52 2qf9 h ARG 75 N 1.19 0.56 -0.27 0.04 9.65 -0.29 -0.94 114.38 124.32 2qf9 h ARG 75 Ca 0.34 -0.25 0.01 0.00 -1.10 0.00 0.00 59.98 58.98 2qf9 h ARG 75 Cb -0.10 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.45 2qf9 h ARG 75 CO -0.08 0.82 0.15 1.25 2.80 0.00 0.00 179.97 184.91 2qf9 h LEU 76 N 0.30 0.25 -1.01 3.80 5.85 -0.86 -0.57 115.31 123.06 2qf9 h LEU 76 Ca 0.06 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.80 2qf9 h LEU 76 Cb 0.65 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 2qf9 h LEU 76 CO 0.04 0.18 0.67 0.00 -0.34 0.00 0.00 178.44 178.99 2qf9 h ALA 77 N 1.12 1.29 -0.19 1.25 0.00 -0.84 0.65 119.26 122.54 2qf9 h ALA 77 Ca 0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2qf9 h ALA 77 Cb 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 2qf9 h ALA 77 CO -0.05 0.65 0.07 -0.92 0.00 0.00 0.00 179.25 179.00 2qf9 h TYR 78 N 1.35 0.30 -0.51 0.00 3.20 -0.78 -0.14 116.97 120.39 2qf9 h TYR 78 Ca 0.38 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.22 2qf9 h TYR 78 Cb -0.13 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.03 2qf9 h TYR 78 CO -0.00 0.36 0.33 -0.44 -1.64 0.00 0.00 178.16 176.77 2qf9 h ASP 79 N 0.15 0.60 -0.32 -2.11 3.32 -0.49 0.05 116.42 117.63 2qf9 h ASP 79 Ca 0.06 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 2qf9 h ASP 79 Cb 0.19 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2qf9 h ASP 79 CO -0.00 0.45 0.13 0.40 -1.72 0.00 0.00 179.24 178.50 2qf9 h ILE 80 N 0.69 1.17 -0.44 0.35 2.04 -0.81 -1.10 117.51 119.41 2qf9 h ILE 80 Ca 0.19 -0.53 0.05 0.00 1.00 0.00 0.00 64.86 65.57 2qf9 h ILE 80 Cb -0.06 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 2qf9 h ILE 80 CO -0.04 0.18 0.19 0.00 0.00 0.00 0.00 178.15 178.49 2qf9 h ALA 81 N 0.98 0.54 -0.17 1.87 0.00 -0.77 0.00 119.26 121.72 2qf9 h ALA 81 Ca 0.11 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2qf9 h ALA 81 Cb 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2qf9 h ALA 81 CO -0.01 -0.18 0.07 1.96 0.00 0.00 0.00 179.25 181.09 2qf9 h GLN 82 N 0.38 0.25 -0.13 0.00 1.08 -0.82 -0.68 115.11 115.19 2qf9 h GLN 82 Ca 0.20 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.32 2qf9 h GLN 82 Cb 0.15 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 2qf9 h GLN 82 CO -0.17 0.31 -0.06 1.15 -0.95 0.00 0.00 178.83 179.11 2qf9 h THR 83 N 0.13 1.31 -0.13 -0.54 2.02 -1.09 -2.18 112.91 112.43 2qf9 h THR 83 Ca 0.06 -1.09 -0.18 0.00 0.77 0.00 0.00 66.41 65.96 2qf9 h THR 83 Cb 0.15 1.75 -0.00 0.00 -1.74 0.00 0.00 68.15 68.31 2qf9 h THR 83 CO -0.01 0.32 -0.68 1.56 0.37 0.00 0.00 175.52 177.08 2qf9 h GLN 84 N -0.06 0.53 -0.76 6.66 4.20 -0.99 -0.12 115.11 124.56 2qf9 h GLN 84 Ca 0.03 -0.40 -0.04 0.00 0.06 0.00 0.00 58.65 58.30 2qf9 h GLN 84 Cb 0.52 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 2qf9 h GLN 84 CO 0.02 1.02 0.31 0.00 -0.67 0.00 0.00 178.83 179.50 2qf9 h ALA 85 N 0.88 0.98 -0.06 3.87 0.00 -1.18 0.11 119.26 123.86 2qf9 h ALA 85 Ca -0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2qf9 h ALA 85 Cb 1.25 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2qf9 h ALA 85 CO 0.12 0.60 0.01 -0.97 0.00 0.00 0.00 179.25 179.02 2qf9 h ASN 86 N 1.09 0.10 -0.70 0.00 -1.24 -1.03 -1.11 115.58 112.68 2qf9 h ASN 86 Ca 0.25 -0.25 -0.03 0.00 0.71 0.00 0.00 56.30 56.98 2qf9 h ASN 86 Cb 0.21 -0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.20 2qf9 h ASN 86 CO -0.02 0.32 0.35 1.56 -1.29 0.00 0.00 177.43 178.35 2qf9 h GLN 87 N -0.14 1.03 -0.32 6.67 4.20 -0.90 -2.19 115.11 123.46 2qf9 h GLN 87 Ca 0.02 -0.14 0.03 0.00 0.06 0.00 0.00 58.65 58.62 2qf9 h GLN 87 Cb 0.27 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 2qf9 h GLN 87 CO 0.00 0.79 0.13 -0.09 -0.67 0.00 0.00 178.83 178.99 2qf9 h ARG 88 N 1.02 0.27 -5.02 1.46 2.43 -0.62 -3.42 114.38 110.50 2qf9 h ARG 88 Ca 0.25 -0.02 -0.35 0.00 -0.81 0.00 0.00 59.98 59.05 2qf9 h ARG 88 Cb 0.10 -0.06 0.09 0.00 -0.42 0.00 0.00 29.97 29.68 2qf9 h ARG 88 CO -0.03 0.18 0.92 0.41 -1.51 0.00 0.00 179.97 179.93 2qf9 n GLY 89 N -1.20 0.19 4.47 2.80 0.00 -0.43 -4.52 105.19 106.50 2qf9 n GLY 89 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2qf9 n GLY 89 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2qf9 n ILE 92 N 7.05 0.00 -0.16 -0.61 5.41 -1.26 -4.56 119.36 125.23 2qf9 n ILE 92 Ca 0.38 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.13 2qf9 n ILE 92 Cb 0.42 0.00 0.26 0.00 -0.71 0.00 0.00 39.64 39.60 2qf9 n ILE 92 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2qf9 h GLY 93 N 0.00 0.93 0.78 7.39 0.00 -1.95 -0.25 103.07 109.97 2qf9 h GLY 93 Ca 0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 2qf9 h GLY 93 CO 0.00 0.39 -0.00 1.49 0.00 0.00 0.00 176.54 178.41 2qf9 h TRP 94 N 0.88 0.29 -0.85 5.60 6.55 -1.95 -0.27 115.95 126.20 2qf9 h TRP 94 Ca 0.23 -0.05 0.05 0.00 0.95 0.00 0.00 58.89 60.06 2qf9 h TRP 94 Cb 0.02 -0.07 -0.06 0.00 -0.86 0.00 0.00 29.16 28.19 2qf9 h TRP 94 CO 0.01 0.49 0.53 -0.07 -1.05 0.00 0.00 178.44 178.35 2qf9 h LEU 95 N 0.00 0.86 -0.09 -4.49 3.38 -1.79 0.10 115.31 113.28 2qf9 h LEU 95 Ca 0.04 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2qf9 h LEU 95 Cb 0.38 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2qf9 h LEU 95 CO 0.01 0.57 0.04 -0.78 0.09 0.00 0.00 178.44 178.36 2qf9 h ASP 96 N 1.00 0.12 -0.58 -0.43 3.58 -0.90 -0.11 116.42 119.10 2qf9 h ASP 96 Ca 0.36 -0.14 -0.02 0.00 0.42 0.00 0.00 57.03 57.65 2qf9 h ASP 96 Cb 0.11 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 2qf9 h ASP 96 CO -0.15 0.23 0.32 0.25 -2.88 0.00 0.00 179.24 177.00 2qf9 h LEU 97 N -0.00 0.75 -0.13 2.28 5.85 -0.57 -1.96 115.31 121.54 2qf9 h LEU 97 Ca 0.03 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2qf9 h LEU 97 Cb 0.14 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.98 2qf9 h LEU 97 CO -0.00 0.62 -0.00 0.79 -0.34 0.00 0.00 178.44 179.51 2qf9 n TRP 98 N -4.37 0.00 -3.81 1.25 8.01 0.32 -4.93 117.44 113.90 2qf9 n TRP 98 Ca 0.06 0.00 -0.26 0.00 -1.31 0.00 0.00 57.50 55.99 2qf9 n TRP 98 Cb 0.11 -0.02 0.03 0.00 -2.01 0.00 0.00 31.31 29.42 2qf9 n TRP 98 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2qf9 n ALA 99 N -0.86 -1.65 -2.66 6.99 0.00 -0.74 -5.01 120.51 116.59 2qf9 n ALA 99 Ca 0.23 0.02 -0.33 0.00 0.00 0.00 0.00 53.44 53.36 2qf9 n ALA 99 Cb 0.15 -3.23 -0.14 0.00 0.00 0.00 0.00 19.45 16.23 2qf9 n ALA 99 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qf9 s LEU 100 N -6.99 2.71 0.46 0.00 1.43 -0.13 -5.04 118.68 111.12 2qf9 s LEU 100 Ca 0.33 -0.24 -0.24 0.00 -1.03 0.00 0.00 54.13 52.96 2qf9 s LEU 100 Cb -0.17 -1.57 -0.09 0.00 0.03 0.00 0.00 46.19 44.40 2qf9 s LEU 100 CO 0.82 0.29 1.18 -2.65 0.23 0.00 0.00 176.35 176.23 2qf9 n PRO 101 N 2.67 1.63 0.17 1.29 -0.02 -1.26 -4.45 135.00 135.03 2qf9 n PRO 101 Ca -0.17 0.59 0.13 0.00 -2.02 0.00 0.00 63.50 62.02 2qf9 n PRO 101 Cb 0.52 -2.31 0.34 0.00 -0.02 0.00 0.00 33.50 32.04 2qf9 n PRO 101 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2qf9 h LYS 102 N 1.66 0.00 -5.54 -0.52 1.57 -1.98 -3.43 116.57 108.33 2qf9 h LYS 102 Ca -0.48 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 57.64 2qf9 h LYS 102 Cb 1.31 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 33.30 2qf9 h LYS 102 CO 0.58 0.00 -0.88 0.08 -0.57 0.00 0.00 179.45 178.66 2qf9 s VAL 103 N -3.21 1.97 0.15 0.50 1.01 -1.26 -4.80 120.40 114.76 2qf9 s VAL 103 Ca 0.08 -0.99 0.06 0.00 0.00 0.00 0.00 61.98 61.13 2qf9 s VAL 103 Cb 0.09 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 2qf9 s VAL 103 CO 0.61 0.54 0.01 -0.55 0.00 0.00 0.00 175.10 175.71 2qf9 s SER 104 N 0.16 4.89 0.39 3.32 0.15 -1.26 -5.01 113.70 116.34 2qf9 s SER 104 Ca -0.12 -0.32 0.20 0.00 0.70 0.00 0.00 55.95 56.41 2qf9 s SER 104 Cb -0.16 -1.09 0.69 0.00 -1.71 0.00 0.00 66.02 63.74 2qf9 s SER 104 CO 0.06 0.11 1.73 -1.28 1.20 0.00 0.00 173.24 175.06 2qf9 h SER 105 N 2.86 0.00 -3.57 5.45 0.87 -2.01 -3.45 113.55 113.71 2qf9 h SER 105 Ca -0.47 0.00 -0.53 0.00 -1.23 0.00 0.00 61.79 59.56 2qf9 h SER 105 Cb 1.19 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 63.22 2qf9 h SER 105 CO 0.59 0.33 0.75 -1.81 -0.53 0.00 0.00 176.83 176.15 2qf9 s ASP 106 N -6.34 6.59 0.44 6.23 1.01 -1.26 -4.98 116.67 118.37 2qf9 s ASP 106 Ca 0.01 2.77 -0.24 0.00 0.71 0.00 0.00 52.55 55.80 2qf9 s ASP 106 Cb 0.10 -2.64 -0.09 0.00 1.01 0.00 0.00 42.92 41.30 2qf9 s ASP 106 CO 0.67 -0.72 1.10 -2.65 0.21 0.00 0.00 175.17 173.78 2qf9 n PRO 107 N 1.67 1.49 -0.98 8.23 -0.02 -1.26 -4.95 135.00 139.19 2qf9 n PRO 107 Ca 0.04 0.54 -0.15 0.00 -2.02 0.00 0.00 63.50 61.92 2qf9 n PRO 107 Cb 0.40 -2.18 -0.05 0.00 -0.02 0.00 0.00 33.50 31.65 2qf9 n PRO 107 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2qf9 n PRO 108 N -0.05 0.02 0.00 0.52 -0.02 -1.26 -4.74 135.00 129.47 2qf9 n PRO 108 Ca 0.09 -0.59 0.00 0.00 -2.02 0.00 0.00 63.50 60.98 2qf9 n PRO 108 Cb 0.40 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2qf9 n PRO 108 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2qf9 n THR 110 N 5.72 0.00 -0.01 3.45 -1.04 -1.26 -4.12 114.28 117.02 2qf9 n THR 110 Ca 0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.21 2qf9 n THR 110 Cb 0.39 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.90 2qf9 n THR 110 CO 0.00 0.00 0.00 -2.67 -0.64 0.00 0.00 175.07 171.76 2qf9 n TRP 111 N 0.00 0.00 -3.15 -1.42 4.27 -1.26 -4.57 117.44 111.30 2qf9 n TRP 111 Ca 0.00 -0.14 -0.21 0.00 -3.89 0.00 0.00 57.50 53.25 2qf9 n TRP 111 Cb 0.00 -0.24 -0.05 0.00 -1.36 0.00 0.00 31.31 29.66 2qf9 n TRP 111 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2qf9 n GLY 113 N 1.61 2.82 0.95 -1.67 0.00 -1.26 -4.77 105.19 102.86 2qf9 n GLY 113 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2qf9 n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qf9 n GLY 115 N 1.12 -1.44 3.57 -0.02 0.00 -1.26 -5.30 105.19 101.88 2qf9 n GLY 115 Ca 0.21 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2qf9 n GLY 115 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2qf9 s PRO 127 N -0.26 0.23 -0.02 1.61 0.02 -1.26 -4.90 135.00 130.41 2qf9 s PRO 127 Ca 0.00 0.43 -0.00 0.00 0.02 0.00 0.00 61.00 61.44 2qf9 s PRO 127 Cb 0.00 0.10 0.00 0.00 0.02 0.00 0.00 34.50 34.62 2qf9 s PRO 127 CO 0.00 -0.05 0.01 0.41 -0.33 0.00 0.00 177.00 177.03 2qf9 n GLY 128 N 3.75 -2.59 3.18 0.52 0.00 -1.26 -4.24 105.19 104.55 2qf9 n GLY 128 Ca -0.16 -0.17 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 2qf9 n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qf9 s ALA 130 N -0.26 1.38 0.68 4.61 0.00 -1.26 -3.26 121.76 123.65 2qf9 s ALA 130 Ca 0.00 -0.92 -0.11 0.00 0.00 0.00 0.00 51.96 50.93 2qf9 s ALA 130 Cb -0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 23.12 22.89 2qf9 s ALA 130 CO 0.05 0.28 1.06 0.95 0.00 0.00 0.00 175.76 178.10 2qf9 s THR 131 N -0.86 4.09 0.31 0.00 -4.23 -1.26 -4.95 115.64 108.74 2qf9 s THR 131 Ca 0.03 0.68 0.05 0.00 -1.18 0.00 0.00 61.69 61.28 2qf9 s THR 131 Cb -0.08 -3.54 0.30 0.00 1.34 0.00 0.00 72.50 70.52 2qf9 s THR 131 CO 0.02 -0.89 1.84 0.44 -0.54 0.00 0.00 174.62 175.48 2qf9 h ASP 132 N -0.61 0.80 -0.33 3.99 3.32 -2.06 -1.75 116.42 119.78 2qf9 h ASP 132 Ca -0.44 0.05 -0.10 0.00 0.02 0.00 0.00 57.03 56.56 2qf9 h ASP 132 Cb 1.22 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.65 2qf9 h ASP 132 CO 0.60 0.39 -0.16 0.00 -1.72 0.00 0.00 179.24 178.35 2qf9 h ALA 133 N 1.58 0.94 0.00 3.45 0.00 -2.05 -1.03 119.26 122.15 2qf9 h ALA 133 Ca 0.50 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2qf9 h ALA 133 Cb 0.66 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2qf9 h ALA 133 CO -0.27 0.62 0.00 0.39 0.00 0.00 0.00 179.25 179.99 2qf9 n GLU 134 N -4.14 0.27 0.00 0.00 1.02 -0.66 -1.06 120.64 116.07 2qf9 n GLU 134 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2qf9 n GLU 134 Cb 0.39 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.58 2qf9 n GLU 134 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2qf9 n LYS 136 N 0.59 0.00 -0.15 3.49 4.81 -0.39 -1.38 118.16 125.12 2qf9 n LYS 136 Ca 0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.38 2qf9 n LYS 136 Cb 0.10 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.17 2qf9 n LYS 136 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 2qf9 h LYS 137 N 0.00 0.56 -0.71 1.64 3.64 -1.36 -2.16 116.57 118.17 2qf9 h LYS 137 Ca 0.00 -0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.47 2qf9 h LYS 137 Cb 0.00 -0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 31.61 2qf9 h LYS 137 CO 0.00 0.37 0.29 1.25 -2.27 0.00 0.00 179.45 179.09 2qf9 h LEU 138 N 0.57 0.30 -1.21 5.20 5.85 -1.49 -0.06 115.31 124.48 2qf9 h LEU 138 Ca 0.19 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.00 2qf9 h LEU 138 Cb -0.00 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.09 2qf9 h LEU 138 CO -0.08 0.14 0.00 1.23 -0.34 0.00 0.00 178.44 179.40 2qf9 h GLY 139 N 0.47 0.00 0.63 3.75 0.00 -1.67 -2.68 103.07 103.57 2qf9 h GLY 139 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2qf9 h GLY 139 CO -0.35 0.00 -1.02 -1.30 0.00 0.00 0.00 176.54 173.87 2qf9 n THR 140 N -2.44 0.20 -2.54 4.70 -2.24 -0.05 -4.98 114.28 106.91 2qf9 n THR 140 Ca 0.00 -0.26 -0.27 0.00 -2.27 0.00 0.00 64.05 61.26 2qf9 n THR 140 Cb 0.17 0.16 0.02 0.00 -2.10 0.00 0.00 70.33 68.58 2qf9 n THR 140 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2qf9 s LEU 141 N -4.01 3.44 0.07 3.22 1.43 -1.01 -5.09 118.68 116.73 2qf9 s LEU 141 Ca 0.03 0.78 0.03 0.00 -1.03 0.00 0.00 54.13 53.95 2qf9 s LEU 141 Cb 0.14 -3.67 -0.03 0.00 0.03 0.00 0.00 46.19 42.66 2qf9 s LEU 141 CO 0.80 -0.82 -0.10 -1.81 0.23 0.00 0.00 176.35 174.65 2qf9 s ASP 142 N -4.21 1.26 0.81 2.29 1.11 -1.26 -4.69 116.67 111.98 2qf9 s ASP 142 Ca 0.51 -0.66 0.00 0.00 0.18 0.00 0.00 52.55 52.57 2qf9 s ASP 142 Cb -0.10 0.01 0.00 0.00 1.07 0.00 0.00 42.92 43.89 2qf9 s ASP 142 CO 0.45 -0.20 0.00 0.61 1.18 0.00 0.00 175.17 177.21 2qf9 n GLY 143 N 1.10 2.90 0.33 0.21 0.00 0.19 -2.13 105.19 107.77 2qf9 n GLY 143 Ca -0.20 -0.06 -0.00 0.00 0.00 0.00 0.00 46.02 45.75 2qf9 n GLY 143 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qf9 h LYS 144 N 0.00 0.89 -0.69 1.61 3.64 -1.99 -0.78 116.57 119.25 2qf9 h LYS 144 Ca 0.00 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.25 2qf9 h LYS 144 Cb 0.00 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.61 2qf9 h LYS 144 CO 0.00 0.66 0.29 1.96 -2.27 0.00 0.00 179.45 180.10 2qf9 h GLN 145 N 0.89 1.03 -0.59 1.90 4.20 -1.85 0.20 115.11 120.89 2qf9 h GLN 145 Ca 0.23 -0.18 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 2qf9 h GLN 145 Cb 0.04 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.63 2qf9 h GLN 145 CO -0.03 0.84 0.16 0.00 -0.67 0.00 0.00 178.83 179.12 2qf9 h ALA 146 N 1.14 0.77 -0.08 3.87 0.00 -0.89 -1.47 119.26 122.60 2qf9 h ALA 146 Ca 0.23 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2qf9 h ALA 146 Cb 0.18 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2qf9 h ALA 146 CO -0.02 0.47 -0.04 0.93 0.00 0.00 0.00 179.25 180.58 2qf9 h GLU 147 N 0.84 -0.03 -0.33 0.00 5.08 -0.73 -0.43 114.58 118.97 2qf9 h GLU 147 Ca 0.19 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2qf9 h GLU 147 Cb 0.33 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2qf9 h GLU 147 CO -0.00 -0.02 0.20 0.28 -1.00 0.00 0.00 179.01 178.47 2qf9 h VAL 148 N -0.03 1.11 -0.65 3.13 2.07 -0.89 -0.25 116.25 120.75 2qf9 h VAL 148 Ca 0.04 -0.26 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 2qf9 h VAL 148 Cb 0.10 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 2qf9 h VAL 148 CO -0.10 0.11 0.12 0.22 0.02 0.00 0.00 177.57 177.94 2qf9 h TYR 149 N 0.43 1.13 -0.08 1.57 3.20 -1.10 0.21 116.97 122.33 2qf9 h TYR 149 Ca 0.12 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.84 2qf9 h TYR 149 Cb 0.00 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 37.96 2qf9 h TYR 149 CO -0.04 0.95 0.05 -0.92 -1.64 0.00 0.00 178.16 176.56 2qf9 h TYR 150 N 0.98 0.10 -0.77 -3.82 3.20 -0.86 -0.29 116.97 115.51 2qf9 h TYR 150 Ca 0.20 0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.08 2qf9 h TYR 150 Cb 0.42 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 2qf9 h TYR 150 CO 0.03 0.06 0.50 -0.07 -1.64 0.00 0.00 178.16 177.05 2qf9 h LEU 151 N 0.11 0.89 -0.07 2.82 3.38 -0.63 -2.90 115.31 118.91 2qf9 h LEU 151 Ca 0.03 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2qf9 h LEU 151 Cb -0.01 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2qf9 h LEU 151 CO -0.01 0.65 -0.04 1.56 0.09 0.00 0.00 178.44 180.69 2qf9 h GLN 152 N 1.05 0.16 -0.59 1.13 4.20 -0.67 -1.30 115.11 119.08 2qf9 h GLN 152 Ca 0.28 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.92 2qf9 h GLN 152 Cb -0.11 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.67 2qf9 h GLN 152 CO -0.06 0.54 0.00 1.28 -0.67 0.00 0.00 178.83 179.93 2qf9 n LEU 153 N -4.76 0.06 0.00 1.46 4.77 -0.14 -2.27 117.00 116.12 2qf9 n LEU 153 Ca -0.07 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2qf9 n LEU 153 Cb 0.27 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2qf9 n LEU 153 CO 0.36 0.01 0.00 0.41 -1.33 0.00 0.00 177.39 176.84 2qf9 n THR 155 N 0.62 0.00 -0.27 -5.08 -1.04 -0.49 -0.84 114.28 107.18 2qf9 n THR 155 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 2qf9 n THR 155 Cb 0.01 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 68.58 2qf9 n THR 155 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2qf9 h GLU 156 N 0.00 1.15 -0.12 -2.82 4.39 -1.72 -0.72 114.58 114.74 2qf9 h GLU 156 Ca 0.00 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2qf9 h GLU 156 Cb 0.00 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.47 2qf9 h GLU 156 CO 0.00 0.96 0.08 1.25 -1.16 0.00 0.00 179.01 180.13 2qf9 h HIS 157 N 1.10 0.15 -0.79 4.33 2.76 -0.96 -1.77 115.15 119.97 2qf9 h HIS 157 Ca 0.25 0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.45 2qf9 h HIS 157 Cb 0.26 -0.05 -0.05 0.00 1.55 0.00 0.00 27.41 29.13 2qf9 h HIS 157 CO 0.02 0.11 0.50 0.45 -1.30 0.00 0.00 177.93 177.72 2qf9 h HIS 158 N 0.15 0.95 -0.47 5.26 3.86 -1.78 -0.99 115.15 122.13 2qf9 h HIS 158 Ca 0.04 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.31 2qf9 h HIS 158 Cb -0.00 -0.31 -0.03 0.00 1.06 0.00 0.00 27.41 28.12 2qf9 h HIS 158 CO -0.06 0.54 0.26 0.00 0.86 0.00 0.00 177.93 179.53 2qf9 h ARG 159 N 0.98 0.51 -0.53 2.45 3.08 -0.72 0.44 114.38 120.59 2qf9 h ARG 159 Ca 0.31 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.31 2qf9 h ARG 159 Cb 0.01 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 2qf9 h ARG 159 CO -0.11 0.34 0.23 0.78 -1.07 0.00 0.00 179.97 180.14 2qf9 h GLY 160 N 0.53 0.84 0.80 0.04 0.00 -1.08 -2.52 103.07 101.67 2qf9 h GLY 160 Ca 0.19 -0.44 0.04 0.00 0.00 0.00 0.00 47.33 47.12 2qf9 h GLY 160 CO -0.10 0.41 0.36 -1.33 0.00 0.00 0.00 176.54 175.88 2qf9 h GLY 161 N 0.72 0.88 0.96 4.60 0.00 -0.69 -2.70 103.07 106.84 2qf9 h GLY 161 Ca 0.18 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2qf9 h GLY 161 CO -0.02 0.20 0.22 -2.08 0.00 0.00 0.00 176.54 174.86 2qf9 h VAL 162 N 0.69 1.17 0.00 4.60 2.07 -0.76 0.17 116.25 124.20 2qf9 h VAL 162 Ca 0.26 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2qf9 h VAL 162 Cb 0.08 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2qf9 h VAL 162 CO -0.13 0.18 0.00 1.57 0.02 0.00 0.00 177.57 179.21 2qf9 n HIS 163 N -4.68 0.00 0.00 1.57 -0.00 -0.96 -0.60 115.22 110.55 2qf9 n HIS 163 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 2qf9 n HIS 163 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.09 2qf9 n HIS 163 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2qf9 n ALA 165 N 0.04 0.00 -0.30 1.57 0.00 0.60 -2.09 120.51 120.31 2qf9 n ALA 165 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 2qf9 n ALA 165 Cb 0.00 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.70 2qf9 n ALA 165 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qf9 h LYS 166 N 0.00 0.96 -0.69 0.00 1.57 -1.10 0.77 116.57 118.08 2qf9 h LYS 166 Ca 0.00 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2qf9 h LYS 166 Cb 0.00 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.06 2qf9 h LYS 166 CO 0.00 0.64 0.41 0.78 -0.57 0.00 0.00 179.45 180.71 2qf9 h GLY 167 N 0.99 1.01 1.23 3.86 0.00 -1.67 -1.69 103.07 106.80 2qf9 h GLY 167 Ca 0.41 -0.42 -0.14 0.00 0.00 0.00 0.00 47.33 47.17 2qf9 h GLY 167 CO -0.17 0.41 -0.32 0.00 0.00 0.00 0.00 176.54 176.46 2qf9 h VAL 169 N 0.72 1.05 -0.18 0.00 2.07 -0.50 0.11 116.25 119.52 2qf9 h VAL 169 Ca 0.08 -0.39 -0.15 0.00 0.82 0.00 0.00 66.70 67.06 2qf9 h VAL 169 Cb 0.88 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2qf9 h VAL 169 CO 0.08 0.21 -0.45 -0.08 0.02 0.00 0.00 177.57 177.34 2qf9 h GLU 170 N 1.13 0.63 0.00 1.57 4.81 -1.14 -3.41 114.58 118.16 2qf9 h GLU 170 Ca 0.44 -0.43 -0.17 0.00 -0.13 0.00 0.00 59.36 59.07 2qf9 h GLU 170 Cb 0.23 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 2qf9 h GLU 170 CO -0.19 1.05 -1.65 0.54 -0.73 0.00 0.00 179.01 178.04 2qf9 n ARG 171 N -4.21 2.33 -1.65 1.92 1.74 -0.13 -5.01 116.66 111.65 2qf9 n ARG 171 Ca -0.06 -0.01 -0.36 0.00 -0.77 0.00 0.00 57.85 56.65 2qf9 n ARG 171 Cb 0.57 -1.25 0.08 0.00 -1.02 0.00 0.00 32.46 30.84 2qf9 n ARG 171 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qf9 n THR 173 N -2.14 0.00 -2.77 0.00 -2.24 -1.26 -4.93 114.28 100.94 2qf9 n THR 173 Ca 0.15 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.41 2qf9 n THR 173 Cb 0.49 0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 69.08 2qf9 n THR 173 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2qf9 s VAL 174 N -2.30 4.77 0.14 2.28 1.01 -1.26 -4.96 120.40 120.09 2qf9 s VAL 174 Ca -0.02 1.82 -0.18 0.00 0.00 0.00 0.00 61.98 63.60 2qf9 s VAL 174 Cb 0.03 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.19 2qf9 s VAL 174 CO 0.18 -0.10 1.71 1.23 0.00 0.00 0.00 175.10 178.12 2qf9 h GLY 175 N 9.06 0.26 1.62 4.51 0.00 -1.99 0.17 103.07 116.68 2qf9 h GLY 175 Ca -0.23 0.04 -0.05 0.00 0.00 0.00 0.00 47.33 47.09 2qf9 h GLY 175 CO 0.91 -0.07 -0.04 -0.24 0.00 0.00 0.00 176.54 177.10 2qf9 h VAL 176 N 0.07 1.20 -0.17 4.60 3.04 -1.99 -1.19 116.25 121.81 2qf9 h VAL 176 Ca 0.13 -0.83 -0.11 0.00 -1.01 0.00 0.00 66.70 64.89 2qf9 h VAL 176 Cb 0.18 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.48 2qf9 h VAL 176 CO -0.23 0.28 -0.32 -0.08 -1.01 0.00 0.00 177.57 176.20 2qf9 h GLU 177 N 0.45 0.51 -0.47 4.17 4.81 -1.77 -1.26 114.58 121.03 2qf9 h GLU 177 Ca 0.09 -0.33 0.05 0.00 -0.13 0.00 0.00 59.36 59.05 2qf9 h GLU 177 Cb 0.37 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.74 2qf9 h GLU 177 CO 0.02 0.93 0.19 0.87 -0.73 0.00 0.00 179.01 180.29 2qf9 h LYS 178 N 0.15 0.37 -0.46 1.92 1.57 -0.75 -0.95 116.57 118.42 2qf9 h LYS 178 Ca 0.01 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 2qf9 h LYS 178 Cb 0.91 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 2qf9 h LYS 178 CO 0.07 0.25 -0.10 0.00 -0.57 0.00 0.00 179.45 179.10 2qf9 h ARG 179 N 0.38 0.84 -0.28 3.15 3.08 -1.21 -0.53 114.38 119.81 2qf9 h ARG 179 Ca 0.21 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2qf9 h ARG 179 Cb 0.18 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2qf9 h ARG 179 CO -0.19 0.91 0.17 1.25 -1.07 0.00 0.00 179.97 181.03 2qf9 h LEU 180 N 0.76 0.35 -0.30 3.04 5.85 -0.95 -1.49 115.31 122.56 2qf9 h LEU 180 Ca 0.13 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.80 2qf9 h LEU 180 Cb 0.60 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2qf9 h LEU 180 CO 0.04 0.31 0.18 0.00 -0.34 0.00 0.00 178.44 178.62 2qf9 h ALA 181 N 1.05 0.37 -0.75 1.25 0.00 -0.86 -2.40 119.26 117.93 2qf9 h ALA 181 Ca 0.10 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2qf9 h ALA 181 Cb 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 2qf9 h ALA 181 CO -0.02 -0.19 0.44 -0.09 0.00 0.00 0.00 179.25 179.39 2qf9 h ARG 182 N 0.36 0.77 -1.82 0.00 2.43 -0.93 -1.92 114.38 113.28 2qf9 h ARG 182 Ca 0.12 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2qf9 h ARG 182 Cb -0.01 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 2qf9 h ARG 182 CO -0.05 0.51 0.00 0.41 -1.51 0.00 0.00 179.97 179.33 2qf9 n GLY 183 N -1.30 0.44 2.16 2.80 0.00 -0.58 -2.45 105.19 106.25 2qf9 n GLY 183 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2qf9 n GLY 183 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qf9 n VAL 185 N 1.00 0.00 0.09 1.61 0.31 -0.72 -0.86 118.33 119.76 2qf9 n VAL 185 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 2qf9 n VAL 185 Cb 0.10 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.95 2qf9 n VAL 185 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2qf9 h GLU 186 N 0.00 -0.15 -0.47 5.55 5.08 -1.78 -1.51 114.58 121.30 2qf9 h GLU 186 Ca 0.00 0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 2qf9 h GLU 186 Cb 0.00 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2qf9 h GLU 186 CO 0.00 -0.01 0.03 0.66 -1.00 0.00 0.00 179.01 178.69 2qf9 h SER 187 N -0.27 0.78 -0.39 1.42 4.64 -1.29 -0.87 113.55 117.57 2qf9 h SER 187 Ca -0.02 -0.29 -0.04 0.00 -0.47 0.00 0.00 61.79 60.97 2qf9 h SER 187 Cb 0.22 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 2qf9 h SER 187 CO 0.03 0.88 0.10 1.56 -0.87 0.00 0.00 176.83 178.53 2qf9 h GLN 188 N 0.66 0.63 -0.68 4.77 7.50 -1.79 -0.72 115.11 125.48 2qf9 h GLN 188 Ca 0.14 -0.15 -0.04 0.00 0.50 0.00 0.00 58.65 59.09 2qf9 h GLN 188 Cb 0.46 -0.08 -0.03 0.00 0.05 0.00 0.00 27.48 27.88 2qf9 h GLN 188 CO 0.02 0.66 0.25 0.93 -1.50 0.00 0.00 178.83 179.18 2qf9 h GLU 189 N 0.49 1.03 -0.58 1.46 5.08 -1.15 0.38 114.58 121.29 2qf9 h GLU 189 Ca 0.12 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2qf9 h GLU 189 Cb 0.31 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2qf9 h GLU 189 CO 0.00 0.87 0.35 1.03 -1.00 0.00 0.00 179.01 180.26 2qf9 h SER 190 N 0.97 0.69 0.05 1.42 0.87 -1.07 -2.48 113.55 114.02 2qf9 h SER 190 Ca 0.22 -0.06 -0.11 0.00 -1.23 0.00 0.00 61.79 60.62 2qf9 h SER 190 Cb 0.24 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 2qf9 h SER 190 CO -0.01 0.55 -0.34 -0.33 -0.53 0.00 0.00 176.83 176.17 2qf9 h GLU 191 N 0.78 0.40 -0.47 2.24 5.08 -0.74 -1.85 114.58 120.03 2qf9 h GLU 191 Ca 0.21 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2qf9 h GLU 191 Cb -0.02 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2qf9 h GLU 191 CO -0.04 0.69 0.30 0.82 -1.00 0.00 0.00 179.01 179.79 2qf9 h ILE 192 N 0.35 1.13 -0.59 3.13 2.04 -0.65 -2.79 117.51 120.13 2qf9 h ILE 192 Ca 0.04 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 2qf9 h ILE 192 Cb 0.76 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 2qf9 h ILE 192 CO 0.06 0.13 0.35 0.03 0.00 0.00 0.00 178.15 178.71 2qf9 h ARG 193 N 0.63 0.80 -0.67 2.37 3.08 -1.14 -0.80 114.38 118.66 2qf9 h ARG 193 Ca 0.17 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2qf9 h ARG 193 Cb -0.05 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.84 2qf9 h ARG 193 CO -0.04 0.59 0.00 -0.11 -1.07 0.00 0.00 179.97 179.34 2qf9 n LEU 194 N -4.62 0.00 0.00 3.04 7.94 -0.72 -2.66 117.00 119.99 2qf9 n LEU 194 Ca 0.04 -0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 2qf9 n LEU 194 Cb 0.06 -0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.01 2qf9 n LEU 194 CO 0.36 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.64 2qf9 n ALA 196 N 0.67 0.00 -0.11 1.96 0.00 -0.31 -1.18 120.51 121.53 2qf9 n ALA 196 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2qf9 n ALA 196 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2qf9 n ALA 196 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2qf9 h ASP 197 N 0.00 0.53 -0.97 0.00 3.32 -1.78 -1.69 116.42 115.83 2qf9 h ASP 197 Ca 0.00 -0.25 0.02 0.00 0.02 0.00 0.00 57.03 56.81 2qf9 h ASP 197 Cb 0.00 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.36 2qf9 h ASP 197 CO 0.00 0.65 0.64 -0.07 -1.72 0.00 0.00 179.24 178.74 2qf9 h LEU 198 N 0.39 1.10 0.35 1.55 3.38 -1.45 -0.88 115.31 119.76 2qf9 h LEU 198 Ca 0.10 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2qf9 h LEU 198 Cb 0.34 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2qf9 h LEU 198 CO 0.01 0.79 -0.17 -0.07 0.09 0.00 0.00 178.44 179.09 2qf9 h LEU 199 N 1.30 -0.40 -0.69 1.67 3.38 -1.80 -2.23 115.31 116.54 2qf9 h LEU 199 Ca 0.36 -0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.39 2qf9 h LEU 199 Cb -0.12 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 2qf9 h LEU 199 CO -0.09 -0.25 0.36 0.00 0.09 0.00 0.00 178.44 178.56 2qf9 h ALA 200 N 0.11 0.94 0.00 1.53 0.00 -1.06 -0.37 119.26 120.40 2qf9 h ALA 200 Ca -0.05 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2qf9 h ALA 200 Cb 0.40 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2qf9 h ALA 200 CO 0.08 -0.01 -0.05 0.93 0.00 0.00 0.00 179.25 180.20 2qf9 h GLU 201 N 0.63 0.00 -0.66 0.00 5.08 -1.06 -0.28 114.58 118.29 2qf9 h GLU 201 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2qf9 h GLU 201 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2qf9 h GLU 201 CO -0.23 0.05 0.00 0.54 -1.00 0.00 0.00 179.01 178.36 2qf9 n ARG 202 N -3.41 3.12 -1.92 2.33 1.74 -0.30 -4.94 116.66 113.27 2qf9 n ARG 202 Ca -0.02 -2.55 -0.06 0.00 -0.77 0.00 0.00 57.85 54.44 2qf9 n ARG 202 Cb 0.17 -1.71 -0.01 0.00 -1.02 0.00 0.00 32.46 29.89 2qf9 n ARG 202 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qf9 n GLY 203 N 1.30 0.27 2.56 -0.13 0.00 -0.12 -5.01 105.19 104.05 2qf9 n GLY 203 Ca 0.23 -0.65 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 2qf9 n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qf9 n ALA 204 N -0.80 0.55 -2.83 4.61 0.00 -0.32 -5.01 120.51 116.72 2qf9 n ALA 204 Ca -0.07 -1.56 -0.15 0.00 0.00 0.00 0.00 53.44 51.65 2qf9 n ALA 204 Cb 0.48 1.23 -0.04 0.00 0.00 0.00 0.00 19.45 21.12 2qf9 n ALA 204 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2qf9 s LYS 205 N -3.10 1.92 0.54 0.00 -2.85 -1.26 -2.68 119.74 112.31 2qf9 s LYS 205 Ca 0.29 -1.81 -0.20 0.00 -1.00 0.00 0.00 55.97 53.26 2qf9 s LYS 205 Cb 0.01 0.43 -0.07 0.00 -2.06 0.00 0.00 37.83 36.14 2qf9 s LYS 205 CO 0.21 -0.79 0.90 -1.91 0.10 0.00 0.00 175.35 173.86 2qf9 n GLU 206 N -0.58 0.98 -1.63 1.78 2.13 -1.26 -4.87 120.64 117.19 2qf9 n GLU 206 Ca 0.02 0.37 -0.39 0.00 0.66 0.00 0.00 57.16 57.81 2qf9 n GLU 206 Cb 0.62 -2.05 0.03 0.00 0.27 0.00 0.00 31.44 30.31 2qf9 n GLU 206 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qf9 n GLY 207 N 1.34 -0.17 3.48 8.31 0.00 -1.26 -4.97 105.19 111.92 2qf9 n GLY 207 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2qf9 n GLY 207 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qf9 s HIS 208 N -1.39 3.24 -1.46 1.61 2.46 -1.26 -5.12 115.29 113.36 2qf9 s HIS 208 Ca 0.69 -0.50 0.12 0.00 0.47 0.00 0.00 55.06 55.84 2qf9 s HIS 208 Cb -0.47 -2.55 0.09 0.00 -0.13 0.00 0.00 32.58 29.52 2qf9 s HIS 208 CO 0.52 -0.53 0.87 0.72 -2.47 0.00 0.00 174.74 173.85